NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
620796 | 5nr5 | 34126 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -5 H1 GLY -5 8.196 -16.330 -20.156 2 H2 GLY -5 H2 GLY -5 9.428 -17.218 -20.770 3 H3 GLY -5 H3 GLY -5 9.747 -15.912 -19.833 4 HA2 GLY -5 HA2 GLY -5 10.110 -17.917 -18.566 5 HA3 GLY -5 HA3 GLY -5 8.764 -16.971 -17.907 6 H SER -4 H SER -4 7.410 -18.517 -17.101 7 HA SER -4 HA SER -4 6.072 -20.328 -19.024 8 HB2 SER -4 HB2 SER -4 7.884 -21.672 -17.969 9 HB3 SER -4 HB3 SER -4 7.194 -21.316 -16.373 10 HG SER -4 HG SER -4 6.466 -23.331 -17.248 11 H HIS -3 H HIS -3 3.925 -20.486 -18.665 12 HA HIS -3 HA HIS -3 2.661 -19.894 -16.103 13 HB2 HIS -3 HB2 HIS -3 3.147 -17.624 -17.267 14 HB3 HIS -3 HB3 HIS -3 1.933 -18.099 -18.449 15 HD2 HIS -3 HD2 HIS -3 2.375 -17.148 -14.734 16 HE1 HIS -3 HE1 HIS -3 -1.820 -17.031 -15.502 17 HE2 HIS -3 HE2 HIS -3 -0.003 -16.521 -13.787 18 H MET -2 H MET -2 0.310 -20.288 -16.175 19 HA MET -2 HA MET -2 -0.824 -21.622 -18.530 20 HB2 MET -2 HB2 MET -2 0.476 -23.416 -17.319 21 HB3 MET -2 HB3 MET -2 -0.540 -23.141 -15.899 22 HG2 MET -2 HG2 MET -2 -2.536 -23.801 -17.198 23 HG3 MET -2 HG3 MET -2 -1.542 -23.983 -18.650 24 HE1 MET -2 HE1 MET -2 -2.518 -26.380 -19.089 25 HE2 MET -2 HE2 MET -2 -2.587 -27.661 -17.861 26 HE3 MET -2 HE3 MET -2 -3.560 -26.187 -17.661 27 H ALA -1 H ALA -1 -2.985 -21.597 -18.632 28 HA ALA -1 HA ALA -1 -4.522 -20.792 -16.247 29 HB1 ALA -1 HB1 ALA -1 -4.899 -19.624 -19.036 30 HB2 ALA -1 HB2 ALA -1 -5.949 -19.325 -17.639 31 HB3 ALA -1 HB3 ALA -1 -4.263 -18.757 -17.614 32 H SER 0 H SER 0 -6.671 -21.462 -16.179 33 HA SER 0 HA SER 0 -7.898 -23.075 -18.250 34 HB2 SER 0 HB2 SER 0 -6.341 -24.686 -16.997 35 HB3 SER 0 HB3 SER 0 -7.379 -24.440 -15.580 36 HG SER 0 HG SER 0 -8.033 -26.255 -16.835 37 H MET 1 H MET 1 -10.079 -23.814 -17.485 38 HA MET 1 HA MET 1 -11.276 -22.100 -15.341 39 HB2 MET 1 HB2 MET 1 -11.845 -21.222 -17.597 40 HB3 MET 1 HB3 MET 1 -12.573 -22.782 -18.003 41 HG2 MET 1 HG2 MET 1 -14.183 -22.489 -16.110 42 HG3 MET 1 HG3 MET 1 -13.420 -20.947 -15.725 43 HE1 MET 1 HE1 MET 1 -15.844 -22.931 -18.014 44 HE2 MET 1 HE2 MET 1 -16.157 -21.821 -19.365 45 HE3 MET 1 HE3 MET 1 -14.574 -22.609 -19.217 46 H ASP 2 H ASP 2 -12.275 -23.196 -13.806 47 HA ASP 2 HA ASP 2 -13.579 -25.815 -14.312 48 HB2 ASP 2 HB2 ASP 2 -11.407 -25.210 -12.264 49 HB3 ASP 2 HB3 ASP 2 -12.555 -26.512 -12.028 50 HA PRO 3 HA PRO 3 -16.616 -24.039 -11.587 51 HB2 PRO 3 HB2 PRO 3 -17.850 -26.210 -10.445 52 HB3 PRO 3 HB3 PRO 3 -18.010 -25.804 -12.181 53 HG2 PRO 3 HG2 PRO 3 -16.096 -27.785 -10.905 54 HG3 PRO 3 HG3 PRO 3 -17.174 -28.040 -12.313 55 HD2 PRO 3 HD2 PRO 3 -14.549 -27.406 -12.615 56 HD3 PRO 3 HD3 PRO 3 -15.788 -26.754 -13.724 57 H LEU 4 H LEU 4 -14.013 -25.682 -10.315 58 HA LEU 4 HA LEU 4 -14.673 -24.996 -7.504 59 HB2 LEU 4 HB2 LEU 4 -12.769 -27.069 -8.653 60 HB3 LEU 4 HB3 LEU 4 -12.969 -26.749 -6.937 61 HG LEU 4 HG LEU 4 -15.172 -27.788 -8.750 62 HD11 LEU 4 HD11 LEU 4 -13.498 -29.181 -6.621 63 HD12 LEU 4 HD12 LEU 4 -14.844 -29.898 -7.536 64 HD13 LEU 4 HD13 LEU 4 -13.362 -29.419 -8.377 65 HD21 LEU 4 HD21 LEU 4 -16.126 -26.522 -6.869 66 HD22 LEU 4 HD22 LEU 4 -16.358 -28.251 -6.615 67 HD23 LEU 4 HD23 LEU 4 -15.079 -27.399 -5.725 68 H ASP 5 H ASP 5 -13.851 -22.851 -9.013 69 HA ASP 5 HA ASP 5 -11.145 -22.246 -7.886 70 HB2 ASP 5 HB2 ASP 5 -12.764 -20.991 -10.123 71 HB3 ASP 5 HB3 ASP 5 -11.365 -20.191 -9.426 72 H LYS 6 H LYS 6 -14.156 -21.973 -6.806 73 HA LYS 6 HA LYS 6 -13.809 -19.217 -5.645 74 HB2 LYS 6 HB2 LYS 6 -16.551 -20.269 -6.358 75 HB3 LYS 6 HB3 LYS 6 -16.009 -18.632 -6.053 76 HG2 LYS 6 HG2 LYS 6 -16.123 -18.470 -8.314 77 HG3 LYS 6 HG3 LYS 6 -14.490 -19.120 -8.215 78 HD2 LYS 6 HD2 LYS 6 -15.571 -20.411 -9.887 79 HD3 LYS 6 HD3 LYS 6 -15.571 -21.462 -8.458 80 HE2 LYS 6 HE2 LYS 6 -17.913 -20.725 -7.953 81 HE3 LYS 6 HE3 LYS 6 -17.896 -19.722 -9.407 82 HZ1 LYS 6 HZ1 LYS 6 -17.554 -22.680 -9.385 83 HZ2 LYS 6 HZ2 LYS 6 -18.937 -21.898 -9.791 84 HZ3 LYS 6 HZ3 LYS 6 -17.612 -21.731 -10.728 85 H ILE 7 H ILE 7 -15.875 -22.054 -5.179 86 HA ILE 7 HA ILE 7 -15.867 -21.599 -2.235 87 HB ILE 7 HB ILE 7 -18.000 -22.892 -2.254 88 HG12 ILE 7 HG12 ILE 7 -19.322 -23.061 -4.291 89 HG13 ILE 7 HG13 ILE 7 -17.989 -22.494 -5.284 90 HG21 ILE 7 HG21 ILE 7 -17.944 -20.356 -3.942 91 HG22 ILE 7 HG22 ILE 7 -19.325 -20.991 -3.025 92 HG23 ILE 7 HG23 ILE 7 -17.882 -20.432 -2.169 93 HD11 ILE 7 HD11 ILE 7 -17.961 -25.091 -3.681 94 HD12 ILE 7 HD12 ILE 7 -18.391 -24.958 -5.397 95 HD13 ILE 7 HD13 ILE 7 -16.749 -24.564 -4.881 96 H ILE 8 H ILE 8 -14.123 -23.373 -4.213 97 HA ILE 8 HA ILE 8 -14.412 -26.022 -3.807 98 HB ILE 8 HB ILE 8 -12.771 -25.102 -5.261 99 HG12 ILE 8 HG12 ILE 8 -11.490 -27.010 -3.258 100 HG13 ILE 8 HG13 ILE 8 -12.542 -27.452 -4.602 101 HG21 ILE 8 HG21 ILE 8 -10.914 -24.491 -2.930 102 HG22 ILE 8 HG22 ILE 8 -10.664 -24.147 -4.647 103 HG23 ILE 8 HG23 ILE 8 -11.892 -23.261 -3.762 104 HD11 ILE 8 HD11 ILE 8 -9.734 -26.276 -4.781 105 HD12 ILE 8 HD12 ILE 8 -10.235 -27.932 -5.147 106 HD13 ILE 8 HD13 ILE 8 -10.779 -26.605 -6.183 107 H ASN 9 H ASN 9 -12.729 -24.030 -1.444 108 HA ASN 9 HA ASN 9 -12.824 -26.201 0.592 109 HB2 ASN 9 HB2 ASN 9 -10.699 -26.147 -0.987 110 HB3 ASN 9 HB3 ASN 9 -10.220 -24.761 -0.020 111 HD21 ASN 9 HD21 ASN 9 -9.455 -26.804 2.837 112 HD22 ASN 9 HD22 ASN 9 -10.088 -25.207 2.398 113 H ASP 10 H ASP 10 -14.188 -23.573 0.338 114 HA ASP 10 HA ASP 10 -12.655 -21.785 1.955 115 HB2 ASP 10 HB2 ASP 10 -13.961 -21.202 -0.124 116 HB3 ASP 10 HB3 ASP 10 -15.443 -21.384 0.809 117 H ILE 11 H ILE 11 -14.049 -24.148 3.222 118 HA ILE 11 HA ILE 11 -14.689 -22.825 5.756 119 HB ILE 11 HB ILE 11 -16.807 -22.918 4.382 120 HG12 ILE 11 HG12 ILE 11 -17.073 -24.392 7.020 121 HG13 ILE 11 HG13 ILE 11 -16.749 -22.663 6.865 122 HG21 ILE 11 HG21 ILE 11 -16.798 -25.907 4.944 123 HG22 ILE 11 HG22 ILE 11 -18.029 -24.972 4.078 124 HG23 ILE 11 HG23 ILE 11 -16.427 -25.169 3.371 125 HD11 ILE 11 HD11 ILE 11 -19.224 -24.129 5.862 126 HD12 ILE 11 HD12 ILE 11 -19.114 -23.011 7.230 127 HD13 ILE 11 HD13 ILE 11 -18.878 -22.405 5.579 128 H LYS 12 H LYS 12 -12.576 -24.527 4.805 129 HA LYS 12 HA LYS 12 -12.704 -26.530 7.027 130 HB2 LYS 12 HB2 LYS 12 -13.068 -27.684 4.877 131 HB3 LYS 12 HB3 LYS 12 -11.572 -26.996 4.237 132 HG2 LYS 12 HG2 LYS 12 -10.286 -28.216 6.017 133 HG3 LYS 12 HG3 LYS 12 -11.804 -28.937 6.582 134 HD2 LYS 12 HD2 LYS 12 -12.086 -30.057 4.400 135 HD3 LYS 12 HD3 LYS 12 -10.632 -29.246 3.778 136 HE2 LYS 12 HE2 LYS 12 -9.290 -30.314 5.591 137 HE3 LYS 12 HE3 LYS 12 -10.729 -31.171 6.141 138 HZ1 LYS 12 HZ1 LYS 12 -9.473 -31.485 3.464 139 HZ2 LYS 12 HZ2 LYS 12 -9.382 -32.567 4.684 140 HZ3 LYS 12 HZ3 LYS 12 -10.818 -32.275 3.962 141 H LYS 13 H LYS 13 -10.541 -24.608 4.974 142 HA LYS 13 HA LYS 13 -8.446 -24.554 7.032 143 HB2 LYS 13 HB2 LYS 13 -8.286 -25.997 4.392 144 HB3 LYS 13 HB3 LYS 13 -6.867 -25.102 4.871 145 HG2 LYS 13 HG2 LYS 13 -8.137 -27.158 6.716 146 HG3 LYS 13 HG3 LYS 13 -6.963 -27.577 5.468 147 HD2 LYS 13 HD2 LYS 13 -5.328 -25.982 6.458 148 HD3 LYS 13 HD3 LYS 13 -6.470 -25.641 7.774 149 HE2 LYS 13 HE2 LYS 13 -6.422 -27.994 8.471 150 HE3 LYS 13 HE3 LYS 13 -5.414 -28.419 7.083 151 HZ1 LYS 13 HZ1 LYS 13 -4.576 -26.606 9.284 152 HZ2 LYS 13 HZ2 LYS 13 -4.079 -28.149 9.091 153 HZ3 LYS 13 HZ3 LYS 13 -3.652 -27.016 7.998 154 H GLU 14 H GLU 14 -7.032 -22.892 6.901 155 HA GLU 14 HA GLU 14 -7.264 -20.947 4.652 156 HB2 GLU 14 HB2 GLU 14 -7.091 -20.234 7.610 157 HB3 GLU 14 HB3 GLU 14 -6.875 -19.119 6.266 158 HG2 GLU 14 HG2 GLU 14 -9.064 -18.723 6.766 159 HG3 GLU 14 HG3 GLU 14 -9.196 -19.878 5.445 160 H ALA 15 H ALA 15 -5.423 -19.760 4.168 161 HA ALA 15 HA ALA 15 -2.806 -20.450 5.298 162 HB1 ALA 15 HB1 ALA 15 -3.675 -21.284 2.494 163 HB2 ALA 15 HB2 ALA 15 -2.023 -21.422 3.153 164 HB3 ALA 15 HB3 ALA 15 -3.345 -22.387 3.848 165 H ASN 16 H ASN 16 -1.044 -19.415 3.887 166 HA ASN 16 HA ASN 16 -1.891 -17.055 2.329 167 HB2 ASN 16 HB2 ASN 16 -1.718 -16.479 4.818 168 HB3 ASN 16 HB3 ASN 16 0.007 -16.794 4.698 169 HD21 ASN 16 HD21 ASN 16 -1.304 -13.162 3.780 170 HD22 ASN 16 HD22 ASN 16 -2.213 -14.326 4.700 171 H ASP 17 H ASP 17 -0.590 -16.762 0.604 172 HA ASP 17 HA ASP 17 2.161 -17.910 0.517 173 HB2 ASP 17 HB2 ASP 17 -0.102 -18.407 -1.455 174 HB3 ASP 17 HB3 ASP 17 1.594 -18.657 -1.852 175 H SER 18 H SER 18 3.573 -16.921 -0.977 176 HA SER 18 HA SER 18 3.023 -14.091 -1.396 177 HB2 SER 18 HB2 SER 18 5.429 -14.015 -2.032 178 HB3 SER 18 HB3 SER 18 5.152 -14.777 -0.456 179 HG SER 18 HG SER 18 6.615 -15.978 -1.787 180 H GLY 19 H GLY 19 2.462 -16.726 -3.404 181 HA2 GLY 19 HA2 GLY 19 1.463 -14.958 -5.376 182 HA3 GLY 19 HA3 GLY 19 2.969 -15.644 -5.988 183 H VAL 20 H VAL 20 -0.357 -16.186 -5.267 184 HA VAL 20 HA VAL 20 -0.377 -18.553 -7.030 185 HB VAL 20 HB VAL 20 -0.221 -19.473 -4.772 186 HG11 VAL 20 HG11 VAL 20 -2.917 -18.207 -4.156 187 HG12 VAL 20 HG12 VAL 20 -1.969 -19.289 -3.121 188 HG13 VAL 20 HG13 VAL 20 -1.359 -17.668 -3.491 189 HG21 VAL 20 HG21 VAL 20 -1.454 -20.695 -6.534 190 HG22 VAL 20 HG22 VAL 20 -2.066 -21.039 -4.909 191 HG23 VAL 20 HG23 VAL 20 -2.974 -19.953 -5.978 192 H THR 21 H THR 21 -2.066 -18.616 -8.360 193 HA THR 21 HA THR 21 -3.815 -17.990 -9.606 194 HB THR 21 HB THR 21 -5.084 -17.368 -6.960 195 HG1 THR 21 HG1 THR 21 -5.787 -19.504 -7.181 196 HG21 THR 21 HG21 THR 21 -6.312 -17.900 -9.693 197 HG22 THR 21 HG22 THR 21 -7.203 -18.066 -8.160 198 HG23 THR 21 HG23 THR 21 -6.570 -16.490 -8.631 199 H LEU 22 H LEU 22 -5.099 -16.356 -10.631 200 HA LEU 22 HA LEU 22 -4.432 -13.572 -9.967 201 HB2 LEU 22 HB2 LEU 22 -3.567 -13.117 -12.141 202 HB3 LEU 22 HB3 LEU 22 -2.696 -14.510 -11.514 203 HG LEU 22 HG LEU 22 -5.056 -14.851 -13.412 204 HD11 LEU 22 HD11 LEU 22 -2.122 -14.489 -14.155 205 HD12 LEU 22 HD12 LEU 22 -3.442 -14.919 -15.271 206 HD13 LEU 22 HD13 LEU 22 -3.433 -13.336 -14.487 207 HD21 LEU 22 HD21 LEU 22 -4.344 -16.945 -12.391 208 HD22 LEU 22 HD22 LEU 22 -3.841 -16.921 -14.071 209 HD23 LEU 22 HD23 LEU 22 -2.645 -16.606 -12.793 210 H ALA 23 H ALA 23 -6.891 -15.135 -9.921 211 HA ALA 23 HA ALA 23 -8.640 -13.175 -11.238 212 HB1 ALA 23 HB1 ALA 23 -8.717 -16.113 -12.025 213 HB2 ALA 23 HB2 ALA 23 -9.909 -14.884 -12.504 214 HB3 ALA 23 HB3 ALA 23 -8.230 -14.747 -13.054 215 HA PRO 24 HA PRO 24 -10.865 -14.611 -7.525 216 HB2 PRO 24 HB2 PRO 24 -12.083 -12.311 -6.805 217 HB3 PRO 24 HB3 PRO 24 -10.321 -12.553 -6.603 218 HG2 PRO 24 HG2 PRO 24 -11.760 -11.096 -8.840 219 HG3 PRO 24 HG3 PRO 24 -10.343 -10.555 -7.892 220 HD2 PRO 24 HD2 PRO 24 -10.164 -11.772 -10.373 221 HD3 PRO 24 HD3 PRO 24 -8.882 -11.904 -9.138 222 H LEU 25 H LEU 25 -12.270 -12.955 -10.333 223 HA LEU 25 HA LEU 25 -14.686 -14.624 -10.237 224 HB2 LEU 25 HB2 LEU 25 -15.076 -12.579 -8.752 225 HB3 LEU 25 HB3 LEU 25 -14.889 -11.588 -10.197 226 HG LEU 25 HG LEU 25 -16.886 -12.753 -11.205 227 HD11 LEU 25 HD11 LEU 25 -17.091 -14.041 -8.449 228 HD12 LEU 25 HD12 LEU 25 -18.370 -14.044 -9.684 229 HD13 LEU 25 HD13 LEU 25 -16.853 -14.888 -9.994 230 HD21 LEU 25 HD21 LEU 25 -17.115 -10.618 -9.993 231 HD22 LEU 25 HD22 LEU 25 -18.544 -11.641 -9.782 232 HD23 LEU 25 HD23 LEU 25 -17.353 -11.502 -8.468 233 H SER 26 H SER 26 -13.206 -15.261 -12.108 234 HA SER 26 HA SER 26 -12.773 -15.383 -14.346 235 HB2 SER 26 HB2 SER 26 -15.597 -14.282 -14.425 236 HB3 SER 26 HB3 SER 26 -14.790 -15.125 -15.771 237 HG SER 26 HG SER 26 -16.097 -16.542 -14.515 238 H VAL 27 H VAL 27 -11.606 -13.126 -13.336 239 HA VAL 27 HA VAL 27 -11.292 -11.400 -15.691 240 HB VAL 27 HB VAL 27 -13.241 -10.528 -14.368 241 HG11 VAL 27 HG11 VAL 27 -11.196 -9.720 -12.268 242 HG12 VAL 27 HG12 VAL 27 -12.928 -9.337 -12.287 243 HG13 VAL 27 HG13 VAL 27 -12.402 -11.011 -12.065 244 HG21 VAL 27 HG21 VAL 27 -11.954 -9.031 -15.839 245 HG22 VAL 27 HG22 VAL 27 -12.605 -8.184 -14.432 246 HG23 VAL 27 HG23 VAL 27 -10.884 -8.605 -14.474 247 HA PRO 28 HA PRO 28 -7.222 -11.675 -13.881 248 HB2 PRO 28 HB2 PRO 28 -5.729 -9.993 -15.409 249 HB3 PRO 28 HB3 PRO 28 -6.485 -11.479 -16.043 250 HG2 PRO 28 HG2 PRO 28 -7.599 -8.654 -16.180 251 HG3 PRO 28 HG3 PRO 28 -7.372 -9.816 -17.529 252 HD2 PRO 28 HD2 PRO 28 -9.757 -9.559 -16.276 253 HD3 PRO 28 HD3 PRO 28 -9.168 -11.161 -16.796 254 H LYS 29 H LYS 29 -8.429 -10.728 -12.017 255 HA LYS 29 HA LYS 29 -8.684 -9.529 -10.168 256 HB2 LYS 29 HB2 LYS 29 -6.181 -9.836 -10.122 257 HB3 LYS 29 HB3 LYS 29 -6.039 -8.171 -10.685 258 HG2 LYS 29 HG2 LYS 29 -5.860 -7.889 -8.375 259 HG3 LYS 29 HG3 LYS 29 -7.592 -7.617 -8.607 260 HD2 LYS 29 HD2 LYS 29 -7.983 -10.019 -8.008 261 HD3 LYS 29 HD3 LYS 29 -6.236 -10.189 -7.736 262 HE2 LYS 29 HE2 LYS 29 -6.359 -8.414 -5.983 263 HE3 LYS 29 HE3 LYS 29 -8.101 -8.279 -6.248 264 HZ1 LYS 29 HZ1 LYS 29 -6.716 -10.739 -5.288 265 HZ2 LYS 29 HZ2 LYS 29 -7.616 -9.740 -4.361 266 HZ3 LYS 29 HZ3 LYS 29 -8.325 -10.609 -5.537 267 HA PRO 30 HA PRO 30 -10.573 -5.817 -11.878 268 HB2 PRO 30 HB2 PRO 30 -12.536 -5.388 -10.061 269 HB3 PRO 30 HB3 PRO 30 -12.581 -6.768 -11.203 270 HG2 PRO 30 HG2 PRO 30 -11.661 -6.771 -8.311 271 HG3 PRO 30 HG3 PRO 30 -12.773 -7.918 -9.121 272 HD2 PRO 30 HD2 PRO 30 -10.083 -8.393 -8.770 273 HD3 PRO 30 HD3 PRO 30 -11.006 -9.042 -10.157 274 H LYS 31 H LYS 31 -10.379 -3.613 -11.536 275 HA LYS 31 HA LYS 31 -8.349 -2.777 -9.661 276 HB2 LYS 31 HB2 LYS 31 -8.449 -0.634 -10.745 277 HB3 LYS 31 HB3 LYS 31 -8.452 -1.934 -11.936 278 HG2 LYS 31 HG2 LYS 31 -11.059 -1.639 -11.944 279 HG3 LYS 31 HG3 LYS 31 -10.744 -0.106 -11.131 280 HD2 LYS 31 HD2 LYS 31 -9.693 -0.981 -13.859 281 HD3 LYS 31 HD3 LYS 31 -11.009 0.159 -13.564 282 HE2 LYS 31 HE2 LYS 31 -9.427 1.706 -12.433 283 HE3 LYS 31 HE3 LYS 31 -8.102 0.572 -12.730 284 HZ1 LYS 31 HZ1 LYS 31 -9.705 1.904 -14.850 285 HZ2 LYS 31 HZ2 LYS 31 -8.180 2.304 -14.432 286 HZ3 LYS 31 HZ3 LYS 31 -8.481 0.856 -15.123 287 H LEU 32 H LEU 32 -8.406 -1.533 -7.842 288 HA LEU 32 HA LEU 32 -11.016 -0.743 -6.682 289 HB2 LEU 32 HB2 LEU 32 -10.249 -3.092 -6.007 290 HB3 LEU 32 HB3 LEU 32 -8.790 -2.352 -5.351 291 HG LEU 32 HG LEU 32 -10.371 -0.885 -3.957 292 HD11 LEU 32 HD11 LEU 32 -12.306 -3.132 -4.675 293 HD12 LEU 32 HD12 LEU 32 -12.577 -1.897 -3.431 294 HD13 LEU 32 HD13 LEU 32 -12.492 -1.427 -5.132 295 HD21 LEU 32 HD21 LEU 32 -9.009 -2.634 -2.975 296 HD22 LEU 32 HD22 LEU 32 -10.597 -2.583 -2.192 297 HD23 LEU 32 HD23 LEU 32 -10.236 -3.857 -3.381 298 H GLU 33 H GLU 33 -10.938 1.093 -5.406 299 HA GLU 33 HA GLU 33 -8.398 2.226 -4.506 300 HB2 GLU 33 HB2 GLU 33 -8.765 4.414 -5.665 301 HB3 GLU 33 HB3 GLU 33 -8.420 3.090 -6.766 302 HG2 GLU 33 HG2 GLU 33 -10.815 2.885 -7.347 303 HG3 GLU 33 HG3 GLU 33 -11.219 4.176 -6.220 304 H GLU 34 H GLU 34 -9.997 1.225 -2.892 305 HA GLU 34 HA GLU 34 -11.775 3.346 -1.738 306 HB2 GLU 34 HB2 GLU 34 -11.995 0.328 -1.579 307 HB3 GLU 34 HB3 GLU 34 -12.950 1.463 -0.606 308 HG2 GLU 34 HG2 GLU 34 -13.631 2.572 -2.823 309 HG3 GLU 34 HG3 GLU 34 -12.967 1.149 -3.625 310 H LEU 35 H LEU 35 -10.087 4.415 -0.836 311 HA LEU 35 HA LEU 35 -9.503 3.518 1.950 312 HB2 LEU 35 HB2 LEU 35 -7.650 4.880 -0.052 313 HB3 LEU 35 HB3 LEU 35 -7.331 4.840 1.671 314 HG LEU 35 HG LEU 35 -7.540 2.394 -0.137 315 HD11 LEU 35 HD11 LEU 35 -5.160 3.659 1.273 316 HD12 LEU 35 HD12 LEU 35 -5.153 2.179 0.285 317 HD13 LEU 35 HD13 LEU 35 -5.514 3.739 -0.472 318 HD21 LEU 35 HD21 LEU 35 -8.273 1.667 2.003 319 HD22 LEU 35 HD22 LEU 35 -6.555 1.258 1.949 320 HD23 LEU 35 HD23 LEU 35 -7.087 2.672 2.864 321 H SER 36 H SER 36 -9.074 5.266 3.441 322 HA SER 36 HA SER 36 -10.927 7.550 3.135 323 HB2 SER 36 HB2 SER 36 -10.623 6.330 5.297 324 HB3 SER 36 HB3 SER 36 -8.956 6.936 5.367 325 HG SER 36 HG SER 36 -10.512 8.240 6.526 326 H GLU 37 H GLU 37 -9.959 9.822 3.713 327 HA GLU 37 HA GLU 37 -8.257 10.557 1.562 328 HB2 GLU 37 HB2 GLU 37 -9.879 12.041 2.677 329 HB3 GLU 37 HB3 GLU 37 -8.857 12.092 4.121 330 HG2 GLU 37 HG2 GLU 37 -7.047 13.168 2.819 331 HG3 GLU 37 HG3 GLU 37 -8.008 13.032 1.344 332 H GLN 38 H GLN 38 -7.379 10.174 5.031 333 HA GLN 38 HA GLN 38 -4.580 10.831 4.603 334 HB2 GLN 38 HB2 GLN 38 -5.850 11.040 6.793 335 HB3 GLN 38 HB3 GLN 38 -5.825 9.275 6.902 336 HG2 GLN 38 HG2 GLN 38 -3.226 9.499 6.676 337 HG3 GLN 38 HG3 GLN 38 -3.476 11.219 6.969 338 HE21 GLN 38 HE21 GLN 38 -3.981 8.481 10.015 339 HE22 GLN 38 HE22 GLN 38 -3.926 7.938 8.342 340 H GLN 39 H GLN 39 -6.415 7.779 4.851 341 HA GLN 39 HA GLN 39 -4.259 5.923 4.682 342 HB2 GLN 39 HB2 GLN 39 -7.135 5.792 3.805 343 HB3 GLN 39 HB3 GLN 39 -6.040 4.418 3.717 344 HG2 GLN 39 HG2 GLN 39 -6.425 5.836 6.368 345 HG3 GLN 39 HG3 GLN 39 -7.672 4.752 5.771 346 HE21 GLN 39 HE21 GLN 39 -4.559 3.047 7.575 347 HE22 GLN 39 HE22 GLN 39 -4.850 4.785 7.645 348 H LYS 40 H LYS 40 -6.192 7.477 2.084 349 HA LYS 40 HA LYS 40 -4.902 6.206 -0.138 350 HB2 LYS 40 HB2 LYS 40 -7.088 7.367 -0.190 351 HB3 LYS 40 HB3 LYS 40 -6.292 8.918 0.098 352 HG2 LYS 40 HG2 LYS 40 -5.058 8.685 -2.045 353 HG3 LYS 40 HG3 LYS 40 -5.858 7.135 -2.344 354 HD2 LYS 40 HD2 LYS 40 -7.293 9.808 -1.988 355 HD3 LYS 40 HD3 LYS 40 -6.852 9.105 -3.554 356 HE2 LYS 40 HE2 LYS 40 -8.243 7.094 -3.025 357 HE3 LYS 40 HE3 LYS 40 -8.739 7.853 -1.506 358 HZ1 LYS 40 HZ1 LYS 40 -9.273 8.956 -4.215 359 HZ2 LYS 40 HZ2 LYS 40 -10.376 8.228 -3.258 360 HZ3 LYS 40 HZ3 LYS 40 -9.731 9.660 -2.812 361 H ILE 41 H ILE 41 -4.110 9.283 1.591 362 HA ILE 41 HA ILE 41 -1.868 9.923 -0.102 363 HB ILE 41 HB ILE 41 -2.427 10.688 2.752 364 HG12 ILE 41 HG12 ILE 41 -2.727 12.455 0.275 365 HG13 ILE 41 HG13 ILE 41 -4.048 11.430 0.791 366 HG21 ILE 41 HG21 ILE 41 -0.394 11.871 0.824 367 HG22 ILE 41 HG22 ILE 41 -0.840 12.588 2.384 368 HG23 ILE 41 HG23 ILE 41 -0.048 11.025 2.348 369 HD11 ILE 41 HD11 ILE 41 -2.814 13.670 2.437 370 HD12 ILE 41 HD12 ILE 41 -4.414 13.631 1.677 371 HD13 ILE 41 HD13 ILE 41 -4.054 12.535 3.024 372 H ILE 42 H ILE 42 -2.033 7.940 2.956 373 HA ILE 42 HA ILE 42 0.820 7.551 3.106 374 HB ILE 42 HB ILE 42 -1.428 5.764 4.074 375 HG12 ILE 42 HG12 ILE 42 0.289 7.553 5.835 376 HG13 ILE 42 HG13 ILE 42 -1.115 8.230 5.029 377 HG21 ILE 42 HG21 ILE 42 1.563 5.762 4.710 378 HG22 ILE 42 HG22 ILE 42 0.352 4.846 5.617 379 HG23 ILE 42 HG23 ILE 42 0.644 4.460 3.926 380 HD11 ILE 42 HD11 ILE 42 -1.185 5.843 6.917 381 HD12 ILE 42 HD12 ILE 42 -1.746 7.491 7.255 382 HD13 ILE 42 HD13 ILE 42 -2.571 6.505 6.026 383 H LEU 43 H LEU 43 -1.745 5.658 1.549 384 HA LEU 43 HA LEU 43 -0.133 3.594 0.439 385 HB2 LEU 43 HB2 LEU 43 -2.570 3.552 0.671 386 HB3 LEU 43 HB3 LEU 43 -2.763 4.860 -0.467 387 HG LEU 43 HG LEU 43 -3.379 2.578 -1.242 388 HD11 LEU 43 HD11 LEU 43 -1.262 3.887 -2.962 389 HD12 LEU 43 HD12 LEU 43 -2.539 2.781 -3.481 390 HD13 LEU 43 HD13 LEU 43 -2.958 4.379 -2.835 391 HD21 LEU 43 HD21 LEU 43 -1.633 1.271 -0.240 392 HD22 LEU 43 HD22 LEU 43 -1.581 1.038 -1.991 393 HD23 LEU 43 HD23 LEU 43 -0.360 2.061 -1.196 394 H ALA 44 H ALA 44 -1.182 6.695 -1.002 395 HA ALA 44 HA ALA 44 0.185 6.426 -3.472 396 HB1 ALA 44 HB1 ALA 44 -0.752 8.872 -1.929 397 HB2 ALA 44 HB2 ALA 44 -0.318 8.851 -3.655 398 HB3 ALA 44 HB3 ALA 44 -1.723 7.921 -3.080 399 H GLU 45 H GLU 45 1.161 8.386 -0.549 400 HA GLU 45 HA GLU 45 3.608 9.314 -1.660 401 HB2 GLU 45 HB2 GLU 45 2.708 8.851 1.204 402 HB3 GLU 45 HB3 GLU 45 4.259 9.578 0.812 403 HG2 GLU 45 HG2 GLU 45 1.618 10.732 -0.174 404 HG3 GLU 45 HG3 GLU 45 2.389 11.199 1.338 405 H TYR 46 H TYR 46 2.903 6.165 -0.191 406 HA TYR 46 HA TYR 46 5.650 5.376 0.176 407 HB2 TYR 46 HB2 TYR 46 3.724 4.374 1.329 408 HB3 TYR 46 HB3 TYR 46 3.094 3.768 -0.193 409 HD1 TYR 46 HD1 TYR 46 2.932 1.658 1.148 410 HD2 TYR 46 HD2 TYR 46 6.726 3.413 0.051 411 HE1 TYR 46 HE1 TYR 46 4.084 -0.497 1.638 412 HE2 TYR 46 HE2 TYR 46 7.866 1.289 0.608 413 HH TYR 46 HH TYR 46 6.090 -1.585 1.780 414 H ILE 47 H ILE 47 3.276 4.480 -2.381 415 HA ILE 47 HA ILE 47 5.026 3.168 -4.142 416 HB ILE 47 HB ILE 47 2.360 4.569 -4.347 417 HG12 ILE 47 HG12 ILE 47 3.121 1.611 -4.411 418 HG13 ILE 47 HG13 ILE 47 2.655 2.455 -2.945 419 HG21 ILE 47 HG21 ILE 47 3.755 2.989 -6.526 420 HG22 ILE 47 HG22 ILE 47 2.015 3.359 -6.548 421 HG23 ILE 47 HG23 ILE 47 3.183 4.664 -6.620 422 HD11 ILE 47 HD11 ILE 47 0.849 1.900 -5.322 423 HD12 ILE 47 HD12 ILE 47 0.717 1.297 -3.663 424 HD13 ILE 47 HD13 ILE 47 0.446 3.018 -4.003 425 H ALA 48 H ALA 48 4.101 6.636 -3.869 426 HA ALA 48 HA ALA 48 5.375 7.506 -6.293 427 HB1 ALA 48 HB1 ALA 48 4.647 8.989 -3.734 428 HB2 ALA 48 HB2 ALA 48 5.034 9.746 -5.297 429 HB3 ALA 48 HB3 ALA 48 3.583 8.734 -5.134 430 H GLU 49 H GLU 49 6.639 6.858 -3.058 431 HA GLU 49 HA GLU 49 9.240 8.136 -3.649 432 HB2 GLU 49 HB2 GLU 49 8.122 8.290 -1.407 433 HB3 GLU 49 HB3 GLU 49 8.334 6.548 -1.224 434 HG2 GLU 49 HG2 GLU 49 10.069 7.613 0.001 435 HG3 GLU 49 HG3 GLU 49 10.831 6.897 -1.407 436 H VAL 50 H VAL 50 7.885 4.808 -3.307 437 HA VAL 50 HA VAL 50 10.592 3.747 -4.007 438 HB VAL 50 HB VAL 50 10.285 1.893 -2.779 439 HG11 VAL 50 HG11 VAL 50 8.842 3.967 -1.107 440 HG12 VAL 50 HG12 VAL 50 9.786 2.578 -0.537 441 HG13 VAL 50 HG13 VAL 50 10.597 3.905 -1.386 442 HG21 VAL 50 HG21 VAL 50 8.034 1.169 -3.488 443 HG22 VAL 50 HG22 VAL 50 8.226 1.102 -1.742 444 HG23 VAL 50 HG23 VAL 50 7.302 2.428 -2.477 445 H GLY 51 H GLY 51 7.604 4.132 -5.487 446 HA2 GLY 51 HA2 GLY 51 7.473 4.043 -7.794 447 HA3 GLY 51 HA3 GLY 51 8.924 3.045 -7.861 448 H LEU 52 H LEU 52 6.101 2.146 -5.995 449 HA LEU 52 HA LEU 52 4.847 0.325 -5.885 450 HB2 LEU 52 HB2 LEU 52 4.200 1.622 -8.251 451 HB3 LEU 52 HB3 LEU 52 4.403 -0.015 -8.814 452 HG LEU 52 HG LEU 52 2.566 0.842 -6.536 453 HD11 LEU 52 HD11 LEU 52 1.931 0.148 -9.425 454 HD12 LEU 52 HD12 LEU 52 0.732 0.450 -8.145 455 HD13 LEU 52 HD13 LEU 52 1.810 1.753 -8.659 456 HD21 LEU 52 HD21 LEU 52 3.167 -1.505 -6.272 457 HD22 LEU 52 HD22 LEU 52 1.488 -1.350 -6.782 458 HD23 LEU 52 HD23 LEU 52 2.728 -1.830 -7.964 459 H GLN 53 H GLN 53 7.790 -0.094 -6.730 460 HA GLN 53 HA GLN 53 7.654 -2.983 -7.519 461 HB2 GLN 53 HB2 GLN 53 9.577 -2.652 -8.894 462 HB3 GLN 53 HB3 GLN 53 8.376 -1.427 -9.289 463 HG2 GLN 53 HG2 GLN 53 9.723 0.118 -7.647 464 HG3 GLN 53 HG3 GLN 53 10.994 -1.102 -7.778 465 HE21 GLN 53 HE21 GLN 53 10.063 1.290 -11.014 466 HE22 GLN 53 HE22 GLN 53 8.872 1.038 -9.730 467 H ASN 54 H ASN 54 8.475 -1.042 -4.974 468 HA ASN 54 HA ASN 54 10.227 -3.167 -3.799 469 HB2 ASN 54 HB2 ASN 54 10.325 -0.180 -3.276 470 HB3 ASN 54 HB3 ASN 54 11.293 -1.381 -2.439 471 HD21 ASN 54 HD21 ASN 54 12.577 0.034 -5.985 472 HD22 ASN 54 HD22 ASN 54 11.075 0.620 -5.279 473 H ILE 55 H ILE 55 7.160 -2.048 -3.708 474 HA ILE 55 HA ILE 55 6.798 -2.024 -0.799 475 HB ILE 55 HB ILE 55 4.496 -1.710 -1.110 476 HG12 ILE 55 HG12 ILE 55 4.807 -2.118 -4.115 477 HG13 ILE 55 HG13 ILE 55 4.043 -3.255 -2.994 478 HG21 ILE 55 HG21 ILE 55 5.745 0.046 -3.247 479 HG22 ILE 55 HG22 ILE 55 4.484 0.448 -2.056 480 HG23 ILE 55 HG23 ILE 55 6.133 0.188 -1.521 481 HD11 ILE 55 HD11 ILE 55 3.088 -0.445 -3.620 482 HD12 ILE 55 HD12 ILE 55 2.304 -1.967 -4.054 483 HD13 ILE 55 HD13 ILE 55 2.398 -1.488 -2.345 484 H THR 56 H THR 56 5.551 -3.536 0.405 485 HA THR 56 HA THR 56 5.142 -6.227 -0.777 486 HB THR 56 HB THR 56 6.003 -6.940 1.665 487 HG1 THR 56 HG1 THR 56 7.795 -5.698 2.249 488 HG21 THR 56 HG21 THR 56 7.968 -6.191 -0.548 489 HG22 THR 56 HG22 THR 56 8.247 -7.368 0.756 490 HG23 THR 56 HG23 THR 56 7.026 -7.698 -0.484 491 H ALA 57 H ALA 57 3.401 -7.376 0.146 492 HA ALA 57 HA ALA 57 1.305 -5.842 1.257 493 HB1 ALA 57 HB1 ALA 57 1.723 -8.868 1.266 494 HB2 ALA 57 HB2 ALA 57 0.184 -8.009 1.501 495 HB3 ALA 57 HB3 ALA 57 1.011 -7.926 -0.064 496 H ILE 58 H ILE 58 3.918 -7.596 2.789 497 HA ILE 58 HA ILE 58 2.912 -7.743 5.492 498 HB ILE 58 HB ILE 58 5.698 -7.693 4.251 499 HG12 ILE 58 HG12 ILE 58 5.796 -10.070 5.035 500 HG13 ILE 58 HG13 ILE 58 4.139 -9.961 5.618 501 HG21 ILE 58 HG21 ILE 58 4.898 -8.057 7.183 502 HG22 ILE 58 HG22 ILE 58 6.507 -8.467 6.537 503 HG23 ILE 58 HG23 ILE 58 5.954 -6.796 6.514 504 HD11 ILE 58 HD11 ILE 58 4.941 -9.659 2.691 505 HD12 ILE 58 HD12 ILE 58 4.447 -11.185 3.449 506 HD13 ILE 58 HD13 ILE 58 3.289 -9.859 3.347 507 H THR 59 H THR 59 5.016 -5.395 3.772 508 HA THR 59 HA THR 59 5.234 -3.647 6.083 509 HB THR 59 HB THR 59 6.083 -3.382 3.187 510 HG1 THR 59 HG1 THR 59 8.028 -4.044 3.967 511 HG21 THR 59 HG21 THR 59 6.894 -1.727 5.619 512 HG22 THR 59 HG22 THR 59 7.660 -1.668 4.009 513 HG23 THR 59 HG23 THR 59 5.981 -1.141 4.208 514 H LEU 60 H LEU 60 3.482 -3.509 2.946 515 HA LEU 60 HA LEU 60 2.193 -1.038 3.397 516 HB2 LEU 60 HB2 LEU 60 2.460 -2.316 1.232 517 HB3 LEU 60 HB3 LEU 60 1.260 -3.457 1.797 518 HG LEU 60 HG LEU 60 -0.403 -1.527 1.885 519 HD11 LEU 60 HD11 LEU 60 1.795 -0.107 0.334 520 HD12 LEU 60 HD12 LEU 60 0.168 0.505 0.661 521 HD13 LEU 60 HD13 LEU 60 1.286 0.317 1.997 522 HD21 LEU 60 HD21 LEU 60 -0.321 -3.084 -0.001 523 HD22 LEU 60 HD22 LEU 60 -0.727 -1.447 -0.545 524 HD23 LEU 60 HD23 LEU 60 0.911 -2.097 -0.792 525 H SER 61 H SER 61 1.257 -4.347 4.450 526 HA SER 61 HA SER 61 -1.179 -3.741 5.699 527 HB2 SER 61 HB2 SER 61 -0.439 -6.009 5.442 528 HB3 SER 61 HB3 SER 61 0.938 -5.718 6.523 529 HG SER 61 HG SER 61 -0.668 -6.690 7.703 530 H LYS 62 H LYS 62 1.987 -2.942 6.642 531 HA LYS 62 HA LYS 62 1.109 -2.055 9.328 532 HB2 LYS 62 HB2 LYS 62 3.874 -2.739 8.281 533 HB3 LYS 62 HB3 LYS 62 3.571 -2.017 9.870 534 HG2 LYS 62 HG2 LYS 62 2.075 -3.917 10.459 535 HG3 LYS 62 HG3 LYS 62 2.441 -4.685 8.904 536 HD2 LYS 62 HD2 LYS 62 4.837 -4.783 9.505 537 HD3 LYS 62 HD3 LYS 62 4.479 -3.982 11.055 538 HE2 LYS 62 HE2 LYS 62 2.947 -5.867 11.646 539 HE3 LYS 62 HE3 LYS 62 3.371 -6.674 10.132 540 HZ1 LYS 62 HZ1 LYS 62 5.284 -6.028 12.317 541 HZ2 LYS 62 HZ2 LYS 62 4.695 -7.513 11.992 542 HZ3 LYS 62 HZ3 LYS 62 5.682 -6.778 10.920 543 H LYS 63 H LYS 63 2.177 -0.672 6.298 544 HA LYS 63 HA LYS 63 2.891 1.962 7.279 545 HB2 LYS 63 HB2 LYS 63 1.817 0.831 4.670 546 HB3 LYS 63 HB3 LYS 63 2.186 2.545 4.850 547 HG2 LYS 63 HG2 LYS 63 4.232 0.306 5.205 548 HG3 LYS 63 HG3 LYS 63 3.921 1.170 3.712 549 HD2 LYS 63 HD2 LYS 63 4.514 3.322 4.940 550 HD3 LYS 63 HD3 LYS 63 5.059 2.288 6.289 551 HE2 LYS 63 HE2 LYS 63 6.612 1.113 4.752 552 HE3 LYS 63 HE3 LYS 63 6.056 2.120 3.408 553 HZ1 LYS 63 HZ1 LYS 63 7.443 3.136 5.836 554 HZ2 LYS 63 HZ2 LYS 63 8.120 2.975 4.361 555 HZ3 LYS 63 HZ3 LYS 63 6.929 4.066 4.592 556 H LEU 64 H LEU 64 -0.143 0.434 6.296 557 HA LEU 64 HA LEU 64 -1.699 2.861 7.045 558 HB2 LEU 64 HB2 LEU 64 -2.336 0.451 5.305 559 HB3 LEU 64 HB3 LEU 64 -3.470 1.739 5.676 560 HG LEU 64 HG LEU 64 -1.179 3.119 4.799 561 HD11 LEU 64 HD11 LEU 64 -1.746 0.829 2.878 562 HD12 LEU 64 HD12 LEU 64 -0.643 2.204 2.619 563 HD13 LEU 64 HD13 LEU 64 -0.282 0.995 3.859 564 HD21 LEU 64 HD21 LEU 64 -3.492 3.735 4.346 565 HD22 LEU 64 HD22 LEU 64 -2.495 3.708 2.889 566 HD23 LEU 64 HD23 LEU 64 -3.646 2.382 3.198 567 H ASN 65 H ASN 65 -0.857 0.062 8.607 568 HA ASN 65 HA ASN 65 -1.702 -1.266 10.220 569 HB2 ASN 65 HB2 ASN 65 -3.395 1.148 10.957 570 HB3 ASN 65 HB3 ASN 65 -3.053 -0.237 11.983 571 HD21 ASN 65 HD21 ASN 65 -0.300 2.719 11.691 572 HD22 ASN 65 HD22 ASN 65 -1.818 2.798 10.807 573 H ILE 66 H ILE 66 -2.576 -2.103 7.972 574 HA ILE 66 HA ILE 66 -5.520 -2.646 8.160 575 HB ILE 66 HB ILE 66 -5.360 -3.129 5.729 576 HG12 ILE 66 HG12 ILE 66 -2.520 -2.011 5.949 577 HG13 ILE 66 HG13 ILE 66 -3.099 -3.582 5.390 578 HG21 ILE 66 HG21 ILE 66 -4.691 -0.273 6.453 579 HG22 ILE 66 HG22 ILE 66 -5.615 -0.860 5.046 580 HG23 ILE 66 HG23 ILE 66 -6.275 -1.051 6.666 581 HD11 ILE 66 HD11 ILE 66 -3.583 -0.956 3.957 582 HD12 ILE 66 HD12 ILE 66 -2.408 -2.201 3.525 583 HD13 ILE 66 HD13 ILE 66 -4.161 -2.556 3.439 584 H THR 67 H THR 67 -5.531 -4.840 6.390 585 HA THR 67 HA THR 67 -4.016 -6.934 7.857 586 HB THR 67 HB THR 67 -5.483 -8.549 6.824 587 HG1 THR 67 HG1 THR 67 -7.296 -7.690 5.612 588 HG21 THR 67 HG21 THR 67 -7.227 -6.294 7.901 589 HG22 THR 67 HG22 THR 67 -7.602 -8.030 7.860 590 HG23 THR 67 HG23 THR 67 -6.306 -7.433 8.910 591 H VAL 68 H VAL 68 -2.938 -8.591 6.592 592 HA VAL 68 HA VAL 68 -1.445 -7.685 4.293 593 HB VAL 68 HB VAL 68 -1.928 -10.479 5.388 594 HG11 VAL 68 HG11 VAL 68 0.130 -9.549 3.338 595 HG12 VAL 68 HG12 VAL 68 0.113 -11.137 4.127 596 HG13 VAL 68 HG13 VAL 68 -1.201 -10.692 3.036 597 HG21 VAL 68 HG21 VAL 68 -0.712 -8.995 6.950 598 HG22 VAL 68 HG22 VAL 68 0.374 -10.215 6.287 599 HG23 VAL 68 HG23 VAL 68 0.431 -8.556 5.660 600 H GLU 69 H GLU 69 -4.718 -8.890 4.570 601 HA GLU 69 HA GLU 69 -4.811 -10.010 1.845 602 HB2 GLU 69 HB2 GLU 69 -6.879 -9.672 4.070 603 HB3 GLU 69 HB3 GLU 69 -7.254 -10.281 2.464 604 HG2 GLU 69 HG2 GLU 69 -7.003 -12.161 3.914 605 HG3 GLU 69 HG3 GLU 69 -5.688 -12.154 2.747 606 H LYS 70 H LYS 70 -5.757 -7.015 3.615 607 HA LYS 70 HA LYS 70 -6.936 -5.784 1.283 608 HB2 LYS 70 HB2 LYS 70 -5.699 -4.629 3.814 609 HB3 LYS 70 HB3 LYS 70 -6.231 -3.635 2.459 610 HG2 LYS 70 HG2 LYS 70 -8.539 -4.824 2.747 611 HG3 LYS 70 HG3 LYS 70 -7.914 -5.256 4.360 612 HD2 LYS 70 HD2 LYS 70 -7.254 -2.773 4.579 613 HD3 LYS 70 HD3 LYS 70 -8.193 -2.472 3.127 614 HE2 LYS 70 HE2 LYS 70 -9.258 -3.671 5.722 615 HE3 LYS 70 HE3 LYS 70 -9.350 -1.963 5.286 616 HZ1 LYS 70 HZ1 LYS 70 -10.650 -4.170 3.771 617 HZ2 LYS 70 HZ2 LYS 70 -11.418 -3.100 4.732 618 HZ3 LYS 70 HZ3 LYS 70 -10.710 -2.587 3.355 619 H ALA 71 H ALA 71 -3.759 -5.639 2.857 620 HA ALA 71 HA ALA 71 -2.534 -3.822 1.182 621 HB1 ALA 71 HB1 ALA 71 -1.284 -6.166 2.664 622 HB2 ALA 71 HB2 ALA 71 -0.452 -4.698 2.138 623 HB3 ALA 71 HB3 ALA 71 -1.713 -4.594 3.371 624 H LYS 72 H LYS 72 -2.665 -7.375 0.784 625 HA LYS 72 HA LYS 72 -0.982 -7.502 -1.559 626 HB2 LYS 72 HB2 LYS 72 -1.262 -9.275 0.168 627 HB3 LYS 72 HB3 LYS 72 -2.960 -9.457 -0.278 628 HG2 LYS 72 HG2 LYS 72 -2.339 -10.306 -2.467 629 HG3 LYS 72 HG3 LYS 72 -0.617 -10.019 -2.141 630 HD2 LYS 72 HD2 LYS 72 -2.394 -11.837 -0.443 631 HD3 LYS 72 HD3 LYS 72 -1.433 -12.418 -1.821 632 HE2 LYS 72 HE2 LYS 72 0.640 -11.564 -0.691 633 HE3 LYS 72 HE3 LYS 72 -0.345 -11.086 0.700 634 HZ1 LYS 72 HZ1 LYS 72 0.063 -13.862 -0.294 635 HZ2 LYS 72 HZ2 LYS 72 0.572 -13.260 1.130 636 HZ3 LYS 72 HZ3 LYS 72 -1.018 -13.472 0.872 637 H ASN 73 H ASN 73 -4.445 -7.031 -1.023 638 HA ASN 73 HA ASN 73 -5.250 -7.732 -3.639 639 HB2 ASN 73 HB2 ASN 73 -7.264 -7.361 -2.765 640 HB3 ASN 73 HB3 ASN 73 -6.533 -6.722 -1.312 641 HD21 ASN 73 HD21 ASN 73 -7.267 -3.337 -2.094 642 HD22 ASN 73 HD22 ASN 73 -6.304 -4.408 -1.086 643 H TYR 74 H TYR 74 -4.147 -4.554 -2.393 644 HA TYR 74 HA TYR 74 -4.461 -3.011 -4.727 645 HB2 TYR 74 HB2 TYR 74 -2.289 -2.791 -2.618 646 HB3 TYR 74 HB3 TYR 74 -2.779 -1.525 -3.742 647 HD1 TYR 74 HD1 TYR 74 -3.125 -2.743 -0.502 648 HD2 TYR 74 HD2 TYR 74 -5.403 -0.884 -3.648 649 HE1 TYR 74 HE1 TYR 74 -4.868 -2.057 1.162 650 HE2 TYR 74 HE2 TYR 74 -7.133 -0.184 -1.987 651 HH TYR 74 HH TYR 74 -6.944 -1.127 1.455 652 H ILE 75 H ILE 75 -1.669 -4.939 -3.622 653 HA ILE 75 HA ILE 75 0.082 -4.275 -5.766 654 HB ILE 75 HB ILE 75 0.003 -6.663 -3.875 655 HG12 ILE 75 HG12 ILE 75 1.668 -4.106 -3.786 656 HG13 ILE 75 HG13 ILE 75 0.193 -4.327 -2.856 657 HG21 ILE 75 HG21 ILE 75 2.302 -5.693 -5.639 658 HG22 ILE 75 HG22 ILE 75 2.413 -6.967 -4.406 659 HG23 ILE 75 HG23 ILE 75 1.417 -7.225 -5.824 660 HD11 ILE 75 HD11 ILE 75 2.780 -5.863 -2.483 661 HD12 ILE 75 HD12 ILE 75 2.014 -4.704 -1.387 662 HD13 ILE 75 HD13 ILE 75 1.237 -6.268 -1.688 663 H LYS 76 H LYS 76 -2.520 -6.656 -5.603 664 HA LYS 76 HA LYS 76 -1.704 -8.080 -8.037 665 HB2 LYS 76 HB2 LYS 76 -3.967 -8.292 -6.033 666 HB3 LYS 76 HB3 LYS 76 -4.069 -9.132 -7.573 667 HG2 LYS 76 HG2 LYS 76 -1.642 -9.504 -5.801 668 HG3 LYS 76 HG3 LYS 76 -3.142 -10.399 -5.522 669 HD2 LYS 76 HD2 LYS 76 -3.094 -11.291 -7.825 670 HD3 LYS 76 HD3 LYS 76 -1.589 -10.411 -8.152 671 HE2 LYS 76 HE2 LYS 76 -0.418 -11.691 -6.428 672 HE3 LYS 76 HE3 LYS 76 -1.916 -12.503 -5.954 673 HZ1 LYS 76 HZ1 LYS 76 -0.715 -12.746 -8.663 674 HZ2 LYS 76 HZ2 LYS 76 -0.494 -13.836 -7.475 675 HZ3 LYS 76 HZ3 LYS 76 -1.986 -13.615 -8.081 676 H ASN 77 H ASN 77 -4.105 -5.493 -7.258 677 HA ASN 77 HA ASN 77 -5.105 -5.767 -10.034 678 HB2 ASN 77 HB2 ASN 77 -6.848 -4.377 -9.558 679 HB3 ASN 77 HB3 ASN 77 -6.804 -5.569 -8.255 680 HD21 ASN 77 HD21 ASN 77 -6.400 -3.059 -5.763 681 HD22 ASN 77 HD22 ASN 77 -6.020 -4.746 -6.079 682 H SER 78 H SER 78 -3.513 -3.388 -7.861 683 HA SER 78 HA SER 78 -3.145 -1.633 -10.182 684 HB2 SER 78 HB2 SER 78 -3.087 -1.084 -7.209 685 HB3 SER 78 HB3 SER 78 -2.401 0.059 -8.380 686 HG SER 78 HG SER 78 -4.646 0.447 -7.863 687 H ASN 79 H ASN 79 -1.436 -2.382 -11.268 688 HA ASN 79 HA ASN 79 1.189 -2.382 -9.852 689 HB2 ASN 79 HB2 ASN 79 -0.071 -4.694 -10.045 690 HB3 ASN 79 HB3 ASN 79 0.492 -4.673 -11.718 691 HD21 ASN 79 HD21 ASN 79 3.030 -5.266 -8.581 692 HD22 ASN 79 HD22 ASN 79 1.294 -4.969 -8.398 693 H ARG 80 H ARG 80 -0.127 -2.895 -13.185 694 HA ARG 80 HA ARG 80 2.250 -1.647 -14.379 695 HB2 ARG 80 HB2 ARG 80 -0.297 -2.875 -15.478 696 HB3 ARG 80 HB3 ARG 80 0.752 -1.912 -16.508 697 HG2 ARG 80 HG2 ARG 80 1.307 -4.224 -16.792 698 HG3 ARG 80 HG3 ARG 80 2.664 -3.370 -16.063 699 HD2 ARG 80 HD2 ARG 80 2.118 -4.308 -13.859 700 HD3 ARG 80 HD3 ARG 80 0.684 -5.105 -14.514 701 HE ARG 80 HE ARG 80 3.499 -5.903 -14.778 702 HH11 ARG 80 HH11 ARG 80 4.008 -7.867 -15.658 703 HH12 ARG 80 HH12 ARG 80 2.804 -8.775 -16.523 704 HH21 ARG 80 HH21 ARG 80 0.301 -6.470 -16.110 705 HH22 ARG 80 HH22 ARG 80 0.761 -8.013 -16.774 706 H LEU 81 H LEU 81 -0.797 -0.425 -13.326 707 HA LEU 81 HA LEU 81 -0.957 1.959 -14.865 708 HB2 LEU 81 HB2 LEU 81 -2.666 0.867 -13.373 709 HB3 LEU 81 HB3 LEU 81 -1.851 1.556 -11.978 710 HG LEU 81 HG LEU 81 -2.846 3.305 -14.271 711 HD11 LEU 81 HD11 LEU 81 -4.455 2.365 -11.860 712 HD12 LEU 81 HD12 LEU 81 -4.967 3.587 -13.048 713 HD13 LEU 81 HD13 LEU 81 -4.741 1.908 -13.554 714 HD21 LEU 81 HD21 LEU 81 -1.465 4.480 -12.584 715 HD22 LEU 81 HD22 LEU 81 -3.143 4.989 -12.463 716 HD23 LEU 81 HD23 LEU 81 -2.486 3.837 -11.282 717 H GLY 82 H GLY 82 0.942 1.190 -11.972 718 HA2 GLY 82 HA2 GLY 82 2.136 3.878 -11.834 719 HA3 GLY 82 HA3 GLY 82 2.413 2.533 -10.733 720 H ARG 83 H ARG 83 2.801 1.565 -14.020 721 HA ARG 83 HA ARG 83 5.792 1.794 -13.822 722 HB2 ARG 83 HB2 ARG 83 4.042 -0.286 -15.167 723 HB3 ARG 83 HB3 ARG 83 5.729 -0.061 -15.592 724 HG2 ARG 83 HG2 ARG 83 4.739 -0.801 -12.813 725 HG3 ARG 83 HG3 ARG 83 5.410 -1.897 -14.020 726 HD2 ARG 83 HD2 ARG 83 7.450 -0.168 -13.969 727 HD3 ARG 83 HD3 ARG 83 6.804 0.212 -12.382 728 HE ARG 83 HE ARG 83 7.153 -2.097 -11.697 729 HH11 ARG 83 HH11 ARG 83 8.560 -3.823 -11.624 730 HH12 ARG 83 HH12 ARG 83 9.727 -4.042 -12.892 731 HH21 ARG 83 HH21 ARG 83 8.755 -1.332 -14.733 732 HH22 ARG 83 HH22 ARG 83 9.835 -2.692 -14.599 733 H THR 84 H THR 84 3.928 1.218 -16.737 734 HA THR 84 HA THR 84 4.209 3.946 -17.696 735 HB THR 84 HB THR 84 6.457 3.391 -18.111 736 HG1 THR 84 HG1 THR 84 6.500 3.613 -20.330 737 HG21 THR 84 HG21 THR 84 5.590 0.879 -19.599 738 HG22 THR 84 HG22 THR 84 7.238 1.526 -19.480 739 HG23 THR 84 HG23 THR 84 6.425 0.935 -18.027 740 H ASN 85 H ASN 85 2.532 4.351 -18.819 741 HA ASN 85 HA ASN 85 1.317 2.470 -20.747 742 HB2 ASN 85 HB2 ASN 85 -0.948 2.798 -19.612 743 HB3 ASN 85 HB3 ASN 85 0.198 1.771 -18.777 744 HD21 ASN 85 HD21 ASN 85 0.352 3.776 -15.881 745 HD22 ASN 85 HD22 ASN 85 0.862 2.308 -16.695 746 H ASN 86 H ASN 86 2.635 5.267 -20.644 747 HA ASN 86 HA ASN 86 0.468 6.945 -21.793 748 HB2 ASN 86 HB2 ASN 86 1.756 7.763 -19.814 749 HB3 ASN 86 HB3 ASN 86 3.228 7.729 -20.784 750 HD21 ASN 86 HD21 ASN 86 2.564 10.986 -21.982 751 HD22 ASN 86 HD22 ASN 86 3.743 9.736 -21.616 752 H LEU 87 H LEU 87 1.125 4.960 -23.522 753 HA LEU 87 HA LEU 87 2.318 6.362 -25.771 754 HB2 LEU 87 HB2 LEU 87 4.127 4.987 -24.287 755 HB3 LEU 87 HB3 LEU 87 3.489 3.636 -25.207 756 HG LEU 87 HG LEU 87 4.081 4.923 -27.327 757 HD11 LEU 87 HD11 LEU 87 5.466 6.780 -25.333 758 HD12 LEU 87 HD12 LEU 87 5.733 6.782 -27.090 759 HD13 LEU 87 HD13 LEU 87 4.158 7.234 -26.438 760 HD21 LEU 87 HD21 LEU 87 5.570 3.191 -26.383 761 HD22 LEU 87 HD22 LEU 87 6.492 4.492 -27.149 762 HD23 LEU 87 HD23 LEU 87 6.366 4.419 -25.376 763 H LYS 88 H LYS 88 2.131 5.048 -27.787 764 HA LYS 88 HA LYS 88 -0.426 3.497 -27.816 765 HB2 LYS 88 HB2 LYS 88 -0.991 4.734 -29.882 766 HB3 LYS 88 HB3 LYS 88 -0.877 5.766 -28.458 767 HG2 LYS 88 HG2 LYS 88 1.306 6.595 -29.125 768 HG3 LYS 88 HG3 LYS 88 1.386 5.445 -30.476 769 HD2 LYS 88 HD2 LYS 88 -0.588 6.541 -31.519 770 HD3 LYS 88 HD3 LYS 88 -0.643 7.706 -30.177 771 HE2 LYS 88 HE2 LYS 88 1.648 8.473 -30.751 772 HE3 LYS 88 HE3 LYS 88 1.719 7.298 -32.071 773 HZ1 LYS 88 HZ1 LYS 88 -0.214 9.550 -31.905 774 HZ2 LYS 88 HZ2 LYS 88 1.092 9.499 -32.880 775 HZ3 LYS 88 HZ3 LYS 88 -0.144 8.464 -33.125 776 H THR 89 H THR 89 2.567 2.743 -28.053 777 HA THR 89 HA THR 89 2.060 0.638 -29.919 778 HB THR 89 HB THR 89 2.976 2.304 -31.470 779 HG1 THR 89 HG1 THR 89 4.464 0.859 -32.335 780 HG21 THR 89 HG21 THR 89 5.632 2.011 -30.001 781 HG22 THR 89 HG22 THR 89 5.293 2.969 -31.458 782 HG23 THR 89 HG23 THR 89 4.596 3.454 -29.902 783 H ILE 90 H ILE 90 2.671 -1.091 -28.952 784 HA ILE 90 HA ILE 90 5.084 -1.208 -27.231 785 HB ILE 90 HB ILE 90 3.646 -2.760 -25.777 786 HG12 ILE 90 HG12 ILE 90 1.680 -2.809 -27.410 787 HG13 ILE 90 HG13 ILE 90 1.407 -2.787 -25.681 788 HG21 ILE 90 HG21 ILE 90 3.118 0.223 -25.672 789 HG22 ILE 90 HG22 ILE 90 2.897 -0.934 -24.341 790 HG23 ILE 90 HG23 ILE 90 4.514 -0.635 -24.997 791 HD11 ILE 90 HD11 ILE 90 1.082 -0.343 -27.473 792 HD12 ILE 90 HD12 ILE 90 -0.208 -1.382 -26.858 793 HD13 ILE 90 HD13 ILE 90 0.760 -0.429 -25.728 794 H GLY 91 H GLY 91 3.940 -2.408 -29.998 795 HA2 GLY 91 HA2 GLY 91 4.186 -4.345 -31.209 796 HA3 GLY 91 HA3 GLY 91 5.451 -4.809 -30.071 797 H ILE 92 H ILE 92 2.393 -4.311 -28.621 798 HA ILE 92 HA ILE 92 0.883 -5.625 -27.585 799 HB ILE 92 HB ILE 92 0.765 -7.222 -30.124 800 HG12 ILE 92 HG12 ILE 92 -0.109 -4.394 -29.403 801 HG13 ILE 92 HG13 ILE 92 0.784 -4.944 -30.824 802 HG21 ILE 92 HG21 ILE 92 -1.377 -6.428 -28.081 803 HG22 ILE 92 HG22 ILE 92 -1.599 -7.466 -29.510 804 HG23 ILE 92 HG23 ILE 92 -0.645 -8.036 -28.169 805 HD11 ILE 92 HD11 ILE 92 -2.155 -5.295 -30.233 806 HD12 ILE 92 HD12 ILE 92 -1.408 -4.316 -31.506 807 HD13 ILE 92 HD13 ILE 92 -1.320 -6.094 -31.598 808 H LEU 93 H LEU 93 3.368 -6.173 -26.699 809 HA LEU 93 HA LEU 93 4.703 -7.578 -25.587 810 HB2 LEU 93 HB2 LEU 93 2.375 -7.644 -24.424 811 HB3 LEU 93 HB3 LEU 93 2.256 -9.277 -25.057 812 HG LEU 93 HG LEU 93 4.389 -9.839 -23.762 813 HD11 LEU 93 HD11 LEU 93 3.894 -7.084 -22.547 814 HD12 LEU 93 HD12 LEU 93 5.014 -8.312 -21.918 815 HD13 LEU 93 HD13 LEU 93 5.324 -7.568 -23.487 816 HD21 LEU 93 HD21 LEU 93 2.143 -10.369 -22.900 817 HD22 LEU 93 HD22 LEU 93 3.250 -9.931 -21.591 818 HD23 LEU 93 HD23 LEU 93 2.039 -8.758 -22.156 819 H GLN 94 H GLN 94 4.435 -8.210 -28.429 820 HA GLN 94 HA GLN 94 5.246 -11.088 -28.504 821 HB2 GLN 94 HB2 GLN 94 3.141 -9.564 -30.061 822 HB3 GLN 94 HB3 GLN 94 3.894 -11.000 -30.762 823 HG2 GLN 94 HG2 GLN 94 3.156 -12.415 -28.971 824 HG3 GLN 94 HG3 GLN 94 2.577 -11.044 -28.026 825 HE21 GLN 94 HE21 GLN 94 -0.425 -10.596 -29.928 826 HE22 GLN 94 HE22 GLN 94 0.753 -9.778 -28.887 827 H GLU 95 H GLU 95 6.916 -8.565 -28.568 828 HA GLU 95 HA GLU 95 7.974 -8.383 -31.279 829 HB2 GLU 95 HB2 GLU 95 9.137 -7.364 -28.659 830 HB3 GLU 95 HB3 GLU 95 9.724 -6.982 -30.284 831 HG2 GLU 95 HG2 GLU 95 7.453 -6.018 -30.809 832 HG3 GLU 95 HG3 GLU 95 7.011 -6.251 -29.113 833 H GLU 96 H GLU 96 9.524 -9.557 -28.254 834 HA GLU 96 HA GLU 96 11.299 -10.894 -27.866 835 HB2 GLU 96 HB2 GLU 96 10.110 -12.622 -30.056 836 HB3 GLU 96 HB3 GLU 96 11.176 -13.151 -28.758 837 HG2 GLU 96 HG2 GLU 96 8.345 -12.072 -28.399 838 HG3 GLU 96 HG3 GLU 96 8.831 -13.755 -28.351 839 H VAL 97 H VAL 97 12.253 -8.822 -29.116 840 HA VAL 97 HA VAL 97 14.532 -9.978 -30.652 841 HB VAL 97 HB VAL 97 13.268 -7.279 -31.275 842 HG11 VAL 97 HG11 VAL 97 15.429 -8.895 -32.702 843 HG12 VAL 97 HG12 VAL 97 14.691 -7.398 -33.314 844 HG13 VAL 97 HG13 VAL 97 15.651 -7.352 -31.842 845 HG21 VAL 97 HG21 VAL 97 11.723 -8.975 -32.026 846 HG22 VAL 97 HG22 VAL 97 12.556 -8.324 -33.431 847 HG23 VAL 97 HG23 VAL 97 13.026 -9.915 -32.779 848 H SER 98 H SER 98 16.511 -9.349 -30.029 849 HA SER 98 HA SER 98 18.191 -8.492 -28.775 850 HB2 SER 98 HB2 SER 98 16.786 -5.923 -29.532 851 HB3 SER 98 HB3 SER 98 18.474 -6.064 -29.000 852 HG SER 98 HG SER 98 18.324 -6.067 -31.273 853 H SER 99 H SER 99 16.109 -9.324 -27.006 854 HA SER 99 HA SER 99 17.005 -7.878 -24.582 855 HB2 SER 99 HB2 SER 99 14.980 -6.654 -25.307 856 HB3 SER 99 HB3 SER 99 14.048 -8.160 -25.257 857 HG SER 99 HG SER 99 13.879 -6.861 -23.327 858 H MET 100 H MET 100 14.822 -10.458 -25.798 859 HA MET 100 HA MET 100 15.855 -12.310 -23.689 860 HB2 MET 100 HB2 MET 100 12.997 -12.043 -24.684 861 HB3 MET 100 HB3 MET 100 13.605 -13.304 -23.595 862 HG2 MET 100 HG2 MET 100 14.301 -11.537 -21.977 863 HG3 MET 100 HG3 MET 100 13.558 -10.320 -23.019 864 HE1 MET 100 HE1 MET 100 12.191 -9.389 -20.984 865 HE2 MET 100 HE2 MET 100 11.175 -10.393 -19.925 866 HE3 MET 100 HE3 MET 100 12.939 -10.610 -19.928 867 H GLU 101 H GLU 101 17.259 -12.270 -25.845 868 HA GLU 101 HA GLU 101 16.360 -14.060 -27.969 869 HB2 GLU 101 HB2 GLU 101 19.096 -12.857 -27.437 870 HB3 GLU 101 HB3 GLU 101 18.595 -13.723 -28.899 871 HG2 GLU 101 HG2 GLU 101 16.789 -11.985 -29.227 872 HG3 GLU 101 HG3 GLU 101 17.511 -11.059 -27.907 873 H ALA 102 H ALA 102 15.949 -15.561 -25.847 874 HA ALA 102 HA ALA 102 18.125 -17.604 -25.726 875 HB1 ALA 102 HB1 ALA 102 16.611 -16.420 -23.357 876 HB2 ALA 102 HB2 ALA 102 17.806 -17.731 -23.283 877 HB3 ALA 102 HB3 ALA 102 18.313 -16.102 -23.768 878 H LYS 103 H LYS 103 17.409 -19.637 -24.726 879 HA LYS 103 HA LYS 103 14.533 -20.314 -24.910 880 HB2 LYS 103 HB2 LYS 103 14.856 -22.207 -26.333 881 HB3 LYS 103 HB3 LYS 103 15.440 -20.764 -27.154 882 HG2 LYS 103 HG2 LYS 103 17.781 -21.388 -26.655 883 HG3 LYS 103 HG3 LYS 103 17.225 -22.805 -25.737 884 HD2 LYS 103 HD2 LYS 103 16.133 -23.700 -27.770 885 HD3 LYS 103 HD3 LYS 103 16.722 -22.304 -28.699 886 HE2 LYS 103 HE2 LYS 103 19.063 -22.940 -28.180 887 HE3 LYS 103 HE3 LYS 103 18.490 -24.306 -27.214 888 HZ1 LYS 103 HZ1 LYS 103 18.039 -23.984 -30.135 889 HZ2 LYS 103 HZ2 LYS 103 19.112 -25.007 -29.454 890 HZ3 LYS 103 HZ3 LYS 103 17.513 -25.247 -29.239 891 H SER 104 H SER 104 14.112 -22.534 -24.157 892 HA SER 104 HA SER 104 16.052 -23.651 -22.202 893 HB2 SER 104 HB2 SER 104 14.355 -22.202 -21.016 894 HB3 SER 104 HB3 SER 104 13.099 -23.327 -21.571 895 HG SER 104 HG SER 104 13.930 -23.825 -19.459 896 H MET 105 H MET 105 15.362 -25.906 -21.535 897 HA MET 105 HA MET 105 13.942 -27.429 -23.641 898 HB2 MET 105 HB2 MET 105 16.532 -27.081 -24.115 899 HB3 MET 105 HB3 MET 105 16.724 -28.331 -22.872 900 HG2 MET 105 HG2 MET 105 15.356 -29.877 -24.206 901 HG3 MET 105 HG3 MET 105 14.991 -28.590 -25.365 902 HE1 MET 105 HE1 MET 105 15.635 -30.012 -27.423 903 HE2 MET 105 HE2 MET 105 17.136 -30.952 -27.559 904 HE3 MET 105 HE3 MET 105 15.922 -31.392 -26.338 905 H THR 106 H THR 106 13.529 -29.634 -23.087 906 HA THR 106 HA THR 106 13.335 -30.154 -20.161 907 HB THR 106 HB THR 106 12.024 -31.687 -22.401 908 HG1 THR 106 HG1 THR 106 10.213 -30.408 -22.042 909 HG21 THR 106 HG21 THR 106 11.350 -31.398 -19.440 910 HG22 THR 106 HG22 THR 106 10.331 -32.228 -20.637 911 HG23 THR 106 HG23 THR 106 11.931 -32.866 -20.264 912 H TRP 107 H TRP 107 14.069 -31.871 -19.209 913 HA TRP 107 HA TRP 107 15.858 -33.753 -20.652 914 HB2 TRP 107 HB2 TRP 107 16.064 -32.624 -17.857 915 HB3 TRP 107 HB3 TRP 107 16.809 -34.152 -18.284 916 HD1 TRP 107 HD1 TRP 107 18.999 -34.167 -19.597 917 HE1 TRP 107 HE1 TRP 107 20.690 -32.381 -20.337 918 HE3 TRP 107 HE3 TRP 107 16.156 -29.979 -18.796 919 HZ2 TRP 107 HZ2 TRP 107 20.802 -29.508 -20.536 920 HZ3 TRP 107 HZ3 TRP 107 17.090 -27.725 -19.263 921 HH2 TRP 107 HH2 TRP 107 19.407 -27.474 -20.130 Start of MODEL 2 1 H1 GLY -5 H1 GLY -5 -13.513 -34.005 -62.011 2 H2 GLY -5 H2 GLY -5 -13.654 -35.468 -62.738 3 H3 GLY -5 H3 GLY -5 -13.783 -34.098 -63.625 4 HA2 GLY -5 HA2 GLY -5 -11.641 -35.085 -64.023 5 HA3 GLY -5 HA3 GLY -5 -11.472 -33.533 -63.184 6 H SER -4 H SER -4 -9.675 -33.828 -61.923 7 HA SER -4 HA SER -4 -9.033 -36.331 -60.615 8 HB2 SER -4 HB2 SER -4 -7.339 -34.706 -61.422 9 HB3 SER -4 HB3 SER -4 -7.851 -33.572 -60.152 10 HG SER -4 HG SER -4 -6.033 -34.893 -59.552 11 H HIS -3 H HIS -3 -8.981 -36.834 -58.416 12 HA HIS -3 HA HIS -3 -11.022 -35.457 -56.735 13 HB2 HIS -3 HB2 HIS -3 -11.302 -37.869 -57.240 14 HB3 HIS -3 HB3 HIS -3 -9.788 -38.209 -56.403 15 HD2 HIS -3 HD2 HIS -3 -13.231 -36.496 -55.631 16 HE1 HIS -3 HE1 HIS -3 -11.948 -38.441 -52.056 17 HE2 HIS -3 HE2 HIS -3 -13.822 -37.092 -53.131 18 H MET -2 H MET -2 -9.663 -33.670 -56.298 19 HA MET -2 HA MET -2 -8.005 -34.067 -53.882 20 HB2 MET -2 HB2 MET -2 -6.438 -34.112 -55.870 21 HB3 MET -2 HB3 MET -2 -6.985 -32.480 -56.274 22 HG2 MET -2 HG2 MET -2 -6.190 -31.715 -54.007 23 HG3 MET -2 HG3 MET -2 -5.640 -33.360 -53.685 24 HE1 MET -2 HE1 MET -2 -5.000 -29.961 -55.412 25 HE2 MET -2 HE2 MET -2 -3.704 -30.302 -56.579 26 HE3 MET -2 HE3 MET -2 -5.343 -30.913 -56.875 27 H ALA -1 H ALA -1 -8.360 -32.592 -52.394 28 HA ALA -1 HA ALA -1 -9.074 -29.865 -53.060 29 HB1 ALA -1 HB1 ALA -1 -11.003 -31.615 -51.440 30 HB2 ALA -1 HB2 ALA -1 -11.176 -29.867 -51.704 31 HB3 ALA -1 HB3 ALA -1 -11.317 -30.983 -53.071 32 H SER 0 H SER 0 -9.199 -28.458 -51.158 33 HA SER 0 HA SER 0 -7.667 -29.402 -48.797 34 HB2 SER 0 HB2 SER 0 -6.088 -27.551 -49.024 35 HB3 SER 0 HB3 SER 0 -6.026 -28.676 -50.410 36 HG SER 0 HG SER 0 -5.969 -26.477 -51.073 37 H MET 1 H MET 1 -8.199 -28.499 -46.940 38 HA MET 1 HA MET 1 -9.336 -25.846 -46.664 39 HB2 MET 1 HB2 MET 1 -11.348 -27.222 -47.290 40 HB3 MET 1 HB3 MET 1 -11.067 -28.242 -45.878 41 HG2 MET 1 HG2 MET 1 -11.362 -26.285 -44.400 42 HG3 MET 1 HG3 MET 1 -11.573 -25.235 -45.804 43 HE1 MET 1 HE1 MET 1 -13.537 -26.825 -47.773 44 HE2 MET 1 HE2 MET 1 -15.089 -26.210 -47.178 45 HE3 MET 1 HE3 MET 1 -13.694 -25.116 -47.304 46 H ASP 2 H ASP 2 -8.555 -25.047 -44.792 47 HA ASP 2 HA ASP 2 -7.979 -26.840 -42.483 48 HB2 ASP 2 HB2 ASP 2 -6.085 -24.841 -43.772 49 HB3 ASP 2 HB3 ASP 2 -5.868 -25.450 -42.140 50 HA PRO 3 HA PRO 3 -9.891 -23.544 -40.231 51 HB2 PRO 3 HB2 PRO 3 -9.228 -24.108 -37.647 52 HB3 PRO 3 HB3 PRO 3 -10.215 -25.225 -38.639 53 HG2 PRO 3 HG2 PRO 3 -7.220 -25.337 -38.142 54 HG3 PRO 3 HG3 PRO 3 -8.418 -26.658 -37.966 55 HD2 PRO 3 HD2 PRO 3 -6.913 -26.338 -40.228 56 HD3 PRO 3 HD3 PRO 3 -8.596 -26.940 -40.287 57 H LEU 4 H LEU 4 -6.682 -23.383 -40.808 58 HA LEU 4 HA LEU 4 -6.245 -20.915 -39.195 59 HB2 LEU 4 HB2 LEU 4 -4.226 -22.928 -40.249 60 HB3 LEU 4 HB3 LEU 4 -3.836 -21.466 -39.354 61 HG LEU 4 HG LEU 4 -5.399 -23.818 -38.243 62 HD11 LEU 4 HD11 LEU 4 -2.579 -22.820 -37.677 63 HD12 LEU 4 HD12 LEU 4 -3.397 -24.180 -36.872 64 HD13 LEU 4 HD13 LEU 4 -3.005 -24.280 -38.596 65 HD21 LEU 4 HD21 LEU 4 -6.135 -21.759 -37.134 66 HD22 LEU 4 HD22 LEU 4 -5.086 -22.673 -36.051 67 HD23 LEU 4 HD23 LEU 4 -4.444 -21.250 -36.900 68 H ASP 5 H ASP 5 -7.682 -20.704 -41.570 69 HA ASP 5 HA ASP 5 -5.809 -19.111 -43.282 70 HB2 ASP 5 HB2 ASP 5 -8.384 -20.592 -43.870 71 HB3 ASP 5 HB3 ASP 5 -7.831 -19.307 -44.930 72 H LYS 6 H LYS 6 -7.760 -18.510 -40.815 73 HA LYS 6 HA LYS 6 -8.997 -16.032 -41.993 74 HB2 LYS 6 HB2 LYS 6 -10.170 -17.296 -39.533 75 HB3 LYS 6 HB3 LYS 6 -10.897 -16.271 -40.742 76 HG2 LYS 6 HG2 LYS 6 -11.863 -18.178 -41.455 77 HG3 LYS 6 HG3 LYS 6 -10.339 -18.424 -42.302 78 HD2 LYS 6 HD2 LYS 6 -10.895 -20.478 -41.196 79 HD3 LYS 6 HD3 LYS 6 -9.537 -19.773 -40.305 80 HE2 LYS 6 HE2 LYS 6 -11.132 -18.870 -38.611 81 HE3 LYS 6 HE3 LYS 6 -12.483 -19.559 -39.512 82 HZ1 LYS 6 HZ1 LYS 6 -10.260 -21.176 -38.367 83 HZ2 LYS 6 HZ2 LYS 6 -11.717 -20.966 -37.635 84 HZ3 LYS 6 HZ3 LYS 6 -11.630 -21.756 -39.059 85 H ILE 7 H ILE 7 -7.939 -17.272 -38.862 86 HA ILE 7 HA ILE 7 -6.919 -14.584 -38.087 87 HB ILE 7 HB ILE 7 -7.771 -14.780 -35.889 88 HG12 ILE 7 HG12 ILE 7 -7.738 -17.191 -35.485 89 HG13 ILE 7 HG13 ILE 7 -9.238 -16.425 -35.017 90 HG21 ILE 7 HG21 ILE 7 -10.032 -15.217 -37.868 91 HG22 ILE 7 HG22 ILE 7 -10.140 -14.450 -36.273 92 HG23 ILE 7 HG23 ILE 7 -9.172 -13.699 -37.552 93 HD11 ILE 7 HD11 ILE 7 -8.829 -18.197 -37.460 94 HD12 ILE 7 HD12 ILE 7 -9.688 -18.594 -35.970 95 HD13 ILE 7 HD13 ILE 7 -10.352 -17.358 -37.045 96 H ILE 8 H ILE 8 -5.647 -17.201 -39.034 97 HA ILE 8 HA ILE 8 -4.105 -18.442 -37.118 98 HB ILE 8 HB ILE 8 -4.095 -19.055 -39.441 99 HG12 ILE 8 HG12 ILE 8 -1.332 -18.538 -38.263 100 HG13 ILE 8 HG13 ILE 8 -2.371 -19.939 -37.996 101 HG21 ILE 8 HG21 ILE 8 -2.178 -16.776 -40.056 102 HG22 ILE 8 HG22 ILE 8 -2.884 -17.948 -41.186 103 HG23 ILE 8 HG23 ILE 8 -3.911 -16.728 -40.434 104 HD11 ILE 8 HD11 ILE 8 -0.917 -19.171 -40.560 105 HD12 ILE 8 HD12 ILE 8 -0.606 -20.556 -39.503 106 HD13 ILE 8 HD13 ILE 8 -2.098 -20.495 -40.460 107 H ASN 9 H ASN 9 -2.702 -17.835 -35.626 108 HA ASN 9 HA ASN 9 -0.792 -15.603 -36.069 109 HB2 ASN 9 HB2 ASN 9 -3.112 -14.991 -34.904 110 HB3 ASN 9 HB3 ASN 9 -2.348 -15.682 -33.477 111 HD21 ASN 9 HD21 ASN 9 0.064 -12.939 -33.309 112 HD22 ASN 9 HD22 ASN 9 0.040 -14.700 -33.163 113 H ASP 10 H ASP 10 -0.920 -18.756 -35.392 114 HA ASP 10 HA ASP 10 0.697 -18.742 -33.004 115 HB2 ASP 10 HB2 ASP 10 -1.146 -20.397 -33.519 116 HB3 ASP 10 HB3 ASP 10 -0.106 -21.097 -34.759 117 H ILE 11 H ILE 11 1.669 -17.831 -35.722 118 HA ILE 11 HA ILE 11 4.446 -18.752 -35.459 119 HB ILE 11 HB ILE 11 3.266 -20.338 -36.993 120 HG12 ILE 11 HG12 ILE 11 4.842 -20.506 -38.771 121 HG13 ILE 11 HG13 ILE 11 5.408 -18.861 -38.551 122 HG21 ILE 11 HG21 ILE 11 2.989 -17.991 -38.909 123 HG22 ILE 11 HG22 ILE 11 2.580 -19.685 -39.235 124 HG23 ILE 11 HG23 ILE 11 1.662 -18.782 -38.029 125 HD11 ILE 11 HD11 ILE 11 5.661 -21.080 -36.469 126 HD12 ILE 11 HD12 ILE 11 6.939 -20.579 -37.594 127 HD13 ILE 11 HD13 ILE 11 6.368 -19.447 -36.361 128 H LYS 12 H LYS 12 3.103 -16.328 -34.856 129 HA LYS 12 HA LYS 12 4.713 -14.475 -36.560 130 HB2 LYS 12 HB2 LYS 12 2.331 -14.350 -37.160 131 HB3 LYS 12 HB3 LYS 12 1.901 -14.007 -35.477 132 HG2 LYS 12 HG2 LYS 12 3.156 -11.891 -35.554 133 HG3 LYS 12 HG3 LYS 12 3.708 -12.254 -37.203 134 HD2 LYS 12 HD2 LYS 12 1.399 -12.131 -38.030 135 HD3 LYS 12 HD3 LYS 12 0.791 -11.890 -36.372 136 HE2 LYS 12 HE2 LYS 12 2.131 -9.828 -36.164 137 HE3 LYS 12 HE3 LYS 12 2.776 -10.058 -37.793 138 HZ1 LYS 12 HZ1 LYS 12 -0.094 -9.599 -37.151 139 HZ2 LYS 12 HZ2 LYS 12 0.916 -8.493 -37.796 140 HZ3 LYS 12 HZ3 LYS 12 0.505 -9.816 -38.658 141 H LYS 13 H LYS 13 3.314 -14.903 -33.320 142 HA LYS 13 HA LYS 13 5.358 -13.081 -32.211 143 HB2 LYS 13 HB2 LYS 13 2.900 -12.142 -32.561 144 HB3 LYS 13 HB3 LYS 13 2.546 -13.078 -31.107 145 HG2 LYS 13 HG2 LYS 13 4.492 -11.782 -29.986 146 HG3 LYS 13 HG3 LYS 13 4.585 -10.832 -31.463 147 HD2 LYS 13 HD2 LYS 13 3.303 -9.545 -29.930 148 HD3 LYS 13 HD3 LYS 13 2.171 -10.176 -31.120 149 HE2 LYS 13 HE2 LYS 13 1.129 -10.372 -28.985 150 HE3 LYS 13 HE3 LYS 13 1.548 -12.009 -29.488 151 HZ1 LYS 13 HZ1 LYS 13 3.173 -10.363 -27.610 152 HZ2 LYS 13 HZ2 LYS 13 2.119 -11.516 -27.144 153 HZ3 LYS 13 HZ3 LYS 13 3.457 -11.935 -27.973 154 H GLU 14 H GLU 14 5.765 -13.283 -29.955 155 HA GLU 14 HA GLU 14 5.257 -15.987 -28.766 156 HB2 GLU 14 HB2 GLU 14 7.751 -14.244 -28.698 157 HB3 GLU 14 HB3 GLU 14 7.497 -15.645 -27.649 158 HG2 GLU 14 HG2 GLU 14 7.246 -17.112 -29.607 159 HG3 GLU 14 HG3 GLU 14 7.521 -15.744 -30.692 160 H ALA 15 H ALA 15 5.621 -15.978 -26.359 161 HA ALA 15 HA ALA 15 4.983 -13.515 -24.902 162 HB1 ALA 15 HB1 ALA 15 3.128 -15.941 -24.914 163 HB2 ALA 15 HB2 ALA 15 2.984 -14.538 -23.829 164 HB3 ALA 15 HB3 ALA 15 2.754 -14.336 -25.579 165 H ASN 16 H ASN 16 5.335 -13.746 -22.603 166 HA ASN 16 HA ASN 16 7.441 -15.679 -21.987 167 HB2 ASN 16 HB2 ASN 16 7.523 -13.246 -21.414 168 HB3 ASN 16 HB3 ASN 16 6.195 -13.490 -20.274 169 HD21 ASN 16 HD21 ASN 16 9.949 -14.931 -19.354 170 HD22 ASN 16 HD22 ASN 16 9.540 -14.631 -21.036 171 H ASP 17 H ASP 17 4.035 -15.410 -21.230 172 HA ASP 17 HA ASP 17 4.055 -18.099 -19.967 173 HB2 ASP 17 HB2 ASP 17 2.761 -15.619 -18.773 174 HB3 ASP 17 HB3 ASP 17 2.228 -17.254 -18.403 175 H SER 18 H SER 18 2.401 -19.354 -20.528 176 HA SER 18 HA SER 18 -0.067 -18.246 -21.665 177 HB2 SER 18 HB2 SER 18 1.415 -18.512 -23.645 178 HB3 SER 18 HB3 SER 18 1.576 -20.240 -23.274 179 HG SER 18 HG SER 18 -0.108 -19.798 -24.801 180 H GLY 19 H GLY 19 -1.269 -19.054 -20.112 181 HA2 GLY 19 HA2 GLY 19 -2.781 -21.069 -19.925 182 HA3 GLY 19 HA3 GLY 19 -1.328 -22.018 -19.598 183 H VAL 20 H VAL 20 -0.659 -19.286 -17.966 184 HA VAL 20 HA VAL 20 -2.310 -19.844 -15.568 185 HB VAL 20 HB VAL 20 -0.355 -21.181 -15.258 186 HG11 VAL 20 HG11 VAL 20 1.377 -18.696 -15.561 187 HG12 VAL 20 HG12 VAL 20 1.912 -20.324 -15.107 188 HG13 VAL 20 HG13 VAL 20 1.268 -20.036 -16.728 189 HG21 VAL 20 HG21 VAL 20 -1.312 -20.027 -13.293 190 HG22 VAL 20 HG22 VAL 20 0.427 -20.318 -13.123 191 HG23 VAL 20 HG23 VAL 20 -0.157 -18.690 -13.516 192 H THR 21 H THR 21 -3.138 -18.088 -14.748 193 HA THR 21 HA THR 21 -1.693 -15.551 -14.631 194 HB THR 21 HB THR 21 -4.163 -14.639 -15.604 195 HG1 THR 21 HG1 THR 21 -4.310 -15.543 -17.655 196 HG21 THR 21 HG21 THR 21 -1.498 -14.875 -17.050 197 HG22 THR 21 HG22 THR 21 -2.819 -13.747 -17.449 198 HG23 THR 21 HG23 THR 21 -1.966 -13.598 -15.903 199 H LEU 22 H LEU 22 -2.752 -13.892 -13.439 200 HA LEU 22 HA LEU 22 -4.259 -14.991 -11.137 201 HB2 LEU 22 HB2 LEU 22 -2.588 -12.467 -11.502 202 HB3 LEU 22 HB3 LEU 22 -3.398 -12.974 -10.014 203 HG LEU 22 HG LEU 22 -2.025 -15.271 -10.710 204 HD11 LEU 22 HD11 LEU 22 -0.170 -12.922 -11.331 205 HD12 LEU 22 HD12 LEU 22 0.308 -14.628 -11.189 206 HD13 LEU 22 HD13 LEU 22 -0.748 -14.120 -12.506 207 HD21 LEU 22 HD21 LEU 22 -2.117 -14.274 -8.456 208 HD22 LEU 22 HD22 LEU 22 -0.441 -14.655 -8.890 209 HD23 LEU 22 HD23 LEU 22 -1.015 -12.968 -8.976 210 H ALA 23 H ALA 23 -6.314 -15.024 -11.914 211 HA ALA 23 HA ALA 23 -7.585 -12.473 -12.757 212 HB1 ALA 23 HB1 ALA 23 -7.191 -15.035 -14.352 213 HB2 ALA 23 HB2 ALA 23 -8.173 -13.642 -14.887 214 HB3 ALA 23 HB3 ALA 23 -6.416 -13.474 -14.645 215 HA PRO 24 HA PRO 24 -10.651 -14.846 -10.369 216 HB2 PRO 24 HB2 PRO 24 -12.154 -12.815 -9.361 217 HB3 PRO 24 HB3 PRO 24 -10.505 -13.191 -8.772 218 HG2 PRO 24 HG2 PRO 24 -11.326 -11.068 -10.778 219 HG3 PRO 24 HG3 PRO 24 -10.251 -10.895 -9.358 220 HD2 PRO 24 HD2 PRO 24 -9.305 -11.305 -11.899 221 HD3 PRO 24 HD3 PRO 24 -8.463 -11.954 -10.463 222 H LEU 25 H LEU 25 -11.597 -12.295 -12.680 223 HA LEU 25 HA LEU 25 -13.839 -13.939 -13.700 224 HB2 LEU 25 HB2 LEU 25 -14.071 -11.217 -12.381 225 HB3 LEU 25 HB3 LEU 25 -15.184 -11.652 -13.670 226 HG LEU 25 HG LEU 25 -14.884 -13.258 -11.109 227 HD11 LEU 25 HD11 LEU 25 -17.045 -11.321 -12.036 228 HD12 LEU 25 HD12 LEU 25 -17.078 -12.302 -10.552 229 HD13 LEU 25 HD13 LEU 25 -15.864 -11.027 -10.739 230 HD21 LEU 25 HD21 LEU 25 -15.675 -14.681 -12.961 231 HD22 LEU 25 HD22 LEU 25 -17.041 -14.285 -11.919 232 HD23 LEU 25 HD23 LEU 25 -16.828 -13.434 -13.468 233 H SER 26 H SER 26 -12.009 -14.152 -15.226 234 HA SER 26 HA SER 26 -11.128 -13.797 -17.283 235 HB2 SER 26 HB2 SER 26 -13.708 -14.045 -17.521 236 HB3 SER 26 HB3 SER 26 -13.676 -12.349 -18.015 237 HG SER 26 HG SER 26 -13.475 -13.819 -19.799 238 H VAL 27 H VAL 27 -10.229 -11.934 -15.501 239 HA VAL 27 HA VAL 27 -9.267 -9.754 -17.200 240 HB VAL 27 HB VAL 27 -11.491 -9.029 -16.289 241 HG11 VAL 27 HG11 VAL 27 -10.117 -8.849 -13.582 242 HG12 VAL 27 HG12 VAL 27 -11.772 -8.358 -13.992 243 HG13 VAL 27 HG13 VAL 27 -11.332 -10.070 -14.014 244 HG21 VAL 27 HG21 VAL 27 -9.810 -7.367 -16.971 245 HG22 VAL 27 HG22 VAL 27 -10.798 -6.789 -15.625 246 HG23 VAL 27 HG23 VAL 27 -9.145 -7.349 -15.316 247 HA PRO 28 HA PRO 28 -5.892 -10.761 -14.430 248 HB2 PRO 28 HB2 PRO 28 -3.964 -8.991 -15.159 249 HB3 PRO 28 HB3 PRO 28 -4.568 -10.267 -16.250 250 HG2 PRO 28 HG2 PRO 28 -5.468 -7.365 -16.141 251 HG3 PRO 28 HG3 PRO 28 -4.929 -8.300 -17.575 252 HD2 PRO 28 HD2 PRO 28 -7.560 -8.013 -16.954 253 HD3 PRO 28 HD3 PRO 28 -6.931 -9.540 -17.636 254 H LYS 29 H LYS 29 -7.517 -10.062 -12.826 255 HA LYS 29 HA LYS 29 -8.194 -9.206 -10.885 256 HB2 LYS 29 HB2 LYS 29 -5.801 -9.585 -10.269 257 HB3 LYS 29 HB3 LYS 29 -5.497 -7.887 -10.602 258 HG2 LYS 29 HG2 LYS 29 -5.783 -7.950 -8.266 259 HG3 LYS 29 HG3 LYS 29 -7.353 -7.383 -8.848 260 HD2 LYS 29 HD2 LYS 29 -8.230 -9.707 -8.652 261 HD3 LYS 29 HD3 LYS 29 -6.631 -10.241 -8.088 262 HE2 LYS 29 HE2 LYS 29 -6.806 -8.685 -6.152 263 HE3 LYS 29 HE3 LYS 29 -8.401 -8.165 -6.711 264 HZ1 LYS 29 HZ1 LYS 29 -7.715 -10.944 -5.879 265 HZ2 LYS 29 HZ2 LYS 29 -8.579 -9.882 -4.995 266 HZ3 LYS 29 HZ3 LYS 29 -9.189 -10.458 -6.390 267 HA PRO 30 HA PRO 30 -9.780 -5.367 -12.583 268 HB2 PRO 30 HB2 PRO 30 -12.044 -5.063 -11.096 269 HB3 PRO 30 HB3 PRO 30 -11.879 -6.316 -12.367 270 HG2 PRO 30 HG2 PRO 30 -11.475 -6.633 -9.374 271 HG3 PRO 30 HG3 PRO 30 -12.443 -7.666 -10.474 272 HD2 PRO 30 HD2 PRO 30 -9.891 -8.291 -9.740 273 HD3 PRO 30 HD3 PRO 30 -10.517 -8.676 -11.370 274 H LYS 31 H LYS 31 -9.809 -3.165 -12.034 275 HA LYS 31 HA LYS 31 -7.945 -2.346 -10.041 276 HB2 LYS 31 HB2 LYS 31 -10.085 -0.722 -11.487 277 HB3 LYS 31 HB3 LYS 31 -8.764 -0.009 -10.584 278 HG2 LYS 31 HG2 LYS 31 -8.252 -1.813 -12.978 279 HG3 LYS 31 HG3 LYS 31 -8.665 -0.115 -13.143 280 HD2 LYS 31 HD2 LYS 31 -6.350 -0.091 -13.279 281 HD3 LYS 31 HD3 LYS 31 -6.698 0.459 -11.651 282 HE2 LYS 31 HE2 LYS 31 -4.829 -1.018 -11.541 283 HE3 LYS 31 HE3 LYS 31 -6.187 -1.854 -10.800 284 HZ1 LYS 31 HZ1 LYS 31 -5.243 -2.285 -13.596 285 HZ2 LYS 31 HZ2 LYS 31 -4.908 -3.266 -12.331 286 HZ3 LYS 31 HZ3 LYS 31 -6.447 -3.129 -12.874 287 H LEU 32 H LEU 32 -8.091 -1.508 -8.024 288 HA LEU 32 HA LEU 32 -10.630 -0.703 -6.864 289 HB2 LEU 32 HB2 LEU 32 -10.434 -3.261 -6.546 290 HB3 LEU 32 HB3 LEU 32 -9.010 -2.931 -5.560 291 HG LEU 32 HG LEU 32 -10.738 -1.169 -4.451 292 HD11 LEU 32 HD11 LEU 32 -12.517 -3.499 -5.271 293 HD12 LEU 32 HD12 LEU 32 -12.970 -2.148 -4.207 294 HD13 LEU 32 HD13 LEU 32 -12.620 -1.847 -5.918 295 HD21 LEU 32 HD21 LEU 32 -9.456 -2.838 -3.221 296 HD22 LEU 32 HD22 LEU 32 -11.131 -2.755 -2.637 297 HD23 LEU 32 HD23 LEU 32 -10.625 -4.098 -3.690 298 H GLU 33 H GLU 33 -10.308 0.980 -5.627 299 HA GLU 33 HA GLU 33 -8.187 0.988 -3.607 300 HB2 GLU 33 HB2 GLU 33 -8.786 3.391 -5.386 301 HB3 GLU 33 HB3 GLU 33 -8.115 3.526 -3.758 302 HG2 GLU 33 HG2 GLU 33 -6.145 2.199 -4.421 303 HG3 GLU 33 HG3 GLU 33 -6.802 2.035 -6.059 304 H GLU 34 H GLU 34 -9.242 1.218 -1.649 305 HA GLU 34 HA GLU 34 -11.752 2.749 -1.483 306 HB2 GLU 34 HB2 GLU 34 -12.274 0.366 -2.120 307 HB3 GLU 34 HB3 GLU 34 -11.544 -0.166 -0.597 308 HG2 GLU 34 HG2 GLU 34 -13.170 1.237 0.654 309 HG3 GLU 34 HG3 GLU 34 -13.833 1.831 -0.866 310 H LEU 35 H LEU 35 -10.116 4.113 -0.559 311 HA LEU 35 HA LEU 35 -9.335 3.486 2.261 312 HB2 LEU 35 HB2 LEU 35 -7.865 4.917 0.015 313 HB3 LEU 35 HB3 LEU 35 -7.288 4.863 1.670 314 HG LEU 35 HG LEU 35 -7.804 2.293 0.111 315 HD11 LEU 35 HD11 LEU 35 -5.191 3.823 0.213 316 HD12 LEU 35 HD12 LEU 35 -5.509 2.246 -0.556 317 HD13 LEU 35 HD13 LEU 35 -6.264 3.705 -1.208 318 HD21 LEU 35 HD21 LEU 35 -7.449 2.104 2.582 319 HD22 LEU 35 HD22 LEU 35 -6.148 1.356 1.643 320 HD23 LEU 35 HD23 LEU 35 -5.874 2.921 2.384 321 H SER 36 H SER 36 -9.099 5.299 3.667 322 HA SER 36 HA SER 36 -10.944 7.570 3.250 323 HB2 SER 36 HB2 SER 36 -10.605 6.491 5.476 324 HB3 SER 36 HB3 SER 36 -8.933 7.084 5.478 325 HG SER 36 HG SER 36 -10.466 8.470 6.578 326 H GLU 37 H GLU 37 -9.912 9.862 3.716 327 HA GLU 37 HA GLU 37 -8.277 10.454 1.458 328 HB2 GLU 37 HB2 GLU 37 -9.858 12.015 2.533 329 HB3 GLU 37 HB3 GLU 37 -8.792 12.144 3.940 330 HG2 GLU 37 HG2 GLU 37 -7.020 13.133 2.533 331 HG3 GLU 37 HG3 GLU 37 -8.006 12.895 1.087 332 H GLN 38 H GLN 38 -7.322 10.265 4.919 333 HA GLN 38 HA GLN 38 -4.528 10.868 4.415 334 HB2 GLN 38 HB2 GLN 38 -5.780 11.180 6.603 335 HB3 GLN 38 HB3 GLN 38 -5.761 9.422 6.794 336 HG2 GLN 38 HG2 GLN 38 -3.172 9.609 6.563 337 HG3 GLN 38 HG3 GLN 38 -3.396 11.348 6.742 338 HE21 GLN 38 HE21 GLN 38 -3.898 8.828 9.965 339 HE22 GLN 38 HE22 GLN 38 -3.808 8.172 8.334 340 H GLN 39 H GLN 39 -6.381 7.863 4.813 341 HA GLN 39 HA GLN 39 -4.262 5.952 4.679 342 HB2 GLN 39 HB2 GLN 39 -7.207 5.954 4.068 343 HB3 GLN 39 HB3 GLN 39 -6.248 4.522 3.777 344 HG2 GLN 39 HG2 GLN 39 -6.220 5.880 6.492 345 HG3 GLN 39 HG3 GLN 39 -7.517 4.784 6.040 346 HE21 GLN 39 HE21 GLN 39 -4.631 2.914 7.731 347 HE22 GLN 39 HE22 GLN 39 -5.286 4.507 8.133 348 H LYS 40 H LYS 40 -6.230 7.448 2.058 349 HA LYS 40 HA LYS 40 -4.928 6.091 -0.129 350 HB2 LYS 40 HB2 LYS 40 -7.109 7.205 -0.329 351 HB3 LYS 40 HB3 LYS 40 -6.373 8.776 0.002 352 HG2 LYS 40 HG2 LYS 40 -5.031 8.618 -2.063 353 HG3 LYS 40 HG3 LYS 40 -5.704 7.020 -2.411 354 HD2 LYS 40 HD2 LYS 40 -7.417 9.519 -2.075 355 HD3 LYS 40 HD3 LYS 40 -6.711 9.085 -3.625 356 HE2 LYS 40 HE2 LYS 40 -8.439 7.112 -2.081 357 HE3 LYS 40 HE3 LYS 40 -9.156 8.367 -3.091 358 HZ1 LYS 40 HZ1 LYS 40 -7.244 6.306 -4.107 359 HZ2 LYS 40 HZ2 LYS 40 -8.862 6.329 -4.351 360 HZ3 LYS 40 HZ3 LYS 40 -7.925 7.498 -4.990 361 H ILE 41 H ILE 41 -4.194 9.253 1.487 362 HA ILE 41 HA ILE 41 -1.997 9.864 -0.254 363 HB ILE 41 HB ILE 41 -2.537 10.774 2.555 364 HG12 ILE 41 HG12 ILE 41 -2.912 12.382 -0.022 365 HG13 ILE 41 HG13 ILE 41 -4.196 11.350 0.558 366 HG21 ILE 41 HG21 ILE 41 -0.559 11.892 0.534 367 HG22 ILE 41 HG22 ILE 41 -1.022 12.709 2.040 368 HG23 ILE 41 HG23 ILE 41 -0.184 11.171 2.115 369 HD11 ILE 41 HD11 ILE 41 -3.028 13.722 2.063 370 HD12 ILE 41 HD12 ILE 41 -4.628 13.589 1.316 371 HD13 ILE 41 HD13 ILE 41 -4.229 12.587 2.725 372 H ILE 42 H ILE 42 -1.977 8.056 2.931 373 HA ILE 42 HA ILE 42 0.896 7.809 2.975 374 HB ILE 42 HB ILE 42 -1.243 5.979 4.102 375 HG12 ILE 42 HG12 ILE 42 0.444 7.870 5.764 376 HG13 ILE 42 HG13 ILE 42 -0.995 8.476 4.956 377 HG21 ILE 42 HG21 ILE 42 1.763 6.076 4.668 378 HG22 ILE 42 HG22 ILE 42 0.595 5.140 5.617 379 HG23 ILE 42 HG23 ILE 42 0.876 4.729 3.932 380 HD11 ILE 42 HD11 ILE 42 -0.955 6.153 6.926 381 HD12 ILE 42 HD12 ILE 42 -1.580 7.787 7.211 382 HD13 ILE 42 HD13 ILE 42 -2.378 6.724 6.030 383 H LEU 43 H LEU 43 -1.660 5.750 1.594 384 HA LEU 43 HA LEU 43 -0.027 3.670 0.554 385 HB2 LEU 43 HB2 LEU 43 -2.449 3.590 0.910 386 HB3 LEU 43 HB3 LEU 43 -2.726 4.799 -0.322 387 HG LEU 43 HG LEU 43 -3.290 2.414 -0.857 388 HD11 LEU 43 HD11 LEU 43 -1.340 3.690 -2.804 389 HD12 LEU 43 HD12 LEU 43 -2.595 2.499 -3.168 390 HD13 LEU 43 HD13 LEU 43 -3.051 4.122 -2.618 391 HD21 LEU 43 HD21 LEU 43 -1.326 1.344 0.123 392 HD22 LEU 43 HD22 LEU 43 -1.523 0.889 -1.580 393 HD23 LEU 43 HD23 LEU 43 -0.272 2.059 -1.117 394 H ALA 44 H ALA 44 -1.163 6.691 -0.988 395 HA ALA 44 HA ALA 44 0.197 6.380 -3.466 396 HB1 ALA 44 HB1 ALA 44 -0.712 8.854 -1.959 397 HB2 ALA 44 HB2 ALA 44 -0.285 8.798 -3.684 398 HB3 ALA 44 HB3 ALA 44 -1.701 7.895 -3.089 399 H GLU 45 H GLU 45 1.184 8.365 -0.555 400 HA GLU 45 HA GLU 45 3.639 9.273 -1.637 401 HB2 GLU 45 HB2 GLU 45 2.763 8.751 1.227 402 HB3 GLU 45 HB3 GLU 45 4.354 9.401 0.821 403 HG2 GLU 45 HG2 GLU 45 3.253 11.257 -0.447 404 HG3 GLU 45 HG3 GLU 45 1.694 10.724 0.170 405 H TYR 46 H TYR 46 2.931 6.109 -0.164 406 HA TYR 46 HA TYR 46 5.675 5.315 0.161 407 HB2 TYR 46 HB2 TYR 46 3.739 4.322 1.322 408 HB3 TYR 46 HB3 TYR 46 3.139 3.678 -0.197 409 HD1 TYR 46 HD1 TYR 46 6.758 3.336 -0.008 410 HD2 TYR 46 HD2 TYR 46 3.012 1.642 1.308 411 HE1 TYR 46 HE1 TYR 46 7.898 1.205 0.482 412 HE2 TYR 46 HE2 TYR 46 4.171 -0.532 1.767 413 HH TYR 46 HH TYR 46 7.677 -0.959 1.204 414 H ILE 47 H ILE 47 3.303 4.459 -2.413 415 HA ILE 47 HA ILE 47 5.057 3.167 -4.190 416 HB ILE 47 HB ILE 47 2.402 4.593 -4.390 417 HG12 ILE 47 HG12 ILE 47 3.093 1.623 -4.516 418 HG13 ILE 47 HG13 ILE 47 2.661 2.442 -3.024 419 HG21 ILE 47 HG21 ILE 47 3.793 3.026 -6.585 420 HG22 ILE 47 HG22 ILE 47 2.057 3.403 -6.612 421 HG23 ILE 47 HG23 ILE 47 3.229 4.705 -6.660 422 HD11 ILE 47 HD11 ILE 47 0.830 1.986 -5.402 423 HD12 ILE 47 HD12 ILE 47 0.691 1.346 -3.757 424 HD13 ILE 47 HD13 ILE 47 0.450 3.080 -4.053 425 H ALA 48 H ALA 48 4.153 6.639 -3.834 426 HA ALA 48 HA ALA 48 5.437 7.535 -6.249 427 HB1 ALA 48 HB1 ALA 48 4.707 8.994 -3.679 428 HB2 ALA 48 HB2 ALA 48 5.096 9.762 -5.235 429 HB3 ALA 48 HB3 ALA 48 3.642 8.754 -5.080 430 H GLU 49 H GLU 49 6.650 6.904 -2.983 431 HA GLU 49 HA GLU 49 9.265 8.152 -3.528 432 HB2 GLU 49 HB2 GLU 49 8.113 8.249 -1.299 433 HB3 GLU 49 HB3 GLU 49 8.329 6.503 -1.154 434 HG2 GLU 49 HG2 GLU 49 10.044 7.548 0.121 435 HG3 GLU 49 HG3 GLU 49 10.826 6.863 -1.291 436 H VAL 50 H VAL 50 7.919 4.815 -3.259 437 HA VAL 50 HA VAL 50 10.629 3.771 -3.971 438 HB VAL 50 HB VAL 50 10.287 1.860 -2.862 439 HG11 VAL 50 HG11 VAL 50 8.838 3.848 -1.100 440 HG12 VAL 50 HG12 VAL 50 9.756 2.417 -0.593 441 HG13 VAL 50 HG13 VAL 50 10.597 3.775 -1.357 442 HG21 VAL 50 HG21 VAL 50 8.053 1.169 -3.644 443 HG22 VAL 50 HG22 VAL 50 8.199 1.018 -1.899 444 HG23 VAL 50 HG23 VAL 50 7.296 2.379 -2.595 445 H GLY 51 H GLY 51 7.694 4.289 -5.480 446 HA2 GLY 51 HA2 GLY 51 7.560 4.319 -7.783 447 HA3 GLY 51 HA3 GLY 51 9.009 3.319 -7.903 448 H LEU 52 H LEU 52 6.252 2.288 -6.038 449 HA LEU 52 HA LEU 52 5.043 0.439 -5.994 450 HB2 LEU 52 HB2 LEU 52 4.350 1.724 -8.359 451 HB3 LEU 52 HB3 LEU 52 4.664 0.110 -8.936 452 HG LEU 52 HG LEU 52 2.676 0.888 -6.758 453 HD11 LEU 52 HD11 LEU 52 2.245 -0.058 -9.618 454 HD12 LEU 52 HD12 LEU 52 0.973 0.314 -8.435 455 HD13 LEU 52 HD13 LEU 52 2.026 1.608 -9.026 456 HD21 LEU 52 HD21 LEU 52 3.453 -1.408 -6.358 457 HD22 LEU 52 HD22 LEU 52 1.783 -1.382 -6.918 458 HD23 LEU 52 HD23 LEU 52 3.084 -1.835 -8.044 459 H GLN 53 H GLN 53 8.014 0.234 -6.988 460 HA GLN 53 HA GLN 53 8.096 -2.573 -8.001 461 HB2 GLN 53 HB2 GLN 53 10.068 -0.270 -7.917 462 HB3 GLN 53 HB3 GLN 53 10.565 -1.902 -8.363 463 HG2 GLN 53 HG2 GLN 53 9.305 -1.935 -10.340 464 HG3 GLN 53 HG3 GLN 53 8.219 -0.651 -9.810 465 HE21 GLN 53 HE21 GLN 53 10.360 2.033 -10.737 466 HE22 GLN 53 HE22 GLN 53 8.959 1.531 -9.774 467 H ASN 54 H ASN 54 8.583 -0.869 -5.082 468 HA ASN 54 HA ASN 54 10.158 -3.136 -3.896 469 HB2 ASN 54 HB2 ASN 54 10.423 -0.190 -3.260 470 HB3 ASN 54 HB3 ASN 54 11.365 -1.485 -2.548 471 HD21 ASN 54 HD21 ASN 54 12.517 0.058 -6.107 472 HD22 ASN 54 HD22 ASN 54 11.049 0.640 -5.334 473 H ILE 55 H ILE 55 7.126 -2.042 -3.802 474 HA ILE 55 HA ILE 55 6.767 -1.989 -0.885 475 HB ILE 55 HB ILE 55 4.444 -1.752 -1.215 476 HG12 ILE 55 HG12 ILE 55 4.871 -2.148 -4.209 477 HG13 ILE 55 HG13 ILE 55 4.053 -3.270 -3.111 478 HG21 ILE 55 HG21 ILE 55 5.707 0.076 -3.284 479 HG22 ILE 55 HG22 ILE 55 4.394 0.423 -2.128 480 HG23 ILE 55 HG23 ILE 55 6.033 0.202 -1.546 481 HD11 ILE 55 HD11 ILE 55 3.144 -0.475 -3.844 482 HD12 ILE 55 HD12 ILE 55 2.374 -2.010 -4.267 483 HD13 ILE 55 HD13 ILE 55 2.387 -1.474 -2.569 484 H THR 56 H THR 56 5.592 -3.527 0.347 485 HA THR 56 HA THR 56 5.142 -6.201 -0.860 486 HB THR 56 HB THR 56 6.050 -6.886 1.621 487 HG1 THR 56 HG1 THR 56 8.003 -5.755 1.963 488 HG21 THR 56 HG21 THR 56 7.892 -6.407 -0.766 489 HG22 THR 56 HG22 THR 56 8.203 -7.511 0.594 490 HG23 THR 56 HG23 THR 56 6.870 -7.843 -0.524 491 H ALA 57 H ALA 57 3.374 -7.311 0.054 492 HA ALA 57 HA ALA 57 1.323 -5.784 1.207 493 HB1 ALA 57 HB1 ALA 57 1.738 -8.809 1.242 494 HB2 ALA 57 HB2 ALA 57 0.204 -7.951 1.496 495 HB3 ALA 57 HB3 ALA 57 1.005 -7.877 -0.083 496 H ILE 58 H ILE 58 3.937 -7.505 2.748 497 HA ILE 58 HA ILE 58 2.921 -7.630 5.460 498 HB ILE 58 HB ILE 58 5.696 -7.703 4.192 499 HG12 ILE 58 HG12 ILE 58 5.696 -10.094 4.962 500 HG13 ILE 58 HG13 ILE 58 4.039 -9.920 5.529 501 HG21 ILE 58 HG21 ILE 58 4.877 -8.044 7.118 502 HG22 ILE 58 HG22 ILE 58 6.463 -8.556 6.480 503 HG23 ILE 58 HG23 ILE 58 6.013 -6.852 6.454 504 HD11 ILE 58 HD11 ILE 58 4.888 -9.625 2.614 505 HD12 ILE 58 HD12 ILE 58 4.325 -11.137 3.352 506 HD13 ILE 58 HD13 ILE 58 3.222 -9.766 3.248 507 H THR 59 H THR 59 4.922 -5.313 3.626 508 HA THR 59 HA THR 59 5.314 -3.542 5.938 509 HB THR 59 HB THR 59 5.996 -3.234 2.994 510 HG1 THR 59 HG1 THR 59 7.795 -4.174 3.484 511 HG21 THR 59 HG21 THR 59 6.868 -1.670 5.471 512 HG22 THR 59 HG22 THR 59 7.629 -1.543 3.865 513 HG23 THR 59 HG23 THR 59 5.945 -1.032 4.086 514 H LEU 60 H LEU 60 3.459 -3.536 2.908 515 HA LEU 60 HA LEU 60 2.125 -1.080 3.261 516 HB2 LEU 60 HB2 LEU 60 2.426 -2.627 1.206 517 HB3 LEU 60 HB3 LEU 60 1.103 -3.576 1.844 518 HG LEU 60 HG LEU 60 -0.353 -1.485 1.646 519 HD11 LEU 60 HD11 LEU 60 2.191 -0.489 0.283 520 HD12 LEU 60 HD12 LEU 60 0.618 0.259 0.080 521 HD13 LEU 60 HD13 LEU 60 1.349 0.242 1.684 522 HD21 LEU 60 HD21 LEU 60 -0.277 -3.259 -0.099 523 HD22 LEU 60 HD22 LEU 60 -0.572 -1.652 -0.782 524 HD23 LEU 60 HD23 LEU 60 1.040 -2.391 -0.904 525 H SER 61 H SER 61 1.225 -4.392 4.444 526 HA SER 61 HA SER 61 -1.223 -3.639 5.621 527 HB2 SER 61 HB2 SER 61 -1.193 -5.615 6.883 528 HB3 SER 61 HB3 SER 61 -0.557 -5.974 5.288 529 HG SER 61 HG SER 61 0.659 -6.878 7.075 530 H LYS 62 H LYS 62 1.954 -2.983 6.587 531 HA LYS 62 HA LYS 62 1.176 -2.240 9.346 532 HB2 LYS 62 HB2 LYS 62 3.872 -2.814 8.091 533 HB3 LYS 62 HB3 LYS 62 3.705 -2.087 9.697 534 HG2 LYS 62 HG2 LYS 62 2.359 -3.985 10.478 535 HG3 LYS 62 HG3 LYS 62 2.469 -4.756 8.885 536 HD2 LYS 62 HD2 LYS 62 4.924 -4.848 9.079 537 HD3 LYS 62 HD3 LYS 62 4.848 -4.077 10.670 538 HE2 LYS 62 HE2 LYS 62 3.511 -6.737 9.971 539 HE3 LYS 62 HE3 LYS 62 5.131 -6.606 10.665 540 HZ1 LYS 62 HZ1 LYS 62 2.642 -5.651 11.988 541 HZ2 LYS 62 HZ2 LYS 62 3.492 -6.975 12.404 542 HZ3 LYS 62 HZ3 LYS 62 4.150 -5.495 12.608 543 H LYS 63 H LYS 63 2.373 -0.697 6.398 544 HA LYS 63 HA LYS 63 3.011 1.900 7.441 545 HB2 LYS 63 HB2 LYS 63 1.953 0.844 4.779 546 HB3 LYS 63 HB3 LYS 63 2.401 2.531 4.999 547 HG2 LYS 63 HG2 LYS 63 4.507 0.597 5.866 548 HG3 LYS 63 HG3 LYS 63 4.077 0.499 4.154 549 HD2 LYS 63 HD2 LYS 63 4.486 2.881 3.859 550 HD3 LYS 63 HD3 LYS 63 4.900 3.065 5.578 551 HE2 LYS 63 HE2 LYS 63 6.340 1.187 3.671 552 HE3 LYS 63 HE3 LYS 63 6.803 2.884 3.867 553 HZ1 LYS 63 HZ1 LYS 63 6.783 0.898 6.086 554 HZ2 LYS 63 HZ2 LYS 63 8.121 1.434 5.316 555 HZ3 LYS 63 HZ3 LYS 63 7.235 2.464 6.214 556 H LEU 64 H LEU 64 0.023 0.382 6.562 557 HA LEU 64 HA LEU 64 -1.596 2.841 7.063 558 HB2 LEU 64 HB2 LEU 64 -1.783 0.441 5.233 559 HB3 LEU 64 HB3 LEU 64 -3.141 1.536 5.442 560 HG LEU 64 HG LEU 64 -0.569 2.909 4.805 561 HD11 LEU 64 HD11 LEU 64 -1.826 1.064 2.720 562 HD12 LEU 64 HD12 LEU 64 -0.538 2.264 2.441 563 HD13 LEU 64 HD13 LEU 64 -0.222 0.864 3.472 564 HD21 LEU 64 HD21 LEU 64 -2.770 4.037 4.807 565 HD22 LEU 64 HD22 LEU 64 -2.005 4.058 3.205 566 HD23 LEU 64 HD23 LEU 64 -3.343 2.939 3.519 567 H ASN 65 H ASN 65 -0.831 0.097 8.716 568 HA ASN 65 HA ASN 65 -1.768 -1.254 10.266 569 HB2 ASN 65 HB2 ASN 65 -3.501 1.179 10.834 570 HB3 ASN 65 HB3 ASN 65 -3.201 -0.163 11.930 571 HD21 ASN 65 HD21 ASN 65 -0.421 2.779 11.570 572 HD22 ASN 65 HD22 ASN 65 -1.875 2.779 10.579 573 H ILE 66 H ILE 66 -2.511 -2.390 8.222 574 HA ILE 66 HA ILE 66 -5.446 -2.937 8.266 575 HB ILE 66 HB ILE 66 -4.947 -3.255 5.647 576 HG12 ILE 66 HG12 ILE 66 -3.329 -0.773 6.124 577 HG13 ILE 66 HG13 ILE 66 -2.479 -2.274 6.096 578 HG21 ILE 66 HG21 ILE 66 -5.552 -0.581 6.964 579 HG22 ILE 66 HG22 ILE 66 -5.976 -1.054 5.303 580 HG23 ILE 66 HG23 ILE 66 -6.713 -1.894 6.678 581 HD11 ILE 66 HD11 ILE 66 -4.125 -1.082 3.828 582 HD12 ILE 66 HD12 ILE 66 -2.375 -1.381 3.876 583 HD13 ILE 66 HD13 ILE 66 -3.505 -2.746 3.805 584 H THR 67 H THR 67 -5.879 -4.958 6.799 585 HA THR 67 HA THR 67 -4.235 -7.137 7.837 586 HB THR 67 HB THR 67 -5.834 -8.571 7.320 587 HG1 THR 67 HG1 THR 67 -7.097 -8.476 5.437 588 HG21 THR 67 HG21 THR 67 -7.604 -6.169 6.652 589 HG22 THR 67 HG22 THR 67 -8.107 -7.743 7.289 590 HG23 THR 67 HG23 THR 67 -7.177 -6.649 8.324 591 H VAL 68 H VAL 68 -3.120 -8.703 6.555 592 HA VAL 68 HA VAL 68 -1.546 -7.699 4.335 593 HB VAL 68 HB VAL 68 -1.997 -10.474 5.475 594 HG11 VAL 68 HG11 VAL 68 0.063 -9.590 3.397 595 HG12 VAL 68 HG12 VAL 68 0.094 -11.139 4.265 596 HG13 VAL 68 HG13 VAL 68 -1.229 -10.790 3.157 597 HG21 VAL 68 HG21 VAL 68 -0.801 -8.866 6.967 598 HG22 VAL 68 HG22 VAL 68 0.265 -10.162 6.421 599 HG23 VAL 68 HG23 VAL 68 0.380 -8.560 5.670 600 H GLU 69 H GLU 69 -4.735 -9.172 4.488 601 HA GLU 69 HA GLU 69 -4.695 -10.107 1.688 602 HB2 GLU 69 HB2 GLU 69 -6.873 -10.093 3.810 603 HB3 GLU 69 HB3 GLU 69 -7.054 -10.712 2.165 604 HG2 GLU 69 HG2 GLU 69 -5.208 -12.337 2.577 605 HG3 GLU 69 HG3 GLU 69 -5.083 -11.766 4.242 606 H LYS 70 H LYS 70 -5.789 -7.366 3.644 607 HA LYS 70 HA LYS 70 -7.223 -6.068 1.500 608 HB2 LYS 70 HB2 LYS 70 -7.363 -5.707 4.132 609 HB3 LYS 70 HB3 LYS 70 -6.098 -4.508 3.794 610 HG2 LYS 70 HG2 LYS 70 -7.742 -3.868 1.778 611 HG3 LYS 70 HG3 LYS 70 -8.945 -4.699 2.776 612 HD2 LYS 70 HD2 LYS 70 -7.186 -2.391 3.636 613 HD3 LYS 70 HD3 LYS 70 -8.810 -2.193 2.982 614 HE2 LYS 70 HE2 LYS 70 -8.155 -3.708 5.552 615 HE3 LYS 70 HE3 LYS 70 -8.680 -2.020 5.476 616 HZ1 LYS 70 HZ1 LYS 70 -10.301 -4.335 4.550 617 HZ2 LYS 70 HZ2 LYS 70 -10.566 -3.465 5.902 618 HZ3 LYS 70 HZ3 LYS 70 -10.757 -2.768 4.441 619 H ALA 71 H ALA 71 -4.009 -5.734 2.954 620 HA ALA 71 HA ALA 71 -2.952 -3.708 1.319 621 HB1 ALA 71 HB1 ALA 71 -1.557 -6.052 2.688 622 HB2 ALA 71 HB2 ALA 71 -0.786 -4.565 2.124 623 HB3 ALA 71 HB3 ALA 71 -1.968 -4.494 3.439 624 H LYS 72 H LYS 72 -2.755 -7.308 0.801 625 HA LYS 72 HA LYS 72 -1.154 -6.971 -1.576 626 HB2 LYS 72 HB2 LYS 72 -1.214 -9.324 -1.808 627 HB3 LYS 72 HB3 LYS 72 -1.186 -9.030 -0.070 628 HG2 LYS 72 HG2 LYS 72 -3.761 -9.263 -0.165 629 HG3 LYS 72 HG3 LYS 72 -3.537 -9.918 -1.785 630 HD2 LYS 72 HD2 LYS 72 -2.373 -11.047 0.799 631 HD3 LYS 72 HD3 LYS 72 -3.752 -11.693 -0.103 632 HE2 LYS 72 HE2 LYS 72 -2.249 -12.078 -2.070 633 HE3 LYS 72 HE3 LYS 72 -0.875 -11.513 -1.106 634 HZ1 LYS 72 HZ1 LYS 72 -2.560 -13.881 -0.457 635 HZ2 LYS 72 HZ2 LYS 72 -1.048 -13.940 -1.061 636 HZ3 LYS 72 HZ3 LYS 72 -1.297 -13.359 0.442 637 H ASN 73 H ASN 73 -4.617 -7.029 -1.000 638 HA ASN 73 HA ASN 73 -5.430 -7.580 -3.609 639 HB2 ASN 73 HB2 ASN 73 -7.391 -7.434 -2.551 640 HB3 ASN 73 HB3 ASN 73 -6.649 -6.644 -1.176 641 HD21 ASN 73 HD21 ASN 73 -7.751 -3.400 -2.033 642 HD22 ASN 73 HD22 ASN 73 -6.666 -4.342 -1.020 643 H TYR 74 H TYR 74 -4.187 -4.519 -2.319 644 HA TYR 74 HA TYR 74 -4.724 -2.865 -4.595 645 HB2 TYR 74 HB2 TYR 74 -2.570 -2.622 -2.464 646 HB3 TYR 74 HB3 TYR 74 -3.100 -1.347 -3.555 647 HD1 TYR 74 HD1 TYR 74 -3.200 -2.180 -0.298 648 HD2 TYR 74 HD2 TYR 74 -5.959 -1.274 -3.492 649 HE1 TYR 74 HE1 TYR 74 -4.913 -1.454 1.373 650 HE2 TYR 74 HE2 TYR 74 -7.696 -0.652 -1.816 651 HH TYR 74 HH TYR 74 -7.107 -0.804 1.695 652 H ILE 75 H ILE 75 -1.876 -4.747 -3.487 653 HA ILE 75 HA ILE 75 -0.140 -4.027 -5.638 654 HB ILE 75 HB ILE 75 -0.081 -6.517 -3.882 655 HG12 ILE 75 HG12 ILE 75 1.189 -3.775 -3.440 656 HG13 ILE 75 HG13 ILE 75 -0.168 -4.426 -2.533 657 HG21 ILE 75 HG21 ILE 75 2.155 -5.124 -5.431 658 HG22 ILE 75 HG22 ILE 75 2.349 -6.539 -4.373 659 HG23 ILE 75 HG23 ILE 75 1.425 -6.692 -5.848 660 HD11 ILE 75 HD11 ILE 75 2.686 -5.429 -2.447 661 HD12 ILE 75 HD12 ILE 75 1.727 -4.693 -1.158 662 HD13 ILE 75 HD13 ILE 75 1.295 -6.306 -1.757 663 H LYS 76 H LYS 76 -2.578 -6.633 -5.357 664 HA LYS 76 HA LYS 76 -1.700 -8.031 -7.740 665 HB2 LYS 76 HB2 LYS 76 -4.251 -8.158 -6.084 666 HB3 LYS 76 HB3 LYS 76 -3.912 -9.240 -7.435 667 HG2 LYS 76 HG2 LYS 76 -2.089 -9.015 -5.014 668 HG3 LYS 76 HG3 LYS 76 -3.435 -10.148 -5.124 669 HD2 LYS 76 HD2 LYS 76 -2.384 -11.220 -7.095 670 HD3 LYS 76 HD3 LYS 76 -1.038 -10.057 -7.019 671 HE2 LYS 76 HE2 LYS 76 -0.507 -10.822 -4.716 672 HE3 LYS 76 HE3 LYS 76 -1.829 -11.994 -4.796 673 HZ1 LYS 76 HZ1 LYS 76 0.546 -12.001 -6.590 674 HZ2 LYS 76 HZ2 LYS 76 0.330 -13.004 -5.323 675 HZ3 LYS 76 HZ3 LYS 76 -0.664 -13.107 -6.609 676 H ASN 77 H ASN 77 -4.191 -5.458 -7.219 677 HA ASN 77 HA ASN 77 -4.965 -5.752 -10.048 678 HB2 ASN 77 HB2 ASN 77 -6.644 -4.257 -9.712 679 HB3 ASN 77 HB3 ASN 77 -6.707 -5.295 -8.284 680 HD21 ASN 77 HD21 ASN 77 -6.320 -2.502 -6.117 681 HD22 ASN 77 HD22 ASN 77 -6.131 -4.261 -6.175 682 H SER 78 H SER 78 -3.307 -3.426 -7.848 683 HA SER 78 HA SER 78 -2.772 -1.767 -10.190 684 HB2 SER 78 HB2 SER 78 -3.716 -0.777 -8.094 685 HB3 SER 78 HB3 SER 78 -2.149 -1.067 -7.310 686 HG SER 78 HG SER 78 -2.326 1.044 -8.260 687 H ASN 79 H ASN 79 -1.256 -2.964 -11.271 688 HA ASN 79 HA ASN 79 1.469 -3.097 -10.050 689 HB2 ASN 79 HB2 ASN 79 -0.114 -5.260 -9.925 690 HB3 ASN 79 HB3 ASN 79 0.430 -5.503 -11.575 691 HD21 ASN 79 HD21 ASN 79 2.974 -5.932 -8.392 692 HD22 ASN 79 HD22 ASN 79 1.308 -5.345 -8.226 693 H ARG 80 H ARG 80 -0.301 -3.708 -13.136 694 HA ARG 80 HA ARG 80 2.110 -3.206 -14.737 695 HB2 ARG 80 HB2 ARG 80 -0.770 -3.937 -15.360 696 HB3 ARG 80 HB3 ARG 80 0.309 -3.389 -16.634 697 HG2 ARG 80 HG2 ARG 80 0.284 -5.788 -16.600 698 HG3 ARG 80 HG3 ARG 80 1.892 -5.189 -16.194 699 HD2 ARG 80 HD2 ARG 80 1.499 -5.693 -13.804 700 HD3 ARG 80 HD3 ARG 80 -0.162 -6.174 -14.168 701 HE ARG 80 HE ARG 80 0.581 -8.191 -15.072 702 HH11 ARG 80 HH11 ARG 80 2.014 -9.861 -15.314 703 HH12 ARG 80 HH12 ARG 80 3.716 -9.596 -15.071 704 HH21 ARG 80 HH21 ARG 80 3.422 -6.273 -14.290 705 HH22 ARG 80 HH22 ARG 80 4.498 -7.622 -14.518 706 H LEU 81 H LEU 81 -0.129 -1.105 -13.346 707 HA LEU 81 HA LEU 81 0.031 0.996 -15.356 708 HB2 LEU 81 HB2 LEU 81 -1.380 0.500 -12.825 709 HB3 LEU 81 HB3 LEU 81 -0.697 2.117 -12.837 710 HG LEU 81 HG LEU 81 -2.435 1.016 -15.090 711 HD11 LEU 81 HD11 LEU 81 -3.176 2.840 -12.759 712 HD12 LEU 81 HD12 LEU 81 -4.233 2.399 -14.124 713 HD13 LEU 81 HD13 LEU 81 -3.708 1.158 -12.975 714 HD21 LEU 81 HD21 LEU 81 -0.972 2.903 -15.783 715 HD22 LEU 81 HD22 LEU 81 -2.659 3.424 -15.687 716 HD23 LEU 81 HD23 LEU 81 -1.518 3.849 -14.386 717 H GLY 82 H GLY 82 1.657 0.429 -12.212 718 HA2 GLY 82 HA2 GLY 82 3.391 2.787 -12.597 719 HA3 GLY 82 HA3 GLY 82 3.361 1.713 -11.200 720 H ARG 83 H ARG 83 4.994 2.499 -14.069 721 HA ARG 83 HA ARG 83 6.396 -0.144 -14.316 722 HB2 ARG 83 HB2 ARG 83 5.843 2.014 -16.378 723 HB3 ARG 83 HB3 ARG 83 6.757 0.539 -16.690 724 HG2 ARG 83 HG2 ARG 83 3.864 0.514 -15.723 725 HG3 ARG 83 HG3 ARG 83 4.303 0.561 -17.416 726 HD2 ARG 83 HD2 ARG 83 5.600 -1.607 -15.793 727 HD3 ARG 83 HD3 ARG 83 3.869 -1.741 -16.002 728 HE ARG 83 HE ARG 83 5.917 -2.083 -18.054 729 HH11 ARG 83 HH11 ARG 83 5.327 -2.786 -20.078 730 HH12 ARG 83 HH12 ARG 83 3.659 -2.749 -20.562 731 HH21 ARG 83 HH21 ARG 83 2.472 -1.457 -17.602 732 HH22 ARG 83 HH22 ARG 83 2.096 -2.012 -19.214 733 H THR 84 H THR 84 8.529 -0.239 -14.963 734 HA THR 84 HA THR 84 10.311 1.452 -13.451 735 HB THR 84 HB THR 84 10.525 -1.013 -13.836 736 HG1 THR 84 HG1 THR 84 12.301 -0.284 -13.041 737 HG21 THR 84 HG21 THR 84 11.678 -0.269 -16.555 738 HG22 THR 84 HG22 THR 84 11.594 -1.879 -15.815 739 HG23 THR 84 HG23 THR 84 10.105 -1.060 -16.299 740 H ASN 85 H ASN 85 9.321 1.568 -16.817 741 HA ASN 85 HA ASN 85 11.608 3.201 -17.598 742 HB2 ASN 85 HB2 ASN 85 9.100 2.400 -19.121 743 HB3 ASN 85 HB3 ASN 85 10.448 3.296 -19.808 744 HD21 ASN 85 HD21 ASN 85 10.708 -0.677 -19.762 745 HD22 ASN 85 HD22 ASN 85 9.204 0.184 -19.478 746 H ASN 86 H ASN 86 11.811 5.272 -17.365 747 HA ASN 86 HA ASN 86 9.615 7.199 -17.667 748 HB2 ASN 86 HB2 ASN 86 9.678 6.469 -15.220 749 HB3 ASN 86 HB3 ASN 86 11.323 7.081 -15.129 750 HD21 ASN 86 HD21 ASN 86 9.473 9.852 -13.772 751 HD22 ASN 86 HD22 ASN 86 10.498 8.476 -13.369 752 H LEU 87 H LEU 87 10.716 9.520 -17.417 753 HA LEU 87 HA LEU 87 12.113 11.038 -18.308 754 HB2 LEU 87 HB2 LEU 87 13.452 9.910 -16.344 755 HB3 LEU 87 HB3 LEU 87 14.467 9.275 -17.630 756 HG LEU 87 HG LEU 87 14.916 11.664 -18.372 757 HD11 LEU 87 HD11 LEU 87 13.498 12.350 -15.758 758 HD12 LEU 87 HD12 LEU 87 14.476 13.463 -16.713 759 HD13 LEU 87 HD13 LEU 87 12.975 12.837 -17.401 760 HD21 LEU 87 HD21 LEU 87 16.487 10.429 -16.907 761 HD22 LEU 87 HD22 LEU 87 16.461 12.160 -16.531 762 HD23 LEU 87 HD23 LEU 87 15.611 11.017 -15.473 763 H LYS 88 H LYS 88 11.047 9.227 -20.160 764 HA LYS 88 HA LYS 88 13.082 9.120 -22.359 765 HB2 LYS 88 HB2 LYS 88 12.015 7.069 -23.126 766 HB3 LYS 88 HB3 LYS 88 12.647 6.885 -21.500 767 HG2 LYS 88 HG2 LYS 88 10.515 6.887 -20.491 768 HG3 LYS 88 HG3 LYS 88 9.721 7.627 -21.882 769 HD2 LYS 88 HD2 LYS 88 10.917 4.823 -21.939 770 HD3 LYS 88 HD3 LYS 88 9.228 5.183 -21.534 771 HE2 LYS 88 HE2 LYS 88 8.922 6.313 -23.730 772 HE3 LYS 88 HE3 LYS 88 10.592 5.935 -24.165 773 HZ1 LYS 88 HZ1 LYS 88 8.489 3.911 -23.612 774 HZ2 LYS 88 HZ2 LYS 88 9.044 4.314 -25.092 775 HZ3 LYS 88 HZ3 LYS 88 10.034 3.568 -24.030 776 H THR 89 H THR 89 10.509 10.887 -21.523 777 HA THR 89 HA THR 89 10.016 11.663 -24.243 778 HB THR 89 HB THR 89 8.289 9.920 -24.003 779 HG1 THR 89 HG1 THR 89 6.669 11.264 -24.782 780 HG21 THR 89 HG21 THR 89 6.911 11.757 -22.003 781 HG22 THR 89 HG22 THR 89 6.334 10.201 -22.634 782 HG23 THR 89 HG23 THR 89 7.738 10.246 -21.552 783 H ILE 90 H ILE 90 10.225 13.722 -24.213 784 HA ILE 90 HA ILE 90 9.127 15.427 -22.052 785 HB ILE 90 HB ILE 90 11.274 16.783 -22.360 786 HG12 ILE 90 HG12 ILE 90 12.114 15.487 -24.356 787 HG13 ILE 90 HG13 ILE 90 13.241 16.014 -23.126 788 HG21 ILE 90 HG21 ILE 90 11.461 14.137 -20.879 789 HG22 ILE 90 HG22 ILE 90 12.454 15.580 -20.589 790 HG23 ILE 90 HG23 ILE 90 10.709 15.630 -20.289 791 HD11 ILE 90 HD11 ILE 90 12.269 13.138 -23.419 792 HD12 ILE 90 HD12 ILE 90 13.822 13.793 -23.938 793 HD13 ILE 90 HD13 ILE 90 13.431 13.741 -22.216 794 H GLY 91 H GLY 91 8.709 14.820 -25.173 795 HA2 GLY 91 HA2 GLY 91 8.002 16.007 -27.012 796 HA3 GLY 91 HA3 GLY 91 7.877 17.450 -25.999 797 H ILE 92 H ILE 92 11.001 16.270 -25.795 798 HA ILE 92 HA ILE 92 13.030 17.000 -26.472 799 HB ILE 92 HB ILE 92 11.916 16.782 -29.278 800 HG12 ILE 92 HG12 ILE 92 11.211 14.773 -28.052 801 HG13 ILE 92 HG13 ILE 92 12.408 14.416 -29.269 802 HG21 ILE 92 HG21 ILE 92 14.721 16.413 -28.137 803 HG22 ILE 92 HG22 ILE 92 14.234 15.814 -29.737 804 HG23 ILE 92 HG23 ILE 92 14.200 17.534 -29.410 805 HD11 ILE 92 HD11 ILE 92 13.040 14.660 -26.295 806 HD12 ILE 92 HD12 ILE 92 12.761 13.146 -27.169 807 HD13 ILE 92 HD13 ILE 92 14.161 14.150 -27.574 808 H LEU 93 H LEU 93 11.302 19.055 -25.681 809 HA LEU 93 HA LEU 93 10.985 21.268 -25.621 810 HB2 LEU 93 HB2 LEU 93 13.478 20.807 -25.074 811 HB3 LEU 93 HB3 LEU 93 13.823 21.539 -26.632 812 HG LEU 93 HG LEU 93 12.676 23.661 -25.796 813 HD11 LEU 93 HD11 LEU 93 12.695 22.149 -23.145 814 HD12 LEU 93 HD12 LEU 93 12.398 23.890 -23.339 815 HD13 LEU 93 HD13 LEU 93 11.255 22.729 -24.014 816 HD21 LEU 93 HD21 LEU 93 15.122 23.375 -25.731 817 HD22 LEU 93 HD22 LEU 93 14.546 24.314 -24.347 818 HD23 LEU 93 HD23 LEU 93 14.998 22.607 -24.131 819 H GLN 94 H GLN 94 10.125 20.132 -28.153 820 HA GLN 94 HA GLN 94 10.255 22.555 -29.899 821 HB2 GLN 94 HB2 GLN 94 10.474 21.166 -31.851 822 HB3 GLN 94 HB3 GLN 94 11.812 20.889 -30.749 823 HG2 GLN 94 HG2 GLN 94 11.052 18.743 -30.125 824 HG3 GLN 94 HG3 GLN 94 9.405 19.035 -30.685 825 HE21 GLN 94 HE21 GLN 94 10.126 18.324 -34.138 826 HE22 GLN 94 HE22 GLN 94 9.054 19.241 -33.083 827 H GLU 95 H GLU 95 8.113 21.878 -28.038 828 HA GLU 95 HA GLU 95 5.848 21.553 -29.967 829 HB2 GLU 95 HB2 GLU 95 6.340 19.477 -28.673 830 HB3 GLU 95 HB3 GLU 95 5.996 20.358 -27.178 831 HG2 GLU 95 HG2 GLU 95 3.683 20.737 -27.905 832 HG3 GLU 95 HG3 GLU 95 4.029 20.043 -29.490 833 H GLU 96 H GLU 96 4.047 22.788 -29.670 834 HA GLU 96 HA GLU 96 4.419 25.282 -28.182 835 HB2 GLU 96 HB2 GLU 96 2.281 24.347 -30.133 836 HB3 GLU 96 HB3 GLU 96 2.367 25.973 -29.451 837 HG2 GLU 96 HG2 GLU 96 4.555 24.725 -31.172 838 HG3 GLU 96 HG3 GLU 96 3.267 25.766 -31.769 839 H VAL 97 H VAL 97 4.363 23.847 -26.196 840 HA VAL 97 HA VAL 97 1.709 24.204 -24.911 841 HB VAL 97 HB VAL 97 3.419 21.679 -24.769 842 HG11 VAL 97 HG11 VAL 97 0.880 22.368 -23.222 843 HG12 VAL 97 HG12 VAL 97 1.604 20.749 -23.328 844 HG13 VAL 97 HG13 VAL 97 2.496 22.042 -22.539 845 HG21 VAL 97 HG21 VAL 97 1.974 21.774 -26.780 846 HG22 VAL 97 HG22 VAL 97 1.408 20.544 -25.653 847 HG23 VAL 97 HG23 VAL 97 0.562 22.106 -25.760 848 H SER 98 H SER 98 1.775 24.659 -22.727 849 HA SER 98 HA SER 98 2.423 25.516 -20.785 850 HB2 SER 98 HB2 SER 98 3.620 23.369 -20.587 851 HB3 SER 98 HB3 SER 98 5.097 24.157 -21.176 852 HG SER 98 HG SER 98 4.954 24.102 -18.869 853 H SER 99 H SER 99 5.324 25.981 -22.905 854 HA SER 99 HA SER 99 6.061 28.515 -21.761 855 HB2 SER 99 HB2 SER 99 6.623 27.410 -24.541 856 HB3 SER 99 HB3 SER 99 7.455 28.775 -23.770 857 HG SER 99 HG SER 99 8.614 26.801 -23.529 858 H MET 100 H MET 100 3.867 27.643 -24.367 859 HA MET 100 HA MET 100 2.494 30.226 -24.092 860 HB2 MET 100 HB2 MET 100 3.362 29.051 -26.770 861 HB3 MET 100 HB3 MET 100 2.016 30.183 -26.613 862 HG2 MET 100 HG2 MET 100 4.869 30.784 -25.763 863 HG3 MET 100 HG3 MET 100 4.138 31.263 -27.291 864 HE1 MET 100 HE1 MET 100 5.006 33.741 -26.743 865 HE2 MET 100 HE2 MET 100 4.559 34.632 -25.270 866 HE3 MET 100 HE3 MET 100 5.610 33.203 -25.157 867 H GLU 101 H GLU 101 0.296 29.981 -24.148 868 HA GLU 101 HA GLU 101 -0.906 27.412 -25.027 869 HB2 GLU 101 HB2 GLU 101 -0.134 27.470 -22.520 870 HB3 GLU 101 HB3 GLU 101 -1.550 28.486 -22.265 871 HG2 GLU 101 HG2 GLU 101 -3.010 26.661 -23.064 872 HG3 GLU 101 HG3 GLU 101 -1.603 25.717 -23.560 873 H ALA 102 H ALA 102 -1.045 30.637 -25.376 874 HA ALA 102 HA ALA 102 -3.912 31.111 -25.037 875 HB1 ALA 102 HB1 ALA 102 -1.693 32.861 -26.175 876 HB2 ALA 102 HB2 ALA 102 -3.343 33.387 -25.776 877 HB3 ALA 102 HB3 ALA 102 -2.255 32.846 -24.486 878 H LYS 103 H LYS 103 -5.355 31.700 -26.665 879 HA LYS 103 HA LYS 103 -4.741 30.831 -29.473 880 HB2 LYS 103 HB2 LYS 103 -7.319 30.476 -27.894 881 HB3 LYS 103 HB3 LYS 103 -7.109 30.050 -29.588 882 HG2 LYS 103 HG2 LYS 103 -5.594 28.764 -27.274 883 HG3 LYS 103 HG3 LYS 103 -7.009 28.099 -28.086 884 HD2 LYS 103 HD2 LYS 103 -5.764 28.010 -30.232 885 HD3 LYS 103 HD3 LYS 103 -4.316 28.644 -29.420 886 HE2 LYS 103 HE2 LYS 103 -4.315 26.704 -27.881 887 HE3 LYS 103 HE3 LYS 103 -5.759 26.061 -28.677 888 HZ1 LYS 103 HZ1 LYS 103 -3.127 26.478 -30.004 889 HZ2 LYS 103 HZ2 LYS 103 -3.730 25.034 -29.543 890 HZ3 LYS 103 HZ3 LYS 103 -4.461 25.877 -30.734 891 H SER 104 H SER 104 -5.088 33.587 -27.886 892 HA SER 104 HA SER 104 -7.065 34.953 -29.563 893 HB2 SER 104 HB2 SER 104 -6.359 36.947 -28.232 894 HB3 SER 104 HB3 SER 104 -6.974 35.592 -27.269 895 HG SER 104 HG SER 104 -5.041 36.495 -26.394 896 H MET 105 H MET 105 -6.571 36.885 -30.766 897 HA MET 105 HA MET 105 -4.170 36.606 -32.453 898 HB2 MET 105 HB2 MET 105 -6.722 38.243 -32.642 899 HB3 MET 105 HB3 MET 105 -5.325 38.578 -33.664 900 HG2 MET 105 HG2 MET 105 -6.778 37.190 -34.908 901 HG3 MET 105 HG3 MET 105 -5.335 36.264 -34.509 902 HE1 MET 105 HE1 MET 105 -6.404 34.040 -35.264 903 HE2 MET 105 HE2 MET 105 -8.008 33.461 -34.753 904 HE3 MET 105 HE3 MET 105 -7.869 34.925 -35.753 905 H THR 106 H THR 106 -2.711 38.245 -32.906 906 HA THR 106 HA THR 106 -2.282 40.319 -30.817 907 HB THR 106 HB THR 106 -0.394 38.862 -31.558 908 HG1 THR 106 HG1 THR 106 1.037 40.560 -31.601 909 HG21 THR 106 HG21 THR 106 -0.480 40.510 -34.127 910 HG22 THR 106 HG22 THR 106 0.769 39.340 -33.650 911 HG23 THR 106 HG23 THR 106 -0.869 38.779 -34.010 912 H TRP 107 H TRP 107 -1.473 42.438 -31.657 913 HA TRP 107 HA TRP 107 -3.639 43.529 -33.394 914 HB2 TRP 107 HB2 TRP 107 -3.614 44.085 -30.937 915 HB3 TRP 107 HB3 TRP 107 -2.136 44.996 -31.214 916 HD1 TRP 107 HD1 TRP 107 -2.412 47.404 -32.172 917 HE1 TRP 107 HE1 TRP 107 -4.404 48.907 -32.798 918 HE3 TRP 107 HE3 TRP 107 -6.132 43.893 -32.007 919 HZ2 TRP 107 HZ2 TRP 107 -7.254 48.617 -33.187 920 HZ3 TRP 107 HZ3 TRP 107 -8.494 44.540 -32.516 921 HH2 TRP 107 HH2 TRP 107 -9.058 46.890 -33.105 Start of MODEL 3 1 H1 GLY -5 H1 GLY -5 -44.516 -29.257 -28.643 2 H2 GLY -5 H2 GLY -5 -45.662 -30.376 -28.977 3 H3 GLY -5 H3 GLY -5 -44.080 -30.806 -28.955 4 HA2 GLY -5 HA2 GLY -5 -45.170 -31.591 -26.960 5 HA3 GLY -5 HA3 GLY -5 -43.920 -30.384 -26.598 6 H SER -4 H SER -4 -45.440 -30.495 -24.592 7 HA SER -4 HA SER -4 -47.158 -28.077 -24.687 8 HB2 SER -4 HB2 SER -4 -48.720 -29.934 -25.053 9 HB3 SER -4 HB3 SER -4 -48.148 -30.731 -23.579 10 HG SER -4 HG SER -4 -50.064 -29.476 -23.249 11 H HIS -3 H HIS -3 -46.271 -30.674 -22.330 12 HA HIS -3 HA HIS -3 -44.694 -28.729 -20.747 13 HB2 HIS -3 HB2 HIS -3 -47.051 -28.602 -19.910 14 HB3 HIS -3 HB3 HIS -3 -46.982 -30.313 -19.505 15 HD2 HIS -3 HD2 HIS -3 -45.606 -30.985 -17.295 16 HE1 HIS -3 HE1 HIS -3 -44.496 -27.049 -16.071 17 HE2 HIS -3 HE2 HIS -3 -44.559 -29.500 -15.381 18 H MET -2 H MET -2 -42.859 -29.850 -21.252 19 HA MET -2 HA MET -2 -42.420 -32.474 -19.979 20 HB2 MET -2 HB2 MET -2 -41.517 -33.465 -22.069 21 HB3 MET -2 HB3 MET -2 -43.240 -33.121 -22.165 22 HG2 MET -2 HG2 MET -2 -42.867 -31.153 -23.520 23 HG3 MET -2 HG3 MET -2 -41.127 -31.229 -23.258 24 HE1 MET -2 HE1 MET -2 -44.221 -33.044 -24.919 25 HE2 MET -2 HE2 MET -2 -43.425 -34.289 -25.908 26 HE3 MET -2 HE3 MET -2 -43.416 -34.426 -24.140 27 H ALA -1 H ALA -1 -41.511 -30.073 -19.105 28 HA ALA -1 HA ALA -1 -38.599 -30.465 -19.281 29 HB1 ALA -1 HB1 ALA -1 -40.007 -27.846 -19.978 30 HB2 ALA -1 HB2 ALA -1 -38.245 -28.082 -19.898 31 HB3 ALA -1 HB3 ALA -1 -39.202 -28.925 -21.138 32 H SER 0 H SER 0 -37.410 -28.968 -17.862 33 HA SER 0 HA SER 0 -38.815 -28.327 -15.316 34 HB2 SER 0 HB2 SER 0 -37.043 -29.435 -14.077 35 HB3 SER 0 HB3 SER 0 -37.821 -30.573 -15.198 36 HG SER 0 HG SER 0 -35.529 -30.738 -15.248 37 H MET 1 H MET 1 -37.569 -26.961 -13.883 38 HA MET 1 HA MET 1 -35.770 -25.022 -15.295 39 HB2 MET 1 HB2 MET 1 -38.106 -24.235 -14.926 40 HB3 MET 1 HB3 MET 1 -37.878 -24.420 -13.184 41 HG2 MET 1 HG2 MET 1 -35.955 -22.812 -13.321 42 HG3 MET 1 HG3 MET 1 -36.295 -22.591 -15.038 43 HE1 MET 1 HE1 MET 1 -39.594 -22.478 -15.061 44 HE2 MET 1 HE2 MET 1 -39.760 -20.714 -14.988 45 HE3 MET 1 HE3 MET 1 -38.486 -21.440 -15.993 46 H ASP 2 H ASP 2 -33.774 -25.493 -14.566 47 HA ASP 2 HA ASP 2 -33.203 -25.493 -11.667 48 HB2 ASP 2 HB2 ASP 2 -33.794 -27.851 -12.412 49 HB3 ASP 2 HB3 ASP 2 -32.382 -27.800 -13.468 50 HA PRO 3 HA PRO 3 -29.634 -23.515 -13.507 51 HB2 PRO 3 HB2 PRO 3 -28.251 -22.710 -11.305 52 HB3 PRO 3 HB3 PRO 3 -29.877 -22.066 -11.689 53 HG2 PRO 3 HG2 PRO 3 -29.178 -24.342 -9.800 54 HG3 PRO 3 HG3 PRO 3 -30.213 -22.915 -9.472 55 HD2 PRO 3 HD2 PRO 3 -31.250 -25.329 -10.235 56 HD3 PRO 3 HD3 PRO 3 -31.982 -23.780 -10.746 57 H LEU 4 H LEU 4 -29.352 -26.559 -12.230 58 HA LEU 4 HA LEU 4 -26.401 -26.666 -12.636 59 HB2 LEU 4 HB2 LEU 4 -28.159 -28.572 -11.065 60 HB3 LEU 4 HB3 LEU 4 -26.409 -28.609 -11.182 61 HG LEU 4 HG LEU 4 -28.023 -26.422 -9.833 62 HD11 LEU 4 HD11 LEU 4 -26.213 -28.593 -8.701 63 HD12 LEU 4 HD12 LEU 4 -27.044 -27.323 -7.773 64 HD13 LEU 4 HD13 LEU 4 -27.988 -28.562 -8.613 65 HD21 LEU 4 HD21 LEU 4 -25.947 -25.472 -10.752 66 HD22 LEU 4 HD22 LEU 4 -25.819 -25.629 -9.000 67 HD23 LEU 4 HD23 LEU 4 -25.003 -26.809 -10.051 68 H ASP 5 H ASP 5 -28.115 -26.720 -14.923 69 HA ASP 5 HA ASP 5 -27.607 -29.472 -15.953 70 HB2 ASP 5 HB2 ASP 5 -29.511 -27.257 -16.662 71 HB3 ASP 5 HB3 ASP 5 -29.004 -28.324 -17.953 72 H LYS 6 H LYS 6 -25.823 -26.806 -15.849 73 HA LYS 6 HA LYS 6 -24.832 -26.994 -18.687 74 HB2 LYS 6 HB2 LYS 6 -24.346 -24.535 -17.020 75 HB3 LYS 6 HB3 LYS 6 -24.398 -24.742 -18.754 76 HG2 LYS 6 HG2 LYS 6 -26.419 -23.758 -18.578 77 HG3 LYS 6 HG3 LYS 6 -26.969 -25.386 -18.187 78 HD2 LYS 6 HD2 LYS 6 -27.928 -23.894 -16.576 79 HD3 LYS 6 HD3 LYS 6 -26.670 -24.810 -15.730 80 HE2 LYS 6 HE2 LYS 6 -25.103 -22.900 -15.978 81 HE3 LYS 6 HE3 LYS 6 -26.322 -22.000 -16.886 82 HZ1 LYS 6 HZ1 LYS 6 -26.690 -22.917 -14.081 83 HZ2 LYS 6 HZ2 LYS 6 -26.217 -21.399 -14.495 84 HZ3 LYS 6 HZ3 LYS 6 -27.698 -21.934 -14.920 85 H ILE 7 H ILE 7 -23.607 -26.119 -15.509 86 HA ILE 7 HA ILE 7 -20.903 -27.197 -16.185 87 HB ILE 7 HB ILE 7 -19.945 -25.240 -14.944 88 HG12 ILE 7 HG12 ILE 7 -21.243 -23.151 -14.827 89 HG13 ILE 7 HG13 ILE 7 -22.720 -24.003 -15.256 90 HG21 ILE 7 HG21 ILE 7 -21.531 -24.536 -17.441 91 HG22 ILE 7 HG22 ILE 7 -20.058 -23.752 -16.844 92 HG23 ILE 7 HG23 ILE 7 -19.994 -25.427 -17.409 93 HD11 ILE 7 HD11 ILE 7 -21.094 -24.532 -12.732 94 HD12 ILE 7 HD12 ILE 7 -22.511 -23.470 -12.830 95 HD13 ILE 7 HD13 ILE 7 -22.701 -25.201 -13.125 96 H ILE 8 H ILE 8 -23.309 -28.042 -14.439 97 HA ILE 8 HA ILE 8 -22.906 -28.080 -11.779 98 HB ILE 8 HB ILE 8 -24.739 -29.159 -12.858 99 HG12 ILE 8 HG12 ILE 8 -23.275 -30.977 -10.898 100 HG13 ILE 8 HG13 ILE 8 -24.321 -29.612 -10.504 101 HG21 ILE 8 HG21 ILE 8 -23.038 -31.606 -13.448 102 HG22 ILE 8 HG22 ILE 8 -24.736 -31.321 -13.877 103 HG23 ILE 8 HG23 ILE 8 -23.468 -30.389 -14.665 104 HD11 ILE 8 HD11 ILE 8 -25.151 -32.270 -11.742 105 HD12 ILE 8 HD12 ILE 8 -25.525 -31.660 -10.124 106 HD13 ILE 8 HD13 ILE 8 -26.247 -30.885 -11.546 107 H ASN 9 H ASN 9 -21.395 -28.536 -10.369 108 HA ASN 9 HA ASN 9 -19.848 -31.018 -10.458 109 HB2 ASN 9 HB2 ASN 9 -18.569 -29.026 -11.687 110 HB3 ASN 9 HB3 ASN 9 -18.253 -28.462 -10.048 111 HD21 ASN 9 HD21 ASN 9 -16.256 -31.540 -9.418 112 HD22 ASN 9 HD22 ASN 9 -17.483 -30.591 -8.571 113 H ASP 10 H ASP 10 -20.047 -31.839 -8.340 114 HA ASP 10 HA ASP 10 -19.679 -30.162 -6.041 115 HB2 ASP 10 HB2 ASP 10 -22.042 -29.554 -6.624 116 HB3 ASP 10 HB3 ASP 10 -22.464 -31.269 -6.560 117 H ILE 11 H ILE 11 -18.071 -31.794 -6.112 118 HA ILE 11 HA ILE 11 -17.078 -33.756 -5.905 119 HB ILE 11 HB ILE 11 -19.137 -34.102 -3.738 120 HG12 ILE 11 HG12 ILE 11 -16.315 -32.982 -3.461 121 HG13 ILE 11 HG13 ILE 11 -17.733 -31.958 -3.649 122 HG21 ILE 11 HG21 ILE 11 -16.401 -35.390 -4.188 123 HG22 ILE 11 HG22 ILE 11 -17.328 -35.557 -2.675 124 HG23 ILE 11 HG23 ILE 11 -17.959 -36.231 -4.163 125 HD11 ILE 11 HD11 ILE 11 -17.240 -33.827 -1.310 126 HD12 ILE 11 HD12 ILE 11 -17.195 -32.060 -1.324 127 HD13 ILE 11 HD13 ILE 11 -18.734 -32.901 -1.592 128 H LYS 12 H LYS 12 -17.955 -34.012 -8.066 129 HA LYS 12 HA LYS 12 -18.891 -36.752 -8.406 130 HB2 LYS 12 HB2 LYS 12 -20.999 -35.326 -8.239 131 HB3 LYS 12 HB3 LYS 12 -20.559 -34.577 -9.762 132 HG2 LYS 12 HG2 LYS 12 -20.735 -37.606 -9.494 133 HG3 LYS 12 HG3 LYS 12 -22.207 -36.667 -9.592 134 HD2 LYS 12 HD2 LYS 12 -20.028 -36.642 -11.722 135 HD3 LYS 12 HD3 LYS 12 -21.462 -37.642 -11.773 136 HE2 LYS 12 HE2 LYS 12 -21.514 -34.588 -11.677 137 HE3 LYS 12 HE3 LYS 12 -21.571 -35.548 -13.157 138 HZ1 LYS 12 HZ1 LYS 12 -23.611 -35.662 -11.002 139 HZ2 LYS 12 HZ2 LYS 12 -23.805 -34.970 -12.466 140 HZ3 LYS 12 HZ3 LYS 12 -23.625 -36.584 -12.350 141 H LYS 13 H LYS 13 -18.098 -33.708 -10.078 142 HA LYS 13 HA LYS 13 -16.517 -35.215 -12.085 143 HB2 LYS 13 HB2 LYS 13 -18.066 -32.628 -12.289 144 HB3 LYS 13 HB3 LYS 13 -16.714 -32.956 -13.379 145 HG2 LYS 13 HG2 LYS 13 -17.789 -35.071 -14.091 146 HG3 LYS 13 HG3 LYS 13 -19.182 -34.703 -13.052 147 HD2 LYS 13 HD2 LYS 13 -19.591 -32.615 -14.306 148 HD3 LYS 13 HD3 LYS 13 -18.194 -32.926 -15.339 149 HE2 LYS 13 HE2 LYS 13 -20.651 -34.730 -15.136 150 HE3 LYS 13 HE3 LYS 13 -20.422 -33.485 -16.363 151 HZ1 LYS 13 HZ1 LYS 13 -18.663 -35.856 -16.016 152 HZ2 LYS 13 HZ2 LYS 13 -19.749 -35.637 -17.211 153 HZ3 LYS 13 HZ3 LYS 13 -18.438 -34.676 -17.126 154 H GLU 14 H GLU 14 -14.651 -34.038 -12.961 155 HA GLU 14 HA GLU 14 -13.079 -32.578 -10.897 156 HB2 GLU 14 HB2 GLU 14 -12.622 -35.049 -10.814 157 HB3 GLU 14 HB3 GLU 14 -12.152 -34.994 -12.510 158 HG2 GLU 14 HG2 GLU 14 -10.180 -35.051 -11.143 159 HG3 GLU 14 HG3 GLU 14 -10.255 -33.487 -11.931 160 H ALA 15 H ALA 15 -11.406 -31.236 -11.730 161 HA ALA 15 HA ALA 15 -11.273 -30.799 -14.663 162 HB1 ALA 15 HB1 ALA 15 -12.049 -28.653 -12.644 163 HB2 ALA 15 HB2 ALA 15 -11.722 -28.381 -14.369 164 HB3 ALA 15 HB3 ALA 15 -13.113 -29.364 -13.876 165 H ASN 16 H ASN 16 -9.460 -29.601 -15.382 166 HA ASN 16 HA ASN 16 -7.080 -30.027 -13.763 167 HB2 ASN 16 HB2 ASN 16 -7.333 -30.436 -16.256 168 HB3 ASN 16 HB3 ASN 16 -7.322 -28.685 -16.489 169 HD21 ASN 16 HD21 ASN 16 -3.786 -28.459 -16.040 170 HD22 ASN 16 HD22 ASN 16 -5.283 -27.539 -16.184 171 H ASP 17 H ASP 17 -8.993 -27.189 -14.655 172 HA ASP 17 HA ASP 17 -7.358 -25.445 -12.865 173 HB2 ASP 17 HB2 ASP 17 -8.221 -24.771 -15.710 174 HB3 ASP 17 HB3 ASP 17 -7.533 -23.634 -14.554 175 H SER 18 H SER 18 -8.937 -25.393 -11.287 176 HA SER 18 HA SER 18 -11.575 -24.149 -11.977 177 HB2 SER 18 HB2 SER 18 -12.598 -25.683 -10.345 178 HB3 SER 18 HB3 SER 18 -11.801 -26.561 -11.660 179 HG SER 18 HG SER 18 -11.294 -27.432 -9.579 180 H GLY 19 H GLY 19 -8.850 -23.662 -10.070 181 HA2 GLY 19 HA2 GLY 19 -10.015 -21.333 -8.925 182 HA3 GLY 19 HA3 GLY 19 -9.941 -22.608 -7.691 183 H VAL 20 H VAL 20 -7.681 -21.765 -10.306 184 HA VAL 20 HA VAL 20 -5.462 -21.297 -8.381 185 HB VAL 20 HB VAL 20 -5.770 -23.711 -8.791 186 HG11 VAL 20 HG11 VAL 20 -5.031 -23.135 -11.680 187 HG12 VAL 20 HG12 VAL 20 -5.220 -24.735 -10.932 188 HG13 VAL 20 HG13 VAL 20 -6.621 -23.663 -11.082 189 HG21 VAL 20 HG21 VAL 20 -3.529 -22.803 -8.226 190 HG22 VAL 20 HG22 VAL 20 -3.527 -24.348 -9.094 191 HG23 VAL 20 HG23 VAL 20 -3.115 -22.861 -9.957 192 H THR 21 H THR 21 -6.972 -19.722 -10.483 193 HA THR 21 HA THR 21 -4.710 -18.921 -12.265 194 HB THR 21 HB THR 21 -7.465 -18.292 -13.136 195 HG1 THR 21 HG1 THR 21 -7.766 -20.345 -13.988 196 HG21 THR 21 HG21 THR 21 -5.034 -19.485 -14.552 197 HG22 THR 21 HG22 THR 21 -6.522 -18.912 -15.336 198 HG23 THR 21 HG23 THR 21 -5.444 -17.762 -14.540 199 H LEU 22 H LEU 22 -4.958 -16.707 -13.171 200 HA LEU 22 HA LEU 22 -4.662 -14.937 -10.927 201 HB2 LEU 22 HB2 LEU 22 -4.289 -14.497 -13.922 202 HB3 LEU 22 HB3 LEU 22 -3.600 -13.480 -12.663 203 HG LEU 22 HG LEU 22 -2.887 -16.433 -12.923 204 HD11 LEU 22 HD11 LEU 22 -1.514 -14.059 -14.211 205 HD12 LEU 22 HD12 LEU 22 -0.878 -15.723 -14.130 206 HD13 LEU 22 HD13 LEU 22 -2.369 -15.398 -15.027 207 HD21 LEU 22 HD21 LEU 22 -2.338 -15.362 -10.760 208 HD22 LEU 22 HD22 LEU 22 -0.880 -15.768 -11.677 209 HD23 LEU 22 HD23 LEU 22 -1.449 -14.084 -11.621 210 H ALA 23 H ALA 23 -7.381 -15.549 -11.389 211 HA ALA 23 HA ALA 23 -8.631 -12.936 -12.003 212 HB1 ALA 23 HB1 ALA 23 -9.006 -15.465 -13.666 213 HB2 ALA 23 HB2 ALA 23 -9.986 -13.990 -13.829 214 HB3 ALA 23 HB3 ALA 23 -8.246 -13.949 -14.188 215 HA PRO 24 HA PRO 24 -11.284 -15.022 -8.951 216 HB2 PRO 24 HB2 PRO 24 -12.432 -12.873 -7.766 217 HB3 PRO 24 HB3 PRO 24 -10.706 -13.284 -7.535 218 HG2 PRO 24 HG2 PRO 24 -11.893 -11.253 -9.455 219 HG3 PRO 24 HG3 PRO 24 -10.532 -11.033 -8.312 220 HD2 PRO 24 HD2 PRO 24 -10.174 -11.645 -10.959 221 HD3 PRO 24 HD3 PRO 24 -9.054 -12.225 -9.691 222 H LEU 25 H LEU 25 -12.474 -12.706 -11.368 223 HA LEU 25 HA LEU 25 -15.029 -14.163 -11.608 224 HB2 LEU 25 HB2 LEU 25 -15.202 -12.367 -9.774 225 HB3 LEU 25 HB3 LEU 25 -14.977 -11.174 -11.047 226 HG LEU 25 HG LEU 25 -17.081 -12.078 -12.162 227 HD11 LEU 25 HD11 LEU 25 -17.326 -13.647 -9.557 228 HD12 LEU 25 HD12 LEU 25 -18.617 -13.431 -10.759 229 HD13 LEU 25 HD13 LEU 25 -17.167 -14.339 -11.188 230 HD21 LEU 25 HD21 LEU 25 -17.125 -10.088 -10.712 231 HD22 LEU 25 HD22 LEU 25 -18.616 -11.029 -10.560 232 HD23 LEU 25 HD23 LEU 25 -17.377 -11.121 -9.286 233 H SER 26 H SER 26 -13.424 -14.522 -13.530 234 HA SER 26 HA SER 26 -12.914 -14.276 -15.723 235 HB2 SER 26 HB2 SER 26 -15.477 -14.563 -15.605 236 HB3 SER 26 HB3 SER 26 -15.558 -12.868 -16.104 237 HG SER 26 HG SER 26 -15.595 -14.335 -17.894 238 H VAL 27 H VAL 27 -11.735 -12.357 -14.203 239 HA VAL 27 HA VAL 27 -11.073 -10.268 -16.143 240 HB VAL 27 HB VAL 27 -13.077 -9.452 -14.902 241 HG11 VAL 27 HG11 VAL 27 -11.276 -9.297 -12.461 242 HG12 VAL 27 HG12 VAL 27 -12.943 -8.703 -12.598 243 HG13 VAL 27 HG13 VAL 27 -12.619 -10.441 -12.665 244 HG21 VAL 27 HG21 VAL 27 -11.488 -7.845 -15.882 245 HG22 VAL 27 HG22 VAL 27 -12.237 -7.214 -14.411 246 HG23 VAL 27 HG23 VAL 27 -10.569 -7.811 -14.354 247 HA PRO 28 HA PRO 28 -7.284 -11.321 -14.055 248 HB2 PRO 28 HB2 PRO 28 -5.457 -9.669 -15.204 249 HB3 PRO 28 HB3 PRO 28 -6.343 -10.921 -16.116 250 HG2 PRO 28 HG2 PRO 28 -7.053 -7.973 -15.882 251 HG3 PRO 28 HG3 PRO 28 -6.864 -8.947 -17.377 252 HD2 PRO 28 HD2 PRO 28 -9.296 -8.525 -16.247 253 HD3 PRO 28 HD3 PRO 28 -8.889 -10.092 -17.002 254 H LYS 29 H LYS 29 -8.558 -10.460 -12.169 255 HA LYS 29 HA LYS 29 -8.860 -9.446 -10.202 256 HB2 LYS 29 HB2 LYS 29 -6.496 -10.008 -9.795 257 HB3 LYS 29 HB3 LYS 29 -6.019 -8.442 -10.439 258 HG2 LYS 29 HG2 LYS 29 -5.955 -8.153 -8.106 259 HG3 LYS 29 HG3 LYS 29 -7.448 -7.372 -8.621 260 HD2 LYS 29 HD2 LYS 29 -8.718 -9.398 -7.849 261 HD3 LYS 29 HD3 LYS 29 -7.180 -10.118 -7.370 262 HE2 LYS 29 HE2 LYS 29 -8.065 -9.212 -5.368 263 HE3 LYS 29 HE3 LYS 29 -6.781 -8.110 -5.868 264 HZ1 LYS 29 HZ1 LYS 29 -9.710 -7.676 -6.146 265 HZ2 LYS 29 HZ2 LYS 29 -8.674 -6.822 -5.216 266 HZ3 LYS 29 HZ3 LYS 29 -8.612 -6.679 -6.842 267 HA PRO 30 HA PRO 30 -10.267 -5.509 -11.850 268 HB2 PRO 30 HB2 PRO 30 -12.348 -4.980 -10.190 269 HB3 PRO 30 HB3 PRO 30 -12.403 -6.295 -11.406 270 HG2 PRO 30 HG2 PRO 30 -11.751 -6.516 -8.451 271 HG3 PRO 30 HG3 PRO 30 -12.892 -7.512 -9.409 272 HD2 PRO 30 HD2 PRO 30 -10.321 -8.284 -8.868 273 HD3 PRO 30 HD3 PRO 30 -11.148 -8.740 -10.378 274 H LYS 31 H LYS 31 -9.985 -3.342 -11.392 275 HA LYS 31 HA LYS 31 -8.120 -2.510 -9.370 276 HB2 LYS 31 HB2 LYS 31 -10.015 -0.956 -11.168 277 HB3 LYS 31 HB3 LYS 31 -8.850 -0.177 -10.116 278 HG2 LYS 31 HG2 LYS 31 -8.062 -2.180 -12.279 279 HG3 LYS 31 HG3 LYS 31 -8.209 -0.455 -12.569 280 HD2 LYS 31 HD2 LYS 31 -6.237 -1.735 -10.629 281 HD3 LYS 31 HD3 LYS 31 -5.884 -1.135 -12.250 282 HE2 LYS 31 HE2 LYS 31 -6.766 1.143 -11.484 283 HE3 LYS 31 HE3 LYS 31 -6.762 0.503 -9.836 284 HZ1 LYS 31 HZ1 LYS 31 -4.380 0.722 -11.605 285 HZ2 LYS 31 HZ2 LYS 31 -4.707 1.687 -10.335 286 HZ3 LYS 31 HZ3 LYS 31 -4.340 0.121 -10.085 287 H LEU 32 H LEU 32 -8.369 -1.419 -7.433 288 HA LEU 32 HA LEU 32 -11.095 -1.012 -6.351 289 HB2 LEU 32 HB2 LEU 32 -10.158 -3.282 -5.710 290 HB3 LEU 32 HB3 LEU 32 -8.772 -2.452 -5.002 291 HG LEU 32 HG LEU 32 -10.523 -1.148 -3.607 292 HD11 LEU 32 HD11 LEU 32 -12.194 -3.589 -4.345 293 HD12 LEU 32 HD12 LEU 32 -12.610 -2.363 -3.128 294 HD13 LEU 32 HD13 LEU 32 -12.547 -1.918 -4.838 295 HD21 LEU 32 HD21 LEU 32 -9.002 -2.647 -2.588 296 HD22 LEU 32 HD22 LEU 32 -10.603 -2.967 -1.904 297 HD23 LEU 32 HD23 LEU 32 -9.951 -4.075 -3.123 298 H GLU 33 H GLU 33 -11.310 0.777 -5.138 299 HA GLU 33 HA GLU 33 -9.008 2.008 -3.761 300 HB2 GLU 33 HB2 GLU 33 -10.890 3.551 -5.602 301 HB3 GLU 33 HB3 GLU 33 -9.870 4.288 -4.359 302 HG2 GLU 33 HG2 GLU 33 -7.845 3.397 -5.482 303 HG3 GLU 33 HG3 GLU 33 -8.860 2.691 -6.749 304 H GLU 34 H GLU 34 -9.648 1.868 -1.671 305 HA GLU 34 HA GLU 34 -12.304 2.819 -0.889 306 HB2 GLU 34 HB2 GLU 34 -12.895 0.753 0.330 307 HB3 GLU 34 HB3 GLU 34 -12.714 0.435 -1.396 308 HG2 GLU 34 HG2 GLU 34 -10.640 -0.687 -1.110 309 HG3 GLU 34 HG3 GLU 34 -10.396 -0.051 0.507 310 H LEU 35 H LEU 35 -10.157 4.109 -0.516 311 HA LEU 35 HA LEU 35 -9.292 3.735 2.326 312 HB2 LEU 35 HB2 LEU 35 -7.902 5.096 -0.009 313 HB3 LEU 35 HB3 LEU 35 -7.299 5.066 1.641 314 HG LEU 35 HG LEU 35 -7.680 2.649 -0.176 315 HD11 LEU 35 HD11 LEU 35 -5.184 3.920 1.010 316 HD12 LEU 35 HD12 LEU 35 -5.253 2.482 -0.031 317 HD13 LEU 35 HD13 LEU 35 -5.724 4.061 -0.683 318 HD21 LEU 35 HD21 LEU 35 -8.138 1.837 2.031 319 HD22 LEU 35 HD22 LEU 35 -6.450 1.434 1.700 320 HD23 LEU 35 HD23 LEU 35 -6.830 2.806 2.744 321 H SER 36 H SER 36 -9.075 5.428 3.734 322 HA SER 36 HA SER 36 -10.961 7.667 3.477 323 HB2 SER 36 HB2 SER 36 -8.860 7.092 5.606 324 HB3 SER 36 HB3 SER 36 -10.177 8.274 5.710 325 HG SER 36 HG SER 36 -10.719 6.320 6.773 326 H GLU 37 H GLU 37 -10.112 9.964 3.895 327 HA GLU 37 HA GLU 37 -8.492 10.762 1.783 328 HB2 GLU 37 HB2 GLU 37 -10.069 12.179 3.059 329 HB3 GLU 37 HB3 GLU 37 -8.931 12.236 4.412 330 HG2 GLU 37 HG2 GLU 37 -7.273 13.393 2.988 331 HG3 GLU 37 HG3 GLU 37 -8.340 13.237 1.589 332 H GLN 38 H GLN 38 -7.363 10.219 5.153 333 HA GLN 38 HA GLN 38 -4.604 10.926 4.480 334 HB2 GLN 38 HB2 GLN 38 -4.029 10.192 6.709 335 HB3 GLN 38 HB3 GLN 38 -5.351 11.350 6.728 336 HG2 GLN 38 HG2 GLN 38 -6.959 9.693 7.343 337 HG3 GLN 38 HG3 GLN 38 -5.894 8.358 6.906 338 HE21 GLN 38 HE21 GLN 38 -4.007 8.414 9.927 339 HE22 GLN 38 HE22 GLN 38 -3.953 7.936 8.235 340 H GLN 39 H GLN 39 -6.455 7.908 4.627 341 HA GLN 39 HA GLN 39 -4.170 6.142 4.512 342 HB2 GLN 39 HB2 GLN 39 -7.066 5.696 3.801 343 HB3 GLN 39 HB3 GLN 39 -5.843 4.432 3.864 344 HG2 GLN 39 HG2 GLN 39 -6.583 6.131 6.287 345 HG3 GLN 39 HG3 GLN 39 -7.400 4.643 5.855 346 HE21 GLN 39 HE21 GLN 39 -5.022 2.693 7.588 347 HE22 GLN 39 HE22 GLN 39 -6.702 2.942 7.126 348 H LYS 40 H LYS 40 -6.284 7.611 2.043 349 HA LYS 40 HA LYS 40 -5.076 6.385 -0.276 350 HB2 LYS 40 HB2 LYS 40 -7.191 7.461 -0.494 351 HB3 LYS 40 HB3 LYS 40 -6.617 8.965 0.231 352 HG2 LYS 40 HG2 LYS 40 -5.296 9.527 -1.685 353 HG3 LYS 40 HG3 LYS 40 -5.548 7.946 -2.430 354 HD2 LYS 40 HD2 LYS 40 -7.899 9.760 -1.771 355 HD3 LYS 40 HD3 LYS 40 -6.942 10.056 -3.217 356 HE2 LYS 40 HE2 LYS 40 -8.232 7.359 -2.611 357 HE3 LYS 40 HE3 LYS 40 -9.036 8.639 -3.526 358 HZ1 LYS 40 HZ1 LYS 40 -6.472 7.370 -4.321 359 HZ2 LYS 40 HZ2 LYS 40 -7.918 7.097 -5.025 360 HZ3 LYS 40 HZ3 LYS 40 -7.229 8.566 -5.141 361 H ILE 41 H ILE 41 -4.218 9.402 1.515 362 HA ILE 41 HA ILE 41 -2.018 10.065 -0.219 363 HB ILE 41 HB ILE 41 -2.513 10.819 2.651 364 HG12 ILE 41 HG12 ILE 41 -2.935 12.568 0.174 365 HG13 ILE 41 HG13 ILE 41 -4.220 11.536 0.760 366 HG21 ILE 41 HG21 ILE 41 -0.567 12.030 0.652 367 HG22 ILE 41 HG22 ILE 41 -0.972 12.746 2.225 368 HG23 ILE 41 HG23 ILE 41 -0.164 11.193 2.169 369 HD11 ILE 41 HD11 ILE 41 -2.945 13.817 2.313 370 HD12 ILE 41 HD12 ILE 41 -4.584 13.729 1.645 371 HD13 ILE 41 HD13 ILE 41 -4.122 12.663 2.984 372 H ILE 42 H ILE 42 -2.104 8.044 2.830 373 HA ILE 42 HA ILE 42 0.766 7.724 2.875 374 HB ILE 42 HB ILE 42 -1.405 5.926 3.982 375 HG12 ILE 42 HG12 ILE 42 0.361 7.750 5.653 376 HG13 ILE 42 HG13 ILE 42 -1.036 8.443 4.851 377 HG21 ILE 42 HG21 ILE 42 1.615 5.983 4.467 378 HG22 ILE 42 HG22 ILE 42 0.466 5.091 5.477 379 HG23 ILE 42 HG23 ILE 42 0.673 4.641 3.787 380 HD11 ILE 42 HD11 ILE 42 -1.138 6.088 6.773 381 HD12 ILE 42 HD12 ILE 42 -1.663 7.756 7.095 382 HD13 ILE 42 HD13 ILE 42 -2.516 6.769 5.885 383 H LEU 43 H LEU 43 -1.833 5.803 1.400 384 HA LEU 43 HA LEU 43 -0.277 3.713 0.282 385 HB2 LEU 43 HB2 LEU 43 -2.731 3.754 0.424 386 HB3 LEU 43 HB3 LEU 43 -2.828 5.063 -0.723 387 HG LEU 43 HG LEU 43 -3.501 2.818 -1.526 388 HD11 LEU 43 HD11 LEU 43 -1.186 3.928 -3.135 389 HD12 LEU 43 HD12 LEU 43 -2.551 2.965 -3.711 390 HD13 LEU 43 HD13 LEU 43 -2.826 4.605 -3.094 391 HD21 LEU 43 HD21 LEU 43 -1.852 1.444 -0.394 392 HD22 LEU 43 HD22 LEU 43 -1.761 1.166 -2.138 393 HD23 LEU 43 HD23 LEU 43 -0.517 2.151 -1.333 394 H ALA 44 H ALA 44 -1.157 6.881 -1.122 395 HA ALA 44 HA ALA 44 0.351 6.633 -3.525 396 HB1 ALA 44 HB1 ALA 44 -0.619 9.057 -1.965 397 HB2 ALA 44 HB2 ALA 44 -0.099 9.071 -3.666 398 HB3 ALA 44 HB3 ALA 44 -1.554 8.161 -3.184 399 H GLU 45 H GLU 45 1.191 8.492 -0.500 400 HA GLU 45 HA GLU 45 3.711 9.405 -1.421 401 HB2 GLU 45 HB2 GLU 45 2.635 8.887 1.371 402 HB3 GLU 45 HB3 GLU 45 4.253 9.536 1.077 403 HG2 GLU 45 HG2 GLU 45 3.241 11.380 -0.284 404 HG3 GLU 45 HG3 GLU 45 1.645 10.851 0.236 405 H TYR 46 H TYR 46 2.880 6.226 -0.075 406 HA TYR 46 HA TYR 46 5.604 5.420 0.437 407 HB2 TYR 46 HB2 TYR 46 3.685 4.419 1.533 408 HB3 TYR 46 HB3 TYR 46 3.030 3.887 -0.009 409 HD1 TYR 46 HD1 TYR 46 6.677 3.436 0.532 410 HD2 TYR 46 HD2 TYR 46 2.753 1.705 0.955 411 HE1 TYR 46 HE1 TYR 46 7.704 1.194 0.826 412 HE2 TYR 46 HE2 TYR 46 3.801 -0.562 1.217 413 HH TYR 46 HH TYR 46 7.334 -1.038 1.124 414 H ILE 47 H ILE 47 3.379 4.621 -2.314 415 HA ILE 47 HA ILE 47 5.277 3.372 -4.013 416 HB ILE 47 HB ILE 47 2.672 4.822 -4.338 417 HG12 ILE 47 HG12 ILE 47 3.375 1.890 -4.783 418 HG13 ILE 47 HG13 ILE 47 3.004 2.496 -3.184 419 HG21 ILE 47 HG21 ILE 47 4.239 3.473 -6.571 420 HG22 ILE 47 HG22 ILE 47 2.513 3.868 -6.678 421 HG23 ILE 47 HG23 ILE 47 3.690 5.159 -6.513 422 HD11 ILE 47 HD11 ILE 47 1.079 2.584 -5.546 423 HD12 ILE 47 HD12 ILE 47 1.000 1.504 -4.140 424 HD13 ILE 47 HD13 ILE 47 0.773 3.250 -3.938 425 H ALA 48 H ALA 48 4.425 6.838 -3.538 426 HA ALA 48 HA ALA 48 5.998 7.832 -5.734 427 HB1 ALA 48 HB1 ALA 48 5.065 9.175 -3.171 428 HB2 ALA 48 HB2 ALA 48 5.611 10.004 -4.645 429 HB3 ALA 48 HB3 ALA 48 4.119 9.037 -4.669 430 H GLU 49 H GLU 49 6.892 6.806 -2.492 431 HA GLU 49 HA GLU 49 9.547 8.094 -2.630 432 HB2 GLU 49 HB2 GLU 49 8.128 8.067 -0.554 433 HB3 GLU 49 HB3 GLU 49 8.342 6.318 -0.482 434 HG2 GLU 49 HG2 GLU 49 9.866 7.319 1.051 435 HG3 GLU 49 HG3 GLU 49 10.827 6.691 -0.273 436 H VAL 50 H VAL 50 8.161 4.776 -2.999 437 HA VAL 50 HA VAL 50 10.964 3.790 -3.424 438 HB VAL 50 HB VAL 50 10.472 1.737 -2.461 439 HG11 VAL 50 HG11 VAL 50 9.187 3.768 -0.599 440 HG12 VAL 50 HG12 VAL 50 10.012 2.261 -0.158 441 HG13 VAL 50 HG13 VAL 50 10.938 3.595 -0.865 442 HG21 VAL 50 HG21 VAL 50 8.199 1.279 -3.216 443 HG22 VAL 50 HG22 VAL 50 8.325 1.087 -1.479 444 HG23 VAL 50 HG23 VAL 50 7.543 2.531 -2.157 445 H GLY 51 H GLY 51 7.871 4.084 -4.916 446 HA2 GLY 51 HA2 GLY 51 7.313 3.546 -7.119 447 HA3 GLY 51 HA3 GLY 51 8.716 2.495 -7.263 448 H LEU 52 H LEU 52 5.736 2.150 -7.764 449 HA LEU 52 HA LEU 52 4.516 0.441 -5.972 450 HB2 LEU 52 HB2 LEU 52 3.477 1.609 -7.931 451 HB3 LEU 52 HB3 LEU 52 4.386 0.573 -9.025 452 HG LEU 52 HG LEU 52 3.045 -1.406 -8.193 453 HD11 LEU 52 HD11 LEU 52 1.351 0.760 -6.885 454 HD12 LEU 52 HD12 LEU 52 0.989 -0.977 -6.946 455 HD13 LEU 52 HD13 LEU 52 2.364 -0.396 -5.996 456 HD21 LEU 52 HD21 LEU 52 2.501 -0.209 -10.256 457 HD22 LEU 52 HD22 LEU 52 1.023 -0.766 -9.424 458 HD23 LEU 52 HD23 LEU 52 1.503 0.932 -9.323 459 H GLN 53 H GLN 53 7.063 -0.258 -7.930 460 HA GLN 53 HA GLN 53 6.797 -3.177 -8.217 461 HB2 GLN 53 HB2 GLN 53 9.094 -1.279 -8.841 462 HB3 GLN 53 HB3 GLN 53 9.027 -2.984 -9.302 463 HG2 GLN 53 HG2 GLN 53 7.080 -2.591 -10.728 464 HG3 GLN 53 HG3 GLN 53 6.998 -0.896 -10.240 465 HE21 GLN 53 HE21 GLN 53 9.891 0.080 -12.167 466 HE22 GLN 53 HE22 GLN 53 9.078 0.419 -10.644 467 H ASN 54 H ASN 54 8.061 -1.052 -5.785 468 HA ASN 54 HA ASN 54 9.747 -3.231 -4.624 469 HB2 ASN 54 HB2 ASN 54 10.028 -0.228 -4.298 470 HB3 ASN 54 HB3 ASN 54 11.120 -1.446 -3.649 471 HD21 ASN 54 HD21 ASN 54 11.871 -0.040 -7.273 472 HD22 ASN 54 HD22 ASN 54 10.849 0.743 -6.058 473 H ILE 55 H ILE 55 6.892 -1.609 -4.032 474 HA ILE 55 HA ILE 55 6.914 -1.792 -1.132 475 HB ILE 55 HB ILE 55 4.556 -1.455 -1.163 476 HG12 ILE 55 HG12 ILE 55 4.624 -1.823 -4.175 477 HG13 ILE 55 HG13 ILE 55 3.882 -2.920 -3.006 478 HG21 ILE 55 HG21 ILE 55 5.680 0.360 -3.330 479 HG22 ILE 55 HG22 ILE 55 4.468 0.739 -2.078 480 HG23 ILE 55 HG23 ILE 55 6.134 0.459 -1.620 481 HD11 ILE 55 HD11 ILE 55 3.016 -0.088 -3.643 482 HD12 ILE 55 HD12 ILE 55 2.143 -1.595 -3.972 483 HD13 ILE 55 HD13 ILE 55 2.361 -1.065 -2.290 484 H THR 56 H THR 56 5.751 -3.305 0.202 485 HA THR 56 HA THR 56 5.184 -5.947 -1.054 486 HB THR 56 HB THR 56 6.034 -6.728 1.386 487 HG1 THR 56 HG1 THR 56 8.059 -5.531 1.684 488 HG21 THR 56 HG21 THR 56 7.950 -6.066 -0.897 489 HG22 THR 56 HG22 THR 56 8.232 -7.256 0.398 490 HG23 THR 56 HG23 THR 56 6.949 -7.531 -0.789 491 H ALA 57 H ALA 57 3.548 -7.212 -0.072 492 HA ALA 57 HA ALA 57 1.368 -5.749 1.017 493 HB1 ALA 57 HB1 ALA 57 1.913 -8.756 1.000 494 HB2 ALA 57 HB2 ALA 57 0.342 -7.967 1.248 495 HB3 ALA 57 HB3 ALA 57 1.160 -7.836 -0.322 496 H ILE 58 H ILE 58 4.060 -7.399 2.527 497 HA ILE 58 HA ILE 58 3.039 -7.553 5.240 498 HB ILE 58 HB ILE 58 5.838 -7.481 4.028 499 HG12 ILE 58 HG12 ILE 58 5.971 -9.841 4.842 500 HG13 ILE 58 HG13 ILE 58 4.308 -9.758 5.414 501 HG21 ILE 58 HG21 ILE 58 4.983 -7.800 6.954 502 HG22 ILE 58 HG22 ILE 58 6.608 -8.213 6.350 503 HG23 ILE 58 HG23 ILE 58 6.044 -6.548 6.277 504 HD11 ILE 58 HD11 ILE 58 5.120 -9.486 2.487 505 HD12 ILE 58 HD12 ILE 58 4.652 -11.009 3.267 506 HD13 ILE 58 HD13 ILE 58 3.468 -9.708 3.137 507 H THR 59 H THR 59 5.142 -5.234 3.490 508 HA THR 59 HA THR 59 5.320 -3.395 5.697 509 HB THR 59 HB THR 59 5.903 -3.014 2.745 510 HG1 THR 59 HG1 THR 59 7.446 -4.276 3.144 511 HG21 THR 59 HG21 THR 59 6.861 -1.523 5.236 512 HG22 THR 59 HG22 THR 59 7.541 -1.327 3.602 513 HG23 THR 59 HG23 THR 59 5.862 -0.849 3.919 514 H LEU 60 H LEU 60 3.374 -3.388 2.686 515 HA LEU 60 HA LEU 60 2.014 -0.956 3.192 516 HB2 LEU 60 HB2 LEU 60 2.250 -2.221 1.004 517 HB3 LEU 60 HB3 LEU 60 1.080 -3.371 1.596 518 HG LEU 60 HG LEU 60 -0.592 -1.425 1.765 519 HD11 LEU 60 HD11 LEU 60 1.536 -0.006 0.118 520 HD12 LEU 60 HD12 LEU 60 -0.072 0.603 0.541 521 HD13 LEU 60 HD13 LEU 60 1.121 0.402 1.808 522 HD21 LEU 60 HD21 LEU 60 -0.572 -2.975 -0.146 523 HD22 LEU 60 HD22 LEU 60 -1.013 -1.335 -0.645 524 HD23 LEU 60 HD23 LEU 60 0.618 -1.966 -0.975 525 H SER 61 H SER 61 1.237 -4.305 4.240 526 HA SER 61 HA SER 61 -1.193 -3.859 5.511 527 HB2 SER 61 HB2 SER 61 -0.436 -6.052 5.245 528 HB3 SER 61 HB3 SER 61 1.074 -5.737 6.107 529 HG SER 61 HG SER 61 -0.613 -6.896 7.287 530 H LYS 62 H LYS 62 1.937 -2.863 6.400 531 HA LYS 62 HA LYS 62 1.118 -2.102 9.142 532 HB2 LYS 62 HB2 LYS 62 3.759 -2.807 7.870 533 HB3 LYS 62 HB3 LYS 62 3.779 -1.712 9.239 534 HG2 LYS 62 HG2 LYS 62 4.158 -4.089 9.831 535 HG3 LYS 62 HG3 LYS 62 2.856 -3.305 10.726 536 HD2 LYS 62 HD2 LYS 62 1.158 -4.482 9.504 537 HD3 LYS 62 HD3 LYS 62 2.329 -5.083 8.318 538 HE2 LYS 62 HE2 LYS 62 3.448 -6.432 10.010 539 HE3 LYS 62 HE3 LYS 62 2.397 -5.773 11.278 540 HZ1 LYS 62 HZ1 LYS 62 1.490 -7.426 8.981 541 HZ2 LYS 62 HZ2 LYS 62 1.593 -7.930 10.532 542 HZ3 LYS 62 HZ3 LYS 62 0.498 -6.789 10.115 543 H LYS 63 H LYS 63 2.210 -0.612 6.121 544 HA LYS 63 HA LYS 63 2.787 2.012 7.115 545 HB2 LYS 63 HB2 LYS 63 1.836 0.893 4.457 546 HB3 LYS 63 HB3 LYS 63 2.225 2.599 4.656 547 HG2 LYS 63 HG2 LYS 63 4.317 0.634 5.563 548 HG3 LYS 63 HG3 LYS 63 3.985 0.698 3.830 549 HD2 LYS 63 HD2 LYS 63 4.434 3.084 3.776 550 HD3 LYS 63 HD3 LYS 63 4.724 3.119 5.526 551 HE2 LYS 63 HE2 LYS 63 6.284 1.357 3.603 552 HE3 LYS 63 HE3 LYS 63 6.750 3.032 3.924 553 HZ1 LYS 63 HZ1 LYS 63 6.555 0.931 6.021 554 HZ2 LYS 63 HZ2 LYS 63 7.948 1.494 5.376 555 HZ3 LYS 63 HZ3 LYS 63 7.009 2.482 6.267 556 H LEU 64 H LEU 64 -0.245 0.498 6.087 557 HA LEU 64 HA LEU 64 -1.773 2.913 6.977 558 HB2 LEU 64 HB2 LEU 64 -2.657 0.748 5.033 559 HB3 LEU 64 HB3 LEU 64 -3.527 2.197 5.486 560 HG LEU 64 HG LEU 64 -1.175 3.299 4.607 561 HD11 LEU 64 HD11 LEU 64 -1.714 0.899 2.790 562 HD12 LEU 64 HD12 LEU 64 -0.505 2.187 2.541 563 HD13 LEU 64 HD13 LEU 64 -0.334 1.025 3.870 564 HD21 LEU 64 HD21 LEU 64 -3.441 3.930 3.931 565 HD22 LEU 64 HD22 LEU 64 -2.331 3.810 2.570 566 HD23 LEU 64 HD23 LEU 64 -3.528 2.517 2.849 567 H ASN 65 H ASN 65 -0.857 0.232 8.462 568 HA ASN 65 HA ASN 65 -1.697 -1.082 10.137 569 HB2 ASN 65 HB2 ASN 65 -1.614 0.994 11.260 570 HB3 ASN 65 HB3 ASN 65 -3.065 1.596 10.485 571 HD21 ASN 65 HD21 ASN 65 -5.125 0.620 13.087 572 HD22 ASN 65 HD22 ASN 65 -4.837 1.606 11.653 573 H ILE 66 H ILE 66 -2.512 -2.267 8.101 574 HA ILE 66 HA ILE 66 -5.443 -2.859 8.318 575 HB ILE 66 HB ILE 66 -5.170 -3.256 5.738 576 HG12 ILE 66 HG12 ILE 66 -3.090 -1.062 6.015 577 HG13 ILE 66 HG13 ILE 66 -2.633 -2.710 5.914 578 HG21 ILE 66 HG21 ILE 66 -5.359 -0.453 6.884 579 HG22 ILE 66 HG22 ILE 66 -5.947 -0.985 5.295 580 HG23 ILE 66 HG23 ILE 66 -6.679 -1.636 6.764 581 HD11 ILE 66 HD11 ILE 66 -4.228 -1.224 3.790 582 HD12 ILE 66 HD12 ILE 66 -2.521 -1.715 3.702 583 HD13 ILE 66 HD13 ILE 66 -3.809 -2.947 3.718 584 H THR 67 H THR 67 -5.569 -4.964 6.549 585 HA THR 67 HA THR 67 -3.923 -7.061 7.848 586 HB THR 67 HB THR 67 -5.378 -8.661 6.797 587 HG1 THR 67 HG1 THR 67 -7.212 -7.772 5.606 588 HG21 THR 67 HG21 THR 67 -7.151 -6.434 7.885 589 HG22 THR 67 HG22 THR 67 -7.502 -8.174 7.831 590 HG23 THR 67 HG23 THR 67 -6.219 -7.567 8.891 591 H VAL 68 H VAL 68 -2.847 -8.682 6.536 592 HA VAL 68 HA VAL 68 -1.406 -7.714 4.215 593 HB VAL 68 HB VAL 68 -1.767 -10.544 5.256 594 HG11 VAL 68 HG11 VAL 68 0.242 -9.435 3.242 595 HG12 VAL 68 HG12 VAL 68 0.317 -11.048 3.980 596 HG13 VAL 68 HG13 VAL 68 -1.021 -10.646 2.909 597 HG21 VAL 68 HG21 VAL 68 -0.614 -9.081 6.882 598 HG22 VAL 68 HG22 VAL 68 0.526 -10.214 6.165 599 HG23 VAL 68 HG23 VAL 68 0.507 -8.530 5.610 600 H GLU 69 H GLU 69 -4.651 -8.976 4.554 601 HA GLU 69 HA GLU 69 -4.760 -10.135 1.847 602 HB2 GLU 69 HB2 GLU 69 -6.838 -9.716 4.041 603 HB3 GLU 69 HB3 GLU 69 -7.205 -10.409 2.463 604 HG2 GLU 69 HG2 GLU 69 -5.209 -11.593 4.447 605 HG3 GLU 69 HG3 GLU 69 -6.884 -12.099 4.277 606 H LYS 70 H LYS 70 -5.773 -7.159 3.595 607 HA LYS 70 HA LYS 70 -6.950 -5.928 1.276 608 HB2 LYS 70 HB2 LYS 70 -5.738 -4.797 3.835 609 HB3 LYS 70 HB3 LYS 70 -6.204 -3.766 2.489 610 HG2 LYS 70 HG2 LYS 70 -8.537 -4.972 2.687 611 HG3 LYS 70 HG3 LYS 70 -7.964 -5.338 4.337 612 HD2 LYS 70 HD2 LYS 70 -7.366 -2.862 4.534 613 HD3 LYS 70 HD3 LYS 70 -8.181 -2.592 2.997 614 HE2 LYS 70 HE2 LYS 70 -9.443 -3.656 5.559 615 HE3 LYS 70 HE3 LYS 70 -9.565 -2.003 4.949 616 HZ1 LYS 70 HZ1 LYS 70 -10.641 -4.400 3.557 617 HZ2 LYS 70 HZ2 LYS 70 -11.530 -3.287 4.351 618 HZ3 LYS 70 HZ3 LYS 70 -10.749 -2.872 2.982 619 H ALA 71 H ALA 71 -3.785 -5.691 2.822 620 HA ALA 71 HA ALA 71 -2.564 -3.863 1.161 621 HB1 ALA 71 HB1 ALA 71 -1.325 -6.192 2.658 622 HB2 ALA 71 HB2 ALA 71 -0.478 -4.749 2.099 623 HB3 ALA 71 HB3 ALA 71 -1.740 -4.597 3.329 624 H LYS 72 H LYS 72 -2.567 -7.441 0.790 625 HA LYS 72 HA LYS 72 -0.899 -7.496 -1.555 626 HB2 LYS 72 HB2 LYS 72 -1.111 -9.367 0.054 627 HB3 LYS 72 HB3 LYS 72 -2.841 -9.485 -0.271 628 HG2 LYS 72 HG2 LYS 72 -2.452 -10.264 -2.518 629 HG3 LYS 72 HG3 LYS 72 -0.703 -10.020 -2.366 630 HD2 LYS 72 HD2 LYS 72 -2.298 -11.826 -0.488 631 HD3 LYS 72 HD3 LYS 72 -1.662 -12.432 -2.020 632 HE2 LYS 72 HE2 LYS 72 0.063 -11.182 0.170 633 HE3 LYS 72 HE3 LYS 72 -0.261 -12.910 0.034 634 HZ1 LYS 72 HZ1 LYS 72 1.100 -11.300 -2.061 635 HZ2 LYS 72 HZ2 LYS 72 1.826 -12.350 -1.045 636 HZ3 LYS 72 HZ3 LYS 72 0.777 -12.900 -2.160 637 H ASN 73 H ASN 73 -4.390 -7.197 -1.015 638 HA ASN 73 HA ASN 73 -5.092 -7.826 -3.683 639 HB2 ASN 73 HB2 ASN 73 -7.067 -7.860 -2.650 640 HB3 ASN 73 HB3 ASN 73 -6.461 -6.934 -1.293 641 HD21 ASN 73 HD21 ASN 73 -7.750 -3.852 -2.340 642 HD22 ASN 73 HD22 ASN 73 -6.558 -4.640 -1.308 643 H TYR 74 H TYR 74 -4.099 -4.681 -2.295 644 HA TYR 74 HA TYR 74 -4.582 -3.045 -4.591 645 HB2 TYR 74 HB2 TYR 74 -2.427 -2.769 -2.480 646 HB3 TYR 74 HB3 TYR 74 -2.932 -1.525 -3.616 647 HD1 TYR 74 HD1 TYR 74 -5.461 -0.746 -3.509 648 HD2 TYR 74 HD2 TYR 74 -3.397 -2.905 -0.418 649 HE1 TYR 74 HE1 TYR 74 -7.163 -0.001 -1.868 650 HE2 TYR 74 HE2 TYR 74 -5.136 -2.182 1.244 651 HH TYR 74 HH TYR 74 -7.997 -0.280 0.267 652 H ILE 75 H ILE 75 -1.774 -4.944 -3.529 653 HA ILE 75 HA ILE 75 -0.079 -4.266 -5.758 654 HB ILE 75 HB ILE 75 0.031 -6.491 -3.681 655 HG12 ILE 75 HG12 ILE 75 1.453 -3.790 -3.821 656 HG13 ILE 75 HG13 ILE 75 0.062 -4.125 -2.796 657 HG21 ILE 75 HG21 ILE 75 2.257 -5.501 -5.518 658 HG22 ILE 75 HG22 ILE 75 2.430 -6.702 -4.222 659 HG23 ILE 75 HG23 ILE 75 1.455 -7.090 -5.620 660 HD11 ILE 75 HD11 ILE 75 2.820 -5.335 -2.489 661 HD12 ILE 75 HD12 ILE 75 1.978 -4.210 -1.414 662 HD13 ILE 75 HD13 ILE 75 1.368 -5.865 -1.599 663 H LYS 76 H LYS 76 -2.640 -6.626 -5.382 664 HA LYS 76 HA LYS 76 -1.797 -8.258 -7.660 665 HB2 LYS 76 HB2 LYS 76 -2.751 -9.093 -5.481 666 HB3 LYS 76 HB3 LYS 76 -4.321 -8.437 -5.965 667 HG2 LYS 76 HG2 LYS 76 -4.365 -9.970 -7.897 668 HG3 LYS 76 HG3 LYS 76 -2.704 -10.490 -7.539 669 HD2 LYS 76 HD2 LYS 76 -3.532 -11.272 -5.261 670 HD3 LYS 76 HD3 LYS 76 -5.185 -10.958 -5.823 671 HE2 LYS 76 HE2 LYS 76 -4.845 -12.570 -7.687 672 HE3 LYS 76 HE3 LYS 76 -3.174 -12.825 -7.165 673 HZ1 LYS 76 HZ1 LYS 76 -5.582 -13.508 -5.558 674 HZ2 LYS 76 HZ2 LYS 76 -4.605 -14.577 -6.311 675 HZ3 LYS 76 HZ3 LYS 76 -4.039 -13.707 -5.054 676 H ASN 77 H ASN 77 -4.201 -5.679 -7.066 677 HA ASN 77 HA ASN 77 -5.210 -6.008 -9.838 678 HB2 ASN 77 HB2 ASN 77 -6.739 -4.332 -9.464 679 HB3 ASN 77 HB3 ASN 77 -6.849 -5.407 -8.066 680 HD21 ASN 77 HD21 ASN 77 -6.232 -2.794 -5.792 681 HD22 ASN 77 HD22 ASN 77 -6.177 -4.548 -5.966 682 H SER 78 H SER 78 -3.225 -3.810 -7.831 683 HA SER 78 HA SER 78 -2.666 -2.258 -10.263 684 HB2 SER 78 HB2 SER 78 -3.684 -1.241 -8.051 685 HB3 SER 78 HB3 SER 78 -1.992 -1.213 -7.527 686 HG SER 78 HG SER 78 -2.304 0.684 -8.599 687 H ASN 79 H ASN 79 -0.950 -3.057 -11.276 688 HA ASN 79 HA ASN 79 1.629 -3.026 -9.880 689 HB2 ASN 79 HB2 ASN 79 0.275 -5.377 -9.759 690 HB3 ASN 79 HB3 ASN 79 1.065 -5.594 -11.322 691 HD21 ASN 79 HD21 ASN 79 3.153 -5.909 -7.890 692 HD22 ASN 79 HD22 ASN 79 1.385 -5.808 -8.007 693 H ARG 80 H ARG 80 3.386 -2.884 -11.207 694 HA ARG 80 HA ARG 80 4.550 -1.950 -12.925 695 HB2 ARG 80 HB2 ARG 80 2.996 -3.888 -14.670 696 HB3 ARG 80 HB3 ARG 80 4.577 -3.201 -14.997 697 HG2 ARG 80 HG2 ARG 80 3.885 -5.282 -12.896 698 HG3 ARG 80 HG3 ARG 80 4.864 -5.464 -14.347 699 HD2 ARG 80 HD2 ARG 80 6.398 -3.636 -13.277 700 HD3 ARG 80 HD3 ARG 80 5.572 -4.034 -11.768 701 HE ARG 80 HE ARG 80 7.510 -5.643 -13.279 702 HH11 ARG 80 HH11 ARG 80 8.385 -7.453 -12.393 703 HH12 ARG 80 HH12 ARG 80 7.666 -8.174 -10.984 704 HH21 ARG 80 HH21 ARG 80 5.103 -5.916 -10.702 705 HH22 ARG 80 HH22 ARG 80 5.893 -7.326 -10.051 706 H LEU 81 H LEU 81 1.573 -0.942 -12.628 707 HA LEU 81 HA LEU 81 1.455 0.691 -15.132 708 HB2 LEU 81 HB2 LEU 81 -0.057 -1.325 -14.998 709 HB3 LEU 81 HB3 LEU 81 -0.781 -0.643 -13.547 710 HG LEU 81 HG LEU 81 -1.550 1.335 -14.929 711 HD11 LEU 81 HD11 LEU 81 -0.588 -0.406 -17.247 712 HD12 LEU 81 HD12 LEU 81 -1.609 1.040 -17.398 713 HD13 LEU 81 HD13 LEU 81 0.049 1.196 -16.807 714 HD21 LEU 81 HD21 LEU 81 -3.035 -0.558 -14.415 715 HD22 LEU 81 HD22 LEU 81 -3.371 0.092 -16.026 716 HD23 LEU 81 HD23 LEU 81 -2.455 -1.423 -15.854 717 H GLY 82 H GLY 82 0.581 0.628 -11.652 718 HA2 GLY 82 HA2 GLY 82 -0.427 3.348 -11.675 719 HA3 GLY 82 HA3 GLY 82 -0.137 2.343 -10.258 720 H ARG 83 H ARG 83 1.456 4.423 -12.663 721 HA ARG 83 HA ARG 83 3.838 4.886 -10.929 722 HB2 ARG 83 HB2 ARG 83 3.110 5.780 -13.755 723 HB3 ARG 83 HB3 ARG 83 4.549 6.332 -12.907 724 HG2 ARG 83 HG2 ARG 83 3.959 3.431 -13.648 725 HG3 ARG 83 HG3 ARG 83 5.032 4.543 -14.504 726 HD2 ARG 83 HD2 ARG 83 6.253 4.802 -12.209 727 HD3 ARG 83 HD3 ARG 83 5.426 3.314 -11.752 728 HE ARG 83 HE ARG 83 7.649 3.673 -13.625 729 HH11 ARG 83 HH11 ARG 83 8.623 1.960 -14.604 730 HH12 ARG 83 HH12 ARG 83 7.885 0.387 -14.557 731 HH21 ARG 83 HH21 ARG 83 5.104 1.405 -12.827 732 HH22 ARG 83 HH22 ARG 83 5.911 0.099 -13.663 733 H THR 84 H THR 84 4.494 7.039 -10.404 734 HA THR 84 HA THR 84 2.372 8.603 -9.270 735 HB THR 84 HB THR 84 4.479 8.464 -8.189 736 HG1 THR 84 HG1 THR 84 4.680 10.671 -7.751 737 HG21 THR 84 HG21 THR 84 5.740 10.241 -10.311 738 HG22 THR 84 HG22 THR 84 6.497 9.544 -8.869 739 HG23 THR 84 HG23 THR 84 6.014 8.490 -10.207 740 H ASN 85 H ASN 85 0.944 9.558 -10.470 741 HA ASN 85 HA ASN 85 1.783 11.670 -12.419 742 HB2 ASN 85 HB2 ASN 85 -0.447 9.604 -12.701 743 HB3 ASN 85 HB3 ASN 85 -0.318 11.048 -13.699 744 HD21 ASN 85 HD21 ASN 85 2.118 7.886 -14.487 745 HD22 ASN 85 HD22 ASN 85 1.201 7.915 -12.979 746 H ASN 86 H ASN 86 0.525 13.544 -12.425 747 HA ASN 86 HA ASN 86 -1.904 13.721 -10.795 748 HB2 ASN 86 HB2 ASN 86 -0.006 14.077 -9.165 749 HB3 ASN 86 HB3 ASN 86 0.468 15.503 -10.079 750 HD21 ASN 86 HD21 ASN 86 -2.178 17.485 -8.716 751 HD22 ASN 86 HD22 ASN 86 -0.889 17.420 -9.908 752 H LEU 87 H LEU 87 0.474 15.697 -12.509 753 HA LEU 87 HA LEU 87 -1.484 16.848 -14.328 754 HB2 LEU 87 HB2 LEU 87 -0.337 18.359 -11.997 755 HB3 LEU 87 HB3 LEU 87 -0.222 19.195 -13.524 756 HG LEU 87 HG LEU 87 -2.841 18.156 -12.370 757 HD11 LEU 87 HD11 LEU 87 -1.687 20.974 -12.499 758 HD12 LEU 87 HD12 LEU 87 -3.306 20.527 -11.915 759 HD13 LEU 87 HD13 LEU 87 -1.871 19.987 -11.031 760 HD21 LEU 87 HD21 LEU 87 -2.945 18.346 -14.840 761 HD22 LEU 87 HD22 LEU 87 -3.863 19.643 -14.082 762 HD23 LEU 87 HD23 LEU 87 -2.256 19.987 -14.750 763 H LYS 88 H LYS 88 -0.368 18.380 -15.846 764 HA LYS 88 HA LYS 88 2.431 17.545 -16.493 765 HB2 LYS 88 HB2 LYS 88 1.762 17.444 -18.868 766 HB3 LYS 88 HB3 LYS 88 0.949 16.240 -17.872 767 HG2 LYS 88 HG2 LYS 88 -1.114 17.497 -17.853 768 HG3 LYS 88 HG3 LYS 88 -0.338 18.900 -18.616 769 HD2 LYS 88 HD2 LYS 88 0.113 17.529 -20.651 770 HD3 LYS 88 HD3 LYS 88 -0.741 16.161 -19.899 771 HE2 LYS 88 HE2 LYS 88 -2.806 17.525 -19.757 772 HE3 LYS 88 HE3 LYS 88 -1.953 18.913 -20.445 773 HZ1 LYS 88 HZ1 LYS 88 -2.413 16.337 -21.853 774 HZ2 LYS 88 HZ2 LYS 88 -3.212 17.728 -22.146 775 HZ3 LYS 88 HZ3 LYS 88 -1.621 17.620 -22.484 776 H THR 89 H THR 89 1.147 20.065 -15.281 777 HA THR 89 HA THR 89 2.899 21.897 -16.600 778 HB THR 89 HB THR 89 0.897 22.211 -17.999 779 HG1 THR 89 HG1 THR 89 0.950 24.444 -17.775 780 HG21 THR 89 HG21 THR 89 -0.456 23.369 -15.522 781 HG22 THR 89 HG22 THR 89 -1.096 23.303 -17.177 782 HG23 THR 89 HG23 THR 89 -0.882 21.806 -16.256 783 H ILE 90 H ILE 90 3.819 23.005 -15.119 784 HA ILE 90 HA ILE 90 2.554 23.606 -12.499 785 HB ILE 90 HB ILE 90 4.895 23.084 -11.570 786 HG12 ILE 90 HG12 ILE 90 5.959 22.805 -13.880 787 HG13 ILE 90 HG13 ILE 90 6.435 21.780 -12.543 788 HG21 ILE 90 HG21 ILE 90 3.104 20.798 -12.440 789 HG22 ILE 90 HG22 ILE 90 4.320 20.746 -11.144 790 HG23 ILE 90 HG23 ILE 90 2.914 21.813 -10.999 791 HD11 ILE 90 HD11 ILE 90 4.572 20.876 -14.781 792 HD12 ILE 90 HD12 ILE 90 6.296 20.517 -14.632 793 HD13 ILE 90 HD13 ILE 90 5.166 19.888 -13.429 794 H GLY 91 H GLY 91 3.661 25.174 -15.079 795 HA2 GLY 91 HA2 GLY 91 4.540 27.267 -15.462 796 HA3 GLY 91 HA3 GLY 91 4.421 27.598 -13.729 797 H ILE 92 H ILE 92 6.301 24.852 -14.210 798 HA ILE 92 HA ILE 92 8.503 24.347 -14.028 799 HB ILE 92 HB ILE 92 8.715 26.591 -16.059 800 HG12 ILE 92 HG12 ILE 92 7.052 24.930 -16.743 801 HG13 ILE 92 HG13 ILE 92 8.463 24.880 -17.769 802 HG21 ILE 92 HG21 ILE 92 10.706 24.398 -15.427 803 HG22 ILE 92 HG22 ILE 92 10.631 25.192 -17.017 804 HG23 ILE 92 HG23 ILE 92 10.972 26.153 -15.593 805 HD11 ILE 92 HD11 ILE 92 7.813 22.872 -15.562 806 HD12 ILE 92 HD12 ILE 92 7.658 22.627 -17.307 807 HD13 ILE 92 HD13 ILE 92 9.265 22.829 -16.592 808 H LEU 93 H LEU 93 7.476 26.111 -12.049 809 HA LEU 93 HA LEU 93 8.040 27.325 -10.266 810 HB2 LEU 93 HB2 LEU 93 9.609 25.229 -10.233 811 HB3 LEU 93 HB3 LEU 93 10.894 26.373 -10.578 812 HG LEU 93 HG LEU 93 10.288 27.585 -8.419 813 HD11 LEU 93 HD11 LEU 93 8.519 25.129 -8.018 814 HD12 LEU 93 HD12 LEU 93 8.951 26.308 -6.761 815 HD13 LEU 93 HD13 LEU 93 7.959 26.812 -8.131 816 HD21 LEU 93 HD21 LEU 93 12.130 25.954 -8.550 817 HD22 LEU 93 HD22 LEU 93 11.320 25.880 -6.978 818 HD23 LEU 93 HD23 LEU 93 10.996 24.630 -8.202 819 H GLN 94 H GLN 94 8.358 28.685 -12.876 820 HA GLN 94 HA GLN 94 10.383 30.789 -12.300 821 HB2 GLN 94 HB2 GLN 94 8.872 30.017 -14.813 822 HB3 GLN 94 HB3 GLN 94 9.857 31.486 -14.678 823 HG2 GLN 94 HG2 GLN 94 11.837 30.109 -14.088 824 HG3 GLN 94 HG3 GLN 94 10.875 28.647 -14.321 825 HE21 GLN 94 HE21 GLN 94 10.748 29.046 -17.936 826 HE22 GLN 94 HE22 GLN 94 9.743 28.513 -16.595 827 H GLU 95 H GLU 95 8.721 31.190 -10.427 828 HA GLU 95 HA GLU 95 6.396 32.830 -11.144 829 HB2 GLU 95 HB2 GLU 95 7.694 32.148 -8.481 830 HB3 GLU 95 HB3 GLU 95 6.208 33.079 -8.648 831 HG2 GLU 95 HG2 GLU 95 6.556 30.216 -9.641 832 HG3 GLU 95 HG3 GLU 95 5.859 30.669 -8.094 833 H GLU 96 H GLU 96 9.557 33.514 -9.639 834 HA GLU 96 HA GLU 96 10.677 35.438 -9.200 835 HB2 GLU 96 HB2 GLU 96 9.774 36.058 -12.037 836 HB3 GLU 96 HB3 GLU 96 11.197 36.719 -11.214 837 HG2 GLU 96 HG2 GLU 96 12.145 34.433 -11.008 838 HG3 GLU 96 HG3 GLU 96 10.778 33.789 -11.920 839 H VAL 97 H VAL 97 8.413 35.696 -7.870 840 HA VAL 97 HA VAL 97 7.336 38.315 -8.306 841 HB VAL 97 HB VAL 97 6.845 36.359 -6.022 842 HG11 VAL 97 HG11 VAL 97 5.232 38.784 -6.930 843 HG12 VAL 97 HG12 VAL 97 4.666 37.560 -5.773 844 HG13 VAL 97 HG13 VAL 97 6.048 38.565 -5.362 845 HG21 VAL 97 HG21 VAL 97 6.244 35.369 -8.191 846 HG22 VAL 97 HG22 VAL 97 4.785 35.761 -7.280 847 HG23 VAL 97 HG23 VAL 97 5.307 36.814 -8.616 848 H SER 98 H SER 98 7.394 40.037 -6.945 849 HA SER 98 HA SER 98 8.393 41.723 -5.798 850 HB2 SER 98 HB2 SER 98 8.937 39.527 -3.783 851 HB3 SER 98 HB3 SER 98 8.988 41.270 -3.456 852 HG SER 98 HG SER 98 6.962 40.362 -2.909 853 H SER 99 H SER 99 10.182 40.408 -7.707 854 HA SER 99 HA SER 99 12.642 41.818 -6.875 855 HB2 SER 99 HB2 SER 99 12.950 39.490 -6.055 856 HB3 SER 99 HB3 SER 99 12.735 38.891 -7.710 857 HG SER 99 HG SER 99 14.961 39.186 -7.093 858 H MET 100 H MET 100 11.055 39.864 -9.444 859 HA MET 100 HA MET 100 12.205 41.698 -11.497 860 HB2 MET 100 HB2 MET 100 13.071 39.227 -11.278 861 HB3 MET 100 HB3 MET 100 11.538 38.810 -12.035 862 HG2 MET 100 HG2 MET 100 13.197 38.977 -13.757 863 HG3 MET 100 HG3 MET 100 12.111 40.345 -13.937 864 HE1 MET 100 HE1 MET 100 15.680 39.066 -13.111 865 HE2 MET 100 HE2 MET 100 16.533 40.513 -12.533 866 HE3 MET 100 HE3 MET 100 15.298 39.749 -11.514 867 H GLU 101 H GLU 101 9.815 42.244 -10.182 868 HA GLU 101 HA GLU 101 7.518 41.330 -11.710 869 HB2 GLU 101 HB2 GLU 101 7.513 41.819 -9.259 870 HB3 GLU 101 HB3 GLU 101 7.726 43.528 -9.616 871 HG2 GLU 101 HG2 GLU 101 5.401 43.096 -9.140 872 HG3 GLU 101 HG3 GLU 101 5.535 43.522 -10.837 873 H ALA 102 H ALA 102 8.380 41.926 -13.792 874 HA ALA 102 HA ALA 102 7.500 44.613 -14.698 875 HB1 ALA 102 HB1 ALA 102 10.224 43.367 -15.296 876 HB2 ALA 102 HB2 ALA 102 9.597 44.879 -15.987 877 HB3 ALA 102 HB3 ALA 102 9.931 44.775 -14.250 878 H LYS 103 H LYS 103 7.319 44.739 -17.061 879 HA LYS 103 HA LYS 103 6.461 42.156 -18.324 880 HB2 LYS 103 HB2 LYS 103 5.481 45.003 -18.758 881 HB3 LYS 103 HB3 LYS 103 5.016 43.620 -19.758 882 HG2 LYS 103 HG2 LYS 103 4.031 42.484 -17.819 883 HG3 LYS 103 HG3 LYS 103 4.523 43.811 -16.751 884 HD2 LYS 103 HD2 LYS 103 3.125 45.391 -18.026 885 HD3 LYS 103 HD3 LYS 103 2.595 44.096 -19.105 886 HE2 LYS 103 HE2 LYS 103 2.165 44.112 -16.078 887 HE3 LYS 103 HE3 LYS 103 0.990 44.735 -17.238 888 HZ1 LYS 103 HZ1 LYS 103 1.936 41.920 -17.144 889 HZ2 LYS 103 HZ2 LYS 103 0.478 42.451 -16.645 890 HZ3 LYS 103 HZ3 LYS 103 0.863 42.515 -18.228 891 H SER 104 H SER 104 7.130 41.603 -20.323 892 HA SER 104 HA SER 104 8.833 43.338 -21.975 893 HB2 SER 104 HB2 SER 104 10.729 41.769 -21.978 894 HB3 SER 104 HB3 SER 104 10.452 42.455 -20.372 895 HG SER 104 HG SER 104 10.809 40.190 -20.287 896 H MET 105 H MET 105 9.533 42.220 -23.991 897 HA MET 105 HA MET 105 7.775 40.004 -24.912 898 HB2 MET 105 HB2 MET 105 8.050 42.734 -26.243 899 HB3 MET 105 HB3 MET 105 7.401 41.301 -27.047 900 HG2 MET 105 HG2 MET 105 5.608 41.134 -25.364 901 HG3 MET 105 HG3 MET 105 6.244 42.558 -24.539 902 HE1 MET 105 HE1 MET 105 4.323 41.162 -27.637 903 HE2 MET 105 HE2 MET 105 4.089 42.602 -28.650 904 HE3 MET 105 HE3 MET 105 5.705 41.891 -28.491 905 H THR 106 H THR 106 8.469 39.040 -26.897 906 HA THR 106 HA THR 106 11.368 39.357 -27.561 907 HB THR 106 HB THR 106 10.778 37.170 -26.582 908 HG1 THR 106 HG1 THR 106 11.902 36.030 -28.127 909 HG21 THR 106 HG21 THR 106 9.222 36.698 -29.165 910 HG22 THR 106 HG22 THR 106 9.579 35.501 -27.903 911 HG23 THR 106 HG23 THR 106 8.502 36.858 -27.547 912 H TRP 107 H TRP 107 11.839 38.665 -29.841 913 HA TRP 107 HA TRP 107 10.169 40.419 -31.579 914 HB2 TRP 107 HB2 TRP 107 12.550 41.038 -30.967 915 HB3 TRP 107 HB3 TRP 107 13.081 39.707 -31.983 916 HD1 TRP 107 HD1 TRP 107 12.814 40.032 -34.619 917 HE1 TRP 107 HE1 TRP 107 12.468 42.097 -36.114 918 HE3 TRP 107 HE3 TRP 107 11.327 43.374 -31.036 919 HZ2 TRP 107 HZ2 TRP 107 11.653 44.851 -35.787 920 HZ3 TRP 107 HZ3 TRP 107 10.771 45.718 -31.656 921 HH2 TRP 107 HH2 TRP 107 10.931 46.466 -34.022 Start of MODEL 4 1 H1 GLY -5 H1 GLY -5 -25.895 2.847 -7.986 2 H2 GLY -5 H2 GLY -5 -24.920 1.970 -7.005 3 H3 GLY -5 H3 GLY -5 -26.282 2.658 -6.405 4 HA2 GLY -5 HA2 GLY -5 -26.636 0.305 -6.685 5 HA3 GLY -5 HA3 GLY -5 -27.673 1.244 -7.774 6 H SER -4 H SER -4 -27.864 -0.347 -9.349 7 HA SER -4 HA SER -4 -25.379 -1.310 -10.716 8 HB2 SER -4 HB2 SER -4 -28.127 -2.588 -10.565 9 HB3 SER -4 HB3 SER -4 -26.722 -3.228 -11.438 10 HG SER -4 HG SER -4 -26.971 -4.149 -9.331 11 H HIS -3 H HIS -3 -25.097 -1.029 -12.830 12 HA HIS -3 HA HIS -3 -27.307 0.029 -14.566 13 HB2 HIS -3 HB2 HIS -3 -24.515 1.189 -14.224 14 HB3 HIS -3 HB3 HIS -3 -25.558 1.546 -15.597 15 HD2 HIS -3 HD2 HIS -3 -25.072 2.444 -11.927 16 HE1 HIS -3 HE1 HIS -3 -28.430 4.703 -13.280 17 HE2 HIS -3 HE2 HIS -3 -26.779 4.381 -11.370 18 H MET -2 H MET -2 -24.148 -1.643 -14.442 19 HA MET -2 HA MET -2 -24.864 -3.130 -16.894 20 HB2 MET -2 HB2 MET -2 -23.467 -1.033 -17.474 21 HB3 MET -2 HB3 MET -2 -22.143 -1.795 -16.594 22 HG2 MET -2 HG2 MET -2 -21.892 -2.217 -18.943 23 HG3 MET -2 HG3 MET -2 -22.286 -3.748 -18.163 24 HE1 MET -2 HE1 MET -2 -22.637 -4.519 -20.809 25 HE2 MET -2 HE2 MET -2 -23.843 -3.761 -21.873 26 HE3 MET -2 HE3 MET -2 -22.413 -2.842 -21.358 27 H ALA -1 H ALA -1 -24.396 -5.199 -16.783 28 HA ALA -1 HA ALA -1 -22.334 -6.233 -14.997 29 HB1 ALA -1 HB1 ALA -1 -25.297 -6.851 -14.549 30 HB2 ALA -1 HB2 ALA -1 -23.943 -7.600 -13.675 31 HB3 ALA -1 HB3 ALA -1 -24.271 -5.872 -13.476 32 H SER 0 H SER 0 -22.316 -8.670 -15.016 33 HA SER 0 HA SER 0 -23.100 -9.820 -17.666 34 HB2 SER 0 HB2 SER 0 -20.607 -9.449 -17.202 35 HB3 SER 0 HB3 SER 0 -20.754 -10.751 -16.002 36 HG SER 0 HG SER 0 -20.144 -11.525 -18.093 37 H MET 1 H MET 1 -23.213 -12.269 -17.552 38 HA MET 1 HA MET 1 -24.770 -13.129 -15.137 39 HB2 MET 1 HB2 MET 1 -26.162 -12.625 -17.131 40 HB3 MET 1 HB3 MET 1 -25.282 -13.859 -18.043 41 HG2 MET 1 HG2 MET 1 -26.056 -15.582 -16.435 42 HG3 MET 1 HG3 MET 1 -26.894 -14.334 -15.502 43 HE1 MET 1 HE1 MET 1 -29.155 -15.665 -15.548 44 HE2 MET 1 HE2 MET 1 -29.883 -16.335 -17.025 45 HE3 MET 1 HE3 MET 1 -28.336 -16.976 -16.429 46 H ASP 2 H ASP 2 -23.928 -14.796 -14.082 47 HA ASP 2 HA ASP 2 -22.288 -16.853 -15.468 48 HB2 ASP 2 HB2 ASP 2 -21.475 -15.161 -13.083 49 HB3 ASP 2 HB3 ASP 2 -20.706 -16.697 -13.467 50 HA PRO 3 HA PRO 3 -24.654 -19.469 -12.811 51 HB2 PRO 3 HB2 PRO 3 -23.453 -21.895 -13.146 52 HB3 PRO 3 HB3 PRO 3 -24.270 -21.044 -14.493 53 HG2 PRO 3 HG2 PRO 3 -21.304 -21.042 -13.824 54 HG3 PRO 3 HG3 PRO 3 -22.079 -21.359 -15.408 55 HD2 PRO 3 HD2 PRO 3 -21.099 -18.898 -14.726 56 HD3 PRO 3 HD3 PRO 3 -22.567 -19.087 -15.732 57 H LEU 4 H LEU 4 -21.392 -19.023 -12.046 58 HA LEU 4 HA LEU 4 -21.713 -20.242 -9.336 59 HB2 LEU 4 HB2 LEU 4 -19.219 -19.911 -11.043 60 HB3 LEU 4 HB3 LEU 4 -19.225 -20.523 -9.392 61 HG LEU 4 HG LEU 4 -20.620 -21.882 -11.723 62 HD11 LEU 4 HD11 LEU 4 -18.056 -22.580 -10.232 63 HD12 LEU 4 HD12 LEU 4 -18.819 -23.540 -11.521 64 HD13 LEU 4 HD13 LEU 4 -18.160 -21.939 -11.888 65 HD21 LEU 4 HD21 LEU 4 -21.750 -22.426 -9.615 66 HD22 LEU 4 HD22 LEU 4 -20.794 -23.805 -10.155 67 HD23 LEU 4 HD23 LEU 4 -20.186 -22.777 -8.839 68 H ASP 5 H ASP 5 -22.694 -17.704 -9.760 69 HA ASP 5 HA ASP 5 -20.766 -15.939 -8.340 70 HB2 ASP 5 HB2 ASP 5 -22.546 -15.568 -10.588 71 HB3 ASP 5 HB3 ASP 5 -23.113 -14.537 -9.296 72 H LYS 6 H LYS 6 -23.067 -17.919 -7.377 73 HA LYS 6 HA LYS 6 -24.335 -16.052 -5.385 74 HB2 LYS 6 HB2 LYS 6 -25.864 -18.414 -6.480 75 HB3 LYS 6 HB3 LYS 6 -26.432 -16.942 -5.729 76 HG2 LYS 6 HG2 LYS 6 -26.985 -16.387 -7.849 77 HG3 LYS 6 HG3 LYS 6 -25.313 -15.842 -7.920 78 HD2 LYS 6 HD2 LYS 6 -25.710 -17.098 -9.908 79 HD3 LYS 6 HD3 LYS 6 -24.718 -18.144 -8.880 80 HE2 LYS 6 HE2 LYS 6 -26.753 -19.368 -8.150 81 HE3 LYS 6 HE3 LYS 6 -27.757 -18.296 -9.132 82 HZ1 LYS 6 HZ1 LYS 6 -25.639 -20.078 -10.230 83 HZ2 LYS 6 HZ2 LYS 6 -27.245 -20.406 -10.261 84 HZ3 LYS 6 HZ3 LYS 6 -26.661 -19.140 -11.107 85 H ILE 7 H ILE 7 -23.922 -19.513 -5.964 86 HA ILE 7 HA ILE 7 -23.593 -20.023 -3.043 87 HB ILE 7 HB ILE 7 -24.774 -22.196 -3.464 88 HG12 ILE 7 HG12 ILE 7 -26.342 -22.351 -5.357 89 HG13 ILE 7 HG13 ILE 7 -25.642 -20.921 -6.103 90 HG21 ILE 7 HG21 ILE 7 -26.408 -19.689 -4.014 91 HG22 ILE 7 HG22 ILE 7 -26.985 -21.217 -3.325 92 HG23 ILE 7 HG23 ILE 7 -25.836 -20.224 -2.419 93 HD11 ILE 7 HD11 ILE 7 -24.129 -23.520 -5.600 94 HD12 ILE 7 HD12 ILE 7 -24.913 -23.075 -7.127 95 HD13 ILE 7 HD13 ILE 7 -23.553 -22.115 -6.538 96 H ILE 8 H ILE 8 -21.691 -19.755 -5.468 97 HA ILE 8 HA ILE 8 -20.386 -22.037 -6.169 98 HB ILE 8 HB ILE 8 -19.829 -19.884 -7.024 99 HG12 ILE 8 HG12 ILE 8 -17.433 -21.382 -5.881 100 HG13 ILE 8 HG13 ILE 8 -18.285 -21.719 -7.387 101 HG21 ILE 8 HG21 ILE 8 -18.184 -19.200 -4.569 102 HG22 ILE 8 HG22 ILE 8 -18.531 -18.196 -5.984 103 HG23 ILE 8 HG23 ILE 8 -19.823 -18.579 -4.851 104 HD11 ILE 8 HD11 ILE 8 -16.550 -19.295 -6.758 105 HD12 ILE 8 HD12 ILE 8 -16.207 -20.613 -7.887 106 HD13 ILE 8 HD13 ILE 8 -17.511 -19.468 -8.244 107 H ASN 9 H ASN 9 -19.869 -23.783 -4.963 108 HA ASN 9 HA ASN 9 -17.899 -23.508 -2.795 109 HB2 ASN 9 HB2 ASN 9 -20.474 -23.368 -2.024 110 HB3 ASN 9 HB3 ASN 9 -20.359 -25.117 -2.121 111 HD21 ASN 9 HD21 ASN 9 -18.182 -25.290 0.753 112 HD22 ASN 9 HD22 ASN 9 -18.528 -26.100 -0.779 113 H ASP 10 H ASP 10 -18.127 -24.923 -5.542 114 HA ASP 10 HA ASP 10 -17.962 -27.692 -4.709 115 HB2 ASP 10 HB2 ASP 10 -19.227 -26.836 -6.728 116 HB3 ASP 10 HB3 ASP 10 -17.674 -26.531 -7.503 117 H ILE 11 H ILE 11 -15.742 -25.629 -4.315 118 HA ILE 11 HA ILE 11 -13.465 -27.446 -4.788 119 HB ILE 11 HB ILE 11 -13.835 -25.979 -6.812 120 HG12 ILE 11 HG12 ILE 11 -11.588 -25.370 -7.306 121 HG13 ILE 11 HG13 ILE 11 -11.098 -25.434 -5.623 122 HG21 ILE 11 HG21 ILE 11 -12.911 -23.691 -5.031 123 HG22 ILE 11 HG22 ILE 11 -13.227 -23.624 -6.773 124 HG23 ILE 11 HG23 ILE 11 -14.560 -23.924 -5.653 125 HD11 ILE 11 HD11 ILE 11 -12.107 -27.826 -7.231 126 HD12 ILE 11 HD12 ILE 11 -10.400 -27.427 -6.949 127 HD13 ILE 11 HD13 ILE 11 -11.431 -27.872 -5.582 128 H LYS 12 H LYS 12 -14.863 -26.458 -2.422 129 HA LYS 12 HA LYS 12 -12.440 -25.447 -0.971 130 HB2 LYS 12 HB2 LYS 12 -15.366 -24.749 -0.573 131 HB3 LYS 12 HB3 LYS 12 -14.159 -24.470 0.686 132 HG2 LYS 12 HG2 LYS 12 -12.856 -23.013 -0.716 133 HG3 LYS 12 HG3 LYS 12 -13.860 -23.340 -2.130 134 HD2 LYS 12 HD2 LYS 12 -14.963 -22.060 0.410 135 HD3 LYS 12 HD3 LYS 12 -14.269 -21.128 -0.931 136 HE2 LYS 12 HE2 LYS 12 -15.882 -22.140 -2.505 137 HE3 LYS 12 HE3 LYS 12 -16.605 -23.067 -1.179 138 HZ1 LYS 12 HZ1 LYS 12 -16.551 -20.100 -1.269 139 HZ2 LYS 12 HZ2 LYS 12 -17.827 -21.005 -1.743 140 HZ3 LYS 12 HZ3 LYS 12 -17.349 -21.028 -0.177 141 H LYS 13 H LYS 13 -15.259 -27.569 -0.612 142 HA LYS 13 HA LYS 13 -15.834 -29.121 0.997 143 HB2 LYS 13 HB2 LYS 13 -12.953 -29.921 0.440 144 HB3 LYS 13 HB3 LYS 13 -14.125 -30.924 1.301 145 HG2 LYS 13 HG2 LYS 13 -15.630 -30.889 -0.669 146 HG3 LYS 13 HG3 LYS 13 -14.398 -29.986 -1.578 147 HD2 LYS 13 HD2 LYS 13 -12.806 -31.848 -1.340 148 HD3 LYS 13 HD3 LYS 13 -13.914 -32.695 -0.258 149 HE2 LYS 13 HE2 LYS 13 -14.070 -33.763 -2.375 150 HE3 LYS 13 HE3 LYS 13 -15.579 -32.896 -2.093 151 HZ1 LYS 13 HZ1 LYS 13 -13.351 -31.930 -3.813 152 HZ2 LYS 13 HZ2 LYS 13 -14.744 -32.576 -4.358 153 HZ3 LYS 13 HZ3 LYS 13 -14.769 -31.142 -3.585 154 H GLU 14 H GLU 14 -15.323 -26.737 2.214 155 HA GLU 14 HA GLU 14 -14.834 -25.609 4.086 156 HB2 GLU 14 HB2 GLU 14 -16.374 -27.358 4.970 157 HB3 GLU 14 HB3 GLU 14 -14.984 -28.229 5.609 158 HG2 GLU 14 HG2 GLU 14 -15.572 -25.305 6.249 159 HG3 GLU 14 HG3 GLU 14 -16.292 -26.628 7.157 160 H ALA 15 H ALA 15 -12.896 -24.750 3.641 161 HA ALA 15 HA ALA 15 -10.565 -25.781 5.120 162 HB1 ALA 15 HB1 ALA 15 -10.531 -25.192 2.127 163 HB2 ALA 15 HB2 ALA 15 -9.113 -25.584 3.127 164 HB3 ALA 15 HB3 ALA 15 -10.383 -26.797 2.875 165 H ASN 16 H ASN 16 -8.889 -24.198 5.400 166 HA ASN 16 HA ASN 16 -9.962 -21.491 5.724 167 HB2 ASN 16 HB2 ASN 16 -8.728 -22.895 7.484 168 HB3 ASN 16 HB3 ASN 16 -7.244 -22.515 6.612 169 HD21 ASN 16 HD21 ASN 16 -7.360 -19.021 7.620 170 HD22 ASN 16 HD22 ASN 16 -6.934 -20.041 6.238 171 H ASP 17 H ASP 17 -9.905 -21.742 3.123 172 HA ASP 17 HA ASP 17 -7.661 -20.021 2.163 173 HB2 ASP 17 HB2 ASP 17 -8.637 -22.584 0.847 174 HB3 ASP 17 HB3 ASP 17 -7.696 -21.349 0.018 175 H SER 18 H SER 18 -8.292 -18.359 0.997 176 HA SER 18 HA SER 18 -10.993 -18.268 -0.281 177 HB2 SER 18 HB2 SER 18 -9.822 -16.175 1.597 178 HB3 SER 18 HB3 SER 18 -11.281 -15.970 0.608 179 HG SER 18 HG SER 18 -11.755 -16.620 2.766 180 H GLY 19 H GLY 19 -10.148 -18.437 -2.284 181 HA2 GLY 19 HA2 GLY 19 -9.607 -17.412 -4.331 182 HA3 GLY 19 HA3 GLY 19 -8.932 -16.026 -3.486 183 H VAL 20 H VAL 20 -8.276 -18.963 -5.048 184 HA VAL 20 HA VAL 20 -5.435 -19.070 -4.162 185 HB VAL 20 HB VAL 20 -7.226 -21.200 -5.393 186 HG11 VAL 20 HG11 VAL 20 -4.357 -21.449 -4.403 187 HG12 VAL 20 HG12 VAL 20 -5.443 -22.830 -4.677 188 HG13 VAL 20 HG13 VAL 20 -4.985 -21.815 -6.033 189 HG21 VAL 20 HG21 VAL 20 -7.839 -20.692 -3.057 190 HG22 VAL 20 HG22 VAL 20 -7.073 -22.272 -3.153 191 HG23 VAL 20 HG23 VAL 20 -6.144 -20.880 -2.556 192 H THR 21 H THR 21 -7.021 -17.707 -6.553 193 HA THR 21 HA THR 21 -4.923 -18.159 -8.633 194 HB THR 21 HB THR 21 -7.614 -17.897 -9.776 195 HG1 THR 21 HG1 THR 21 -8.244 -19.998 -9.343 196 HG21 THR 21 HG21 THR 21 -5.428 -20.005 -10.077 197 HG22 THR 21 HG22 THR 21 -6.806 -19.746 -11.176 198 HG23 THR 21 HG23 THR 21 -5.538 -18.517 -11.051 199 H LEU 22 H LEU 22 -5.220 -16.714 -10.562 200 HA LEU 22 HA LEU 22 -4.780 -14.063 -9.552 201 HB2 LEU 22 HB2 LEU 22 -4.645 -15.253 -12.364 202 HB3 LEU 22 HB3 LEU 22 -3.933 -13.708 -11.926 203 HG LEU 22 HG LEU 22 -3.064 -16.270 -10.543 204 HD11 LEU 22 HD11 LEU 22 -1.963 -15.112 -13.122 205 HD12 LEU 22 HD12 LEU 22 -1.209 -16.403 -12.152 206 HD13 LEU 22 HD13 LEU 22 -2.789 -16.679 -12.904 207 HD21 LEU 22 HD21 LEU 22 -2.415 -14.086 -9.537 208 HD22 LEU 22 HD22 LEU 22 -1.014 -15.000 -10.130 209 HD23 LEU 22 HD23 LEU 22 -1.642 -13.625 -11.068 210 H ALA 23 H ALA 23 -7.547 -14.950 -9.714 211 HA ALA 23 HA ALA 23 -8.855 -12.759 -11.203 212 HB1 ALA 23 HB1 ALA 23 -9.056 -15.689 -12.022 213 HB2 ALA 23 HB2 ALA 23 -10.074 -14.373 -12.669 214 HB3 ALA 23 HB3 ALA 23 -8.320 -14.374 -12.952 215 HA PRO 24 HA PRO 24 -11.413 -14.045 -7.624 216 HB2 PRO 24 HB2 PRO 24 -12.410 -11.626 -6.883 217 HB3 PRO 24 HB3 PRO 24 -10.730 -12.135 -6.530 218 HG2 PRO 24 HG2 PRO 24 -11.710 -10.374 -8.792 219 HG3 PRO 24 HG3 PRO 24 -10.327 -10.103 -7.693 220 HD2 PRO 24 HD2 PRO 24 -10.068 -11.186 -10.215 221 HD3 PRO 24 HD3 PRO 24 -8.973 -11.627 -8.875 222 H LEU 25 H LEU 25 -12.525 -11.850 -10.215 223 HA LEU 25 HA LEU 25 -14.958 -13.454 -10.641 224 HB2 LEU 25 HB2 LEU 25 -14.931 -10.554 -9.748 225 HB3 LEU 25 HB3 LEU 25 -16.179 -11.106 -10.856 226 HG LEU 25 HG LEU 25 -15.720 -12.280 -8.090 227 HD11 LEU 25 HD11 LEU 25 -17.907 -10.473 -9.193 228 HD12 LEU 25 HD12 LEU 25 -17.839 -11.163 -7.556 229 HD13 LEU 25 HD13 LEU 25 -16.620 -9.983 -8.068 230 HD21 LEU 25 HD21 LEU 25 -16.674 -13.999 -9.549 231 HD22 LEU 25 HD22 LEU 25 -17.979 -13.337 -8.568 232 HD23 LEU 25 HD23 LEU 25 -17.797 -12.832 -10.264 233 H SER 26 H SER 26 -13.830 -14.128 -12.415 234 HA SER 26 HA SER 26 -13.289 -14.210 -14.595 235 HB2 SER 26 HB2 SER 26 -15.175 -13.800 -15.996 236 HB3 SER 26 HB3 SER 26 -15.752 -14.273 -14.382 237 HG SER 26 HG SER 26 -16.928 -12.513 -15.229 238 H VAL 27 H VAL 27 -11.809 -12.156 -13.448 239 HA VAL 27 HA VAL 27 -10.910 -10.664 -15.811 240 HB VAL 27 HB VAL 27 -12.807 -9.381 -14.672 241 HG11 VAL 27 HG11 VAL 27 -10.715 -8.642 -12.594 242 HG12 VAL 27 HG12 VAL 27 -12.402 -8.101 -12.700 243 HG13 VAL 27 HG13 VAL 27 -12.041 -9.782 -12.290 244 HG21 VAL 27 HG21 VAL 27 -11.229 -8.290 -16.223 245 HG22 VAL 27 HG22 VAL 27 -11.803 -7.207 -14.949 246 HG23 VAL 27 HG23 VAL 27 -10.169 -7.884 -14.845 247 HA PRO 28 HA PRO 28 -7.140 -11.460 -13.531 248 HB2 PRO 28 HB2 PRO 28 -5.268 -10.031 -14.902 249 HB3 PRO 28 HB3 PRO 28 -6.110 -11.451 -15.579 250 HG2 PRO 28 HG2 PRO 28 -6.849 -8.527 -15.960 251 HG3 PRO 28 HG3 PRO 28 -6.598 -9.775 -17.225 252 HD2 PRO 28 HD2 PRO 28 -9.071 -9.188 -16.320 253 HD3 PRO 28 HD3 PRO 28 -8.616 -10.875 -16.671 254 H LYS 29 H LYS 29 -8.355 -10.358 -11.830 255 HA LYS 29 HA LYS 29 -8.550 -9.160 -9.964 256 HB2 LYS 29 HB2 LYS 29 -6.096 -9.685 -9.815 257 HB3 LYS 29 HB3 LYS 29 -5.778 -8.045 -10.379 258 HG2 LYS 29 HG2 LYS 29 -5.654 -7.785 -8.047 259 HG3 LYS 29 HG3 LYS 29 -7.335 -7.325 -8.359 260 HD2 LYS 29 HD2 LYS 29 -7.973 -9.714 -7.828 261 HD3 LYS 29 HD3 LYS 29 -6.273 -10.002 -7.408 262 HE2 LYS 29 HE2 LYS 29 -6.420 -8.227 -5.665 263 HE3 LYS 29 HE3 LYS 29 -8.113 -7.947 -6.090 264 HZ1 LYS 29 HZ1 LYS 29 -7.035 -10.511 -5.013 265 HZ2 LYS 29 HZ2 LYS 29 -7.932 -9.436 -4.171 266 HZ3 LYS 29 HZ3 LYS 29 -8.598 -10.248 -5.412 267 HA PRO 30 HA PRO 30 -10.076 -5.354 -11.837 268 HB2 PRO 30 HB2 PRO 30 -12.136 -4.796 -10.154 269 HB3 PRO 30 HB3 PRO 30 -12.197 -6.144 -11.328 270 HG2 PRO 30 HG2 PRO 30 -11.496 -6.268 -8.379 271 HG3 PRO 30 HG3 PRO 30 -12.627 -7.317 -9.293 272 HD2 PRO 30 HD2 PRO 30 -10.026 -8.011 -8.755 273 HD3 PRO 30 HD3 PRO 30 -10.868 -8.539 -10.245 274 H LYS 31 H LYS 31 -9.960 -3.125 -11.398 275 HA LYS 31 HA LYS 31 -7.931 -2.352 -9.491 276 HB2 LYS 31 HB2 LYS 31 -9.705 -0.676 -11.306 277 HB3 LYS 31 HB3 LYS 31 -8.340 -0.051 -10.373 278 HG2 LYS 31 HG2 LYS 31 -6.768 -1.476 -11.605 279 HG3 LYS 31 HG3 LYS 31 -8.100 -2.227 -12.503 280 HD2 LYS 31 HD2 LYS 31 -8.705 -0.009 -13.454 281 HD3 LYS 31 HD3 LYS 31 -7.312 0.716 -12.621 282 HE2 LYS 31 HE2 LYS 31 -5.770 -0.739 -13.865 283 HE3 LYS 31 HE3 LYS 31 -7.129 -1.589 -14.614 284 HZ1 LYS 31 HZ1 LYS 31 -6.498 1.288 -15.027 285 HZ2 LYS 31 HZ2 LYS 31 -6.238 0.092 -16.113 286 HZ3 LYS 31 HZ3 LYS 31 -7.760 0.499 -15.701 287 H LEU 32 H LEU 32 -8.042 -1.209 -7.584 288 HA LEU 32 HA LEU 32 -10.659 -0.426 -6.474 289 HB2 LEU 32 HB2 LEU 32 -10.016 -2.847 -5.867 290 HB3 LEU 32 HB3 LEU 32 -8.582 -2.181 -5.085 291 HG LEU 32 HG LEU 32 -10.239 -0.685 -3.785 292 HD11 LEU 32 HD11 LEU 32 -12.135 -2.910 -4.658 293 HD12 LEU 32 HD12 LEU 32 -12.483 -1.684 -3.422 294 HD13 LEU 32 HD13 LEU 32 -12.275 -1.198 -5.110 295 HD21 LEU 32 HD21 LEU 32 -8.964 -2.458 -2.727 296 HD22 LEU 32 HD22 LEU 32 -10.603 -2.396 -2.055 297 HD23 LEU 32 HD23 LEU 32 -10.173 -3.664 -3.229 298 H GLU 33 H GLU 33 -10.539 1.382 -5.158 299 HA GLU 33 HA GLU 33 -7.999 2.276 -4.049 300 HB2 GLU 33 HB2 GLU 33 -8.069 4.517 -5.121 301 HB3 GLU 33 HB3 GLU 33 -7.854 3.241 -6.310 302 HG2 GLU 33 HG2 GLU 33 -10.188 3.362 -6.995 303 HG3 GLU 33 HG3 GLU 33 -10.567 4.501 -5.709 304 H GLU 34 H GLU 34 -9.969 1.328 -2.750 305 HA GLU 34 HA GLU 34 -11.656 3.508 -1.610 306 HB2 GLU 34 HB2 GLU 34 -11.858 0.490 -1.427 307 HB3 GLU 34 HB3 GLU 34 -12.832 1.611 -0.451 308 HG2 GLU 34 HG2 GLU 34 -13.496 2.735 -2.667 309 HG3 GLU 34 HG3 GLU 34 -12.816 1.321 -3.473 310 H LEU 35 H LEU 35 -9.978 4.582 -0.638 311 HA LEU 35 HA LEU 35 -9.045 3.559 2.030 312 HB2 LEU 35 HB2 LEU 35 -7.670 5.302 -0.048 313 HB3 LEU 35 HB3 LEU 35 -7.039 5.031 1.562 314 HG LEU 35 HG LEU 35 -7.613 2.532 -0.004 315 HD11 LEU 35 HD11 LEU 35 -5.280 4.325 -0.746 316 HD12 LEU 35 HD12 LEU 35 -5.612 2.680 -1.345 317 HD13 LEU 35 HD13 LEU 35 -6.705 4.005 -1.765 318 HD21 LEU 35 HD21 LEU 35 -6.532 2.500 2.232 319 HD22 LEU 35 HD22 LEU 35 -5.496 1.822 0.965 320 HD23 LEU 35 HD23 LEU 35 -5.174 3.455 1.568 321 H SER 36 H SER 36 -8.726 5.243 3.652 322 HA SER 36 HA SER 36 -10.670 7.449 3.582 323 HB2 SER 36 HB2 SER 36 -9.987 7.975 5.752 324 HB3 SER 36 HB3 SER 36 -9.926 6.210 5.687 325 HG SER 36 HG SER 36 -8.075 7.115 6.675 326 H GLU 37 H GLU 37 -9.832 9.771 4.066 327 HA GLU 37 HA GLU 37 -8.213 10.699 1.918 328 HB2 GLU 37 HB2 GLU 37 -9.832 12.062 3.170 329 HB3 GLU 37 HB3 GLU 37 -8.802 11.999 4.608 330 HG2 GLU 37 HG2 GLU 37 -7.016 13.220 3.395 331 HG3 GLU 37 HG3 GLU 37 -7.994 13.212 1.925 332 H GLN 38 H GLN 38 -7.286 9.982 5.307 333 HA GLN 38 HA GLN 38 -4.497 10.736 4.956 334 HB2 GLN 38 HB2 GLN 38 -5.783 10.703 7.151 335 HB3 GLN 38 HB3 GLN 38 -5.804 8.940 7.051 336 HG2 GLN 38 HG2 GLN 38 -3.185 9.152 6.901 337 HG3 GLN 38 HG3 GLN 38 -3.435 10.799 7.465 338 HE21 GLN 38 HE21 GLN 38 -4.078 7.608 10.010 339 HE22 GLN 38 HE22 GLN 38 -3.985 7.330 8.278 340 H GLN 39 H GLN 39 -6.260 7.578 4.931 341 HA GLN 39 HA GLN 39 -3.901 5.989 4.565 342 HB2 GLN 39 HB2 GLN 39 -6.832 5.497 4.030 343 HB3 GLN 39 HB3 GLN 39 -5.597 4.294 3.675 344 HG2 GLN 39 HG2 GLN 39 -4.821 4.305 6.005 345 HG3 GLN 39 HG3 GLN 39 -6.053 5.493 6.434 346 HE21 GLN 39 HE21 GLN 39 -7.159 1.820 6.966 347 HE22 GLN 39 HE22 GLN 39 -5.554 2.486 7.206 348 H LYS 40 H LYS 40 -6.060 7.575 2.183 349 HA LYS 40 HA LYS 40 -4.802 6.493 -0.164 350 HB2 LYS 40 HB2 LYS 40 -7.000 7.605 -0.157 351 HB3 LYS 40 HB3 LYS 40 -6.254 9.141 0.298 352 HG2 LYS 40 HG2 LYS 40 -5.023 9.217 -1.823 353 HG3 LYS 40 HG3 LYS 40 -5.661 7.640 -2.297 354 HD2 LYS 40 HD2 LYS 40 -7.392 10.076 -1.687 355 HD3 LYS 40 HD3 LYS 40 -6.798 9.719 -3.304 356 HE2 LYS 40 HE2 LYS 40 -8.528 7.795 -1.682 357 HE3 LYS 40 HE3 LYS 40 -9.184 9.002 -2.786 358 HZ1 LYS 40 HZ1 LYS 40 -7.328 6.841 -3.625 359 HZ2 LYS 40 HZ2 LYS 40 -8.944 6.836 -3.864 360 HZ3 LYS 40 HZ3 LYS 40 -8.022 7.943 -4.615 361 H ILE 41 H ILE 41 -4.049 9.481 1.746 362 HA ILE 41 HA ILE 41 -1.867 10.278 0.065 363 HB ILE 41 HB ILE 41 -2.295 10.805 2.986 364 HG12 ILE 41 HG12 ILE 41 -2.753 12.770 0.685 365 HG13 ILE 41 HG13 ILE 41 -4.029 11.674 1.163 366 HG21 ILE 41 HG21 ILE 41 -0.384 12.160 1.045 367 HG22 ILE 41 HG22 ILE 41 -0.766 12.774 2.666 368 HG23 ILE 41 HG23 ILE 41 0.046 11.230 2.498 369 HD11 ILE 41 HD11 ILE 41 -2.761 13.785 2.949 370 HD12 ILE 41 HD12 ILE 41 -4.394 13.781 2.262 371 HD13 ILE 41 HD13 ILE 41 -3.953 12.578 3.488 372 H ILE 42 H ILE 42 -1.875 8.192 3.048 373 HA ILE 42 HA ILE 42 0.991 7.876 3.082 374 HB ILE 42 HB ILE 42 -1.234 6.121 4.140 375 HG12 ILE 42 HG12 ILE 42 0.615 7.841 5.821 376 HG13 ILE 42 HG13 ILE 42 -0.837 8.529 5.097 377 HG21 ILE 42 HG21 ILE 42 1.781 5.945 4.618 378 HG22 ILE 42 HG22 ILE 42 0.582 5.099 5.604 379 HG23 ILE 42 HG23 ILE 42 0.739 4.692 3.905 380 HD11 ILE 42 HD11 ILE 42 -0.808 6.129 6.974 381 HD12 ILE 42 HD12 ILE 42 -1.336 7.773 7.357 382 HD13 ILE 42 HD13 ILE 42 -2.237 6.801 6.162 383 H LEU 43 H LEU 43 -1.601 5.896 1.646 384 HA LEU 43 HA LEU 43 -0.026 3.825 0.519 385 HB2 LEU 43 HB2 LEU 43 -2.461 3.783 0.787 386 HB3 LEU 43 HB3 LEU 43 -2.664 5.095 -0.341 387 HG LEU 43 HG LEU 43 -3.311 2.821 -1.108 388 HD11 LEU 43 HD11 LEU 43 -1.267 4.160 -2.896 389 HD12 LEU 43 HD12 LEU 43 -2.591 3.092 -3.374 390 HD13 LEU 43 HD13 LEU 43 -2.945 4.676 -2.666 391 HD21 LEU 43 HD21 LEU 43 -1.643 1.387 -0.306 392 HD22 LEU 43 HD22 LEU 43 -1.480 1.363 -2.057 393 HD23 LEU 43 HD23 LEU 43 -0.309 2.279 -1.078 394 H ALA 44 H ALA 44 -1.103 6.920 -0.926 395 HA ALA 44 HA ALA 44 0.248 6.627 -3.410 396 HB1 ALA 44 HB1 ALA 44 -0.675 9.084 -1.868 397 HB2 ALA 44 HB2 ALA 44 -0.234 9.063 -3.594 398 HB3 ALA 44 HB3 ALA 44 -1.648 8.143 -3.023 399 H GLU 45 H GLU 45 1.240 8.592 -0.491 400 HA GLU 45 HA GLU 45 3.706 9.456 -1.614 401 HB2 GLU 45 HB2 GLU 45 2.797 9.061 1.258 402 HB3 GLU 45 HB3 GLU 45 4.358 9.762 0.848 403 HG2 GLU 45 HG2 GLU 45 1.714 10.924 -0.132 404 HG3 GLU 45 HG3 GLU 45 2.529 11.427 1.343 405 H TYR 46 H TYR 46 2.946 6.330 -0.144 406 HA TYR 46 HA TYR 46 5.688 5.496 0.211 407 HB2 TYR 46 HB2 TYR 46 3.779 4.596 1.448 408 HB3 TYR 46 HB3 TYR 46 3.083 3.957 -0.032 409 HD1 TYR 46 HD1 TYR 46 2.869 1.905 1.347 410 HD2 TYR 46 HD2 TYR 46 6.718 3.495 0.199 411 HE1 TYR 46 HE1 TYR 46 3.928 -0.305 1.789 412 HE2 TYR 46 HE2 TYR 46 7.762 1.295 0.663 413 HH TYR 46 HH TYR 46 5.852 -1.500 1.834 414 H ILE 47 H ILE 47 3.250 4.526 -2.292 415 HA ILE 47 HA ILE 47 4.963 3.193 -4.098 416 HB ILE 47 HB ILE 47 2.327 4.615 -4.212 417 HG12 ILE 47 HG12 ILE 47 3.081 1.670 -4.465 418 HG13 ILE 47 HG13 ILE 47 2.808 2.411 -2.909 419 HG21 ILE 47 HG21 ILE 47 3.543 3.016 -6.506 420 HG22 ILE 47 HG22 ILE 47 1.866 3.606 -6.413 421 HG23 ILE 47 HG23 ILE 47 3.172 4.754 -6.525 422 HD11 ILE 47 HD11 ILE 47 0.679 2.231 -5.075 423 HD12 ILE 47 HD12 ILE 47 0.795 1.236 -3.612 424 HD13 ILE 47 HD13 ILE 47 0.503 2.977 -3.484 425 H ALA 48 H ALA 48 4.129 6.678 -3.813 426 HA ALA 48 HA ALA 48 5.398 7.512 -6.254 427 HB1 ALA 48 HB1 ALA 48 4.724 9.006 -3.690 428 HB2 ALA 48 HB2 ALA 48 5.122 9.763 -5.251 429 HB3 ALA 48 HB3 ALA 48 3.648 8.784 -5.086 430 H GLU 49 H GLU 49 6.686 6.796 -3.053 431 HA GLU 49 HA GLU 49 9.274 8.103 -3.630 432 HB2 GLU 49 HB2 GLU 49 8.179 8.386 -1.456 433 HB3 GLU 49 HB3 GLU 49 8.281 6.642 -1.157 434 HG2 GLU 49 HG2 GLU 49 10.714 6.747 -1.115 435 HG3 GLU 49 HG3 GLU 49 10.698 8.422 -1.678 436 H VAL 50 H VAL 50 7.927 4.768 -3.577 437 HA VAL 50 HA VAL 50 10.695 3.779 -4.174 438 HB VAL 50 HB VAL 50 10.341 1.812 -2.984 439 HG11 VAL 50 HG11 VAL 50 9.240 4.007 -1.192 440 HG12 VAL 50 HG12 VAL 50 10.122 2.550 -0.701 441 HG13 VAL 50 HG13 VAL 50 10.955 3.811 -1.627 442 HG21 VAL 50 HG21 VAL 50 8.010 1.271 -3.433 443 HG22 VAL 50 HG22 VAL 50 8.319 1.262 -1.706 444 HG23 VAL 50 HG23 VAL 50 7.453 2.623 -2.445 445 H GLY 51 H GLY 51 7.408 3.791 -5.331 446 HA2 GLY 51 HA2 GLY 51 6.657 3.037 -7.386 447 HA3 GLY 51 HA3 GLY 51 8.125 2.102 -7.633 448 H LEU 52 H LEU 52 5.238 1.413 -7.906 449 HA LEU 52 HA LEU 52 4.315 0.039 -5.664 450 HB2 LEU 52 HB2 LEU 52 3.229 1.074 -7.887 451 HB3 LEU 52 HB3 LEU 52 3.222 -0.584 -8.430 452 HG LEU 52 HG LEU 52 2.005 0.159 -5.743 453 HD11 LEU 52 HD11 LEU 52 0.654 0.420 -8.450 454 HD12 LEU 52 HD12 LEU 52 -0.113 0.650 -6.854 455 HD13 LEU 52 HD13 LEU 52 1.151 1.756 -7.390 456 HD21 LEU 52 HD21 LEU 52 1.955 -2.221 -6.152 457 HD22 LEU 52 HD22 LEU 52 0.332 -1.593 -6.348 458 HD23 LEU 52 HD23 LEU 52 1.305 -1.976 -7.787 459 H GLN 53 H GLN 53 6.648 -1.046 -7.620 460 HA GLN 53 HA GLN 53 6.144 -3.953 -7.106 461 HB2 GLN 53 HB2 GLN 53 7.679 -4.549 -8.790 462 HB3 GLN 53 HB3 GLN 53 6.502 -3.438 -9.463 463 HG2 GLN 53 HG2 GLN 53 9.337 -2.659 -8.618 464 HG3 GLN 53 HG3 GLN 53 8.869 -3.106 -10.250 465 HE21 GLN 53 HE21 GLN 53 8.394 0.696 -9.214 466 HE22 GLN 53 HE22 GLN 53 9.299 -0.431 -8.211 467 H ASN 54 H ASN 54 7.805 -1.396 -5.707 468 HA ASN 54 HA ASN 54 9.783 -3.237 -4.431 469 HB2 ASN 54 HB2 ASN 54 9.785 -0.208 -4.595 470 HB3 ASN 54 HB3 ASN 54 11.030 -1.193 -3.834 471 HD21 ASN 54 HD21 ASN 54 11.613 -0.296 -7.580 472 HD22 ASN 54 HD22 ASN 54 10.583 0.588 -6.448 473 H ILE 55 H ILE 55 6.890 -1.655 -3.865 474 HA ILE 55 HA ILE 55 7.001 -1.652 -0.940 475 HB ILE 55 HB ILE 55 4.604 -1.443 -0.960 476 HG12 ILE 55 HG12 ILE 55 4.669 -1.663 -3.987 477 HG13 ILE 55 HG13 ILE 55 4.091 -2.943 -2.918 478 HG21 ILE 55 HG21 ILE 55 5.598 0.407 -3.155 479 HG22 ILE 55 HG22 ILE 55 4.463 0.748 -1.822 480 HG23 ILE 55 HG23 ILE 55 6.168 0.512 -1.487 481 HD11 ILE 55 HD11 ILE 55 2.863 -0.165 -3.099 482 HD12 ILE 55 HD12 ILE 55 2.219 -1.631 -3.824 483 HD13 ILE 55 HD13 ILE 55 2.328 -1.498 -2.056 484 H THR 56 H THR 56 5.921 -3.159 0.460 485 HA THR 56 HA THR 56 5.449 -5.886 -0.654 486 HB THR 56 HB THR 56 6.124 -6.532 1.821 487 HG1 THR 56 HG1 THR 56 7.847 -5.224 2.527 488 HG21 THR 56 HG21 THR 56 8.235 -5.729 -0.236 489 HG22 THR 56 HG22 THR 56 8.461 -6.878 1.104 490 HG23 THR 56 HG23 THR 56 7.350 -7.272 -0.218 491 H ALA 57 H ALA 57 3.671 -7.005 0.121 492 HA ALA 57 HA ALA 57 1.431 -5.551 1.087 493 HB1 ALA 57 HB1 ALA 57 2.005 -8.557 1.112 494 HB2 ALA 57 HB2 ALA 57 0.417 -7.786 1.271 495 HB3 ALA 57 HB3 ALA 57 1.310 -7.659 -0.252 496 H ILE 58 H ILE 58 4.020 -7.302 2.714 497 HA ILE 58 HA ILE 58 2.904 -7.488 5.360 498 HB ILE 58 HB ILE 58 5.754 -7.333 4.282 499 HG12 ILE 58 HG12 ILE 58 5.893 -9.703 5.066 500 HG13 ILE 58 HG13 ILE 58 4.205 -9.654 5.567 501 HG21 ILE 58 HG21 ILE 58 4.806 -7.744 7.168 502 HG22 ILE 58 HG22 ILE 58 6.463 -8.069 6.606 503 HG23 ILE 58 HG23 ILE 58 5.832 -6.427 6.569 504 HD11 ILE 58 HD11 ILE 58 5.135 -9.319 2.683 505 HD12 ILE 58 HD12 ILE 58 4.659 -10.863 3.418 506 HD13 ILE 58 HD13 ILE 58 3.461 -9.577 3.259 507 H THR 59 H THR 59 5.188 -5.116 3.910 508 HA THR 59 HA THR 59 5.123 -3.376 6.200 509 HB THR 59 HB THR 59 6.061 -3.026 3.345 510 HG1 THR 59 HG1 THR 59 8.022 -3.509 4.222 511 HG21 THR 59 HG21 THR 59 6.619 -1.241 5.755 512 HG22 THR 59 HG22 THR 59 7.470 -1.171 4.189 513 HG23 THR 59 HG23 THR 59 5.751 -0.774 4.273 514 H LEU 60 H LEU 60 3.443 -3.232 3.010 515 HA LEU 60 HA LEU 60 2.076 -0.808 3.517 516 HB2 LEU 60 HB2 LEU 60 2.348 -1.982 1.302 517 HB3 LEU 60 HB3 LEU 60 1.200 -3.187 1.839 518 HG LEU 60 HG LEU 60 -0.515 -1.288 2.094 519 HD11 LEU 60 HD11 LEU 60 1.613 0.241 0.543 520 HD12 LEU 60 HD12 LEU 60 -0.014 0.809 0.928 521 HD13 LEU 60 HD13 LEU 60 1.128 0.592 2.231 522 HD21 LEU 60 HD21 LEU 60 -0.469 -2.758 0.127 523 HD22 LEU 60 HD22 LEU 60 -0.975 -1.112 -0.287 524 HD23 LEU 60 HD23 LEU 60 0.665 -1.668 -0.672 525 H SER 61 H SER 61 1.183 -4.188 4.441 526 HA SER 61 HA SER 61 -1.305 -3.536 5.536 527 HB2 SER 61 HB2 SER 61 -1.410 -5.586 6.537 528 HB3 SER 61 HB3 SER 61 -0.422 -5.840 5.113 529 HG SER 61 HG SER 61 1.430 -5.684 6.522 530 H LYS 62 H LYS 62 1.740 -2.713 6.688 531 HA LYS 62 HA LYS 62 0.668 -1.923 9.348 532 HB2 LYS 62 HB2 LYS 62 3.527 -2.589 8.565 533 HB3 LYS 62 HB3 LYS 62 3.159 -1.597 9.970 534 HG2 LYS 62 HG2 LYS 62 3.235 -3.611 11.010 535 HG3 LYS 62 HG3 LYS 62 1.513 -3.529 10.647 536 HD2 LYS 62 HD2 LYS 62 2.248 -4.800 8.441 537 HD3 LYS 62 HD3 LYS 62 3.706 -5.166 9.346 538 HE2 LYS 62 HE2 LYS 62 2.358 -7.029 9.736 539 HE3 LYS 62 HE3 LYS 62 2.094 -6.059 11.191 540 HZ1 LYS 62 HZ1 LYS 62 0.322 -6.128 8.797 541 HZ2 LYS 62 HZ2 LYS 62 -0.001 -6.883 10.217 542 HZ3 LYS 62 HZ3 LYS 62 0.019 -5.248 10.145 543 H LYS 63 H LYS 63 2.072 -0.512 6.432 544 HA LYS 63 HA LYS 63 2.497 2.145 7.446 545 HB2 LYS 63 HB2 LYS 63 1.634 1.054 4.734 546 HB3 LYS 63 HB3 LYS 63 2.056 2.739 4.995 547 HG2 LYS 63 HG2 LYS 63 4.164 0.859 5.932 548 HG3 LYS 63 HG3 LYS 63 3.778 0.696 4.217 549 HD2 LYS 63 HD2 LYS 63 4.157 3.119 3.892 550 HD3 LYS 63 HD3 LYS 63 4.587 3.270 5.615 551 HE2 LYS 63 HE2 LYS 63 6.455 1.674 5.275 552 HE3 LYS 63 HE3 LYS 63 6.005 1.508 3.571 553 HZ1 LYS 63 HZ1 LYS 63 6.905 4.039 4.838 554 HZ2 LYS 63 HZ2 LYS 63 7.813 3.100 3.859 555 HZ3 LYS 63 HZ3 LYS 63 6.499 3.862 3.261 556 H LEU 64 H LEU 64 -0.347 0.441 6.347 557 HA LEU 64 HA LEU 64 -2.110 2.801 6.798 558 HB2 LEU 64 HB2 LEU 64 -2.230 0.317 5.082 559 HB3 LEU 64 HB3 LEU 64 -3.579 1.459 5.185 560 HG LEU 64 HG LEU 64 -0.771 2.125 4.198 561 HD11 LEU 64 HD11 LEU 64 -3.309 1.541 2.618 562 HD12 LEU 64 HD12 LEU 64 -1.724 2.024 1.967 563 HD13 LEU 64 HD13 LEU 64 -1.908 0.459 2.764 564 HD21 LEU 64 HD21 LEU 64 -2.047 4.086 5.010 565 HD22 LEU 64 HD22 LEU 64 -1.856 4.095 3.248 566 HD23 LEU 64 HD23 LEU 64 -3.404 3.613 3.959 567 H ASN 65 H ASN 65 -1.302 0.118 8.542 568 HA ASN 65 HA ASN 65 -2.248 -1.195 10.123 569 HB2 ASN 65 HB2 ASN 65 -4.220 1.083 10.503 570 HB3 ASN 65 HB3 ASN 65 -3.787 -0.151 11.675 571 HD21 ASN 65 HD21 ASN 65 -1.438 3.125 11.260 572 HD22 ASN 65 HD22 ASN 65 -2.879 2.895 10.275 573 H ILE 66 H ILE 66 -2.802 -2.511 8.125 574 HA ILE 66 HA ILE 66 -5.707 -3.212 8.032 575 HB ILE 66 HB ILE 66 -5.037 -3.554 5.436 576 HG12 ILE 66 HG12 ILE 66 -3.706 -0.924 5.943 577 HG13 ILE 66 HG13 ILE 66 -2.704 -2.332 6.029 578 HG21 ILE 66 HG21 ILE 66 -6.008 -0.972 6.710 579 HG22 ILE 66 HG22 ILE 66 -6.196 -1.405 5.001 580 HG23 ILE 66 HG23 ILE 66 -6.996 -2.377 6.250 581 HD11 ILE 66 HD11 ILE 66 -4.244 -1.326 3.613 582 HD12 ILE 66 HD12 ILE 66 -2.495 -1.593 3.792 583 HD13 ILE 66 HD13 ILE 66 -3.590 -2.978 3.692 584 H THR 67 H THR 67 -5.947 -5.275 6.545 585 HA THR 67 HA THR 67 -4.305 -7.357 7.739 586 HB THR 67 HB THR 67 -5.725 -8.889 7.039 587 HG1 THR 67 HG1 THR 67 -6.774 -8.884 5.038 588 HG21 THR 67 HG21 THR 67 -7.566 -6.588 6.237 589 HG22 THR 67 HG22 THR 67 -8.031 -8.207 6.789 590 HG23 THR 67 HG23 THR 67 -7.271 -7.086 7.929 591 H VAL 68 H VAL 68 -3.004 -8.878 6.644 592 HA VAL 68 HA VAL 68 -1.131 -7.786 4.740 593 HB VAL 68 HB VAL 68 -1.604 -10.615 5.726 594 HG11 VAL 68 HG11 VAL 68 0.769 -9.460 4.181 595 HG12 VAL 68 HG12 VAL 68 0.765 -11.038 4.999 596 HG13 VAL 68 HG13 VAL 68 -0.317 -10.760 3.637 597 HG21 VAL 68 HG21 VAL 68 -0.919 -9.004 7.505 598 HG22 VAL 68 HG22 VAL 68 0.363 -10.166 7.162 599 HG23 VAL 68 HG23 VAL 68 0.472 -8.517 6.517 600 H GLU 69 H GLU 69 -4.225 -9.371 4.270 601 HA GLU 69 HA GLU 69 -3.583 -10.102 1.452 602 HB2 GLU 69 HB2 GLU 69 -6.149 -10.329 3.109 603 HB3 GLU 69 HB3 GLU 69 -5.969 -10.888 1.456 604 HG2 GLU 69 HG2 GLU 69 -4.470 -11.965 3.886 605 HG3 GLU 69 HG3 GLU 69 -5.846 -12.724 3.095 606 H LYS 70 H LYS 70 -5.440 -7.706 3.392 607 HA LYS 70 HA LYS 70 -6.750 -6.449 1.203 608 HB2 LYS 70 HB2 LYS 70 -7.190 -6.237 3.757 609 HB3 LYS 70 HB3 LYS 70 -6.003 -4.919 3.665 610 HG2 LYS 70 HG2 LYS 70 -7.448 -4.140 1.579 611 HG3 LYS 70 HG3 LYS 70 -8.666 -5.263 2.228 612 HD2 LYS 70 HD2 LYS 70 -8.631 -4.044 4.359 613 HD3 LYS 70 HD3 LYS 70 -7.382 -2.954 3.694 614 HE2 LYS 70 HE2 LYS 70 -8.956 -2.246 1.899 615 HE3 LYS 70 HE3 LYS 70 -10.203 -3.298 2.578 616 HZ1 LYS 70 HZ1 LYS 70 -8.996 -0.962 3.968 617 HZ2 LYS 70 HZ2 LYS 70 -10.486 -1.007 3.311 618 HZ3 LYS 70 HZ3 LYS 70 -10.146 -1.939 4.607 619 H ALA 71 H ALA 71 -3.679 -5.781 2.819 620 HA ALA 71 HA ALA 71 -2.704 -3.627 1.253 621 HB1 ALA 71 HB1 ALA 71 -1.294 -5.947 2.647 622 HB2 ALA 71 HB2 ALA 71 -0.516 -4.461 2.086 623 HB3 ALA 71 HB3 ALA 71 -1.732 -4.386 3.370 624 H LYS 72 H LYS 72 -2.631 -7.153 0.690 625 HA LYS 72 HA LYS 72 -0.866 -7.089 -1.585 626 HB2 LYS 72 HB2 LYS 72 -1.394 -8.929 0.133 627 HB3 LYS 72 HB3 LYS 72 -2.805 -9.303 -0.858 628 HG2 LYS 72 HG2 LYS 72 -1.414 -10.010 -2.674 629 HG3 LYS 72 HG3 LYS 72 0.000 -9.155 -2.022 630 HD2 LYS 72 HD2 LYS 72 0.251 -11.557 -1.598 631 HD3 LYS 72 HD3 LYS 72 0.053 -10.657 -0.072 632 HE2 LYS 72 HE2 LYS 72 -2.293 -11.241 0.033 633 HE3 LYS 72 HE3 LYS 72 -2.175 -12.177 -1.461 634 HZ1 LYS 72 HZ1 LYS 72 -0.491 -12.766 0.913 635 HZ2 LYS 72 HZ2 LYS 72 -1.964 -13.410 0.752 636 HZ3 LYS 72 HZ3 LYS 72 -0.789 -13.757 -0.359 637 H ASN 73 H ASN 73 -4.381 -6.966 -1.160 638 HA ASN 73 HA ASN 73 -5.119 -7.465 -3.780 639 HB2 ASN 73 HB2 ASN 73 -7.143 -7.222 -2.867 640 HB3 ASN 73 HB3 ASN 73 -6.415 -6.626 -1.392 641 HD21 ASN 73 HD21 ASN 73 -7.288 -3.226 -2.045 642 HD22 ASN 73 HD22 ASN 73 -6.286 -4.291 -1.071 643 H TYR 74 H TYR 74 -3.904 -4.393 -2.480 644 HA TYR 74 HA TYR 74 -4.473 -2.724 -4.725 645 HB2 TYR 74 HB2 TYR 74 -2.302 -2.499 -2.613 646 HB3 TYR 74 HB3 TYR 74 -2.800 -1.219 -3.713 647 HD1 TYR 74 HD1 TYR 74 -3.134 -2.447 -0.484 648 HD2 TYR 74 HD2 TYR 74 -5.445 -0.636 -3.633 649 HE1 TYR 74 HE1 TYR 74 -4.839 -1.726 1.192 650 HE2 TYR 74 HE2 TYR 74 -7.140 0.104 -1.957 651 HH TYR 74 HH TYR 74 -6.833 -0.666 1.528 652 H ILE 75 H ILE 75 -1.650 -4.616 -3.694 653 HA ILE 75 HA ILE 75 0.091 -3.931 -5.864 654 HB ILE 75 HB ILE 75 0.089 -6.359 -4.025 655 HG12 ILE 75 HG12 ILE 75 1.632 -3.745 -3.788 656 HG13 ILE 75 HG13 ILE 75 0.169 -4.078 -2.869 657 HG21 ILE 75 HG21 ILE 75 2.326 -5.169 -5.732 658 HG22 ILE 75 HG22 ILE 75 2.490 -6.533 -4.606 659 HG23 ILE 75 HG23 ILE 75 1.493 -6.709 -6.042 660 HD11 ILE 75 HD11 ILE 75 2.814 -5.525 -2.584 661 HD12 ILE 75 HD12 ILE 75 2.003 -4.461 -1.420 662 HD13 ILE 75 HD13 ILE 75 1.289 -6.031 -1.815 663 H LYS 76 H LYS 76 -2.171 -6.670 -5.371 664 HA LYS 76 HA LYS 76 -1.510 -8.103 -7.746 665 HB2 LYS 76 HB2 LYS 76 -4.006 -8.078 -6.007 666 HB3 LYS 76 HB3 LYS 76 -3.718 -9.264 -7.277 667 HG2 LYS 76 HG2 LYS 76 -1.672 -8.885 -5.075 668 HG3 LYS 76 HG3 LYS 76 -3.134 -9.801 -4.759 669 HD2 LYS 76 HD2 LYS 76 -1.213 -10.459 -7.037 670 HD3 LYS 76 HD3 LYS 76 -1.050 -11.093 -5.394 671 HE2 LYS 76 HE2 LYS 76 -3.423 -11.978 -5.571 672 HE3 LYS 76 HE3 LYS 76 -3.392 -11.550 -7.289 673 HZ1 LYS 76 HZ1 LYS 76 -1.506 -13.429 -5.950 674 HZ2 LYS 76 HZ2 LYS 76 -2.739 -13.872 -6.916 675 HZ3 LYS 76 HZ3 LYS 76 -1.463 -13.045 -7.532 676 H ASN 77 H ASN 77 -3.839 -5.404 -7.275 677 HA ASN 77 HA ASN 77 -4.793 -5.833 -10.034 678 HB2 ASN 77 HB2 ASN 77 -6.491 -4.354 -9.661 679 HB3 ASN 77 HB3 ASN 77 -6.400 -5.284 -8.173 680 HD21 ASN 77 HD21 ASN 77 -5.941 -2.394 -6.209 681 HD22 ASN 77 HD22 ASN 77 -5.921 -4.159 -6.214 682 H SER 78 H SER 78 -2.870 -3.473 -8.093 683 HA SER 78 HA SER 78 -2.897 -1.678 -10.366 684 HB2 SER 78 HB2 SER 78 -3.299 -1.109 -7.919 685 HB3 SER 78 HB3 SER 78 -1.535 -1.107 -7.747 686 HG SER 78 HG SER 78 -2.519 0.966 -8.271 687 H ASN 79 H ASN 79 -0.618 -4.048 -9.510 688 HA ASN 79 HA ASN 79 1.806 -2.696 -9.949 689 HB2 ASN 79 HB2 ASN 79 2.865 -4.814 -10.059 690 HB3 ASN 79 HB3 ASN 79 1.594 -4.894 -8.854 691 HD21 ASN 79 HD21 ASN 79 -0.263 -7.379 -10.672 692 HD22 ASN 79 HD22 ASN 79 -0.304 -6.212 -9.347 693 H ARG 80 H ARG 80 3.261 -2.512 -11.563 694 HA ARG 80 HA ARG 80 3.910 -1.585 -13.482 695 HB2 ARG 80 HB2 ARG 80 2.545 -3.895 -14.877 696 HB3 ARG 80 HB3 ARG 80 3.753 -2.819 -15.561 697 HG2 ARG 80 HG2 ARG 80 5.314 -4.281 -14.914 698 HG3 ARG 80 HG3 ARG 80 5.070 -3.659 -13.286 699 HD2 ARG 80 HD2 ARG 80 4.824 -5.965 -13.006 700 HD3 ARG 80 HD3 ARG 80 3.160 -5.371 -13.118 701 HE ARG 80 HE ARG 80 4.240 -6.149 -15.704 702 HH11 ARG 80 HH11 ARG 80 3.732 -8.061 -16.701 703 HH12 ARG 80 HH12 ARG 80 2.877 -9.295 -15.831 704 HH21 ARG 80 HH21 ARG 80 2.593 -7.511 -12.920 705 HH22 ARG 80 HH22 ARG 80 2.307 -9.025 -13.731 706 H LEU 81 H LEU 81 1.102 -0.785 -12.539 707 HA LEU 81 HA LEU 81 0.479 0.846 -14.968 708 HB2 LEU 81 HB2 LEU 81 -0.920 -1.299 -14.586 709 HB3 LEU 81 HB3 LEU 81 -1.693 -0.435 -13.269 710 HG LEU 81 HG LEU 81 -1.558 0.688 -16.108 711 HD11 LEU 81 HD11 LEU 81 -3.697 -1.139 -14.939 712 HD12 LEU 81 HD12 LEU 81 -3.762 -0.317 -16.523 713 HD13 LEU 81 HD13 LEU 81 -2.547 -1.561 -16.223 714 HD21 LEU 81 HD21 LEU 81 -2.347 2.308 -14.423 715 HD22 LEU 81 HD22 LEU 81 -3.675 1.819 -15.460 716 HD23 LEU 81 HD23 LEU 81 -3.535 1.135 -13.821 717 H GLY 82 H GLY 82 0.013 0.553 -11.425 718 HA2 GLY 82 HA2 GLY 82 -1.016 3.213 -11.136 719 HA3 GLY 82 HA3 GLY 82 -0.497 2.130 -9.846 720 H ARG 83 H ARG 83 0.851 4.268 -12.383 721 HA ARG 83 HA ARG 83 2.715 5.474 -10.365 722 HB2 ARG 83 HB2 ARG 83 3.559 4.466 -13.079 723 HB3 ARG 83 HB3 ARG 83 4.414 5.737 -12.182 724 HG2 ARG 83 HG2 ARG 83 4.442 4.141 -10.168 725 HG3 ARG 83 HG3 ARG 83 3.879 2.884 -11.267 726 HD2 ARG 83 HD2 ARG 83 6.289 2.767 -10.964 727 HD3 ARG 83 HD3 ARG 83 5.856 3.122 -12.639 728 HE ARG 83 HE ARG 83 7.120 5.019 -12.513 729 HH11 ARG 83 HH11 ARG 83 8.353 6.641 -11.675 730 HH12 ARG 83 HH12 ARG 83 8.370 6.927 -9.961 731 HH21 ARG 83 HH21 ARG 83 6.159 4.434 -9.194 732 HH22 ARG 83 HH22 ARG 83 7.182 5.705 -8.586 733 H THR 84 H THR 84 2.233 6.168 -13.801 734 HA THR 84 HA THR 84 0.639 8.554 -13.288 735 HB THR 84 HB THR 84 2.678 9.561 -12.674 736 HG1 THR 84 HG1 THR 84 2.875 11.102 -14.269 737 HG21 THR 84 HG21 THR 84 3.966 8.480 -15.212 738 HG22 THR 84 HG22 THR 84 4.701 9.624 -14.069 739 HG23 THR 84 HG23 THR 84 4.331 7.977 -13.543 740 H ASN 85 H ASN 85 -0.592 8.969 -14.961 741 HA ASN 85 HA ASN 85 0.095 7.971 -17.699 742 HB2 ASN 85 HB2 ASN 85 -2.472 7.451 -16.131 743 HB3 ASN 85 HB3 ASN 85 -2.240 7.068 -17.834 744 HD21 ASN 85 HD21 ASN 85 -0.781 4.511 -15.036 745 HD22 ASN 85 HD22 ASN 85 -1.611 5.987 -14.568 746 H ASN 86 H ASN 86 -0.671 10.690 -16.005 747 HA ASN 86 HA ASN 86 -2.801 11.697 -17.788 748 HB2 ASN 86 HB2 ASN 86 -3.283 13.238 -15.979 749 HB3 ASN 86 HB3 ASN 86 -3.188 11.591 -15.372 750 HD21 ASN 86 HD21 ASN 86 -0.425 14.363 -14.137 751 HD22 ASN 86 HD22 ASN 86 -1.431 14.694 -15.546 752 H LEU 87 H LEU 87 0.229 11.800 -18.429 753 HA LEU 87 HA LEU 87 0.578 14.725 -18.710 754 HB2 LEU 87 HB2 LEU 87 2.273 12.544 -17.837 755 HB3 LEU 87 HB3 LEU 87 3.000 13.242 -19.260 756 HG LEU 87 HG LEU 87 3.899 14.218 -17.245 757 HD11 LEU 87 HD11 LEU 87 2.174 16.308 -18.634 758 HD12 LEU 87 HD12 LEU 87 3.666 16.583 -17.713 759 HD13 LEU 87 HD13 LEU 87 3.723 15.679 -19.236 760 HD21 LEU 87 HD21 LEU 87 1.931 13.919 -15.773 761 HD22 LEU 87 HD22 LEU 87 2.612 15.553 -15.686 762 HD23 LEU 87 HD23 LEU 87 1.116 15.268 -16.597 763 H LYS 88 H LYS 88 -0.462 12.376 -20.674 764 HA LYS 88 HA LYS 88 0.334 13.870 -23.123 765 HB2 LYS 88 HB2 LYS 88 0.707 11.895 -24.398 766 HB3 LYS 88 HB3 LYS 88 1.794 11.927 -23.029 767 HG2 LYS 88 HG2 LYS 88 -0.753 10.238 -23.121 768 HG3 LYS 88 HG3 LYS 88 0.823 9.699 -23.687 769 HD2 LYS 88 HD2 LYS 88 1.730 10.159 -21.332 770 HD3 LYS 88 HD3 LYS 88 0.051 10.405 -20.834 771 HE2 LYS 88 HE2 LYS 88 0.577 8.170 -20.276 772 HE3 LYS 88 HE3 LYS 88 -0.510 8.109 -21.664 773 HZ1 LYS 88 HZ1 LYS 88 2.453 7.812 -21.795 774 HZ2 LYS 88 HZ2 LYS 88 1.384 6.586 -21.906 775 HZ3 LYS 88 HZ3 LYS 88 1.446 7.714 -23.080 776 H THR 89 H THR 89 -2.139 13.630 -21.370 777 HA THR 89 HA THR 89 -4.056 13.821 -23.528 778 HB THR 89 HB THR 89 -4.068 11.393 -23.161 779 HG1 THR 89 HG1 THR 89 -6.303 11.289 -22.951 780 HG21 THR 89 HG21 THR 89 -5.271 11.894 -20.412 781 HG22 THR 89 HG22 THR 89 -4.868 10.340 -21.174 782 HG23 THR 89 HG23 THR 89 -3.571 11.433 -20.649 783 H ILE 90 H ILE 90 -4.965 15.693 -23.017 784 HA ILE 90 HA ILE 90 -5.893 16.194 -20.253 785 HB ILE 90 HB ILE 90 -5.052 18.556 -20.604 786 HG12 ILE 90 HG12 ILE 90 -4.599 18.291 -23.097 787 HG13 ILE 90 HG13 ILE 90 -3.528 19.254 -22.103 788 HG21 ILE 90 HG21 ILE 90 -2.916 16.416 -20.270 789 HG22 ILE 90 HG22 ILE 90 -2.821 18.105 -19.738 790 HG23 ILE 90 HG23 ILE 90 -4.013 17.012 -19.019 791 HD11 ILE 90 HD11 ILE 90 -2.872 16.439 -23.073 792 HD12 ILE 90 HD12 ILE 90 -2.284 17.960 -23.755 793 HD13 ILE 90 HD13 ILE 90 -1.817 17.502 -22.114 794 H GLY 91 H GLY 91 -7.066 15.850 -23.240 795 HA2 GLY 91 HA2 GLY 91 -8.924 16.589 -24.382 796 HA3 GLY 91 HA3 GLY 91 -9.442 17.420 -22.911 797 H ILE 92 H ILE 92 -6.419 18.535 -23.770 798 HA ILE 92 HA ILE 92 -5.639 20.552 -24.320 799 HB ILE 92 HB ILE 92 -7.134 20.272 -26.932 800 HG12 ILE 92 HG12 ILE 92 -4.796 19.115 -27.536 801 HG13 ILE 92 HG13 ILE 92 -4.780 18.679 -25.835 802 HG21 ILE 92 HG21 ILE 92 -4.368 21.382 -26.225 803 HG22 ILE 92 HG22 ILE 92 -5.092 21.322 -27.846 804 HG23 ILE 92 HG23 ILE 92 -5.782 22.371 -26.627 805 HD11 ILE 92 HD11 ILE 92 -7.007 18.005 -27.820 806 HD12 ILE 92 HD12 ILE 92 -5.669 16.925 -27.379 807 HD13 ILE 92 HD13 ILE 92 -6.858 17.382 -26.159 808 H LEU 93 H LEU 93 -7.717 20.795 -22.611 809 HA LEU 93 HA LEU 93 -9.205 22.161 -21.663 810 HB2 LEU 93 HB2 LEU 93 -6.933 23.416 -21.892 811 HB3 LEU 93 HB3 LEU 93 -7.766 24.426 -23.061 812 HG LEU 93 HG LEU 93 -9.417 25.052 -21.219 813 HD11 LEU 93 HD11 LEU 93 -7.426 23.542 -19.469 814 HD12 LEU 93 HD12 LEU 93 -8.706 24.624 -18.879 815 HD13 LEU 93 HD13 LEU 93 -9.137 23.126 -19.704 816 HD21 LEU 93 HD21 LEU 93 -7.491 26.476 -21.796 817 HD22 LEU 93 HD22 LEU 93 -7.844 26.540 -20.062 818 HD23 LEU 93 HD23 LEU 93 -6.472 25.574 -20.651 819 H GLN 94 H GLN 94 -10.148 21.198 -24.259 820 HA GLN 94 HA GLN 94 -12.127 23.323 -25.015 821 HB2 GLN 94 HB2 GLN 94 -10.199 21.737 -26.727 822 HB3 GLN 94 HB3 GLN 94 -11.696 22.395 -27.409 823 HG2 GLN 94 HG2 GLN 94 -11.096 24.652 -26.893 824 HG3 GLN 94 HG3 GLN 94 -9.712 24.150 -25.926 825 HE21 GLN 94 HE21 GLN 94 -7.582 23.493 -28.719 826 HE22 GLN 94 HE22 GLN 94 -7.888 23.103 -27.017 827 H GLU 95 H GLU 95 -13.269 21.899 -23.338 828 HA GLU 95 HA GLU 95 -14.505 19.452 -24.438 829 HB2 GLU 95 HB2 GLU 95 -14.978 21.027 -21.880 830 HB3 GLU 95 HB3 GLU 95 -15.807 19.531 -22.294 831 HG2 GLU 95 HG2 GLU 95 -12.794 19.814 -21.916 832 HG3 GLU 95 HG3 GLU 95 -13.924 19.194 -20.721 833 H GLU 96 H GLU 96 -15.495 22.810 -23.858 834 HA GLU 96 HA GLU 96 -17.462 23.940 -24.254 835 HB2 GLU 96 HB2 GLU 96 -16.727 22.806 -26.970 836 HB3 GLU 96 HB3 GLU 96 -17.853 24.151 -26.705 837 HG2 GLU 96 HG2 GLU 96 -16.025 25.366 -25.459 838 HG3 GLU 96 HG3 GLU 96 -14.903 24.093 -25.939 839 H VAL 97 H VAL 97 -18.457 22.375 -22.819 840 HA VAL 97 HA VAL 97 -20.334 20.531 -23.895 841 HB VAL 97 HB VAL 97 -20.140 21.498 -21.023 842 HG11 VAL 97 HG11 VAL 97 -21.103 18.833 -22.156 843 HG12 VAL 97 HG12 VAL 97 -21.044 19.292 -20.441 844 HG13 VAL 97 HG13 VAL 97 -22.167 20.105 -21.532 845 HG21 VAL 97 HG21 VAL 97 -17.928 20.725 -21.674 846 HG22 VAL 97 HG22 VAL 97 -18.681 19.496 -20.664 847 HG23 VAL 97 HG23 VAL 97 -18.614 19.265 -22.426 848 H SER 98 H SER 98 -21.228 22.342 -25.239 849 HA SER 98 HA SER 98 -23.964 22.832 -24.420 850 HB2 SER 98 HB2 SER 98 -22.816 24.680 -23.227 851 HB3 SER 98 HB3 SER 98 -22.169 25.271 -24.764 852 HG SER 98 HG SER 98 -24.105 26.363 -24.124 853 H SER 99 H SER 99 -21.378 23.845 -26.695 854 HA SER 99 HA SER 99 -23.328 23.677 -28.974 855 HB2 SER 99 HB2 SER 99 -20.945 25.527 -28.637 856 HB3 SER 99 HB3 SER 99 -22.058 25.480 -30.017 857 HG SER 99 HG SER 99 -22.613 27.123 -28.509 858 H MET 100 H MET 100 -20.168 22.550 -27.901 859 HA MET 100 HA MET 100 -19.780 21.161 -30.503 860 HB2 MET 100 HB2 MET 100 -17.662 22.865 -29.139 861 HB3 MET 100 HB3 MET 100 -17.382 21.766 -30.500 862 HG2 MET 100 HG2 MET 100 -19.062 23.060 -31.835 863 HG3 MET 100 HG3 MET 100 -19.144 24.235 -30.516 864 HE1 MET 100 HE1 MET 100 -18.658 26.182 -32.199 865 HE2 MET 100 HE2 MET 100 -17.283 26.205 -33.324 866 HE3 MET 100 HE3 MET 100 -18.579 25.007 -33.532 867 H GLU 101 H GLU 101 -20.847 20.085 -28.243 868 HA GLU 101 HA GLU 101 -18.907 18.708 -26.592 869 HB2 GLU 101 HB2 GLU 101 -21.198 19.546 -25.923 870 HB3 GLU 101 HB3 GLU 101 -21.898 18.235 -26.871 871 HG2 GLU 101 HG2 GLU 101 -20.432 16.657 -25.399 872 HG3 GLU 101 HG3 GLU 101 -20.168 18.063 -24.374 873 H ALA 102 H ALA 102 -17.738 17.814 -28.556 874 HA ALA 102 HA ALA 102 -18.621 15.020 -29.070 875 HB1 ALA 102 HB1 ALA 102 -17.815 17.005 -31.244 876 HB2 ALA 102 HB2 ALA 102 -18.152 15.276 -31.482 877 HB3 ALA 102 HB3 ALA 102 -19.451 16.366 -30.967 878 H LYS 103 H LYS 103 -17.001 13.563 -29.519 879 HA LYS 103 HA LYS 103 -14.131 14.437 -29.351 880 HB2 LYS 103 HB2 LYS 103 -15.512 12.277 -27.700 881 HB3 LYS 103 HB3 LYS 103 -13.759 12.410 -27.877 882 HG2 LYS 103 HG2 LYS 103 -13.839 14.725 -26.978 883 HG3 LYS 103 HG3 LYS 103 -15.577 14.542 -26.681 884 HD2 LYS 103 HD2 LYS 103 -15.171 12.679 -25.147 885 HD3 LYS 103 HD3 LYS 103 -13.432 12.736 -25.463 886 HE2 LYS 103 HE2 LYS 103 -15.052 15.039 -24.284 887 HE3 LYS 103 HE3 LYS 103 -14.177 13.855 -23.313 888 HZ1 LYS 103 HZ1 LYS 103 -12.885 15.620 -25.317 889 HZ2 LYS 103 HZ2 LYS 103 -12.895 15.915 -23.720 890 HZ3 LYS 103 HZ3 LYS 103 -12.114 14.593 -24.298 891 H SER 104 H SER 104 -16.410 12.105 -30.676 892 HA SER 104 HA SER 104 -14.360 11.163 -32.583 893 HB2 SER 104 HB2 SER 104 -14.886 8.797 -32.143 894 HB3 SER 104 HB3 SER 104 -14.151 9.586 -30.740 895 HG SER 104 HG SER 104 -15.965 8.303 -30.157 896 H MET 105 H MET 105 -15.265 9.874 -34.340 897 HA MET 105 HA MET 105 -18.160 10.235 -34.909 898 HB2 MET 105 HB2 MET 105 -15.883 11.206 -36.694 899 HB3 MET 105 HB3 MET 105 -17.565 11.043 -37.205 900 HG2 MET 105 HG2 MET 105 -18.260 12.672 -35.471 901 HG3 MET 105 HG3 MET 105 -16.575 12.851 -34.975 902 HE1 MET 105 HE1 MET 105 -19.302 13.659 -37.631 903 HE2 MET 105 HE2 MET 105 -18.387 14.450 -38.932 904 HE3 MET 105 HE3 MET 105 -18.213 12.704 -38.666 905 H THR 106 H THR 106 -18.971 8.890 -36.547 906 HA THR 106 HA THR 106 -17.386 6.460 -37.210 907 HB THR 106 HB THR 106 -19.648 6.190 -36.255 908 HG1 THR 106 HG1 THR 106 -20.198 4.592 -37.697 909 HG21 THR 106 HG21 THR 106 -20.643 7.234 -38.946 910 HG22 THR 106 HG22 THR 106 -21.625 6.516 -37.652 911 HG23 THR 106 HG23 THR 106 -20.826 8.072 -37.390 912 H TRP 107 H TRP 107 -17.821 5.598 -39.459 913 HA TRP 107 HA TRP 107 -16.958 7.748 -41.342 914 HB2 TRP 107 HB2 TRP 107 -15.270 6.022 -40.418 915 HB3 TRP 107 HB3 TRP 107 -16.023 4.888 -41.528 916 HD1 TRP 107 HD1 TRP 107 -15.220 5.026 -44.005 917 HE1 TRP 107 HE1 TRP 107 -13.573 6.498 -45.321 918 HE3 TRP 107 HE3 TRP 107 -14.397 8.653 -40.486 919 HZ2 TRP 107 HZ2 TRP 107 -12.078 8.936 -44.890 920 HZ3 TRP 107 HZ3 TRP 107 -12.853 10.542 -40.963 921 HH2 TRP 107 HH2 TRP 107 -11.689 10.693 -43.155 Start of MODEL 5 1 H1 GLY -5 H1 GLY -5 -31.553 -54.865 30.668 2 H2 GLY -5 H2 GLY -5 -32.023 -54.170 29.264 3 H3 GLY -5 H3 GLY -5 -32.786 -53.784 30.663 4 HA2 GLY -5 HA2 GLY -5 -31.309 -51.999 30.014 5 HA3 GLY -5 HA3 GLY -5 -30.811 -52.746 31.542 6 H SER -4 H SER -4 -28.863 -51.441 30.532 7 HA SER -4 HA SER -4 -26.961 -53.447 29.446 8 HB2 SER -4 HB2 SER -4 -26.006 -51.787 27.906 9 HB3 SER -4 HB3 SER -4 -27.684 -52.173 27.499 10 HG SER -4 HG SER -4 -27.285 -49.914 27.434 11 H HIS -3 H HIS -3 -24.692 -52.837 29.784 12 HA HIS -3 HA HIS -3 -24.162 -50.893 31.964 13 HB2 HIS -3 HB2 HIS -3 -24.857 -53.151 32.934 14 HB3 HIS -3 HB3 HIS -3 -23.401 -53.830 32.212 15 HD2 HIS -3 HD2 HIS -3 -21.189 -53.569 33.630 16 HE1 HIS -3 HE1 HIS -3 -22.602 -50.878 36.611 17 HE2 HIS -3 HE2 HIS -3 -20.655 -52.335 35.898 18 H MET -2 H MET -2 -22.033 -50.249 32.143 19 HA MET -2 HA MET -2 -20.068 -49.508 31.286 20 HB2 MET -2 HB2 MET -2 -19.634 -51.625 32.610 21 HB3 MET -2 HB3 MET -2 -19.472 -52.480 31.076 22 HG2 MET -2 HG2 MET -2 -17.291 -51.903 31.928 23 HG3 MET -2 HG3 MET -2 -17.578 -50.956 30.475 24 HE1 MET -2 HE1 MET -2 -15.505 -49.423 31.071 25 HE2 MET -2 HE2 MET -2 -15.280 -48.636 32.648 26 HE3 MET -2 HE3 MET -2 -15.227 -50.408 32.527 27 H ALA -1 H ALA -1 -21.450 -48.793 29.392 28 HA ALA -1 HA ALA -1 -19.988 -49.514 26.923 29 HB1 ALA -1 HB1 ALA -1 -23.029 -49.449 27.195 30 HB2 ALA -1 HB2 ALA -1 -22.129 -49.700 25.680 31 HB3 ALA -1 HB3 ALA -1 -22.038 -50.908 26.982 32 H SER 0 H SER 0 -19.902 -48.017 25.333 33 HA SER 0 HA SER 0 -20.860 -45.235 25.768 34 HB2 SER 0 HB2 SER 0 -17.964 -46.145 25.566 35 HB3 SER 0 HB3 SER 0 -18.487 -44.463 25.318 36 HG SER 0 HG SER 0 -17.783 -44.867 27.475 37 H MET 1 H MET 1 -21.333 -44.246 23.869 38 HA MET 1 HA MET 1 -20.086 -45.078 21.315 39 HB2 MET 1 HB2 MET 1 -23.105 -45.022 21.764 40 HB3 MET 1 HB3 MET 1 -22.306 -45.132 20.195 41 HG2 MET 1 HG2 MET 1 -21.271 -47.290 20.885 42 HG3 MET 1 HG3 MET 1 -22.109 -47.176 22.433 43 HE1 MET 1 HE1 MET 1 -22.368 -47.943 18.632 44 HE2 MET 1 HE2 MET 1 -24.117 -48.092 18.360 45 HE3 MET 1 HE3 MET 1 -23.406 -46.497 18.667 46 H ASP 2 H ASP 2 -19.757 -43.367 19.965 47 HA ASP 2 HA ASP 2 -21.255 -40.824 20.336 48 HB2 ASP 2 HB2 ASP 2 -18.233 -41.093 20.419 49 HB3 ASP 2 HB3 ASP 2 -19.088 -39.580 20.133 50 HA PRO 3 HA PRO 3 -20.760 -41.383 15.851 51 HB2 PRO 3 HB2 PRO 3 -22.877 -39.942 14.953 52 HB3 PRO 3 HB3 PRO 3 -23.107 -41.481 15.840 53 HG2 PRO 3 HG2 PRO 3 -23.196 -38.658 16.963 54 HG3 PRO 3 HG3 PRO 3 -24.408 -39.962 17.170 55 HD2 PRO 3 HD2 PRO 3 -22.462 -39.473 19.034 56 HD3 PRO 3 HD3 PRO 3 -23.044 -41.126 18.688 57 H LEU 4 H LEU 4 -20.284 -38.581 17.573 58 HA LEU 4 HA LEU 4 -19.720 -36.912 15.193 59 HB2 LEU 4 HB2 LEU 4 -20.195 -35.012 16.529 60 HB3 LEU 4 HB3 LEU 4 -21.501 -36.162 16.601 61 HG LEU 4 HG LEU 4 -19.676 -36.715 18.812 62 HD11 LEU 4 HD11 LEU 4 -20.653 -33.836 18.649 63 HD12 LEU 4 HD12 LEU 4 -19.880 -34.611 20.058 64 HD13 LEU 4 HD13 LEU 4 -18.964 -34.369 18.556 65 HD21 LEU 4 HD21 LEU 4 -22.091 -37.251 18.674 66 HD22 LEU 4 HD22 LEU 4 -21.681 -36.343 20.147 67 HD23 LEU 4 HD23 LEU 4 -22.474 -35.523 18.776 68 H ASP 5 H ASP 5 -17.692 -38.809 16.215 69 HA ASP 5 HA ASP 5 -15.634 -36.942 17.250 70 HB2 ASP 5 HB2 ASP 5 -16.287 -39.806 17.651 71 HB3 ASP 5 HB3 ASP 5 -14.580 -39.525 17.401 72 H LYS 6 H LYS 6 -16.348 -38.070 14.294 73 HA LYS 6 HA LYS 6 -13.491 -37.947 13.402 74 HB2 LYS 6 HB2 LYS 6 -13.606 -39.875 12.120 75 HB3 LYS 6 HB3 LYS 6 -14.207 -40.282 13.711 76 HG2 LYS 6 HG2 LYS 6 -15.923 -39.844 11.230 77 HG3 LYS 6 HG3 LYS 6 -15.377 -41.393 11.847 78 HD2 LYS 6 HD2 LYS 6 -16.675 -41.020 13.944 79 HD3 LYS 6 HD3 LYS 6 -17.328 -39.514 13.249 80 HE2 LYS 6 HE2 LYS 6 -18.244 -40.769 11.331 81 HE3 LYS 6 HE3 LYS 6 -17.566 -42.272 11.964 82 HZ1 LYS 6 HZ1 LYS 6 -19.608 -40.633 13.379 83 HZ2 LYS 6 HZ2 LYS 6 -19.927 -41.999 12.529 84 HZ3 LYS 6 HZ3 LYS 6 -19.016 -42.081 13.880 85 H ILE 7 H ILE 7 -16.758 -37.212 12.393 86 HA ILE 7 HA ILE 7 -15.669 -35.632 10.109 87 HB ILE 7 HB ILE 7 -17.681 -36.333 8.753 88 HG12 ILE 7 HG12 ILE 7 -18.626 -38.595 9.239 89 HG13 ILE 7 HG13 ILE 7 -17.912 -38.536 10.848 90 HG21 ILE 7 HG21 ILE 7 -15.692 -38.528 9.410 91 HG22 ILE 7 HG22 ILE 7 -16.639 -38.341 7.924 92 HG23 ILE 7 HG23 ILE 7 -15.405 -37.145 8.338 93 HD11 ILE 7 HD11 ILE 7 -19.976 -36.553 9.805 94 HD12 ILE 7 HD12 ILE 7 -20.343 -37.987 10.785 95 HD13 ILE 7 HD13 ILE 7 -19.371 -36.684 11.479 96 H ILE 8 H ILE 8 -16.807 -35.052 12.897 97 HA ILE 8 HA ILE 8 -19.321 -33.878 12.746 98 HB ILE 8 HB ILE 8 -18.112 -34.503 14.733 99 HG12 ILE 8 HG12 ILE 8 -20.159 -33.226 14.914 100 HG13 ILE 8 HG13 ILE 8 -19.055 -32.955 16.251 101 HG21 ILE 8 HG21 ILE 8 -16.570 -31.896 14.647 102 HG22 ILE 8 HG22 ILE 8 -16.570 -33.117 15.927 103 HG23 ILE 8 HG23 ILE 8 -15.902 -33.507 14.337 104 HD11 ILE 8 HD11 ILE 8 -19.711 -30.985 14.031 105 HD12 ILE 8 HD12 ILE 8 -20.131 -30.892 15.739 106 HD13 ILE 8 HD13 ILE 8 -18.440 -30.725 15.252 107 H ASN 9 H ASN 9 -20.006 -32.325 11.391 108 HA ASN 9 HA ASN 9 -18.607 -29.708 11.269 109 HB2 ASN 9 HB2 ASN 9 -18.016 -31.489 9.351 110 HB3 ASN 9 HB3 ASN 9 -19.548 -30.952 8.679 111 HD21 ASN 9 HD21 ASN 9 -18.208 -27.627 7.966 112 HD22 ASN 9 HD22 ASN 9 -19.669 -28.348 8.635 113 H ASP 10 H ASP 10 -21.466 -31.176 11.935 114 HA ASP 10 HA ASP 10 -23.113 -29.681 10.157 115 HB2 ASP 10 HB2 ASP 10 -23.482 -32.061 10.921 116 HB3 ASP 10 HB3 ASP 10 -23.915 -31.442 12.513 117 H ILE 11 H ILE 11 -21.704 -28.501 12.642 118 HA ILE 11 HA ILE 11 -23.643 -26.343 13.108 119 HB ILE 11 HB ILE 11 -24.100 -28.204 14.754 120 HG12 ILE 11 HG12 ILE 11 -23.381 -25.616 16.162 121 HG13 ILE 11 HG13 ILE 11 -24.776 -25.813 15.096 122 HG21 ILE 11 HG21 ILE 11 -21.500 -27.370 16.098 123 HG22 ILE 11 HG22 ILE 11 -22.644 -28.611 16.638 124 HG23 ILE 11 HG23 ILE 11 -21.726 -28.859 15.156 125 HD11 ILE 11 HD11 ILE 11 -24.261 -27.342 17.681 126 HD12 ILE 11 HD12 ILE 11 -25.469 -26.079 17.401 127 HD13 ILE 11 HD13 ILE 11 -25.623 -27.640 16.572 128 H LYS 12 H LYS 12 -21.062 -26.595 11.803 129 HA LYS 12 HA LYS 12 -19.722 -24.333 13.238 130 HB2 LYS 12 HB2 LYS 12 -18.342 -26.389 13.080 131 HB3 LYS 12 HB3 LYS 12 -18.431 -26.309 11.314 132 HG2 LYS 12 HG2 LYS 12 -17.344 -24.041 11.399 133 HG3 LYS 12 HG3 LYS 12 -17.207 -24.194 13.153 134 HD2 LYS 12 HD2 LYS 12 -15.913 -26.034 11.089 135 HD3 LYS 12 HD3 LYS 12 -15.107 -24.705 11.936 136 HE2 LYS 12 HE2 LYS 12 -15.561 -25.827 14.119 137 HE3 LYS 12 HE3 LYS 12 -16.305 -27.182 13.257 138 HZ1 LYS 12 HZ1 LYS 12 -13.475 -26.324 12.962 139 HZ2 LYS 12 HZ2 LYS 12 -13.981 -27.642 13.778 140 HZ3 LYS 12 HZ3 LYS 12 -14.161 -27.570 12.157 141 H LYS 13 H LYS 13 -20.416 -25.532 9.946 142 HA LYS 13 HA LYS 13 -20.975 -22.887 8.927 143 HB2 LYS 13 HB2 LYS 13 -18.374 -23.064 9.124 144 HB3 LYS 13 HB3 LYS 13 -18.465 -24.264 7.853 145 HG2 LYS 13 HG2 LYS 13 -17.854 -22.163 6.909 146 HG3 LYS 13 HG3 LYS 13 -19.489 -22.518 6.344 147 HD2 LYS 13 HD2 LYS 13 -20.464 -20.922 7.857 148 HD3 LYS 13 HD3 LYS 13 -18.972 -20.752 8.786 149 HE2 LYS 13 HE2 LYS 13 -19.237 -19.941 5.856 150 HE3 LYS 13 HE3 LYS 13 -19.561 -18.845 7.202 151 HZ1 LYS 13 HZ1 LYS 13 -16.944 -20.161 6.696 152 HZ2 LYS 13 HZ2 LYS 13 -17.287 -18.588 6.442 153 HZ3 LYS 13 HZ3 LYS 13 -17.269 -19.175 7.959 154 H GLU 14 H GLU 14 -22.353 -23.068 7.263 155 HA GLU 14 HA GLU 14 -21.996 -25.057 5.159 156 HB2 GLU 14 HB2 GLU 14 -23.344 -26.325 6.828 157 HB3 GLU 14 HB3 GLU 14 -24.594 -25.078 6.766 158 HG2 GLU 14 HG2 GLU 14 -24.958 -25.562 4.358 159 HG3 GLU 14 HG3 GLU 14 -23.624 -26.718 4.376 160 H ALA 15 H ALA 15 -21.916 -23.619 3.516 161 HA ALA 15 HA ALA 15 -24.266 -22.026 2.828 162 HB1 ALA 15 HB1 ALA 15 -21.583 -20.666 3.374 163 HB2 ALA 15 HB2 ALA 15 -23.023 -19.891 2.675 164 HB3 ALA 15 HB3 ALA 15 -23.060 -20.478 4.346 165 H ASN 16 H ASN 16 -23.999 -20.956 0.706 166 HA ASN 16 HA ASN 16 -22.509 -22.693 -1.179 167 HB2 ASN 16 HB2 ASN 16 -24.883 -20.829 -1.508 168 HB3 ASN 16 HB3 ASN 16 -24.086 -21.644 -2.854 169 HD21 ASN 16 HD21 ASN 16 -26.701 -23.768 -0.650 170 HD22 ASN 16 HD22 ASN 16 -26.452 -22.053 -0.368 171 H ASP 17 H ASP 17 -20.746 -21.168 0.083 172 HA ASP 17 HA ASP 17 -19.048 -19.692 -0.129 173 HB2 ASP 17 HB2 ASP 17 -18.766 -21.399 -1.983 174 HB3 ASP 17 HB3 ASP 17 -19.369 -20.177 -3.103 175 H SER 18 H SER 18 -21.392 -18.315 0.239 176 HA SER 18 HA SER 18 -21.731 -16.268 -1.687 177 HB2 SER 18 HB2 SER 18 -22.784 -16.385 1.162 178 HB3 SER 18 HB3 SER 18 -23.386 -15.341 -0.139 179 HG SER 18 HG SER 18 -24.654 -17.227 0.058 180 H GLY 19 H GLY 19 -20.080 -14.881 -2.062 181 HA2 GLY 19 HA2 GLY 19 -18.936 -12.915 -1.865 182 HA3 GLY 19 HA3 GLY 19 -20.025 -12.526 -0.526 183 H VAL 20 H VAL 20 -17.535 -15.064 -0.711 184 HA VAL 20 HA VAL 20 -16.167 -13.897 1.676 185 HB VAL 20 HB VAL 20 -17.971 -15.383 2.260 186 HG11 VAL 20 HG11 VAL 20 -16.468 -17.609 0.854 187 HG12 VAL 20 HG12 VAL 20 -17.919 -17.788 1.866 188 HG13 VAL 20 HG13 VAL 20 -18.009 -16.883 0.349 189 HG21 VAL 20 HG21 VAL 20 -16.002 -15.202 3.749 190 HG22 VAL 20 HG22 VAL 20 -16.930 -16.702 3.914 191 HG23 VAL 20 HG23 VAL 20 -15.383 -16.723 3.059 192 H THR 21 H THR 21 -15.200 -13.711 -0.940 193 HA THR 21 HA THR 21 -12.692 -15.320 -0.789 194 HB THR 21 HB THR 21 -13.589 -14.885 -3.547 195 HG1 THR 21 HG1 THR 21 -15.082 -16.585 -3.516 196 HG21 THR 21 HG21 THR 21 -12.788 -17.395 -2.006 197 HG22 THR 21 HG22 THR 21 -12.856 -17.217 -3.774 198 HG23 THR 21 HG23 THR 21 -11.642 -16.330 -2.839 199 H LEU 22 H LEU 22 -11.093 -14.643 -2.482 200 HA LEU 22 HA LEU 22 -10.333 -11.948 -1.727 201 HB2 LEU 22 HB2 LEU 22 -8.825 -14.137 -3.218 202 HB3 LEU 22 HB3 LEU 22 -8.088 -12.739 -2.441 203 HG LEU 22 HG LEU 22 -9.659 -14.846 -0.902 204 HD11 LEU 22 HD11 LEU 22 -6.679 -14.735 -1.432 205 HD12 LEU 22 HD12 LEU 22 -7.497 -15.813 -0.271 206 HD13 LEU 22 HD13 LEU 22 -7.845 -15.964 -2.000 207 HD21 LEU 22 HD21 LEU 22 -9.362 -12.678 0.263 208 HD22 LEU 22 HD22 LEU 22 -8.420 -13.962 1.032 209 HD23 LEU 22 HD23 LEU 22 -7.606 -12.774 -0.009 210 H ALA 23 H ALA 23 -12.343 -11.929 -3.651 211 HA ALA 23 HA ALA 23 -11.181 -10.519 -5.949 212 HB1 ALA 23 HB1 ALA 23 -12.615 -13.203 -6.221 213 HB2 ALA 23 HB2 ALA 23 -12.121 -12.158 -7.579 214 HB3 ALA 23 HB3 ALA 23 -10.898 -12.910 -6.526 215 HA PRO 24 HA PRO 24 -15.230 -8.678 -5.412 216 HB2 PRO 24 HB2 PRO 24 -15.309 -6.894 -7.466 217 HB3 PRO 24 HB3 PRO 24 -14.177 -6.732 -6.089 218 HG2 PRO 24 HG2 PRO 24 -13.616 -7.910 -8.831 219 HG3 PRO 24 HG3 PRO 24 -12.652 -6.702 -7.922 220 HD2 PRO 24 HD2 PRO 24 -12.058 -9.381 -7.901 221 HD3 PRO 24 HD3 PRO 24 -11.788 -8.331 -6.477 222 H LEU 25 H LEU 25 -14.446 -10.213 -8.509 223 HA LEU 25 HA LEU 25 -17.081 -11.373 -8.797 224 HB2 LEU 25 HB2 LEU 25 -16.575 -8.832 -10.037 225 HB3 LEU 25 HB3 LEU 25 -16.468 -9.993 -11.335 226 HG LEU 25 HG LEU 25 -18.813 -9.738 -9.390 227 HD11 LEU 25 HD11 LEU 25 -18.538 -8.822 -12.284 228 HD12 LEU 25 HD12 LEU 25 -20.008 -8.723 -11.285 229 HD13 LEU 25 HD13 LEU 25 -18.581 -7.769 -10.851 230 HD21 LEU 25 HD21 LEU 25 -18.692 -12.018 -10.342 231 HD22 LEU 25 HD22 LEU 25 -20.048 -11.123 -11.019 232 HD23 LEU 25 HD23 LEU 25 -18.579 -11.328 -11.987 233 H SER 26 H SER 26 -16.872 -12.287 -11.366 234 HA SER 26 HA SER 26 -14.592 -14.133 -11.360 235 HB2 SER 26 HB2 SER 26 -16.940 -14.772 -12.025 236 HB3 SER 26 HB3 SER 26 -16.716 -13.822 -13.505 237 HG SER 26 HG SER 26 -16.174 -16.048 -13.789 238 H VAL 27 H VAL 27 -13.220 -12.147 -11.291 239 HA VAL 27 HA VAL 27 -12.061 -11.515 -13.918 240 HB VAL 27 HB VAL 27 -13.904 -9.897 -13.619 241 HG11 VAL 27 HG11 VAL 27 -12.411 -8.798 -11.206 242 HG12 VAL 27 HG12 VAL 27 -13.874 -8.136 -11.960 243 HG13 VAL 27 HG13 VAL 27 -13.934 -9.702 -11.146 244 HG21 VAL 27 HG21 VAL 27 -11.937 -9.211 -14.907 245 HG22 VAL 27 HG22 VAL 27 -12.660 -7.842 -14.059 246 HG23 VAL 27 HG23 VAL 27 -11.170 -8.568 -13.431 247 HA PRO 28 HA PRO 28 -8.574 -11.395 -11.023 248 HB2 PRO 28 HB2 PRO 28 -6.513 -10.753 -12.635 249 HB3 PRO 28 HB3 PRO 28 -7.343 -12.334 -12.723 250 HG2 PRO 28 HG2 PRO 28 -7.825 -9.900 -14.482 251 HG3 PRO 28 HG3 PRO 28 -7.570 -11.597 -14.996 252 HD2 PRO 28 HD2 PRO 28 -10.060 -10.497 -14.722 253 HD3 PRO 28 HD3 PRO 28 -9.744 -12.216 -14.355 254 H LYS 29 H LYS 29 -9.905 -9.638 -10.180 255 HA LYS 29 HA LYS 29 -10.258 -7.530 -9.358 256 HB2 LYS 29 HB2 LYS 29 -8.409 -6.848 -7.913 257 HB3 LYS 29 HB3 LYS 29 -8.961 -8.506 -7.776 258 HG2 LYS 29 HG2 LYS 29 -6.526 -8.023 -9.477 259 HG3 LYS 29 HG3 LYS 29 -6.355 -7.798 -7.744 260 HD2 LYS 29 HD2 LYS 29 -7.476 -10.343 -8.987 261 HD3 LYS 29 HD3 LYS 29 -5.781 -10.099 -8.579 262 HE2 LYS 29 HE2 LYS 29 -6.365 -9.746 -6.200 263 HE3 LYS 29 HE3 LYS 29 -8.081 -9.853 -6.573 264 HZ1 LYS 29 HZ1 LYS 29 -6.136 -12.083 -6.840 265 HZ2 LYS 29 HZ2 LYS 29 -7.334 -11.946 -5.726 266 HZ3 LYS 29 HZ3 LYS 29 -7.707 -12.170 -7.292 267 HA PRO 30 HA PRO 30 -8.937 -4.419 -12.423 268 HB2 PRO 30 HB2 PRO 30 -11.181 -2.850 -12.246 269 HB3 PRO 30 HB3 PRO 30 -11.090 -4.317 -13.270 270 HG2 PRO 30 HG2 PRO 30 -12.208 -4.082 -10.455 271 HG3 PRO 30 HG3 PRO 30 -12.987 -4.820 -11.894 272 HD2 PRO 30 HD2 PRO 30 -11.691 -6.322 -10.082 273 HD3 PRO 30 HD3 PRO 30 -11.542 -6.694 -11.825 274 H LYS 31 H LYS 31 -8.572 -2.126 -12.101 275 HA LYS 31 HA LYS 31 -7.170 -1.353 -9.842 276 HB2 LYS 31 HB2 LYS 31 -8.627 0.116 -12.041 277 HB3 LYS 31 HB3 LYS 31 -8.114 1.078 -10.674 278 HG2 LYS 31 HG2 LYS 31 -6.159 -0.717 -12.162 279 HG3 LYS 31 HG3 LYS 31 -6.524 0.943 -12.663 280 HD2 LYS 31 HD2 LYS 31 -5.890 1.763 -10.389 281 HD3 LYS 31 HD3 LYS 31 -5.412 0.114 -9.951 282 HE2 LYS 31 HE2 LYS 31 -3.710 0.104 -11.722 283 HE3 LYS 31 HE3 LYS 31 -4.252 1.696 -12.287 284 HZ1 LYS 31 HZ1 LYS 31 -3.112 1.147 -9.601 285 HZ2 LYS 31 HZ2 LYS 31 -2.290 1.888 -10.833 286 HZ3 LYS 31 HZ3 LYS 31 -3.579 2.615 -10.137 287 H LEU 32 H LEU 32 -7.625 -0.949 -7.790 288 HA LEU 32 HA LEU 32 -10.406 -0.321 -6.988 289 HB2 LEU 32 HB2 LEU 32 -9.381 -2.670 -6.731 290 HB3 LEU 32 HB3 LEU 32 -8.379 -1.996 -5.448 291 HG LEU 32 HG LEU 32 -11.272 -1.355 -5.324 292 HD11 LEU 32 HD11 LEU 32 -10.284 -4.193 -4.811 293 HD12 LEU 32 HD12 LEU 32 -11.900 -3.578 -4.387 294 HD13 LEU 32 HD13 LEU 32 -11.414 -3.690 -6.082 295 HD21 LEU 32 HD21 LEU 32 -9.727 -0.720 -3.488 296 HD22 LEU 32 HD22 LEU 32 -10.988 -1.819 -2.923 297 HD23 LEU 32 HD23 LEU 32 -9.349 -2.439 -3.227 298 H GLU 33 H GLU 33 -10.742 1.409 -5.805 299 HA GLU 33 HA GLU 33 -8.472 2.854 -4.501 300 HB2 GLU 33 HB2 GLU 33 -10.599 3.998 -6.369 301 HB3 GLU 33 HB3 GLU 33 -9.390 4.946 -5.492 302 HG2 GLU 33 HG2 GLU 33 -7.580 3.786 -6.730 303 HG3 GLU 33 HG3 GLU 33 -8.784 2.874 -7.645 304 H GLU 34 H GLU 34 -9.608 1.520 -2.817 305 HA GLU 34 HA GLU 34 -11.778 3.092 -1.483 306 HB2 GLU 34 HB2 GLU 34 -12.432 0.873 -2.424 307 HB3 GLU 34 HB3 GLU 34 -11.303 0.095 -1.306 308 HG2 GLU 34 HG2 GLU 34 -12.529 1.092 0.606 309 HG3 GLU 34 HG3 GLU 34 -13.599 1.938 -0.512 310 H LEU 35 H LEU 35 -10.118 4.404 -0.594 311 HA LEU 35 HA LEU 35 -8.791 3.339 1.865 312 HB2 LEU 35 HB2 LEU 35 -7.744 5.220 -0.289 313 HB3 LEU 35 HB3 LEU 35 -6.959 5.010 1.266 314 HG LEU 35 HG LEU 35 -7.445 2.496 -0.310 315 HD11 LEU 35 HD11 LEU 35 -5.240 4.410 -1.108 316 HD12 LEU 35 HD12 LEU 35 -5.563 2.785 -1.750 317 HD13 LEU 35 HD13 LEU 35 -6.712 4.089 -2.055 318 HD21 LEU 35 HD21 LEU 35 -6.292 2.473 1.883 319 HD22 LEU 35 HD22 LEU 35 -5.241 1.915 0.574 320 HD23 LEU 35 HD23 LEU 35 -5.034 3.552 1.225 321 H SER 36 H SER 36 -8.622 4.885 3.587 322 HA SER 36 HA SER 36 -10.639 7.040 3.640 323 HB2 SER 36 HB2 SER 36 -8.497 6.213 5.638 324 HB3 SER 36 HB3 SER 36 -9.696 7.495 5.900 325 HG SER 36 HG SER 36 -10.370 5.472 6.773 326 H GLU 37 H GLU 37 -9.939 9.348 4.211 327 HA GLU 37 HA GLU 37 -8.427 10.371 2.110 328 HB2 GLU 37 HB2 GLU 37 -10.074 11.618 3.430 329 HB3 GLU 37 HB3 GLU 37 -8.960 11.677 4.805 330 HG2 GLU 37 HG2 GLU 37 -7.367 13.019 3.473 331 HG3 GLU 37 HG3 GLU 37 -8.406 12.874 2.053 332 H GLN 38 H GLN 38 -7.165 9.807 5.437 333 HA GLN 38 HA GLN 38 -4.476 10.681 4.675 334 HB2 GLN 38 HB2 GLN 38 -3.778 9.837 6.858 335 HB3 GLN 38 HB3 GLN 38 -5.097 10.993 6.963 336 HG2 GLN 38 HG2 GLN 38 -6.672 9.357 7.624 337 HG3 GLN 38 HG3 GLN 38 -5.704 8.014 7.020 338 HE21 GLN 38 HE21 GLN 38 -3.636 7.760 9.904 339 HE22 GLN 38 HE22 GLN 38 -3.743 7.370 8.194 340 H GLN 39 H GLN 39 -6.134 7.536 4.824 341 HA GLN 39 HA GLN 39 -3.777 5.921 4.471 342 HB2 GLN 39 HB2 GLN 39 -6.710 5.416 3.975 343 HB3 GLN 39 HB3 GLN 39 -5.466 4.217 3.617 344 HG2 GLN 39 HG2 GLN 39 -4.668 4.305 5.963 345 HG3 GLN 39 HG3 GLN 39 -5.956 5.446 6.362 346 HE21 GLN 39 HE21 GLN 39 -6.937 1.790 7.035 347 HE22 GLN 39 HE22 GLN 39 -5.375 2.547 7.293 348 H LYS 40 H LYS 40 -6.011 7.472 2.189 349 HA LYS 40 HA LYS 40 -4.919 6.366 -0.220 350 HB2 LYS 40 HB2 LYS 40 -7.112 7.515 0.014 351 HB3 LYS 40 HB3 LYS 40 -6.298 9.044 0.347 352 HG2 LYS 40 HG2 LYS 40 -5.292 9.038 -1.898 353 HG3 LYS 40 HG3 LYS 40 -6.042 7.476 -2.259 354 HD2 LYS 40 HD2 LYS 40 -7.582 10.023 -1.558 355 HD3 LYS 40 HD3 LYS 40 -7.233 9.487 -3.211 356 HE2 LYS 40 HE2 LYS 40 -8.460 7.356 -2.769 357 HE3 LYS 40 HE3 LYS 40 -8.865 7.935 -1.147 358 HZ1 LYS 40 HZ1 LYS 40 -9.697 9.250 -3.680 359 HZ2 LYS 40 HZ2 LYS 40 -10.668 8.365 -2.712 360 HZ3 LYS 40 HZ3 LYS 40 -10.070 9.787 -2.182 361 H ILE 41 H ILE 41 -4.045 9.337 1.611 362 HA ILE 41 HA ILE 41 -1.953 10.132 -0.210 363 HB ILE 41 HB ILE 41 -2.288 10.781 2.707 364 HG12 ILE 41 HG12 ILE 41 -3.024 12.586 0.350 365 HG13 ILE 41 HG13 ILE 41 -4.196 11.461 1.002 366 HG21 ILE 41 HG21 ILE 41 -0.589 12.142 0.581 367 HG22 ILE 41 HG22 ILE 41 -0.889 12.804 2.200 368 HG23 ILE 41 HG23 ILE 41 -0.009 11.295 2.031 369 HD11 ILE 41 HD11 ILE 41 -2.913 13.740 2.546 370 HD12 ILE 41 HD12 ILE 41 -4.592 13.603 1.995 371 HD13 ILE 41 HD13 ILE 41 -3.987 12.504 3.246 372 H ILE 42 H ILE 42 -1.870 8.141 2.837 373 HA ILE 42 HA ILE 42 1.000 7.846 2.844 374 HB ILE 42 HB ILE 42 -1.206 6.077 3.931 375 HG12 ILE 42 HG12 ILE 42 0.666 7.798 5.588 376 HG13 ILE 42 HG13 ILE 42 -0.778 8.498 4.870 377 HG21 ILE 42 HG21 ILE 42 1.805 5.908 4.428 378 HG22 ILE 42 HG22 ILE 42 0.582 5.030 5.362 379 HG23 ILE 42 HG23 ILE 42 0.792 4.669 3.658 380 HD11 ILE 42 HD11 ILE 42 -0.737 6.145 6.801 381 HD12 ILE 42 HD12 ILE 42 -1.328 7.789 7.110 382 HD13 ILE 42 HD13 ILE 42 -2.178 6.741 5.952 383 H LEU 43 H LEU 43 -1.592 5.852 1.451 384 HA LEU 43 HA LEU 43 -0.033 3.783 0.318 385 HB2 LEU 43 HB2 LEU 43 -2.439 3.740 0.695 386 HB3 LEU 43 HB3 LEU 43 -2.708 5.001 -0.489 387 HG LEU 43 HG LEU 43 -3.350 2.679 -1.099 388 HD11 LEU 43 HD11 LEU 43 -1.377 3.937 -3.026 389 HD12 LEU 43 HD12 LEU 43 -2.673 2.797 -3.412 390 HD13 LEU 43 HD13 LEU 43 -3.070 4.416 -2.806 391 HD21 LEU 43 HD21 LEU 43 -1.464 1.464 -0.180 392 HD22 LEU 43 HD22 LEU 43 -1.630 1.109 -1.905 393 HD23 LEU 43 HD23 LEU 43 -0.343 2.200 -1.347 394 H ALA 44 H ALA 44 -1.186 6.825 -1.178 395 HA ALA 44 HA ALA 44 0.156 6.561 -3.665 396 HB1 ALA 44 HB1 ALA 44 -0.711 9.001 -2.069 397 HB2 ALA 44 HB2 ALA 44 -0.292 9.007 -3.799 398 HB3 ALA 44 HB3 ALA 44 -1.717 8.100 -3.230 399 H GLU 45 H GLU 45 1.184 8.490 -0.738 400 HA GLU 45 HA GLU 45 3.649 9.356 -1.852 401 HB2 GLU 45 HB2 GLU 45 2.742 8.906 1.013 402 HB3 GLU 45 HB3 GLU 45 4.319 9.575 0.624 403 HG2 GLU 45 HG2 GLU 45 1.727 10.839 -0.358 404 HG3 GLU 45 HG3 GLU 45 2.504 11.260 1.164 405 H TYR 46 H TYR 46 2.894 6.252 -0.254 406 HA TYR 46 HA TYR 46 5.617 5.406 0.065 407 HB2 TYR 46 HB2 TYR 46 3.696 4.457 1.265 408 HB3 TYR 46 HB3 TYR 46 3.031 3.832 -0.235 409 HD1 TYR 46 HD1 TYR 46 6.652 3.402 -0.031 410 HD2 TYR 46 HD2 TYR 46 2.851 1.750 1.174 411 HE1 TYR 46 HE1 TYR 46 7.754 1.251 0.499 412 HE2 TYR 46 HE2 TYR 46 3.962 -0.441 1.638 413 HH TYR 46 HH TYR 46 7.480 -0.907 1.212 414 H ILE 47 H ILE 47 3.212 4.579 -2.482 415 HA ILE 47 HA ILE 47 4.916 3.143 -4.212 416 HB ILE 47 HB ILE 47 2.303 4.630 -4.383 417 HG12 ILE 47 HG12 ILE 47 3.012 1.653 -4.457 418 HG13 ILE 47 HG13 ILE 47 2.521 2.515 -3.010 419 HG21 ILE 47 HG21 ILE 47 3.619 3.089 -6.633 420 HG22 ILE 47 HG22 ILE 47 1.876 3.449 -6.604 421 HG23 ILE 47 HG23 ILE 47 3.037 4.760 -6.664 422 HD11 ILE 47 HD11 ILE 47 0.769 1.918 -5.414 423 HD12 ILE 47 HD12 ILE 47 0.586 1.371 -3.742 424 HD13 ILE 47 HD13 ILE 47 0.337 3.084 -4.145 425 H ALA 48 H ALA 48 4.094 6.634 -4.009 426 HA ALA 48 HA ALA 48 5.409 7.402 -6.455 427 HB1 ALA 48 HB1 ALA 48 4.778 8.988 -3.929 428 HB2 ALA 48 HB2 ALA 48 5.189 9.675 -5.518 429 HB3 ALA 48 HB3 ALA 48 3.686 8.751 -5.306 430 H GLU 49 H GLU 49 6.521 7.125 -3.063 431 HA GLU 49 HA GLU 49 9.171 8.190 -3.641 432 HB2 GLU 49 HB2 GLU 49 8.058 8.434 -1.461 433 HB3 GLU 49 HB3 GLU 49 8.135 6.681 -1.210 434 HG2 GLU 49 HG2 GLU 49 10.587 6.765 -1.197 435 HG3 GLU 49 HG3 GLU 49 10.562 8.477 -1.633 436 H VAL 50 H VAL 50 7.833 4.859 -3.316 437 HA VAL 50 HA VAL 50 10.568 3.817 -3.923 438 HB VAL 50 HB VAL 50 10.210 1.929 -2.784 439 HG11 VAL 50 HG11 VAL 50 8.681 3.939 -1.118 440 HG12 VAL 50 HG12 VAL 50 9.590 2.527 -0.546 441 HG13 VAL 50 HG13 VAL 50 10.445 3.876 -1.309 442 HG21 VAL 50 HG21 VAL 50 8.021 1.189 -3.632 443 HG22 VAL 50 HG22 VAL 50 8.103 1.075 -1.880 444 HG23 VAL 50 HG23 VAL 50 7.204 2.403 -2.637 445 H GLY 51 H GLY 51 7.630 4.233 -5.517 446 HA2 GLY 51 HA2 GLY 51 7.588 4.210 -7.840 447 HA3 GLY 51 HA3 GLY 51 9.029 3.195 -7.885 448 H LEU 52 H LEU 52 6.146 2.329 -6.093 449 HA LEU 52 HA LEU 52 4.934 0.480 -5.971 450 HB2 LEU 52 HB2 LEU 52 4.260 1.766 -8.331 451 HB3 LEU 52 HB3 LEU 52 4.488 0.134 -8.900 452 HG LEU 52 HG LEU 52 2.642 0.961 -6.617 453 HD11 LEU 52 HD11 LEU 52 1.997 0.195 -9.485 454 HD12 LEU 52 HD12 LEU 52 0.814 0.530 -8.198 455 HD13 LEU 52 HD13 LEU 52 1.872 1.825 -8.765 456 HD21 LEU 52 HD21 LEU 52 3.295 -1.372 -6.338 457 HD22 LEU 52 HD22 LEU 52 1.611 -1.249 -6.833 458 HD23 LEU 52 HD23 LEU 52 2.854 -1.714 -8.022 459 H GLN 53 H GLN 53 7.885 0.082 -6.799 460 HA GLN 53 HA GLN 53 7.764 -2.801 -7.613 461 HB2 GLN 53 HB2 GLN 53 9.738 -2.469 -8.905 462 HB3 GLN 53 HB3 GLN 53 8.560 -1.232 -9.328 463 HG2 GLN 53 HG2 GLN 53 9.862 0.272 -7.601 464 HG3 GLN 53 HG3 GLN 53 11.133 -0.948 -7.739 465 HE21 GLN 53 HE21 GLN 53 10.256 1.513 -10.943 466 HE22 GLN 53 HE22 GLN 53 9.033 1.210 -9.701 467 H ASN 54 H ASN 54 8.443 -0.949 -4.985 468 HA ASN 54 HA ASN 54 10.130 -3.111 -3.788 469 HB2 ASN 54 HB2 ASN 54 10.317 -0.144 -3.187 470 HB3 ASN 54 HB3 ASN 54 11.239 -1.403 -2.389 471 HD21 ASN 54 HD21 ASN 54 12.592 0.098 -5.877 472 HD22 ASN 54 HD22 ASN 54 11.079 0.681 -5.192 473 H ILE 55 H ILE 55 7.083 -1.965 -3.775 474 HA ILE 55 HA ILE 55 6.651 -1.917 -0.879 475 HB ILE 55 HB ILE 55 4.348 -1.674 -1.237 476 HG12 ILE 55 HG12 ILE 55 4.752 -2.137 -4.221 477 HG13 ILE 55 HG13 ILE 55 3.965 -3.251 -3.093 478 HG21 ILE 55 HG21 ILE 55 5.614 0.095 -3.355 479 HG22 ILE 55 HG22 ILE 55 4.289 0.469 -2.224 480 HG23 ILE 55 HG23 ILE 55 5.921 0.275 -1.616 481 HD11 ILE 55 HD11 ILE 55 2.990 -0.486 -3.863 482 HD12 ILE 55 HD12 ILE 55 2.246 -2.044 -4.245 483 HD13 ILE 55 HD13 ILE 55 2.275 -1.475 -2.560 484 H THR 56 H THR 56 5.499 -3.459 0.359 485 HA THR 56 HA THR 56 5.104 -6.150 -0.842 486 HB THR 56 HB THR 56 6.006 -6.851 1.611 487 HG1 THR 56 HG1 THR 56 8.014 -5.580 1.828 488 HG21 THR 56 HG21 THR 56 7.900 -6.193 -0.692 489 HG22 THR 56 HG22 THR 56 8.195 -7.362 0.618 490 HG23 THR 56 HG23 THR 56 6.920 -7.671 -0.568 491 H ALA 57 H ALA 57 3.392 -7.342 0.103 492 HA ALA 57 HA ALA 57 1.262 -5.859 1.192 493 HB1 ALA 57 HB1 ALA 57 1.786 -8.866 1.298 494 HB2 ALA 57 HB2 ALA 57 0.218 -8.053 1.501 495 HB3 ALA 57 HB3 ALA 57 1.045 -8.000 -0.066 496 H ILE 58 H ILE 58 3.922 -7.454 2.769 497 HA ILE 58 HA ILE 58 2.899 -7.573 5.486 498 HB ILE 58 HB ILE 58 5.663 -7.632 4.198 499 HG12 ILE 58 HG12 ILE 58 5.716 -9.989 5.050 500 HG13 ILE 58 HG13 ILE 58 4.072 -9.819 5.657 501 HG21 ILE 58 HG21 ILE 58 4.909 -7.851 7.149 502 HG22 ILE 58 HG22 ILE 58 6.489 -8.374 6.500 503 HG23 ILE 58 HG23 ILE 58 6.012 -6.679 6.403 504 HD11 ILE 58 HD11 ILE 58 4.831 -9.615 2.710 505 HD12 ILE 58 HD12 ILE 58 4.312 -11.108 3.515 506 HD13 ILE 58 HD13 ILE 58 3.187 -9.754 3.398 507 H THR 59 H THR 59 4.819 -5.247 3.584 508 HA THR 59 HA THR 59 5.211 -3.445 5.871 509 HB THR 59 HB THR 59 5.825 -3.084 2.920 510 HG1 THR 59 HG1 THR 59 7.311 -4.416 3.329 511 HG21 THR 59 HG21 THR 59 6.773 -1.628 5.435 512 HG22 THR 59 HG22 THR 59 7.497 -1.445 3.819 513 HG23 THR 59 HG23 THR 59 5.817 -0.936 4.101 514 H LEU 60 H LEU 60 3.344 -3.470 2.838 515 HA LEU 60 HA LEU 60 1.983 -1.036 3.206 516 HB2 LEU 60 HB2 LEU 60 2.288 -2.552 1.129 517 HB3 LEU 60 HB3 LEU 60 0.977 -3.524 1.761 518 HG LEU 60 HG LEU 60 -0.484 -1.423 1.639 519 HD11 LEU 60 HD11 LEU 60 1.985 -0.413 0.148 520 HD12 LEU 60 HD12 LEU 60 0.405 0.363 0.114 521 HD13 LEU 60 HD13 LEU 60 1.284 0.280 1.638 522 HD21 LEU 60 HD21 LEU 60 -0.503 -3.166 -0.114 523 HD22 LEU 60 HD22 LEU 60 -0.773 -1.550 -0.786 524 HD23 LEU 60 HD23 LEU 60 0.814 -2.334 -0.956 525 H SER 61 H SER 61 1.130 -4.350 4.395 526 HA SER 61 HA SER 61 -1.341 -3.633 5.568 527 HB2 SER 61 HB2 SER 61 -1.253 -5.588 6.871 528 HB3 SER 61 HB3 SER 61 -0.647 -5.952 5.265 529 HG SER 61 HG SER 61 0.629 -6.824 7.013 530 H LYS 62 H LYS 62 1.823 -2.896 6.526 531 HA LYS 62 HA LYS 62 1.021 -2.125 9.269 532 HB2 LYS 62 HB2 LYS 62 3.751 -2.666 8.071 533 HB3 LYS 62 HB3 LYS 62 3.503 -2.047 9.710 534 HG2 LYS 62 HG2 LYS 62 2.156 -4.021 10.308 535 HG3 LYS 62 HG3 LYS 62 2.331 -4.665 8.669 536 HD2 LYS 62 HD2 LYS 62 4.827 -4.664 8.991 537 HD3 LYS 62 HD3 LYS 62 4.555 -4.179 10.682 538 HE2 LYS 62 HE2 LYS 62 3.173 -6.236 11.018 539 HE3 LYS 62 HE3 LYS 62 3.469 -6.700 9.337 540 HZ1 LYS 62 HZ1 LYS 62 5.569 -6.416 11.426 541 HZ2 LYS 62 HZ2 LYS 62 5.002 -7.830 10.845 542 HZ3 LYS 62 HZ3 LYS 62 5.852 -6.834 9.870 543 H LYS 63 H LYS 63 2.203 -0.616 6.299 544 HA LYS 63 HA LYS 63 2.840 1.999 7.339 545 HB2 LYS 63 HB2 LYS 63 1.821 0.914 4.674 546 HB3 LYS 63 HB3 LYS 63 2.231 2.613 4.882 547 HG2 LYS 63 HG2 LYS 63 4.274 0.435 5.462 548 HG3 LYS 63 HG3 LYS 63 3.956 1.009 3.826 549 HD2 LYS 63 HD2 LYS 63 4.490 3.339 4.603 550 HD3 LYS 63 HD3 LYS 63 4.966 2.636 6.176 551 HE2 LYS 63 HE2 LYS 63 6.618 1.191 4.993 552 HE3 LYS 63 HE3 LYS 63 6.153 1.936 3.455 553 HZ1 LYS 63 HZ1 LYS 63 7.360 3.387 5.756 554 HZ2 LYS 63 HZ2 LYS 63 8.144 2.980 4.385 555 HZ3 LYS 63 HZ3 LYS 63 6.935 4.074 4.334 556 H LEU 64 H LEU 64 -0.112 0.445 6.388 557 HA LEU 64 HA LEU 64 -1.749 2.907 6.745 558 HB2 LEU 64 HB2 LEU 64 -1.881 0.395 5.068 559 HB3 LEU 64 HB3 LEU 64 -3.241 1.524 5.138 560 HG LEU 64 HG LEU 64 -0.515 2.627 4.460 561 HD11 LEU 64 HD11 LEU 64 -2.222 1.096 2.468 562 HD12 LEU 64 HD12 LEU 64 -0.777 2.088 2.096 563 HD13 LEU 64 HD13 LEU 64 -0.626 0.612 3.066 564 HD21 LEU 64 HD21 LEU 64 -2.509 4.076 4.670 565 HD22 LEU 64 HD22 LEU 64 -1.834 4.072 3.026 566 HD23 LEU 64 HD23 LEU 64 -3.308 3.139 3.384 567 H ASN 65 H ASN 65 -1.066 0.204 8.508 568 HA ASN 65 HA ASN 65 -2.031 -1.077 10.077 569 HB2 ASN 65 HB2 ASN 65 -3.935 1.256 10.510 570 HB3 ASN 65 HB3 ASN 65 -3.495 0.016 11.674 571 HD21 ASN 65 HD21 ASN 65 -1.102 3.253 11.179 572 HD22 ASN 65 HD22 ASN 65 -2.566 3.036 10.225 573 H ILE 66 H ILE 66 -2.657 -2.348 8.101 574 HA ILE 66 HA ILE 66 -5.568 -2.989 8.055 575 HB ILE 66 HB ILE 66 -4.935 -3.385 5.458 576 HG12 ILE 66 HG12 ILE 66 -3.540 -0.759 5.948 577 HG13 ILE 66 HG13 ILE 66 -2.577 -2.199 5.924 578 HG21 ILE 66 HG21 ILE 66 -5.863 -0.791 6.756 579 HG22 ILE 66 HG22 ILE 66 -6.076 -1.183 5.048 580 HG23 ILE 66 HG23 ILE 66 -6.874 -2.174 6.281 581 HD11 ILE 66 HD11 ILE 66 -4.235 -1.059 3.643 582 HD12 ILE 66 HD12 ILE 66 -2.486 -1.340 3.708 583 HD13 ILE 66 HD13 ILE 66 -3.593 -2.717 3.615 584 H THR 67 H THR 67 -5.844 -5.112 6.631 585 HA THR 67 HA THR 67 -4.089 -7.148 7.829 586 HB THR 67 HB THR 67 -5.543 -8.772 7.195 587 HG1 THR 67 HG1 THR 67 -7.105 -8.467 5.540 588 HG21 THR 67 HG21 THR 67 -7.490 -6.427 7.233 589 HG22 THR 67 HG22 THR 67 -7.808 -8.116 7.677 590 HG23 THR 67 HG23 THR 67 -6.741 -7.129 8.690 591 H VAL 68 H VAL 68 -2.977 -8.799 6.545 592 HA VAL 68 HA VAL 68 -1.427 -7.756 4.332 593 HB VAL 68 HB VAL 68 -1.818 -10.596 5.343 594 HG11 VAL 68 HG11 VAL 68 0.264 -9.543 3.378 595 HG12 VAL 68 HG12 VAL 68 0.275 -11.150 4.128 596 HG13 VAL 68 HG13 VAL 68 -1.014 -10.724 3.002 597 HG21 VAL 68 HG21 VAL 68 -0.702 -9.049 6.952 598 HG22 VAL 68 HG22 VAL 68 0.421 -10.263 6.337 599 HG23 VAL 68 HG23 VAL 68 0.478 -8.610 5.694 600 H GLU 69 H GLU 69 -4.598 -9.283 4.444 601 HA GLU 69 HA GLU 69 -4.493 -10.225 1.641 602 HB2 GLU 69 HB2 GLU 69 -6.697 -10.141 3.745 603 HB3 GLU 69 HB3 GLU 69 -6.890 -10.816 2.124 604 HG2 GLU 69 HG2 GLU 69 -5.302 -12.568 2.544 605 HG3 GLU 69 HG3 GLU 69 -4.748 -11.829 4.043 606 H LYS 70 H LYS 70 -5.901 -7.633 3.605 607 HA LYS 70 HA LYS 70 -7.290 -6.278 1.530 608 HB2 LYS 70 HB2 LYS 70 -7.607 -6.160 4.037 609 HB3 LYS 70 HB3 LYS 70 -6.163 -5.166 4.146 610 HG2 LYS 70 HG2 LYS 70 -8.701 -4.489 2.607 611 HG3 LYS 70 HG3 LYS 70 -8.324 -3.988 4.263 612 HD2 LYS 70 HD2 LYS 70 -6.235 -2.849 3.261 613 HD3 LYS 70 HD3 LYS 70 -7.039 -3.018 1.694 614 HE2 LYS 70 HE2 LYS 70 -8.327 -1.730 4.145 615 HE3 LYS 70 HE3 LYS 70 -7.400 -0.816 2.948 616 HZ1 LYS 70 HZ1 LYS 70 -9.853 -2.363 2.306 617 HZ2 LYS 70 HZ2 LYS 70 -9.763 -0.735 2.459 618 HZ3 LYS 70 HZ3 LYS 70 -8.957 -1.462 1.256 619 H ALA 71 H ALA 71 -4.129 -5.730 3.025 620 HA ALA 71 HA ALA 71 -3.101 -3.711 1.345 621 HB1 ALA 71 HB1 ALA 71 -1.651 -6.020 2.714 622 HB2 ALA 71 HB2 ALA 71 -0.906 -4.534 2.115 623 HB3 ALA 71 HB3 ALA 71 -2.063 -4.459 3.452 624 H LYS 72 H LYS 72 -2.898 -7.305 0.859 625 HA LYS 72 HA LYS 72 -1.284 -7.090 -1.506 626 HB2 LYS 72 HB2 LYS 72 -1.278 -9.016 0.037 627 HB3 LYS 72 HB3 LYS 72 -2.964 -9.371 -0.348 628 HG2 LYS 72 HG2 LYS 72 -2.400 -10.006 -2.586 629 HG3 LYS 72 HG3 LYS 72 -0.741 -9.404 -2.426 630 HD2 LYS 72 HD2 LYS 72 -1.853 -11.623 -0.645 631 HD3 LYS 72 HD3 LYS 72 -1.116 -11.951 -2.228 632 HE2 LYS 72 HE2 LYS 72 0.963 -10.759 -1.448 633 HE3 LYS 72 HE3 LYS 72 0.230 -10.608 0.157 634 HZ1 LYS 72 HZ1 LYS 72 0.815 -13.176 -1.229 635 HZ2 LYS 72 HZ2 LYS 72 1.660 -12.567 0.024 636 HZ3 LYS 72 HZ3 LYS 72 0.118 -13.055 0.245 637 H ASN 73 H ASN 73 -4.756 -7.033 -0.949 638 HA ASN 73 HA ASN 73 -5.598 -7.564 -3.543 639 HB2 ASN 73 HB2 ASN 73 -7.576 -7.212 -2.584 640 HB3 ASN 73 HB3 ASN 73 -6.801 -6.564 -1.156 641 HD21 ASN 73 HD21 ASN 73 -7.594 -3.181 -1.951 642 HD22 ASN 73 HD22 ASN 73 -6.661 -4.250 -0.907 643 H TYR 74 H TYR 74 -4.278 -4.490 -2.274 644 HA TYR 74 HA TYR 74 -4.631 -2.910 -4.626 645 HB2 TYR 74 HB2 TYR 74 -2.546 -2.670 -2.441 646 HB3 TYR 74 HB3 TYR 74 -2.948 -1.441 -3.630 647 HD1 TYR 74 HD1 TYR 74 -5.642 -0.905 -3.731 648 HD2 TYR 74 HD2 TYR 74 -3.391 -2.330 -0.339 649 HE1 TYR 74 HE1 TYR 74 -7.391 -0.003 -2.212 650 HE2 TYR 74 HE2 TYR 74 -5.129 -1.368 1.197 651 HH TYR 74 HH TYR 74 -8.031 0.332 -0.016 652 H ILE 75 H ILE 75 -1.902 -4.872 -3.406 653 HA ILE 75 HA ILE 75 -0.111 -4.243 -5.541 654 HB ILE 75 HB ILE 75 -0.167 -6.638 -3.662 655 HG12 ILE 75 HG12 ILE 75 1.226 -3.927 -3.432 656 HG13 ILE 75 HG13 ILE 75 -0.171 -4.427 -2.489 657 HG21 ILE 75 HG21 ILE 75 2.143 -5.485 -5.292 658 HG22 ILE 75 HG22 ILE 75 2.268 -6.804 -4.108 659 HG23 ILE 75 HG23 ILE 75 1.348 -7.054 -5.572 660 HD11 ILE 75 HD11 ILE 75 2.624 -5.565 -2.275 661 HD12 ILE 75 HD12 ILE 75 1.706 -4.641 -1.080 662 HD13 ILE 75 HD13 ILE 75 1.176 -6.277 -1.512 663 H LYS 76 H LYS 76 -2.746 -6.552 -5.372 664 HA LYS 76 HA LYS 76 -1.939 -7.997 -7.798 665 HB2 LYS 76 HB2 LYS 76 -4.344 -8.177 -5.952 666 HB3 LYS 76 HB3 LYS 76 -4.114 -9.201 -7.368 667 HG2 LYS 76 HG2 LYS 76 -2.104 -9.093 -5.089 668 HG3 LYS 76 HG3 LYS 76 -3.460 -10.219 -5.159 669 HD2 LYS 76 HD2 LYS 76 -2.578 -11.130 -7.308 670 HD3 LYS 76 HD3 LYS 76 -1.185 -10.031 -7.186 671 HE2 LYS 76 HE2 LYS 76 -0.556 -11.049 -5.020 672 HE3 LYS 76 HE3 LYS 76 -1.955 -12.126 -5.105 673 HZ1 LYS 76 HZ1 LYS 76 0.301 -12.121 -7.042 674 HZ2 LYS 76 HZ2 LYS 76 0.066 -13.232 -5.871 675 HZ3 LYS 76 HZ3 LYS 76 -0.991 -13.122 -7.108 676 H ASN 77 H ASN 77 -4.079 -5.218 -7.194 677 HA ASN 77 HA ASN 77 -4.959 -5.439 -10.035 678 HB2 ASN 77 HB2 ASN 77 -6.433 -3.654 -9.667 679 HB3 ASN 77 HB3 ASN 77 -6.770 -4.928 -8.484 680 HD21 ASN 77 HD21 ASN 77 -6.289 -2.726 -5.763 681 HD22 ASN 77 HD22 ASN 77 -6.312 -4.428 -6.195 682 H SER 78 H SER 78 -3.186 -3.324 -7.760 683 HA SER 78 HA SER 78 -2.258 -1.707 -10.043 684 HB2 SER 78 HB2 SER 78 -2.151 -1.198 -7.040 685 HB3 SER 78 HB3 SER 78 -1.376 -0.168 -8.250 686 HG SER 78 HG SER 78 -4.151 -0.778 -8.053 687 H ASN 79 H ASN 79 -0.556 -2.606 -11.011 688 HA ASN 79 HA ASN 79 1.816 -3.264 -9.357 689 HB2 ASN 79 HB2 ASN 79 0.186 -5.277 -9.721 690 HB3 ASN 79 HB3 ASN 79 0.834 -5.337 -11.355 691 HD21 ASN 79 HD21 ASN 79 3.059 -6.397 -8.103 692 HD22 ASN 79 HD22 ASN 79 1.406 -5.757 -7.999 693 H ARG 80 H ARG 80 1.063 -3.924 -12.792 694 HA ARG 80 HA ARG 80 3.648 -2.745 -13.584 695 HB2 ARG 80 HB2 ARG 80 1.473 -4.071 -15.260 696 HB3 ARG 80 HB3 ARG 80 3.103 -3.677 -15.792 697 HG2 ARG 80 HG2 ARG 80 2.326 -5.790 -13.737 698 HG3 ARG 80 HG3 ARG 80 2.955 -6.025 -15.365 699 HD2 ARG 80 HD2 ARG 80 5.012 -4.621 -14.465 700 HD3 ARG 80 HD3 ARG 80 4.417 -5.109 -12.878 701 HE ARG 80 HE ARG 80 5.530 -6.814 -15.050 702 HH11 ARG 80 HH11 ARG 80 6.189 -8.860 -14.631 703 HH12 ARG 80 HH12 ARG 80 5.856 -9.590 -13.089 704 HH21 ARG 80 HH21 ARG 80 4.203 -6.895 -11.765 705 HH22 ARG 80 HH22 ARG 80 4.777 -8.520 -11.533 706 H LEU 81 H LEU 81 0.406 -1.646 -13.507 707 HA LEU 81 HA LEU 81 0.535 0.250 -15.679 708 HB2 LEU 81 HB2 LEU 81 -1.451 -0.955 -14.714 709 HB3 LEU 81 HB3 LEU 81 -1.398 0.112 -13.321 710 HG LEU 81 HG LEU 81 -1.720 1.145 -16.178 711 HD11 LEU 81 HD11 LEU 81 -3.882 0.291 -14.202 712 HD12 LEU 81 HD12 LEU 81 -4.164 1.141 -15.741 713 HD13 LEU 81 HD13 LEU 81 -3.493 -0.492 -15.745 714 HD21 LEU 81 HD21 LEU 81 -1.252 2.951 -14.588 715 HD22 LEU 81 HD22 LEU 81 -2.953 3.008 -15.014 716 HD23 LEU 81 HD23 LEU 81 -2.455 2.320 -13.453 717 H GLY 82 H GLY 82 1.100 0.529 -12.169 718 HA2 GLY 82 HA2 GLY 82 2.211 2.191 -10.961 719 HA3 GLY 82 HA3 GLY 82 2.558 3.024 -12.467 720 H ARG 83 H ARG 83 2.118 4.942 -11.227 721 HA ARG 83 HA ARG 83 -0.448 5.964 -12.101 722 HB2 ARG 83 HB2 ARG 83 0.225 6.054 -9.148 723 HB3 ARG 83 HB3 ARG 83 -0.593 7.402 -9.939 724 HG2 ARG 83 HG2 ARG 83 -2.193 5.477 -10.897 725 HG3 ARG 83 HG3 ARG 83 -1.588 4.603 -9.482 726 HD2 ARG 83 HD2 ARG 83 -3.626 5.727 -8.870 727 HD3 ARG 83 HD3 ARG 83 -2.277 6.532 -8.061 728 HE ARG 83 HE ARG 83 -2.713 8.474 -9.234 729 HH11 ARG 83 HH11 ARG 83 -3.775 9.858 -10.590 730 HH12 ARG 83 HH12 ARG 83 -4.946 9.246 -11.718 731 HH21 ARG 83 HH21 ARG 83 -4.604 5.966 -10.797 732 HH22 ARG 83 HH22 ARG 83 -5.400 7.105 -11.845 733 H THR 84 H THR 84 -0.363 8.125 -12.571 734 HA THR 84 HA THR 84 2.202 9.428 -12.916 735 HB THR 84 HB THR 84 0.399 9.847 -14.432 736 HG1 THR 84 HG1 THR 84 0.597 12.083 -14.443 737 HG21 THR 84 HG21 THR 84 -1.091 11.396 -12.275 738 HG22 THR 84 HG22 THR 84 -1.591 11.078 -13.946 739 HG23 THR 84 HG23 THR 84 -1.539 9.753 -12.771 740 H ASN 85 H ASN 85 3.371 10.381 -11.431 741 HA ASN 85 HA ASN 85 2.085 11.831 -9.156 742 HB2 ASN 85 HB2 ASN 85 4.295 9.747 -8.932 743 HB3 ASN 85 HB3 ASN 85 3.949 10.946 -7.684 744 HD21 ASN 85 HD21 ASN 85 1.441 7.775 -8.092 745 HD22 ASN 85 HD22 ASN 85 2.646 8.063 -9.341 746 H ASN 86 H ASN 86 5.510 11.275 -10.022 747 HA ASN 86 HA ASN 86 7.270 12.679 -10.212 748 HB2 ASN 86 HB2 ASN 86 5.938 12.998 -12.369 749 HB3 ASN 86 HB3 ASN 86 5.378 14.529 -11.707 750 HD21 ASN 86 HD21 ASN 86 8.178 15.542 -13.755 751 HD22 ASN 86 HD22 ASN 86 6.473 15.126 -13.878 752 H LEU 87 H LEU 87 7.677 15.427 -10.162 753 HA LEU 87 HA LEU 87 8.122 17.132 -8.749 754 HB2 LEU 87 HB2 LEU 87 5.162 16.750 -8.213 755 HB3 LEU 87 HB3 LEU 87 6.088 18.047 -7.480 756 HG LEU 87 HG LEU 87 6.681 18.957 -9.682 757 HD11 LEU 87 HD11 LEU 87 4.799 16.815 -10.758 758 HD12 LEU 87 HD12 LEU 87 5.289 18.266 -11.662 759 HD13 LEU 87 HD13 LEU 87 6.507 17.083 -11.204 760 HD21 LEU 87 HD21 LEU 87 4.724 19.762 -8.404 761 HD22 LEU 87 HD22 LEU 87 4.445 19.873 -10.148 762 HD23 LEU 87 HD23 LEU 87 3.696 18.558 -9.212 763 H LYS 88 H LYS 88 9.009 14.714 -7.823 764 HA LYS 88 HA LYS 88 8.705 14.804 -4.848 765 HB2 LYS 88 HB2 LYS 88 8.983 12.431 -4.823 766 HB3 LYS 88 HB3 LYS 88 7.718 12.837 -5.984 767 HG2 LYS 88 HG2 LYS 88 9.442 12.601 -7.843 768 HG3 LYS 88 HG3 LYS 88 10.605 12.058 -6.618 769 HD2 LYS 88 HD2 LYS 88 8.995 10.219 -6.001 770 HD3 LYS 88 HD3 LYS 88 7.966 10.725 -7.360 771 HE2 LYS 88 HE2 LYS 88 9.964 10.372 -8.892 772 HE3 LYS 88 HE3 LYS 88 10.855 9.746 -7.496 773 HZ1 LYS 88 HZ1 LYS 88 8.431 8.559 -8.725 774 HZ2 LYS 88 HZ2 LYS 88 9.918 7.885 -8.630 775 HZ3 LYS 88 HZ3 LYS 88 8.998 8.077 -7.276 776 H THR 89 H THR 89 10.914 15.609 -7.174 777 HA THR 89 HA THR 89 12.971 15.849 -5.200 778 HB THR 89 HB THR 89 13.534 13.617 -6.070 779 HG1 THR 89 HG1 THR 89 15.685 14.159 -6.409 780 HG21 THR 89 HG21 THR 89 14.228 14.973 -8.708 781 HG22 THR 89 HG22 THR 89 14.411 13.259 -8.280 782 HG23 THR 89 HG23 THR 89 12.791 13.951 -8.471 783 H ILE 90 H ILE 90 13.620 17.800 -5.364 784 HA ILE 90 HA ILE 90 13.948 19.194 -7.960 785 HB ILE 90 HB ILE 90 12.994 21.219 -6.690 786 HG12 ILE 90 HG12 ILE 90 12.904 20.029 -4.432 787 HG13 ILE 90 HG13 ILE 90 11.638 21.139 -4.908 788 HG21 ILE 90 HG21 ILE 90 11.089 19.044 -7.598 789 HG22 ILE 90 HG22 ILE 90 10.720 20.776 -7.445 790 HG23 ILE 90 HG23 ILE 90 11.921 20.224 -8.625 791 HD11 ILE 90 HD11 ILE 90 11.346 18.105 -4.983 792 HD12 ILE 90 HD12 ILE 90 10.723 19.198 -3.744 793 HD13 ILE 90 HD13 ILE 90 10.095 19.300 -5.391 794 H GLY 91 H GLY 91 15.729 18.120 -5.534 795 HA2 GLY 91 HA2 GLY 91 17.680 18.746 -4.490 796 HA3 GLY 91 HA3 GLY 91 17.781 20.127 -5.588 797 H ILE 92 H ILE 92 14.864 20.230 -3.936 798 HA ILE 92 HA ILE 92 13.959 21.668 -2.463 799 HB ILE 92 HB ILE 92 16.158 20.822 -0.554 800 HG12 ILE 92 HG12 ILE 92 14.276 19.072 0.086 801 HG13 ILE 92 HG13 ILE 92 13.719 19.292 -1.563 802 HG21 ILE 92 HG21 ILE 92 13.211 21.540 -0.124 803 HG22 ILE 92 HG22 ILE 92 14.357 21.031 1.135 804 HG23 ILE 92 HG23 ILE 92 14.582 22.565 0.328 805 HD11 ILE 92 HD11 ILE 92 16.535 18.400 -0.769 806 HD12 ILE 92 HD12 ILE 92 15.194 17.299 -1.132 807 HD13 ILE 92 HD13 ILE 92 15.827 18.340 -2.403 808 H LEU 93 H LEU 93 15.396 22.957 -4.319 809 HA LEU 93 HA LEU 93 16.456 24.800 -4.964 810 HB2 LEU 93 HB2 LEU 93 14.248 25.530 -3.837 811 HB3 LEU 93 HB3 LEU 93 15.258 26.170 -2.548 812 HG LEU 93 HG LEU 93 16.361 27.696 -4.228 813 HD11 LEU 93 HD11 LEU 93 14.294 26.524 -6.141 814 HD12 LEU 93 HD12 LEU 93 15.252 27.991 -6.441 815 HD13 LEU 93 HD13 LEU 93 16.062 26.433 -6.312 816 HD21 LEU 93 HD21 LEU 93 14.409 28.438 -2.913 817 HD22 LEU 93 HD22 LEU 93 14.433 29.176 -4.522 818 HD23 LEU 93 HD23 LEU 93 13.320 27.831 -4.181 819 H GLN 94 H GLN 94 18.077 23.133 -3.235 820 HA GLN 94 HA GLN 94 20.104 25.074 -2.211 821 HB2 GLN 94 HB2 GLN 94 18.884 22.605 -0.943 822 HB3 GLN 94 HB3 GLN 94 20.501 23.167 -0.470 823 HG2 GLN 94 HG2 GLN 94 19.678 25.280 0.272 824 HG3 GLN 94 HG3 GLN 94 18.092 25.019 -0.445 825 HE21 GLN 94 HE21 GLN 94 16.884 22.932 2.178 826 HE22 GLN 94 HE22 GLN 94 16.689 23.373 0.470 827 H GLU 95 H GLU 95 20.382 24.516 -4.700 828 HA GLU 95 HA GLU 95 22.791 22.790 -4.826 829 HB2 GLU 95 HB2 GLU 95 22.177 21.989 -7.056 830 HB3 GLU 95 HB3 GLU 95 21.067 21.423 -5.810 831 HG2 GLU 95 HG2 GLU 95 19.374 23.068 -6.508 832 HG3 GLU 95 HG3 GLU 95 20.504 23.778 -7.665 833 H GLU 96 H GLU 96 24.268 23.365 -6.572 834 HA GLU 96 HA GLU 96 24.018 26.142 -7.620 835 HB2 GLU 96 HB2 GLU 96 25.291 26.156 -5.446 836 HB3 GLU 96 HB3 GLU 96 26.450 25.037 -6.156 837 HG2 GLU 96 HG2 GLU 96 27.403 27.211 -6.286 838 HG3 GLU 96 HG3 GLU 96 26.953 26.774 -7.927 839 H VAL 97 H VAL 97 24.129 26.055 -9.685 840 HA VAL 97 HA VAL 97 26.043 24.306 -11.083 841 HB VAL 97 HB VAL 97 23.103 24.365 -11.885 842 HG11 VAL 97 HG11 VAL 97 25.422 22.557 -12.713 843 HG12 VAL 97 HG12 VAL 97 23.732 22.359 -13.222 844 HG13 VAL 97 HG13 VAL 97 24.623 23.786 -13.726 845 HG21 VAL 97 HG21 VAL 97 23.169 23.156 -9.756 846 HG22 VAL 97 HG22 VAL 97 22.930 22.023 -11.079 847 HG23 VAL 97 HG23 VAL 97 24.535 22.170 -10.332 848 H SER 98 H SER 98 26.495 25.023 -13.259 849 HA SER 98 HA SER 98 25.332 27.622 -14.133 850 HB2 SER 98 HB2 SER 98 27.319 28.230 -12.855 851 HB3 SER 98 HB3 SER 98 28.319 27.156 -13.848 852 HG SER 98 HG SER 98 28.364 29.367 -14.549 853 H SER 99 H SER 99 27.978 25.407 -15.237 854 HA SER 99 HA SER 99 27.402 25.784 -17.990 855 HB2 SER 99 HB2 SER 99 29.548 24.978 -16.989 856 HB3 SER 99 HB3 SER 99 28.786 23.402 -16.699 857 HG SER 99 HG SER 99 29.980 23.503 -18.683 858 H MET 100 H MET 100 26.139 23.406 -15.724 859 HA MET 100 HA MET 100 24.466 22.121 -17.834 860 HB2 MET 100 HB2 MET 100 25.300 21.123 -15.088 861 HB3 MET 100 HB3 MET 100 24.253 20.251 -16.205 862 HG2 MET 100 HG2 MET 100 27.139 21.032 -16.743 863 HG3 MET 100 HG3 MET 100 26.582 19.441 -16.256 864 HE1 MET 100 HE1 MET 100 24.030 18.778 -17.990 865 HE2 MET 100 HE2 MET 100 24.806 18.018 -19.394 866 HE3 MET 100 HE3 MET 100 25.425 17.697 -17.761 867 H GLU 101 H GLU 101 23.893 24.754 -16.320 868 HA GLU 101 HA GLU 101 21.613 24.101 -14.624 869 HB2 GLU 101 HB2 GLU 101 23.284 25.963 -14.224 870 HB3 GLU 101 HB3 GLU 101 22.472 26.861 -15.511 871 HG2 GLU 101 HG2 GLU 101 20.296 26.543 -14.162 872 HG3 GLU 101 HG3 GLU 101 21.272 25.799 -12.907 873 H ALA 102 H ALA 102 20.901 22.925 -16.790 874 HA ALA 102 HA ALA 102 19.510 22.613 -18.519 875 HB1 ALA 102 HB1 ALA 102 17.882 24.914 -17.385 876 HB2 ALA 102 HB2 ALA 102 17.304 23.599 -18.428 877 HB3 ALA 102 HB3 ALA 102 17.855 23.240 -16.785 878 H LYS 103 H LYS 103 18.159 23.860 -20.358 879 HA LYS 103 HA LYS 103 19.547 26.168 -21.492 880 HB2 LYS 103 HB2 LYS 103 20.199 25.088 -23.595 881 HB3 LYS 103 HB3 LYS 103 21.041 24.431 -22.213 882 HG2 LYS 103 HG2 LYS 103 20.625 22.560 -23.462 883 HG3 LYS 103 HG3 LYS 103 19.340 22.475 -22.264 884 HD2 LYS 103 HD2 LYS 103 17.720 23.335 -23.950 885 HD3 LYS 103 HD3 LYS 103 19.043 23.536 -25.119 886 HE2 LYS 103 HE2 LYS 103 19.492 21.089 -24.994 887 HE3 LYS 103 HE3 LYS 103 18.165 20.905 -23.841 888 HZ1 LYS 103 HZ1 LYS 103 17.869 21.866 -26.640 889 HZ2 LYS 103 HZ2 LYS 103 17.451 20.384 -26.102 890 HZ3 LYS 103 HZ3 LYS 103 16.639 21.696 -25.574 891 H SER 104 H SER 104 18.536 27.002 -23.423 892 HA SER 104 HA SER 104 15.857 25.998 -24.135 893 HB2 SER 104 HB2 SER 104 14.778 28.204 -23.777 894 HB3 SER 104 HB3 SER 104 15.249 27.370 -22.289 895 HG SER 104 HG SER 104 15.828 29.565 -22.190 896 H MET 105 H MET 105 17.139 29.253 -24.706 897 HA MET 105 HA MET 105 18.066 28.641 -27.433 898 HB2 MET 105 HB2 MET 105 15.466 28.973 -27.447 899 HB3 MET 105 HB3 MET 105 15.828 30.676 -27.112 900 HG2 MET 105 HG2 MET 105 17.162 30.790 -29.187 901 HG3 MET 105 HG3 MET 105 16.877 29.070 -29.478 902 HE1 MET 105 HE1 MET 105 16.103 29.590 -31.936 903 HE2 MET 105 HE2 MET 105 14.856 30.786 -32.352 904 HE3 MET 105 HE3 MET 105 16.401 31.321 -31.655 905 H THR 106 H THR 106 19.441 30.201 -28.251 906 HA THR 106 HA THR 106 20.318 32.384 -26.487 907 HB THR 106 HB THR 106 21.205 31.818 -29.316 908 HG1 THR 106 HG1 THR 106 22.839 30.562 -28.403 909 HG21 THR 106 HG21 THR 106 22.602 33.182 -26.970 910 HG22 THR 106 HG22 THR 106 23.372 32.797 -28.526 911 HG23 THR 106 HG23 THR 106 22.045 33.958 -28.472 912 H TRP 107 H TRP 107 20.140 34.484 -26.825 913 HA TRP 107 HA TRP 107 17.842 35.377 -28.441 914 HB2 TRP 107 HB2 TRP 107 18.086 35.729 -25.914 915 HB3 TRP 107 HB3 TRP 107 19.256 36.984 -26.307 916 HD1 TRP 107 HD1 TRP 107 18.224 39.312 -26.726 917 HE1 TRP 107 HE1 TRP 107 15.865 40.267 -27.108 918 HE3 TRP 107 HE3 TRP 107 15.647 34.914 -27.119 919 HZ2 TRP 107 HZ2 TRP 107 13.195 39.238 -27.547 920 HZ3 TRP 107 HZ3 TRP 107 13.188 34.925 -27.531 921 HH2 TRP 107 HH2 TRP 107 11.958 37.075 -27.746 Start of MODEL 6 1 H1 GLY -5 H1 GLY -5 -18.945 -61.192 -26.594 2 H2 GLY -5 H2 GLY -5 -17.784 -60.722 -27.649 3 H3 GLY -5 H3 GLY -5 -19.220 -61.284 -28.206 4 HA2 GLY -5 HA2 GLY -5 -19.165 -58.908 -28.447 5 HA3 GLY -5 HA3 GLY -5 -20.389 -59.394 -27.262 6 H SER -4 H SER -4 -20.271 -57.322 -26.291 7 HA SER -4 HA SER -4 -17.800 -56.146 -25.414 8 HB2 SER -4 HB2 SER -4 -20.662 -55.318 -24.838 9 HB3 SER -4 HB3 SER -4 -19.208 -54.320 -24.631 10 HG SER -4 HG SER -4 -20.264 -53.914 -26.633 11 H HIS -3 H HIS -3 -17.410 -58.310 -24.094 12 HA HIS -3 HA HIS -3 -18.497 -58.319 -21.357 13 HB2 HIS -3 HB2 HIS -3 -16.401 -59.946 -22.821 14 HB3 HIS -3 HB3 HIS -3 -16.605 -60.049 -21.078 15 HD2 HIS -3 HD2 HIS -3 -19.595 -59.894 -23.601 16 HE1 HIS -3 HE1 HIS -3 -19.752 -63.645 -21.581 17 HE2 HIS -3 HE2 HIS -3 -20.949 -62.121 -23.232 18 H MET -2 H MET -2 -17.918 -56.870 -19.911 19 HA MET -2 HA MET -2 -15.103 -56.384 -19.254 20 HB2 MET -2 HB2 MET -2 -15.681 -54.632 -20.983 21 HB3 MET -2 HB3 MET -2 -16.959 -54.050 -19.909 22 HG2 MET -2 HG2 MET -2 -15.277 -53.463 -18.206 23 HG3 MET -2 HG3 MET -2 -14.006 -54.208 -19.180 24 HE1 MET -2 HE1 MET -2 -16.399 -51.164 -18.684 25 HE2 MET -2 HE2 MET -2 -16.115 -50.186 -20.140 26 HE3 MET -2 HE3 MET -2 -16.991 -51.723 -20.267 27 H ALA -1 H ALA -1 -14.766 -55.846 -17.141 28 HA ALA -1 HA ALA -1 -17.098 -55.476 -15.389 29 HB1 ALA -1 HB1 ALA -1 -15.073 -57.742 -15.070 30 HB2 ALA -1 HB2 ALA -1 -16.398 -57.371 -13.945 31 HB3 ALA -1 HB3 ALA -1 -16.764 -57.931 -15.586 32 H SER 0 H SER 0 -16.563 -55.016 -13.153 33 HA SER 0 HA SER 0 -13.947 -53.732 -12.640 34 HB2 SER 0 HB2 SER 0 -14.990 -51.606 -12.077 35 HB3 SER 0 HB3 SER 0 -15.341 -52.055 -13.762 36 HG SER 0 HG SER 0 -17.204 -51.277 -12.672 37 H MET 1 H MET 1 -13.531 -53.285 -10.441 38 HA MET 1 HA MET 1 -15.321 -54.440 -8.365 39 HB2 MET 1 HB2 MET 1 -12.479 -55.408 -8.918 40 HB3 MET 1 HB3 MET 1 -13.421 -55.778 -7.468 41 HG2 MET 1 HG2 MET 1 -15.131 -56.904 -8.885 42 HG3 MET 1 HG3 MET 1 -14.153 -56.556 -10.311 43 HE1 MET 1 HE1 MET 1 -14.635 -58.755 -7.148 44 HE2 MET 1 HE2 MET 1 -13.118 -59.674 -7.049 45 HE3 MET 1 HE3 MET 1 -13.128 -57.942 -6.660 46 H ASP 2 H ASP 2 -15.563 -52.327 -7.570 47 HA ASP 2 HA ASP 2 -13.218 -51.158 -6.163 48 HB2 ASP 2 HB2 ASP 2 -15.040 -49.709 -8.125 49 HB3 ASP 2 HB3 ASP 2 -13.974 -48.890 -6.992 50 HA PRO 3 HA PRO 3 -16.357 -50.413 -3.050 51 HB2 PRO 3 HB2 PRO 3 -15.028 -48.829 -1.283 52 HB3 PRO 3 HB3 PRO 3 -14.504 -50.512 -1.605 53 HG2 PRO 3 HG2 PRO 3 -13.427 -47.960 -2.864 54 HG3 PRO 3 HG3 PRO 3 -12.498 -49.281 -2.087 55 HD2 PRO 3 HD2 PRO 3 -12.880 -49.159 -4.792 56 HD3 PRO 3 HD3 PRO 3 -12.822 -50.717 -3.917 57 H LEU 4 H LEU 4 -15.539 -48.128 -5.254 58 HA LEU 4 HA LEU 4 -17.454 -46.089 -4.220 59 HB2 LEU 4 HB2 LEU 4 -15.168 -45.804 -6.205 60 HB3 LEU 4 HB3 LEU 4 -16.285 -44.521 -5.754 61 HG LEU 4 HG LEU 4 -14.340 -45.875 -3.852 62 HD11 LEU 4 HD11 LEU 4 -14.345 -43.090 -5.084 63 HD12 LEU 4 HD12 LEU 4 -13.173 -43.717 -3.903 64 HD13 LEU 4 HD13 LEU 4 -13.256 -44.424 -5.524 65 HD21 LEU 4 HD21 LEU 4 -16.309 -45.104 -2.606 66 HD22 LEU 4 HD22 LEU 4 -14.954 -44.019 -2.304 67 HD23 LEU 4 HD23 LEU 4 -16.240 -43.524 -3.425 68 H ASP 5 H ASP 5 -18.492 -48.428 -5.288 69 HA ASP 5 HA ASP 5 -19.578 -47.589 -7.917 70 HB2 ASP 5 HB2 ASP 5 -18.650 -49.930 -7.471 71 HB3 ASP 5 HB3 ASP 5 -20.026 -50.162 -6.378 72 H LYS 6 H LYS 6 -20.476 -47.559 -4.724 73 HA LYS 6 HA LYS 6 -23.400 -47.539 -5.329 74 HB2 LYS 6 HB2 LYS 6 -23.868 -48.504 -3.208 75 HB3 LYS 6 HB3 LYS 6 -22.791 -49.515 -4.141 76 HG2 LYS 6 HG2 LYS 6 -21.824 -47.712 -1.875 77 HG3 LYS 6 HG3 LYS 6 -22.409 -49.351 -1.642 78 HD2 LYS 6 HD2 LYS 6 -20.646 -50.143 -3.283 79 HD3 LYS 6 HD3 LYS 6 -19.920 -48.532 -3.191 80 HE2 LYS 6 HE2 LYS 6 -20.503 -50.223 -0.722 81 HE3 LYS 6 HE3 LYS 6 -19.016 -50.414 -1.654 82 HZ1 LYS 6 HZ1 LYS 6 -19.856 -47.884 -0.350 83 HZ2 LYS 6 HZ2 LYS 6 -18.685 -48.886 0.180 84 HZ3 LYS 6 HZ3 LYS 6 -18.478 -48.103 -1.238 85 H ILE 7 H ILE 7 -21.022 -45.728 -3.481 86 HA ILE 7 HA ILE 7 -23.068 -43.612 -2.985 87 HB ILE 7 HB ILE 7 -22.098 -43.206 -0.742 88 HG12 ILE 7 HG12 ILE 7 -20.925 -45.088 0.409 89 HG13 ILE 7 HG13 ILE 7 -20.643 -45.855 -1.150 90 HG21 ILE 7 HG21 ILE 7 -23.240 -46.003 -1.059 91 HG22 ILE 7 HG22 ILE 7 -23.317 -44.955 0.366 92 HG23 ILE 7 HG23 ILE 7 -24.180 -44.497 -1.107 93 HD11 ILE 7 HD11 ILE 7 -19.587 -43.106 -0.375 94 HD12 ILE 7 HD12 ILE 7 -18.680 -44.622 -0.218 95 HD13 ILE 7 HD13 ILE 7 -19.148 -44.053 -1.823 96 H ILE 8 H ILE 8 -20.626 -44.019 -4.868 97 HA ILE 8 HA ILE 8 -18.541 -42.355 -4.219 98 HB ILE 8 HB ILE 8 -18.569 -43.871 -6.097 99 HG12 ILE 8 HG12 ILE 8 -17.797 -41.012 -6.831 100 HG13 ILE 8 HG13 ILE 8 -16.836 -42.145 -5.879 101 HG21 ILE 8 HG21 ILE 8 -20.087 -41.822 -7.745 102 HG22 ILE 8 HG22 ILE 8 -19.557 -43.445 -8.227 103 HG23 ILE 8 HG23 ILE 8 -20.841 -43.262 -7.032 104 HD11 ILE 8 HD11 ILE 8 -17.531 -42.371 -8.836 105 HD12 ILE 8 HD12 ILE 8 -15.947 -42.059 -8.113 106 HD13 ILE 8 HD13 ILE 8 -16.708 -43.646 -7.907 107 H ASN 9 H ASN 9 -18.276 -40.264 -3.854 108 HA ASN 9 HA ASN 9 -19.822 -38.202 -5.336 109 HB2 ASN 9 HB2 ASN 9 -20.858 -39.030 -3.030 110 HB3 ASN 9 HB3 ASN 9 -19.616 -38.005 -2.321 111 HD21 ASN 9 HD21 ASN 9 -21.263 -34.978 -3.462 112 HD22 ASN 9 HD22 ASN 9 -19.644 -35.645 -3.260 113 H ASP 10 H ASP 10 -16.789 -39.182 -4.426 114 HA ASP 10 HA ASP 10 -15.835 -36.568 -3.644 115 HB2 ASP 10 HB2 ASP 10 -14.356 -39.207 -3.996 116 HB3 ASP 10 HB3 ASP 10 -13.670 -37.760 -3.258 117 H ILE 11 H ILE 11 -16.599 -37.337 -6.483 118 HA ILE 11 HA ILE 11 -14.550 -35.742 -7.888 119 HB ILE 11 HB ILE 11 -13.882 -38.175 -7.906 120 HG12 ILE 11 HG12 ILE 11 -14.335 -37.142 -10.722 121 HG13 ILE 11 HG13 ILE 11 -13.123 -36.493 -9.612 122 HG21 ILE 11 HG21 ILE 11 -16.244 -38.590 -9.783 123 HG22 ILE 11 HG22 ILE 11 -15.044 -39.795 -9.284 124 HG23 ILE 11 HG23 ILE 11 -16.170 -39.145 -8.097 125 HD11 ILE 11 HD11 ILE 11 -13.260 -39.354 -10.654 126 HD12 ILE 11 HD12 ILE 11 -12.092 -38.102 -11.101 127 HD13 ILE 11 HD13 ILE 11 -12.087 -38.759 -9.453 128 H LYS 12 H LYS 12 -17.320 -35.356 -7.090 129 HA LYS 12 HA LYS 12 -18.489 -34.851 -9.790 130 HB2 LYS 12 HB2 LYS 12 -19.509 -36.726 -8.517 131 HB3 LYS 12 HB3 LYS 12 -19.943 -35.601 -7.222 132 HG2 LYS 12 HG2 LYS 12 -21.456 -34.386 -8.738 133 HG3 LYS 12 HG3 LYS 12 -20.879 -35.339 -10.116 134 HD2 LYS 12 HD2 LYS 12 -23.014 -36.207 -9.442 135 HD3 LYS 12 HD3 LYS 12 -21.765 -37.401 -9.047 136 HE2 LYS 12 HE2 LYS 12 -21.791 -36.585 -6.670 137 HE3 LYS 12 HE3 LYS 12 -23.077 -35.448 -7.096 138 HZ1 LYS 12 HZ1 LYS 12 -23.279 -38.410 -7.289 139 HZ2 LYS 12 HZ2 LYS 12 -23.965 -37.491 -6.129 140 HZ3 LYS 12 HZ3 LYS 12 -24.474 -37.363 -7.676 141 H LYS 13 H LYS 13 -18.263 -33.510 -6.517 142 HA LYS 13 HA LYS 13 -18.885 -30.830 -7.557 143 HB2 LYS 13 HB2 LYS 13 -21.021 -32.010 -6.838 144 HB3 LYS 13 HB3 LYS 13 -20.403 -31.999 -5.186 145 HG2 LYS 13 HG2 LYS 13 -20.341 -29.509 -5.238 146 HG3 LYS 13 HG3 LYS 13 -20.890 -29.536 -6.929 147 HD2 LYS 13 HD2 LYS 13 -22.951 -30.789 -6.171 148 HD3 LYS 13 HD3 LYS 13 -22.452 -30.539 -4.497 149 HE2 LYS 13 HE2 LYS 13 -22.998 -28.325 -6.536 150 HE3 LYS 13 HE3 LYS 13 -24.180 -28.926 -5.372 151 HZ1 LYS 13 HZ1 LYS 13 -21.619 -27.604 -4.653 152 HZ2 LYS 13 HZ2 LYS 13 -23.103 -26.941 -4.535 153 HZ3 LYS 13 HZ3 LYS 13 -22.702 -28.197 -3.577 154 H GLU 14 H GLU 14 -17.410 -29.472 -6.872 155 HA GLU 14 HA GLU 14 -16.338 -29.559 -4.098 156 HB2 GLU 14 HB2 GLU 14 -14.636 -29.550 -6.628 157 HB3 GLU 14 HB3 GLU 14 -14.042 -29.126 -5.016 158 HG2 GLU 14 HG2 GLU 14 -14.708 -31.368 -4.186 159 HG3 GLU 14 HG3 GLU 14 -15.204 -31.818 -5.823 160 H ALA 15 H ALA 15 -16.315 -27.590 -3.221 161 HA ALA 15 HA ALA 15 -16.236 -25.128 -4.885 162 HB1 ALA 15 HB1 ALA 15 -18.591 -26.009 -3.151 163 HB2 ALA 15 HB2 ALA 15 -18.474 -24.476 -4.054 164 HB3 ALA 15 HB3 ALA 15 -18.554 -26.018 -4.925 165 H ASN 16 H ASN 16 -14.901 -26.473 -2.245 166 HA ASN 16 HA ASN 16 -15.275 -24.139 -0.412 167 HB2 ASN 16 HB2 ASN 16 -16.188 -26.309 0.343 168 HB3 ASN 16 HB3 ASN 16 -14.582 -27.031 0.212 169 HD21 ASN 16 HD21 ASN 16 -14.730 -26.265 3.734 170 HD22 ASN 16 HD22 ASN 16 -15.183 -27.499 2.565 171 H ASP 17 H ASP 17 -13.665 -22.814 -1.224 172 HA ASP 17 HA ASP 17 -11.078 -23.295 -0.010 173 HB2 ASP 17 HB2 ASP 17 -11.090 -24.164 -2.548 174 HB3 ASP 17 HB3 ASP 17 -10.881 -22.455 -2.897 175 H SER 18 H SER 18 -9.721 -21.311 -0.079 176 HA SER 18 HA SER 18 -11.380 -18.805 -0.054 177 HB2 SER 18 HB2 SER 18 -9.406 -19.742 2.060 178 HB3 SER 18 HB3 SER 18 -10.189 -18.150 2.011 179 HG SER 18 HG SER 18 -11.298 -19.631 3.379 180 H GLY 19 H GLY 19 -10.549 -18.420 -2.108 181 HA2 GLY 19 HA2 GLY 19 -9.297 -16.830 -3.319 182 HA3 GLY 19 HA3 GLY 19 -8.045 -16.839 -2.084 183 H VAL 20 H VAL 20 -9.088 -18.098 -5.071 184 HA VAL 20 HA VAL 20 -6.763 -19.981 -5.287 185 HB VAL 20 HB VAL 20 -9.405 -20.109 -6.782 186 HG11 VAL 20 HG11 VAL 20 -6.999 -21.992 -6.742 187 HG12 VAL 20 HG12 VAL 20 -8.569 -22.349 -7.498 188 HG13 VAL 20 HG13 VAL 20 -7.576 -21.037 -8.125 189 HG21 VAL 20 HG21 VAL 20 -9.728 -20.762 -4.433 190 HG22 VAL 20 HG22 VAL 20 -9.777 -22.189 -5.469 191 HG23 VAL 20 HG23 VAL 20 -8.317 -21.839 -4.518 192 H THR 21 H THR 21 -5.266 -19.577 -6.743 193 HA THR 21 HA THR 21 -3.968 -18.442 -8.211 194 HB THR 21 HB THR 21 -6.182 -18.063 -10.155 195 HG1 THR 21 HG1 THR 21 -6.157 -20.258 -10.627 196 HG21 THR 21 HG21 THR 21 -3.481 -19.479 -10.339 197 HG22 THR 21 HG22 THR 21 -4.533 -19.012 -11.692 198 HG23 THR 21 HG23 THR 21 -3.696 -17.771 -10.745 199 H LEU 22 H LEU 22 -4.679 -16.385 -10.166 200 HA LEU 22 HA LEU 22 -4.743 -14.044 -8.327 201 HB2 LEU 22 HB2 LEU 22 -3.182 -14.407 -10.916 202 HB3 LEU 22 HB3 LEU 22 -3.048 -13.042 -9.809 203 HG LEU 22 HG LEU 22 -2.260 -15.910 -9.135 204 HD11 LEU 22 HD11 LEU 22 -0.529 -13.528 -9.886 205 HD12 LEU 22 HD12 LEU 22 0.053 -15.119 -9.337 206 HD13 LEU 22 HD13 LEU 22 -0.823 -14.985 -10.869 207 HD21 LEU 22 HD21 LEU 22 -2.837 -14.594 -7.120 208 HD22 LEU 22 HD22 LEU 22 -1.096 -14.880 -7.206 209 HD23 LEU 22 HD23 LEU 22 -1.752 -13.288 -7.653 210 H ALA 23 H ALA 23 -6.987 -15.174 -9.630 211 HA ALA 23 HA ALA 23 -7.996 -12.955 -11.331 212 HB1 ALA 23 HB1 ALA 23 -7.683 -15.843 -12.245 213 HB2 ALA 23 HB2 ALA 23 -8.540 -14.561 -13.136 214 HB3 ALA 23 HB3 ALA 23 -6.792 -14.436 -12.849 215 HA PRO 24 HA PRO 24 -11.354 -14.588 -8.649 216 HB2 PRO 24 HB2 PRO 24 -12.792 -12.313 -8.302 217 HB3 PRO 24 HB3 PRO 24 -11.204 -12.561 -7.514 218 HG2 PRO 24 HG2 PRO 24 -11.785 -11.059 -10.092 219 HG3 PRO 24 HG3 PRO 24 -10.843 -10.497 -8.675 220 HD2 PRO 24 HD2 PRO 24 -9.667 -11.605 -10.887 221 HD3 PRO 24 HD3 PRO 24 -9.004 -11.863 -9.242 222 H LEU 25 H LEU 25 -11.528 -13.182 -11.790 223 HA LEU 25 HA LEU 25 -13.899 -14.703 -12.553 224 HB2 LEU 25 HB2 LEU 25 -14.453 -12.210 -11.681 225 HB3 LEU 25 HB3 LEU 25 -13.845 -11.749 -13.257 226 HG LEU 25 HG LEU 25 -15.605 -13.335 -14.259 227 HD11 LEU 25 HD11 LEU 25 -16.645 -13.294 -11.390 228 HD12 LEU 25 HD12 LEU 25 -17.530 -13.902 -12.807 229 HD13 LEU 25 HD13 LEU 25 -16.067 -14.727 -12.261 230 HD21 LEU 25 HD21 LEU 25 -15.913 -10.892 -14.161 231 HD22 LEU 25 HD22 LEU 25 -17.447 -11.740 -13.904 232 HD23 LEU 25 HD23 LEU 25 -16.582 -11.033 -12.520 233 H SER 26 H SER 26 -14.058 -13.435 -15.169 234 HA SER 26 HA SER 26 -11.631 -14.459 -16.442 235 HB2 SER 26 HB2 SER 26 -14.006 -14.777 -17.291 236 HB3 SER 26 HB3 SER 26 -13.949 -13.089 -17.827 237 HG SER 26 HG SER 26 -13.292 -14.582 -19.466 238 H VAL 27 H VAL 27 -10.620 -12.695 -14.919 239 HA VAL 27 HA VAL 27 -9.582 -10.538 -16.589 240 HB VAL 27 HB VAL 27 -11.721 -9.649 -15.693 241 HG11 VAL 27 HG11 VAL 27 -10.426 -9.684 -12.949 242 HG12 VAL 27 HG12 VAL 27 -12.020 -9.038 -13.384 243 HG13 VAL 27 HG13 VAL 27 -11.718 -10.781 -13.467 244 HG21 VAL 27 HG21 VAL 27 -9.911 -8.096 -16.274 245 HG22 VAL 27 HG22 VAL 27 -10.877 -7.493 -14.924 246 HG23 VAL 27 HG23 VAL 27 -9.276 -8.189 -14.611 247 HA PRO 28 HA PRO 28 -6.235 -11.536 -13.701 248 HB2 PRO 28 HB2 PRO 28 -4.241 -9.950 -14.617 249 HB3 PRO 28 HB3 PRO 28 -4.901 -11.296 -15.585 250 HG2 PRO 28 HG2 PRO 28 -5.667 -8.359 -15.761 251 HG3 PRO 28 HG3 PRO 28 -5.173 -9.453 -17.093 252 HD2 PRO 28 HD2 PRO 28 -7.791 -8.979 -16.486 253 HD3 PRO 28 HD3 PRO 28 -7.235 -10.574 -17.067 254 H LYS 29 H LYS 29 -7.923 -10.544 -12.257 255 HA LYS 29 HA LYS 29 -8.591 -9.384 -10.461 256 HB2 LYS 29 HB2 LYS 29 -6.240 -9.791 -9.726 257 HB3 LYS 29 HB3 LYS 29 -5.816 -8.201 -10.345 258 HG2 LYS 29 HG2 LYS 29 -6.096 -7.870 -8.046 259 HG3 LYS 29 HG3 LYS 29 -7.582 -7.237 -8.766 260 HD2 LYS 29 HD2 LYS 29 -8.768 -9.296 -8.140 261 HD3 LYS 29 HD3 LYS 29 -7.261 -9.975 -7.486 262 HE2 LYS 29 HE2 LYS 29 -7.111 -8.188 -5.827 263 HE3 LYS 29 HE3 LYS 29 -8.492 -7.348 -6.538 264 HZ1 LYS 29 HZ1 LYS 29 -8.664 -10.029 -5.249 265 HZ2 LYS 29 HZ2 LYS 29 -9.161 -8.624 -4.576 266 HZ3 LYS 29 HZ3 LYS 29 -9.919 -9.204 -5.891 267 HA PRO 30 HA PRO 30 -9.879 -5.593 -12.527 268 HB2 PRO 30 HB2 PRO 30 -12.198 -5.079 -11.226 269 HB3 PRO 30 HB3 PRO 30 -12.023 -6.467 -12.347 270 HG2 PRO 30 HG2 PRO 30 -11.803 -6.477 -9.320 271 HG3 PRO 30 HG3 PRO 30 -12.748 -7.584 -10.364 272 HD2 PRO 30 HD2 PRO 30 -10.245 -8.177 -9.405 273 HD3 PRO 30 HD3 PRO 30 -10.838 -8.785 -10.976 274 H LYS 31 H LYS 31 -9.810 -3.369 -12.126 275 HA LYS 31 HA LYS 31 -8.111 -2.532 -9.951 276 HB2 LYS 31 HB2 LYS 31 -9.533 -0.994 -12.136 277 HB3 LYS 31 HB3 LYS 31 -8.457 -0.239 -10.952 278 HG2 LYS 31 HG2 LYS 31 -6.587 -1.652 -11.632 279 HG3 LYS 31 HG3 LYS 31 -7.595 -2.522 -12.791 280 HD2 LYS 31 HD2 LYS 31 -6.986 0.464 -12.936 281 HD3 LYS 31 HD3 LYS 31 -6.104 -0.800 -13.810 282 HE2 LYS 31 HE2 LYS 31 -8.225 -1.506 -14.922 283 HE3 LYS 31 HE3 LYS 31 -9.081 -0.190 -14.108 284 HZ1 LYS 31 HZ1 LYS 31 -6.835 0.163 -16.024 285 HZ2 LYS 31 HZ2 LYS 31 -8.407 0.444 -16.349 286 HZ3 LYS 31 HZ3 LYS 31 -7.625 1.383 -15.271 287 H LEU 32 H LEU 32 -8.414 -1.294 -8.181 288 HA LEU 32 HA LEU 32 -11.193 -0.742 -7.284 289 HB2 LEU 32 HB2 LEU 32 -10.309 -2.875 -6.369 290 HB3 LEU 32 HB3 LEU 32 -8.868 -2.033 -5.799 291 HG LEU 32 HG LEU 32 -10.299 -0.641 -4.318 292 HD11 LEU 32 HD11 LEU 32 -12.486 -2.601 -5.162 293 HD12 LEU 32 HD12 LEU 32 -12.605 -1.477 -3.797 294 HD13 LEU 32 HD13 LEU 32 -12.499 -0.848 -5.442 295 HD21 LEU 32 HD21 LEU 32 -9.148 -2.613 -3.458 296 HD22 LEU 32 HD22 LEU 32 -10.703 -2.387 -2.637 297 HD23 LEU 32 HD23 LEU 32 -10.535 -3.638 -3.893 298 H GLU 33 H GLU 33 -11.473 1.041 -5.956 299 HA GLU 33 HA GLU 33 -9.193 2.804 -5.292 300 HB2 GLU 33 HB2 GLU 33 -11.334 3.370 -7.312 301 HB3 GLU 33 HB3 GLU 33 -10.999 4.682 -6.196 302 HG2 GLU 33 HG2 GLU 33 -8.776 3.321 -7.747 303 HG3 GLU 33 HG3 GLU 33 -9.711 4.677 -8.370 304 H GLU 34 H GLU 34 -9.742 1.682 -3.312 305 HA GLU 34 HA GLU 34 -11.797 3.164 -1.730 306 HB2 GLU 34 HB2 GLU 34 -11.545 0.160 -2.017 307 HB3 GLU 34 HB3 GLU 34 -12.240 0.920 -0.570 308 HG2 GLU 34 HG2 GLU 34 -13.850 2.159 -2.045 309 HG3 GLU 34 HG3 GLU 34 -13.228 1.249 -3.426 310 H LEU 35 H LEU 35 -10.099 4.421 -1.016 311 HA LEU 35 HA LEU 35 -8.780 3.347 1.431 312 HB2 LEU 35 HB2 LEU 35 -7.695 5.287 -0.652 313 HB3 LEU 35 HB3 LEU 35 -6.975 5.068 0.931 314 HG LEU 35 HG LEU 35 -7.312 2.538 -0.628 315 HD11 LEU 35 HD11 LEU 35 -5.251 4.570 -1.522 316 HD12 LEU 35 HD12 LEU 35 -5.469 2.904 -2.108 317 HD13 LEU 35 HD13 LEU 35 -6.714 4.111 -2.428 318 HD21 LEU 35 HD21 LEU 35 -6.140 2.622 1.539 319 HD22 LEU 35 HD22 LEU 35 -5.065 2.108 0.232 320 HD23 LEU 35 HD23 LEU 35 -4.958 3.767 0.857 321 H SER 36 H SER 36 -8.721 4.903 3.162 322 HA SER 36 HA SER 36 -10.798 7.003 3.134 323 HB2 SER 36 HB2 SER 36 -8.710 6.266 5.221 324 HB3 SER 36 HB3 SER 36 -9.994 7.472 5.429 325 HG SER 36 HG SER 36 -10.597 5.423 6.273 326 H GLU 37 H GLU 37 -10.169 9.335 3.757 327 HA GLU 37 HA GLU 37 -8.560 10.418 1.741 328 HB2 GLU 37 HB2 GLU 37 -10.310 11.607 3.014 329 HB3 GLU 37 HB3 GLU 37 -9.246 11.675 4.427 330 HG2 GLU 37 HG2 GLU 37 -7.631 13.057 3.161 331 HG3 GLU 37 HG3 GLU 37 -8.616 12.904 1.704 332 H GLN 38 H GLN 38 -7.511 9.801 5.117 333 HA GLN 38 HA GLN 38 -4.784 10.744 4.642 334 HB2 GLN 38 HB2 GLN 38 -5.963 10.715 6.886 335 HB3 GLN 38 HB3 GLN 38 -5.891 8.950 6.848 336 HG2 GLN 38 HG2 GLN 38 -3.311 9.240 6.620 337 HG3 GLN 38 HG3 GLN 38 -3.584 10.934 7.028 338 HE21 GLN 38 HE21 GLN 38 -4.036 8.002 9.901 339 HE22 GLN 38 HE22 GLN 38 -3.998 7.555 8.203 340 H GLN 39 H GLN 39 -6.388 7.536 4.659 341 HA GLN 39 HA GLN 39 -3.980 6.019 4.341 342 HB2 GLN 39 HB2 GLN 39 -6.878 5.388 3.789 343 HB3 GLN 39 HB3 GLN 39 -5.580 4.240 3.451 344 HG2 GLN 39 HG2 GLN 39 -4.805 4.423 5.822 345 HG3 GLN 39 HG3 GLN 39 -6.190 5.453 6.183 346 HE21 GLN 39 HE21 GLN 39 -6.904 1.773 6.946 347 HE22 GLN 39 HE22 GLN 39 -5.471 2.715 7.300 348 H LYS 40 H LYS 40 -6.141 7.503 1.939 349 HA LYS 40 HA LYS 40 -4.900 6.464 -0.420 350 HB2 LYS 40 HB2 LYS 40 -7.048 7.568 -0.475 351 HB3 LYS 40 HB3 LYS 40 -6.386 9.065 0.179 352 HG2 LYS 40 HG2 LYS 40 -5.180 9.559 -1.814 353 HG3 LYS 40 HG3 LYS 40 -5.432 7.945 -2.483 354 HD2 LYS 40 HD2 LYS 40 -7.734 9.849 -1.866 355 HD3 LYS 40 HD3 LYS 40 -6.879 9.895 -3.405 356 HE2 LYS 40 HE2 LYS 40 -8.235 7.392 -2.303 357 HE3 LYS 40 HE3 LYS 40 -9.018 8.532 -3.400 358 HZ1 LYS 40 HZ1 LYS 40 -6.509 7.082 -4.061 359 HZ2 LYS 40 HZ2 LYS 40 -7.977 6.624 -4.581 360 HZ3 LYS 40 HZ3 LYS 40 -7.362 8.048 -5.070 361 H ILE 41 H ILE 41 -4.099 9.343 1.580 362 HA ILE 41 HA ILE 41 -1.918 10.203 -0.099 363 HB ILE 41 HB ILE 41 -2.422 10.777 2.803 364 HG12 ILE 41 HG12 ILE 41 -2.996 12.646 0.449 365 HG13 ILE 41 HG13 ILE 41 -4.210 11.502 0.977 366 HG21 ILE 41 HG21 ILE 41 -0.588 12.181 0.824 367 HG22 ILE 41 HG22 ILE 41 -0.994 12.806 2.436 368 HG23 ILE 41 HG23 ILE 41 -0.106 11.299 2.290 369 HD11 ILE 41 HD11 ILE 41 -3.051 13.733 2.681 370 HD12 ILE 41 HD12 ILE 41 -4.686 13.611 2.000 371 HD13 ILE 41 HD13 ILE 41 -4.174 12.478 3.260 372 H ILE 42 H ILE 42 -1.988 8.104 2.885 373 HA ILE 42 HA ILE 42 0.879 7.812 2.984 374 HB ILE 42 HB ILE 42 -1.286 5.909 3.938 375 HG12 ILE 42 HG12 ILE 42 0.324 7.770 5.723 376 HG13 ILE 42 HG13 ILE 42 -1.137 8.356 4.943 377 HG21 ILE 42 HG21 ILE 42 1.707 6.054 4.554 378 HG22 ILE 42 HG22 ILE 42 0.560 5.066 5.469 379 HG23 ILE 42 HG23 ILE 42 0.846 4.712 3.771 380 HD11 ILE 42 HD11 ILE 42 -1.022 5.929 6.778 381 HD12 ILE 42 HD12 ILE 42 -1.667 7.530 7.171 382 HD13 ILE 42 HD13 ILE 42 -2.460 6.533 5.928 383 H LEU 43 H LEU 43 -1.662 5.894 1.413 384 HA LEU 43 HA LEU 43 -0.081 3.835 0.298 385 HB2 LEU 43 HB2 LEU 43 -2.534 3.862 0.482 386 HB3 LEU 43 HB3 LEU 43 -2.657 5.152 -0.685 387 HG LEU 43 HG LEU 43 -3.299 2.848 -1.394 388 HD11 LEU 43 HD11 LEU 43 -1.164 4.146 -3.106 389 HD12 LEU 43 HD12 LEU 43 -2.400 2.996 -3.638 390 HD13 LEU 43 HD13 LEU 43 -2.874 4.592 -3.031 391 HD21 LEU 43 HD21 LEU 43 -1.584 1.548 -0.342 392 HD22 LEU 43 HD22 LEU 43 -1.540 1.262 -2.085 393 HD23 LEU 43 HD23 LEU 43 -0.300 2.288 -1.328 394 H ALA 44 H ALA 44 -1.064 6.971 -1.124 395 HA ALA 44 HA ALA 44 0.443 6.747 -3.529 396 HB1 ALA 44 HB1 ALA 44 -0.543 9.156 -1.951 397 HB2 ALA 44 HB2 ALA 44 -0.005 9.195 -3.648 398 HB3 ALA 44 HB3 ALA 44 -1.461 8.275 -3.194 399 H GLU 45 H GLU 45 1.274 8.584 -0.483 400 HA GLU 45 HA GLU 45 3.798 9.487 -1.413 401 HB2 GLU 45 HB2 GLU 45 2.719 8.954 1.376 402 HB3 GLU 45 HB3 GLU 45 4.311 9.646 1.104 403 HG2 GLU 45 HG2 GLU 45 1.770 10.912 -0.004 404 HG3 GLU 45 HG3 GLU 45 2.453 11.303 1.570 405 H TYR 46 H TYR 46 2.964 6.299 -0.106 406 HA TYR 46 HA TYR 46 5.693 5.466 0.367 407 HB2 TYR 46 HB2 TYR 46 3.744 4.502 1.478 408 HB3 TYR 46 HB3 TYR 46 3.105 3.938 -0.057 409 HD1 TYR 46 HD1 TYR 46 2.827 1.816 1.184 410 HD2 TYR 46 HD2 TYR 46 6.733 3.441 0.326 411 HE1 TYR 46 HE1 TYR 46 3.848 -0.423 1.551 412 HE2 TYR 46 HE2 TYR 46 7.740 1.201 0.698 413 HH TYR 46 HH TYR 46 5.749 -1.630 1.597 414 H ILE 47 H ILE 47 3.400 4.619 -2.300 415 HA ILE 47 HA ILE 47 5.181 3.319 -4.068 416 HB ILE 47 HB ILE 47 2.593 4.814 -4.300 417 HG12 ILE 47 HG12 ILE 47 3.327 1.853 -4.447 418 HG13 ILE 47 HG13 ILE 47 2.866 2.624 -2.952 419 HG21 ILE 47 HG21 ILE 47 3.981 3.208 -6.487 420 HG22 ILE 47 HG22 ILE 47 2.285 3.737 -6.545 421 HG23 ILE 47 HG23 ILE 47 3.565 4.931 -6.547 422 HD11 ILE 47 HD11 ILE 47 1.019 2.341 -5.351 423 HD12 ILE 47 HD12 ILE 47 0.934 1.471 -3.808 424 HD13 ILE 47 HD13 ILE 47 0.656 3.221 -3.865 425 H ALA 48 H ALA 48 4.375 6.813 -3.663 426 HA ALA 48 HA ALA 48 5.838 7.739 -5.960 427 HB1 ALA 48 HB1 ALA 48 4.976 9.133 -3.396 428 HB2 ALA 48 HB2 ALA 48 5.500 9.945 -4.890 429 HB3 ALA 48 HB3 ALA 48 4.009 8.978 -4.878 430 H GLU 49 H GLU 49 6.880 6.861 -2.706 431 HA GLU 49 HA GLU 49 9.506 8.180 -3.017 432 HB2 GLU 49 HB2 GLU 49 8.200 8.212 -0.874 433 HB3 GLU 49 HB3 GLU 49 8.428 6.466 -0.754 434 HG2 GLU 49 HG2 GLU 49 10.021 7.511 0.667 435 HG3 GLU 49 HG3 GLU 49 10.923 6.867 -0.690 436 H VAL 50 H VAL 50 8.140 4.843 -3.219 437 HA VAL 50 HA VAL 50 10.935 3.862 -3.701 438 HB VAL 50 HB VAL 50 10.476 1.833 -2.667 439 HG11 VAL 50 HG11 VAL 50 9.275 3.935 -0.828 440 HG12 VAL 50 HG12 VAL 50 10.106 2.439 -0.366 441 HG13 VAL 50 HG13 VAL 50 11.013 3.741 -1.156 442 HG21 VAL 50 HG21 VAL 50 8.175 1.358 -3.311 443 HG22 VAL 50 HG22 VAL 50 8.371 1.227 -1.576 444 HG23 VAL 50 HG23 VAL 50 7.564 2.647 -2.272 445 H GLY 51 H GLY 51 7.787 4.059 -5.127 446 HA2 GLY 51 HA2 GLY 51 7.161 3.416 -7.279 447 HA3 GLY 51 HA3 GLY 51 8.612 2.435 -7.455 448 H LEU 52 H LEU 52 5.621 1.879 -7.815 449 HA LEU 52 HA LEU 52 4.714 0.269 -5.724 450 HB2 LEU 52 HB2 LEU 52 3.632 1.389 -7.949 451 HB3 LEU 52 HB3 LEU 52 3.715 -0.249 -8.543 452 HG LEU 52 HG LEU 52 2.389 0.493 -5.902 453 HD11 LEU 52 HD11 LEU 52 1.159 0.326 -8.669 454 HD12 LEU 52 HD12 LEU 52 0.269 0.557 -7.142 455 HD13 LEU 52 HD13 LEU 52 1.407 1.796 -7.687 456 HD21 LEU 52 HD21 LEU 52 2.683 -1.858 -5.989 457 HD22 LEU 52 HD22 LEU 52 1.003 -1.539 -6.370 458 HD23 LEU 52 HD23 LEU 52 2.142 -1.937 -7.681 459 H GLN 53 H GLN 53 7.035 -0.472 -7.888 460 HA GLN 53 HA GLN 53 6.807 -3.415 -8.018 461 HB2 GLN 53 HB2 GLN 53 8.967 -1.453 -8.870 462 HB3 GLN 53 HB3 GLN 53 9.074 -3.198 -9.123 463 HG2 GLN 53 HG2 GLN 53 7.212 -3.234 -10.618 464 HG3 GLN 53 HG3 GLN 53 6.709 -1.599 -10.189 465 HE21 GLN 53 HE21 GLN 53 9.152 0.044 -12.220 466 HE22 GLN 53 HE22 GLN 53 8.182 0.220 -10.762 467 H ASN 54 H ASN 54 8.055 -1.136 -5.741 468 HA ASN 54 HA ASN 54 9.834 -3.193 -4.500 469 HB2 ASN 54 HB2 ASN 54 10.031 -0.169 -4.347 470 HB3 ASN 54 HB3 ASN 54 11.184 -1.323 -3.683 471 HD21 ASN 54 HD21 ASN 54 11.647 -0.134 -7.462 472 HD22 ASN 54 HD22 ASN 54 10.661 0.693 -6.250 473 H ILE 55 H ILE 55 6.911 -1.729 -3.948 474 HA ILE 55 HA ILE 55 6.999 -1.814 -1.019 475 HB ILE 55 HB ILE 55 4.656 -1.474 -1.009 476 HG12 ILE 55 HG12 ILE 55 4.633 -1.941 -4.006 477 HG13 ILE 55 HG13 ILE 55 3.905 -2.975 -2.774 478 HG21 ILE 55 HG21 ILE 55 5.678 0.301 -3.251 479 HG22 ILE 55 HG22 ILE 55 4.537 0.694 -1.934 480 HG23 ILE 55 HG23 ILE 55 6.231 0.420 -1.573 481 HD11 ILE 55 HD11 ILE 55 3.058 -0.166 -3.529 482 HD12 ILE 55 HD12 ILE 55 2.150 -1.667 -3.738 483 HD13 ILE 55 HD13 ILE 55 2.436 -1.046 -2.101 484 H THR 56 H THR 56 5.752 -3.300 0.278 485 HA THR 56 HA THR 56 5.219 -5.971 -0.920 486 HB THR 56 HB THR 56 6.022 -6.723 1.529 487 HG1 THR 56 HG1 THR 56 7.928 -5.552 2.042 488 HG21 THR 56 HG21 THR 56 8.010 -6.057 -0.690 489 HG22 THR 56 HG22 THR 56 8.253 -7.239 0.620 490 HG23 THR 56 HG23 THR 56 7.014 -7.527 -0.611 491 H ALA 57 H ALA 57 3.489 -7.126 -0.006 492 HA ALA 57 HA ALA 57 1.359 -5.616 1.108 493 HB1 ALA 57 HB1 ALA 57 1.833 -8.634 1.061 494 HB2 ALA 57 HB2 ALA 57 0.283 -7.814 1.341 495 HB3 ALA 57 HB3 ALA 57 1.078 -7.684 -0.239 496 H ILE 58 H ILE 58 3.973 -7.409 2.611 497 HA ILE 58 HA ILE 58 2.981 -7.595 5.314 498 HB ILE 58 HB ILE 58 5.757 -7.509 4.054 499 HG12 ILE 58 HG12 ILE 58 5.878 -9.888 4.838 500 HG13 ILE 58 HG13 ILE 58 4.222 -9.788 5.425 501 HG21 ILE 58 HG21 ILE 58 5.023 -7.890 6.999 502 HG22 ILE 58 HG22 ILE 58 6.619 -8.275 6.311 503 HG23 ILE 58 HG23 ILE 58 6.045 -6.612 6.310 504 HD11 ILE 58 HD11 ILE 58 5.020 -9.471 2.498 505 HD12 ILE 58 HD12 ILE 58 4.527 -11.000 3.249 506 HD13 ILE 58 HD13 ILE 58 3.368 -9.675 3.153 507 H THR 59 H THR 59 5.055 -5.221 3.627 508 HA THR 59 HA THR 59 5.227 -3.443 5.911 509 HB THR 59 HB THR 59 6.000 -3.133 2.999 510 HG1 THR 59 HG1 THR 59 7.795 -4.030 3.574 511 HG21 THR 59 HG21 THR 59 6.825 -1.512 5.451 512 HG22 THR 59 HG22 THR 59 7.561 -1.396 3.831 513 HG23 THR 59 HG23 THR 59 5.874 -0.910 4.070 514 H LEU 60 H LEU 60 3.357 -3.386 2.836 515 HA LEU 60 HA LEU 60 2.018 -0.942 3.342 516 HB2 LEU 60 HB2 LEU 60 2.247 -2.266 1.167 517 HB3 LEU 60 HB3 LEU 60 1.026 -3.357 1.778 518 HG LEU 60 HG LEU 60 -0.554 -1.321 1.903 519 HD11 LEU 60 HD11 LEU 60 1.683 -0.074 0.247 520 HD12 LEU 60 HD12 LEU 60 0.101 0.636 0.592 521 HD13 LEU 60 HD13 LEU 60 1.237 0.412 1.906 522 HD21 LEU 60 HD21 LEU 60 -0.609 -2.939 0.031 523 HD22 LEU 60 HD22 LEU 60 -0.973 -1.293 -0.512 524 HD23 LEU 60 HD23 LEU 60 0.626 -2.003 -0.823 525 H SER 61 H SER 61 1.191 -4.292 4.346 526 HA SER 61 HA SER 61 -1.227 -3.826 5.688 527 HB2 SER 61 HB2 SER 61 -0.396 -6.033 5.325 528 HB3 SER 61 HB3 SER 61 1.034 -5.720 6.321 529 HG SER 61 HG SER 61 -0.434 -6.838 7.550 530 H LYS 62 H LYS 62 1.961 -2.889 6.539 531 HA LYS 62 HA LYS 62 1.212 -2.201 9.305 532 HB2 LYS 62 HB2 LYS 62 3.892 -2.477 7.932 533 HB3 LYS 62 HB3 LYS 62 3.726 -1.743 9.530 534 HG2 LYS 62 HG2 LYS 62 2.761 -3.746 10.467 535 HG3 LYS 62 HG3 LYS 62 2.672 -4.531 8.879 536 HD2 LYS 62 HD2 LYS 62 5.079 -4.518 8.653 537 HD3 LYS 62 HD3 LYS 62 5.278 -3.607 10.156 538 HE2 LYS 62 HE2 LYS 62 3.973 -6.364 10.019 539 HE3 LYS 62 HE3 LYS 62 5.712 -6.140 10.241 540 HZ1 LYS 62 HZ1 LYS 62 3.636 -5.096 12.094 541 HZ2 LYS 62 HZ2 LYS 62 4.601 -6.380 12.374 542 HZ3 LYS 62 HZ3 LYS 62 5.249 -4.889 12.272 543 H LYS 63 H LYS 63 2.326 -0.592 6.319 544 HA LYS 63 HA LYS 63 2.783 2.014 7.335 545 HB2 LYS 63 HB2 LYS 63 1.915 0.910 4.644 546 HB3 LYS 63 HB3 LYS 63 2.298 2.615 4.866 547 HG2 LYS 63 HG2 LYS 63 4.400 0.755 5.875 548 HG3 LYS 63 HG3 LYS 63 4.058 0.596 4.150 549 HD2 LYS 63 HD2 LYS 63 4.471 2.949 3.773 550 HD3 LYS 63 HD3 LYS 63 4.751 3.234 5.500 551 HE2 LYS 63 HE2 LYS 63 6.385 1.311 3.787 552 HE3 LYS 63 HE3 LYS 63 6.804 3.013 3.989 553 HZ1 LYS 63 HZ1 LYS 63 6.621 1.064 6.228 554 HZ2 LYS 63 HZ2 LYS 63 8.005 1.637 5.579 555 HZ3 LYS 63 HZ3 LYS 63 7.008 2.645 6.379 556 H LEU 64 H LEU 64 -0.247 0.496 6.291 557 HA LEU 64 HA LEU 64 -1.733 2.970 7.077 558 HB2 LEU 64 HB2 LEU 64 -2.629 0.855 5.096 559 HB3 LEU 64 HB3 LEU 64 -3.431 2.356 5.504 560 HG LEU 64 HG LEU 64 -0.992 3.316 4.717 561 HD11 LEU 64 HD11 LEU 64 -1.546 0.924 2.897 562 HD12 LEU 64 HD12 LEU 64 -0.264 2.148 2.710 563 HD13 LEU 64 HD13 LEU 64 -0.223 0.990 4.054 564 HD21 LEU 64 HD21 LEU 64 -3.183 4.021 3.905 565 HD22 LEU 64 HD22 LEU 64 -2.020 3.821 2.600 566 HD23 LEU 64 HD23 LEU 64 -3.284 2.588 2.856 567 H ASN 65 H ASN 65 -1.001 0.247 8.565 568 HA ASN 65 HA ASN 65 -1.845 -1.081 10.155 569 HB2 ASN 65 HB2 ASN 65 -3.864 1.124 10.708 570 HB3 ASN 65 HB3 ASN 65 -3.239 -0.067 11.839 571 HD21 ASN 65 HD21 ASN 65 -1.177 3.363 11.146 572 HD22 ASN 65 HD22 ASN 65 -2.666 2.995 10.280 573 H ILE 66 H ILE 66 -2.515 -2.324 8.144 574 HA ILE 66 HA ILE 66 -5.429 -2.985 8.152 575 HB ILE 66 HB ILE 66 -4.794 -3.415 5.551 576 HG12 ILE 66 HG12 ILE 66 -3.300 -0.851 6.105 577 HG13 ILE 66 HG13 ILE 66 -2.426 -2.331 5.963 578 HG21 ILE 66 HG21 ILE 66 -5.680 -0.807 6.839 579 HG22 ILE 66 HG22 ILE 66 -5.922 -1.226 5.139 580 HG23 ILE 66 HG23 ILE 66 -6.710 -2.188 6.396 581 HD11 ILE 66 HD11 ILE 66 -4.120 -1.033 3.793 582 HD12 ILE 66 HD12 ILE 66 -2.370 -1.283 3.810 583 HD13 ILE 66 HD13 ILE 66 -3.454 -2.677 3.664 584 H THR 67 H THR 67 -5.371 -5.112 6.382 585 HA THR 67 HA THR 67 -3.727 -7.152 7.813 586 HB THR 67 HB THR 67 -5.184 -8.798 7.257 587 HG1 THR 67 HG1 THR 67 -6.785 -8.554 5.632 588 HG21 THR 67 HG21 THR 67 -7.153 -6.471 7.299 589 HG22 THR 67 HG22 THR 67 -7.447 -8.155 7.778 590 HG23 THR 67 HG23 THR 67 -6.364 -7.143 8.749 591 H VAL 68 H VAL 68 -2.647 -8.810 6.523 592 HA VAL 68 HA VAL 68 -1.165 -7.764 4.279 593 HB VAL 68 HB VAL 68 -1.512 -10.642 5.198 594 HG11 VAL 68 HG11 VAL 68 0.569 -9.403 3.338 595 HG12 VAL 68 HG12 VAL 68 0.643 -11.047 4.005 596 HG13 VAL 68 HG13 VAL 68 -0.647 -10.620 2.885 597 HG21 VAL 68 HG21 VAL 68 -0.489 -9.221 6.943 598 HG22 VAL 68 HG22 VAL 68 0.721 -10.295 6.243 599 HG23 VAL 68 HG23 VAL 68 0.678 -8.586 5.759 600 H GLU 69 H GLU 69 -4.332 -9.308 4.433 601 HA GLU 69 HA GLU 69 -4.238 -10.166 1.595 602 HB2 GLU 69 HB2 GLU 69 -6.463 -10.188 3.679 603 HB3 GLU 69 HB3 GLU 69 -6.631 -10.776 2.026 604 HG2 GLU 69 HG2 GLU 69 -4.715 -11.901 4.119 605 HG3 GLU 69 HG3 GLU 69 -6.256 -12.603 3.649 606 H LYS 70 H LYS 70 -5.670 -7.646 3.648 607 HA LYS 70 HA LYS 70 -7.120 -6.290 1.626 608 HB2 LYS 70 HB2 LYS 70 -7.330 -6.195 4.154 609 HB3 LYS 70 HB3 LYS 70 -5.909 -5.164 4.198 610 HG2 LYS 70 HG2 LYS 70 -8.533 -4.554 2.784 611 HG3 LYS 70 HG3 LYS 70 -8.083 -4.035 4.414 612 HD2 LYS 70 HD2 LYS 70 -6.080 -2.846 3.320 613 HD3 LYS 70 HD3 LYS 70 -6.932 -3.063 1.782 614 HE2 LYS 70 HE2 LYS 70 -8.182 -1.781 4.252 615 HE3 LYS 70 HE3 LYS 70 -7.313 -0.853 3.022 616 HZ1 LYS 70 HZ1 LYS 70 -9.732 -2.486 2.461 617 HZ2 LYS 70 HZ2 LYS 70 -9.698 -0.858 2.605 618 HZ3 LYS 70 HZ3 LYS 70 -8.903 -1.565 1.378 619 H ALA 71 H ALA 71 -3.932 -5.727 3.021 620 HA ALA 71 HA ALA 71 -2.933 -3.695 1.340 621 HB1 ALA 71 HB1 ALA 71 -1.498 -6.005 2.713 622 HB2 ALA 71 HB2 ALA 71 -0.728 -4.552 2.072 623 HB3 ALA 71 HB3 ALA 71 -1.869 -4.419 3.420 624 H LYS 72 H LYS 72 -2.706 -7.291 0.843 625 HA LYS 72 HA LYS 72 -1.141 -7.073 -1.557 626 HB2 LYS 72 HB2 LYS 72 -1.105 -9.016 -0.045 627 HB3 LYS 72 HB3 LYS 72 -2.814 -9.331 -0.350 628 HG2 LYS 72 HG2 LYS 72 -2.376 -9.981 -2.603 629 HG3 LYS 72 HG3 LYS 72 -0.695 -9.430 -2.530 630 HD2 LYS 72 HD2 LYS 72 -1.782 -11.561 -0.637 631 HD3 LYS 72 HD3 LYS 72 -1.219 -11.998 -2.251 632 HE2 LYS 72 HE2 LYS 72 0.499 -10.516 -0.208 633 HE3 LYS 72 HE3 LYS 72 0.431 -12.273 -0.330 634 HZ1 LYS 72 HZ1 LYS 72 1.310 -10.483 -2.535 635 HZ2 LYS 72 HZ2 LYS 72 2.286 -11.410 -1.612 636 HZ3 LYS 72 HZ3 LYS 72 1.220 -12.113 -2.620 637 H ASN 73 H ASN 73 -4.609 -7.068 -0.921 638 HA ASN 73 HA ASN 73 -5.487 -7.594 -3.499 639 HB2 ASN 73 HB2 ASN 73 -7.410 -7.442 -2.379 640 HB3 ASN 73 HB3 ASN 73 -6.633 -6.644 -1.034 641 HD21 ASN 73 HD21 ASN 73 -7.804 -3.416 -1.869 642 HD22 ASN 73 HD22 ASN 73 -6.665 -4.340 -0.889 643 H TYR 74 H TYR 74 -4.215 -4.509 -2.257 644 HA TYR 74 HA TYR 74 -4.772 -2.869 -4.528 645 HB2 TYR 74 HB2 TYR 74 -2.569 -2.654 -2.457 646 HB3 TYR 74 HB3 TYR 74 -3.004 -1.415 -3.619 647 HD1 TYR 74 HD1 TYR 74 -5.597 -0.690 -3.596 648 HD2 TYR 74 HD2 TYR 74 -3.404 -2.424 -0.322 649 HE1 TYR 74 HE1 TYR 74 -7.236 0.284 -1.993 650 HE2 TYR 74 HE2 TYR 74 -5.047 -1.435 1.293 651 HH TYR 74 HH TYR 74 -7.880 0.473 0.197 652 H ILE 75 H ILE 75 -1.971 -4.815 -3.527 653 HA ILE 75 HA ILE 75 -0.282 -4.117 -5.740 654 HB ILE 75 HB ILE 75 -0.161 -6.418 -3.750 655 HG12 ILE 75 HG12 ILE 75 1.233 -3.702 -3.762 656 HG13 ILE 75 HG13 ILE 75 -0.150 -4.096 -2.749 657 HG21 ILE 75 HG21 ILE 75 2.018 -5.322 -5.587 658 HG22 ILE 75 HG22 ILE 75 2.257 -6.547 -4.321 659 HG23 ILE 75 HG23 ILE 75 1.257 -6.926 -5.705 660 HD11 ILE 75 HD11 ILE 75 2.622 -5.297 -2.511 661 HD12 ILE 75 HD12 ILE 75 1.780 -4.230 -1.380 662 HD13 ILE 75 HD13 ILE 75 1.181 -5.879 -1.638 663 H LYS 76 H LYS 76 -2.750 -6.609 -5.358 664 HA LYS 76 HA LYS 76 -1.983 -8.075 -7.768 665 HB2 LYS 76 HB2 LYS 76 -4.399 -8.255 -5.934 666 HB3 LYS 76 HB3 LYS 76 -4.179 -9.245 -7.393 667 HG2 LYS 76 HG2 LYS 76 -1.903 -9.921 -6.468 668 HG3 LYS 76 HG3 LYS 76 -2.394 -9.194 -4.944 669 HD2 LYS 76 HD2 LYS 76 -3.787 -11.502 -6.376 670 HD3 LYS 76 HD3 LYS 76 -2.698 -11.644 -4.993 671 HE2 LYS 76 HE2 LYS 76 -4.295 -10.254 -3.634 672 HE3 LYS 76 HE3 LYS 76 -5.409 -10.246 -5.008 673 HZ1 LYS 76 HZ1 LYS 76 -4.471 -12.693 -3.592 674 HZ2 LYS 76 HZ2 LYS 76 -5.948 -12.027 -3.424 675 HZ3 LYS 76 HZ3 LYS 76 -5.508 -12.687 -4.852 676 H ASN 77 H ASN 77 -4.332 -5.443 -7.119 677 HA ASN 77 HA ASN 77 -5.296 -5.760 -9.901 678 HB2 ASN 77 HB2 ASN 77 -6.864 -4.174 -9.559 679 HB3 ASN 77 HB3 ASN 77 -6.987 -5.253 -8.158 680 HD21 ASN 77 HD21 ASN 77 -6.279 -2.625 -5.871 681 HD22 ASN 77 HD22 ASN 77 -6.112 -4.370 -6.060 682 H SER 78 H SER 78 -3.447 -3.452 -7.848 683 HA SER 78 HA SER 78 -2.740 -2.083 -10.360 684 HB2 SER 78 HB2 SER 78 -3.894 -0.650 -8.700 685 HB3 SER 78 HB3 SER 78 -2.526 -0.889 -7.587 686 HG SER 78 HG SER 78 -2.394 1.025 -8.957 687 H ASN 79 H ASN 79 -0.822 -2.457 -11.146 688 HA ASN 79 HA ASN 79 1.463 -3.257 -9.393 689 HB2 ASN 79 HB2 ASN 79 -0.182 -5.169 -9.926 690 HB3 ASN 79 HB3 ASN 79 0.382 -5.058 -11.596 691 HD21 ASN 79 HD21 ASN 79 2.705 -6.653 -8.631 692 HD22 ASN 79 HD22 ASN 79 1.130 -5.895 -8.327 693 H ARG 80 H ARG 80 0.447 -3.000 -12.815 694 HA ARG 80 HA ARG 80 3.081 -1.755 -13.481 695 HB2 ARG 80 HB2 ARG 80 1.683 -3.985 -14.663 696 HB3 ARG 80 HB3 ARG 80 1.651 -2.682 -15.831 697 HG2 ARG 80 HG2 ARG 80 3.649 -3.930 -16.248 698 HG3 ARG 80 HG3 ARG 80 4.142 -2.405 -15.517 699 HD2 ARG 80 HD2 ARG 80 5.463 -4.025 -14.453 700 HD3 ARG 80 HD3 ARG 80 4.203 -3.674 -13.255 701 HE ARG 80 HE ARG 80 3.208 -5.826 -14.713 702 HH11 ARG 80 HH11 ARG 80 3.465 -7.979 -14.205 703 HH12 ARG 80 HH12 ARG 80 4.800 -8.484 -13.212 704 HH21 ARG 80 HH21 ARG 80 6.101 -5.340 -12.803 705 HH22 ARG 80 HH22 ARG 80 6.262 -7.037 -12.441 706 H LEU 81 H LEU 81 0.590 -0.503 -12.429 707 HA LEU 81 HA LEU 81 0.257 1.634 -14.488 708 HB2 LEU 81 HB2 LEU 81 -1.639 -0.090 -14.235 709 HB3 LEU 81 HB3 LEU 81 -1.980 0.654 -12.680 710 HG LEU 81 HG LEU 81 -2.034 2.042 -15.405 711 HD11 LEU 81 HD11 LEU 81 -4.298 1.162 -13.563 712 HD12 LEU 81 HD12 LEU 81 -4.475 2.014 -15.116 713 HD13 LEU 81 HD13 LEU 81 -3.826 0.367 -15.084 714 HD21 LEU 81 HD21 LEU 81 -1.605 3.750 -13.730 715 HD22 LEU 81 HD22 LEU 81 -3.293 3.848 -14.196 716 HD23 LEU 81 HD23 LEU 81 -2.860 3.076 -12.658 717 H GLY 82 H GLY 82 -0.404 1.051 -10.965 718 HA2 GLY 82 HA2 GLY 82 -0.158 2.506 -9.187 719 HA3 GLY 82 HA3 GLY 82 1.072 3.365 -10.124 720 H ARG 83 H ARG 83 0.568 5.351 -10.838 721 HA ARG 83 HA ARG 83 -2.258 6.374 -10.750 722 HB2 ARG 83 HB2 ARG 83 0.292 7.751 -9.964 723 HB3 ARG 83 HB3 ARG 83 -1.204 8.620 -10.368 724 HG2 ARG 83 HG2 ARG 83 -2.452 7.419 -8.642 725 HG3 ARG 83 HG3 ARG 83 -1.045 6.409 -8.274 726 HD2 ARG 83 HD2 ARG 83 -1.187 8.116 -6.606 727 HD3 ARG 83 HD3 ARG 83 0.233 8.384 -7.621 728 HE ARG 83 HE ARG 83 -0.632 10.401 -8.348 729 HH11 ARG 83 HH11 ARG 83 -1.994 12.143 -8.369 730 HH12 ARG 83 HH12 ARG 83 -3.582 12.018 -7.674 731 HH21 ARG 83 HH21 ARG 83 -3.262 8.738 -6.732 732 HH22 ARG 83 HH22 ARG 83 -4.288 10.146 -6.775 733 H THR 84 H THR 84 0.537 7.978 -12.137 734 HA THR 84 HA THR 84 -0.126 7.280 -14.899 735 HB THR 84 HB THR 84 -1.758 8.927 -14.738 736 HG1 THR 84 HG1 THR 84 -1.005 10.441 -16.180 737 HG21 THR 84 HG21 THR 84 0.214 10.876 -13.482 738 HG22 THR 84 HG22 THR 84 -1.443 11.236 -14.004 739 HG23 THR 84 HG23 THR 84 -1.171 10.104 -12.673 740 H ASN 85 H ASN 85 1.791 6.694 -15.520 741 HA ASN 85 HA ASN 85 4.162 8.448 -15.347 742 HB2 ASN 85 HB2 ASN 85 5.489 6.692 -14.144 743 HB3 ASN 85 HB3 ASN 85 4.218 7.397 -13.162 744 HD21 ASN 85 HD21 ASN 85 2.410 4.368 -12.800 745 HD22 ASN 85 HD22 ASN 85 2.616 6.057 -12.341 746 H ASN 86 H ASN 86 2.490 5.858 -16.922 747 HA ASN 86 HA ASN 86 4.829 4.901 -18.420 748 HB2 ASN 86 HB2 ASN 86 3.030 3.364 -17.616 749 HB3 ASN 86 HB3 ASN 86 1.871 4.209 -18.648 750 HD21 ASN 86 HD21 ASN 86 2.659 1.952 -21.247 751 HD22 ASN 86 HD22 ASN 86 1.415 2.782 -20.325 752 H LEU 87 H LEU 87 4.865 4.896 -20.777 753 HA LEU 87 HA LEU 87 5.029 5.912 -22.744 754 HB2 LEU 87 HB2 LEU 87 2.286 5.959 -22.256 755 HB3 LEU 87 HB3 LEU 87 2.641 7.633 -22.634 756 HG LEU 87 HG LEU 87 3.804 6.778 -24.760 757 HD11 LEU 87 HD11 LEU 87 2.365 4.196 -23.981 758 HD12 LEU 87 HD12 LEU 87 3.154 4.519 -25.539 759 HD13 LEU 87 HD13 LEU 87 4.126 4.403 -24.068 760 HD21 LEU 87 HD21 LEU 87 1.538 7.735 -24.809 761 HD22 LEU 87 HD22 LEU 87 1.677 6.395 -25.955 762 HD23 LEU 87 HD23 LEU 87 0.843 6.151 -24.403 763 H LYS 88 H LYS 88 5.136 8.062 -23.907 764 HA LYS 88 HA LYS 88 6.589 10.012 -22.171 765 HB2 LYS 88 HB2 LYS 88 7.932 10.505 -24.192 766 HB3 LYS 88 HB3 LYS 88 8.107 8.851 -23.609 767 HG2 LYS 88 HG2 LYS 88 6.679 7.978 -25.363 768 HG3 LYS 88 HG3 LYS 88 6.242 9.616 -25.897 769 HD2 LYS 88 HD2 LYS 88 8.622 10.047 -26.495 770 HD3 LYS 88 HD3 LYS 88 9.037 8.389 -26.003 771 HE2 LYS 88 HE2 LYS 88 7.487 7.486 -27.711 772 HE3 LYS 88 HE3 LYS 88 7.020 9.127 -28.175 773 HZ1 LYS 88 HZ1 LYS 88 9.760 8.002 -28.439 774 HZ2 LYS 88 HZ2 LYS 88 8.715 8.237 -29.669 775 HZ3 LYS 88 HZ3 LYS 88 9.325 9.519 -28.866 776 H THR 89 H THR 89 3.678 9.746 -23.399 777 HA THR 89 HA THR 89 3.244 12.568 -23.382 778 HB THR 89 HB THR 89 3.712 12.289 -25.771 779 HG1 THR 89 HG1 THR 89 1.829 13.304 -26.431 780 HG21 THR 89 HG21 THR 89 1.209 10.563 -25.955 781 HG22 THR 89 HG22 THR 89 2.307 11.042 -27.268 782 HG23 THR 89 HG23 THR 89 2.861 9.905 -26.023 783 H ILE 90 H ILE 90 1.614 12.773 -22.052 784 HA ILE 90 HA ILE 90 -0.690 10.910 -22.107 785 HB ILE 90 HB ILE 90 -0.605 11.152 -19.538 786 HG12 ILE 90 HG12 ILE 90 1.297 12.861 -19.565 787 HG13 ILE 90 HG13 ILE 90 1.220 11.623 -18.328 788 HG21 ILE 90 HG21 ILE 90 1.391 9.332 -20.904 789 HG22 ILE 90 HG22 ILE 90 0.707 9.123 -19.281 790 HG23 ILE 90 HG23 ILE 90 -0.345 9.042 -20.702 791 HD11 ILE 90 HD11 ILE 90 3.105 11.504 -20.721 792 HD12 ILE 90 HD12 ILE 90 3.517 11.998 -19.075 793 HD13 ILE 90 HD13 ILE 90 3.008 10.334 -19.386 794 H GLY 91 H GLY 91 -0.005 14.007 -22.639 795 HA2 GLY 91 HA2 GLY 91 -1.136 16.008 -22.460 796 HA3 GLY 91 HA3 GLY 91 -2.551 15.118 -21.889 797 H ILE 92 H ILE 92 0.138 14.507 -19.938 798 HA ILE 92 HA ILE 92 0.619 14.905 -17.776 799 HB ILE 92 HB ILE 92 0.594 17.838 -18.543 800 HG12 ILE 92 HG12 ILE 92 3.143 17.246 -18.982 801 HG13 ILE 92 HG13 ILE 92 2.553 15.620 -19.277 802 HG21 ILE 92 HG21 ILE 92 2.352 16.222 -16.626 803 HG22 ILE 92 HG22 ILE 92 2.497 17.960 -16.970 804 HG23 ILE 92 HG23 ILE 92 1.089 17.361 -16.130 805 HD11 ILE 92 HD11 ILE 92 1.604 18.127 -20.752 806 HD12 ILE 92 HD12 ILE 92 2.912 17.066 -21.306 807 HD13 ILE 92 HD13 ILE 92 1.269 16.440 -21.214 808 H LEU 93 H LEU 93 -1.967 14.286 -17.980 809 HA LEU 93 HA LEU 93 -3.995 14.299 -17.043 810 HB2 LEU 93 HB2 LEU 93 -2.253 13.778 -15.185 811 HB3 LEU 93 HB3 LEU 93 -2.669 15.357 -14.540 812 HG LEU 93 HG LEU 93 -5.086 14.547 -14.350 813 HD11 LEU 93 HD11 LEU 93 -3.822 11.861 -15.052 814 HD12 LEU 93 HD12 LEU 93 -5.454 12.096 -14.391 815 HD13 LEU 93 HD13 LEU 93 -5.065 12.713 -15.996 816 HD21 LEU 93 HD21 LEU 93 -3.539 14.529 -12.435 817 HD22 LEU 93 HD22 LEU 93 -4.654 13.155 -12.379 818 HD23 LEU 93 HD23 LEU 93 -2.971 12.910 -12.898 819 H GLN 94 H GLN 94 -3.386 16.796 -18.406 820 HA GLN 94 HA GLN 94 -5.163 18.750 -17.002 821 HB2 GLN 94 HB2 GLN 94 -2.475 19.029 -18.340 822 HB3 GLN 94 HB3 GLN 94 -3.587 20.411 -18.323 823 HG2 GLN 94 HG2 GLN 94 -3.693 20.460 -15.938 824 HG3 GLN 94 HG3 GLN 94 -2.884 18.901 -15.786 825 HE21 GLN 94 HE21 GLN 94 0.405 20.198 -16.284 826 HE22 GLN 94 HE22 GLN 94 -0.607 18.746 -16.370 827 H GLU 95 H GLU 95 -6.598 17.151 -18.325 828 HA GLU 95 HA GLU 95 -7.171 17.976 -21.071 829 HB2 GLU 95 HB2 GLU 95 -7.611 15.693 -20.024 830 HB3 GLU 95 HB3 GLU 95 -8.955 16.436 -19.147 831 HG2 GLU 95 HG2 GLU 95 -10.035 17.025 -21.298 832 HG3 GLU 95 HG3 GLU 95 -8.641 16.399 -22.185 833 H GLU 96 H GLU 96 -9.111 19.127 -21.743 834 HA GLU 96 HA GLU 96 -9.978 21.215 -19.794 835 HB2 GLU 96 HB2 GLU 96 -8.566 22.000 -21.637 836 HB3 GLU 96 HB3 GLU 96 -9.730 21.376 -22.814 837 HG2 GLU 96 HG2 GLU 96 -11.443 22.935 -22.005 838 HG3 GLU 96 HG3 GLU 96 -10.413 23.428 -20.661 839 H VAL 97 H VAL 97 -11.787 20.730 -18.959 840 HA VAL 97 HA VAL 97 -14.144 20.183 -20.706 841 HB VAL 97 HB VAL 97 -13.703 19.064 -17.917 842 HG11 VAL 97 HG11 VAL 97 -15.989 18.653 -19.894 843 HG12 VAL 97 HG12 VAL 97 -15.805 17.830 -18.329 844 HG13 VAL 97 HG13 VAL 97 -16.084 19.573 -18.378 845 HG21 VAL 97 HG21 VAL 97 -12.343 17.822 -19.531 846 HG22 VAL 97 HG22 VAL 97 -13.727 16.845 -19.038 847 HG23 VAL 97 HG23 VAL 97 -13.737 17.658 -20.621 848 H SER 98 H SER 98 -14.777 22.256 -20.845 849 HA SER 98 HA SER 98 -16.315 23.409 -18.777 850 HB2 SER 98 HB2 SER 98 -14.121 24.021 -17.798 851 HB3 SER 98 HB3 SER 98 -13.671 24.846 -19.298 852 HG SER 98 HG SER 98 -14.490 26.266 -17.646 853 H SER 99 H SER 99 -14.423 24.031 -21.733 854 HA SER 99 HA SER 99 -16.803 25.276 -23.009 855 HB2 SER 99 HB2 SER 99 -15.314 27.096 -22.211 856 HB3 SER 99 HB3 SER 99 -13.981 26.404 -23.156 857 HG SER 99 HG SER 99 -15.116 28.089 -24.266 858 H MET 100 H MET 100 -17.221 24.395 -24.874 859 HA MET 100 HA MET 100 -17.155 23.150 -26.768 860 HB2 MET 100 HB2 MET 100 -14.529 24.624 -27.094 861 HB3 MET 100 HB3 MET 100 -15.391 23.772 -28.387 862 HG2 MET 100 HG2 MET 100 -17.373 25.194 -28.032 863 HG3 MET 100 HG3 MET 100 -16.517 26.105 -26.789 864 HE1 MET 100 HE1 MET 100 -13.659 26.714 -27.805 865 HE2 MET 100 HE2 MET 100 -13.935 28.217 -28.711 866 HE3 MET 100 HE3 MET 100 -14.791 27.935 -27.180 867 H GLU 101 H GLU 101 -16.666 21.555 -24.772 868 HA GLU 101 HA GLU 101 -14.326 19.838 -25.237 869 HB2 GLU 101 HB2 GLU 101 -15.040 18.660 -23.246 870 HB3 GLU 101 HB3 GLU 101 -14.956 20.388 -22.953 871 HG2 GLU 101 HG2 GLU 101 -17.612 19.079 -23.650 872 HG3 GLU 101 HG3 GLU 101 -16.958 18.988 -22.025 873 H ALA 102 H ALA 102 -17.013 20.007 -26.987 874 HA ALA 102 HA ALA 102 -17.986 17.291 -27.039 875 HB1 ALA 102 HB1 ALA 102 -18.383 19.606 -28.981 876 HB2 ALA 102 HB2 ALA 102 -19.358 18.124 -28.908 877 HB3 ALA 102 HB3 ALA 102 -19.381 19.261 -27.549 878 H LYS 103 H LYS 103 -18.112 15.984 -28.996 879 HA LYS 103 HA LYS 103 -15.574 15.863 -30.593 880 HB2 LYS 103 HB2 LYS 103 -17.360 13.626 -29.564 881 HB3 LYS 103 HB3 LYS 103 -16.082 13.405 -30.765 882 HG2 LYS 103 HG2 LYS 103 -14.376 14.177 -29.177 883 HG3 LYS 103 HG3 LYS 103 -15.615 14.530 -27.968 884 HD2 LYS 103 HD2 LYS 103 -14.531 12.446 -27.421 885 HD3 LYS 103 HD3 LYS 103 -16.222 12.145 -27.846 886 HE2 LYS 103 HE2 LYS 103 -15.528 11.399 -30.110 887 HE3 LYS 103 HE3 LYS 103 -13.839 11.756 -29.719 888 HZ1 LYS 103 HZ1 LYS 103 -15.518 9.731 -28.331 889 HZ2 LYS 103 HZ2 LYS 103 -14.349 9.398 -29.420 890 HZ3 LYS 103 HZ3 LYS 103 -13.955 10.053 -27.980 891 H SER 104 H SER 104 -15.693 15.157 -32.755 892 HA SER 104 HA SER 104 -17.994 16.180 -34.220 893 HB2 SER 104 HB2 SER 104 -16.580 15.572 -36.206 894 HB3 SER 104 HB3 SER 104 -15.835 16.699 -35.059 895 HG SER 104 HG SER 104 -14.389 15.022 -35.700 896 H MET 105 H MET 105 -16.393 12.995 -34.086 897 HA MET 105 HA MET 105 -17.010 10.882 -34.636 898 HB2 MET 105 HB2 MET 105 -19.778 11.761 -33.747 899 HB3 MET 105 HB3 MET 105 -19.241 10.095 -33.959 900 HG2 MET 105 HG2 MET 105 -17.429 10.463 -32.297 901 HG3 MET 105 HG3 MET 105 -18.066 12.075 -31.971 902 HE1 MET 105 HE1 MET 105 -21.206 11.772 -31.852 903 HE2 MET 105 HE2 MET 105 -21.411 11.409 -30.126 904 HE3 MET 105 HE3 MET 105 -20.210 12.614 -30.640 905 H THR 106 H THR 106 -19.269 9.707 -35.788 906 HA THR 106 HA THR 106 -19.727 11.007 -38.385 907 HB THR 106 HB THR 106 -17.592 9.745 -38.620 908 HG1 THR 106 HG1 THR 106 -18.213 8.828 -40.552 909 HG21 THR 106 HG21 THR 106 -19.326 7.250 -38.343 910 HG22 THR 106 HG22 THR 106 -17.610 7.316 -38.796 911 HG23 THR 106 HG23 THR 106 -18.107 7.787 -37.164 912 H TRP 107 H TRP 107 -21.148 9.795 -39.736 913 HA TRP 107 HA TRP 107 -23.419 8.639 -38.188 914 HB2 TRP 107 HB2 TRP 107 -23.423 10.607 -40.491 915 HB3 TRP 107 HB3 TRP 107 -24.842 9.687 -40.021 916 HD1 TRP 107 HD1 TRP 107 -26.263 10.523 -38.089 917 HE1 TRP 107 HE1 TRP 107 -26.195 12.503 -36.455 918 HE3 TRP 107 HE3 TRP 107 -21.567 12.291 -39.149 919 HZ2 TRP 107 HZ2 TRP 107 -24.312 14.532 -35.645 920 HZ3 TRP 107 HZ3 TRP 107 -20.643 14.221 -37.886 921 HH2 TRP 107 HH2 TRP 107 -22.000 15.347 -36.136 Start of MODEL 7 1 H1 GLY -5 H1 GLY -5 15.485 -43.559 -41.374 2 H2 GLY -5 H2 GLY -5 14.842 -44.395 -40.121 3 H3 GLY -5 H3 GLY -5 16.284 -44.847 -40.756 4 HA2 GLY -5 HA2 GLY -5 16.648 -43.731 -38.669 5 HA3 GLY -5 HA3 GLY -5 17.322 -42.805 -40.021 6 H SER -4 H SER -4 17.169 -40.806 -38.997 7 HA SER -4 HA SER -4 14.698 -39.942 -37.711 8 HB2 SER -4 HB2 SER -4 17.310 -38.452 -38.120 9 HB3 SER -4 HB3 SER -4 16.005 -38.025 -36.997 10 HG SER -4 HG SER -4 17.704 -39.181 -35.961 11 H HIS -3 H HIS -3 15.540 -39.775 -40.954 12 HA HIS -3 HA HIS -3 14.827 -37.023 -41.528 13 HB2 HIS -3 HB2 HIS -3 16.412 -38.382 -42.865 14 HB3 HIS -3 HB3 HIS -3 15.077 -39.394 -43.413 15 HD2 HIS -3 HD2 HIS -3 13.325 -38.277 -45.174 16 HE1 HIS -3 HE1 HIS -3 15.598 -34.756 -45.985 17 HE2 HIS -3 HE2 HIS -3 13.610 -36.163 -46.729 18 H MET -2 H MET -2 12.842 -36.303 -41.162 19 HA MET -2 HA MET -2 10.568 -37.307 -42.691 20 HB2 MET -2 HB2 MET -2 9.068 -37.621 -40.811 21 HB3 MET -2 HB3 MET -2 10.433 -38.718 -40.640 22 HG2 MET -2 HG2 MET -2 11.467 -37.167 -38.993 23 HG3 MET -2 HG3 MET -2 10.091 -36.072 -39.171 24 HE1 MET -2 HE1 MET -2 9.601 -35.957 -36.636 25 HE2 MET -2 HE2 MET -2 9.499 -37.378 -35.574 26 HE3 MET -2 HE3 MET -2 11.042 -36.963 -36.355 27 H ALA -1 H ALA -1 8.697 -35.906 -42.593 28 HA ALA -1 HA ALA -1 9.198 -33.255 -41.437 29 HB1 ALA -1 HB1 ALA -1 8.371 -33.670 -44.344 30 HB2 ALA -1 HB2 ALA -1 8.455 -32.107 -43.504 31 HB3 ALA -1 HB3 ALA -1 9.940 -33.044 -43.779 32 H SER 0 H SER 0 7.532 -32.203 -40.679 33 HA SER 0 HA SER 0 4.720 -33.056 -41.014 34 HB2 SER 0 HB2 SER 0 6.313 -33.189 -38.425 35 HB3 SER 0 HB3 SER 0 4.533 -33.146 -38.472 36 HG SER 0 HG SER 0 5.319 -35.288 -38.359 37 H MET 1 H MET 1 3.270 -31.428 -40.426 38 HA MET 1 HA MET 1 4.282 -28.881 -39.297 39 HB2 MET 1 HB2 MET 1 4.492 -28.861 -41.835 40 HB3 MET 1 HB3 MET 1 2.738 -28.961 -41.918 41 HG2 MET 1 HG2 MET 1 3.402 -26.655 -42.154 42 HG3 MET 1 HG3 MET 1 2.589 -26.832 -40.610 43 HE1 MET 1 HE1 MET 1 5.832 -25.943 -42.519 44 HE2 MET 1 HE2 MET 1 7.091 -25.957 -41.267 45 HE3 MET 1 HE3 MET 1 6.377 -27.486 -41.820 46 H ASP 2 H ASP 2 2.996 -30.279 -37.644 47 HA ASP 2 HA ASP 2 0.184 -29.298 -37.547 48 HB2 ASP 2 HB2 ASP 2 1.131 -32.144 -37.034 49 HB3 ASP 2 HB3 ASP 2 -0.450 -31.529 -36.575 50 HA PRO 3 HA PRO 3 1.411 -28.477 -33.327 51 HB2 PRO 3 HB2 PRO 3 -0.939 -27.685 -32.202 52 HB3 PRO 3 HB3 PRO 3 -0.147 -26.743 -33.502 53 HG2 PRO 3 HG2 PRO 3 -2.405 -28.748 -33.769 54 HG3 PRO 3 HG3 PRO 3 -2.295 -27.108 -34.471 55 HD2 PRO 3 HD2 PRO 3 -1.641 -29.392 -35.867 56 HD3 PRO 3 HD3 PRO 3 -0.839 -27.820 -36.150 57 H LEU 4 H LEU 4 -0.484 -31.113 -34.069 58 HA LEU 4 HA LEU 4 -0.793 -31.991 -31.268 59 HB2 LEU 4 HB2 LEU 4 -2.147 -32.873 -33.838 60 HB3 LEU 4 HB3 LEU 4 -2.441 -33.647 -32.287 61 HG LEU 4 HG LEU 4 -2.963 -30.697 -32.779 62 HD11 LEU 4 HD11 LEU 4 -4.902 -33.039 -32.800 63 HD12 LEU 4 HD12 LEU 4 -5.335 -31.319 -32.908 64 HD13 LEU 4 HD13 LEU 4 -4.407 -32.076 -34.210 65 HD21 LEU 4 HD21 LEU 4 -2.660 -31.292 -30.382 66 HD22 LEU 4 HD22 LEU 4 -4.328 -30.844 -30.746 67 HD23 LEU 4 HD23 LEU 4 -3.904 -32.555 -30.559 68 H ASP 5 H ASP 5 1.797 -32.177 -32.053 69 HA ASP 5 HA ASP 5 2.262 -35.130 -32.211 70 HB2 ASP 5 HB2 ASP 5 4.007 -32.724 -32.795 71 HB3 ASP 5 HB3 ASP 5 4.715 -34.303 -32.505 72 H LYS 6 H LYS 6 1.815 -32.985 -29.845 73 HA LYS 6 HA LYS 6 3.866 -34.185 -28.000 74 HB2 LYS 6 HB2 LYS 6 3.138 -31.273 -27.700 75 HB3 LYS 6 HB3 LYS 6 4.535 -32.161 -27.140 76 HG2 LYS 6 HG2 LYS 6 5.533 -31.027 -28.841 77 HG3 LYS 6 HG3 LYS 6 5.006 -32.441 -29.750 78 HD2 LYS 6 HD2 LYS 6 4.409 -30.557 -31.077 79 HD3 LYS 6 HD3 LYS 6 2.888 -31.097 -30.349 80 HE2 LYS 6 HE2 LYS 6 3.161 -29.351 -28.564 81 HE3 LYS 6 HE3 LYS 6 4.637 -28.798 -29.362 82 HZ1 LYS 6 HZ1 LYS 6 1.942 -28.824 -30.621 83 HZ2 LYS 6 HZ2 LYS 6 2.671 -27.489 -30.004 84 HZ3 LYS 6 HZ3 LYS 6 3.314 -28.233 -31.307 85 H ILE 7 H ILE 7 1.020 -32.083 -27.875 86 HA ILE 7 HA ILE 7 0.149 -33.359 -25.333 87 HB ILE 7 HB ILE 7 -1.082 -31.249 -24.912 88 HG12 ILE 7 HG12 ILE 7 -0.383 -29.184 -26.068 89 HG13 ILE 7 HG13 ILE 7 0.488 -30.116 -27.279 90 HG21 ILE 7 HG21 ILE 7 1.921 -30.943 -25.331 91 HG22 ILE 7 HG22 ILE 7 0.900 -30.024 -24.207 92 HG23 ILE 7 HG23 ILE 7 1.141 -31.759 -23.959 93 HD11 ILE 7 HD11 ILE 7 -2.523 -30.270 -26.815 94 HD12 ILE 7 HD12 ILE 7 -1.729 -29.259 -28.037 95 HD13 ILE 7 HD13 ILE 7 -1.610 -31.018 -28.154 96 H ILE 8 H ILE 8 -0.439 -34.020 -28.319 97 HA ILE 8 HA ILE 8 -3.135 -33.875 -28.885 98 HB ILE 8 HB ILE 8 -1.451 -34.817 -30.360 99 HG12 ILE 8 HG12 ILE 8 -3.840 -36.653 -29.905 100 HG13 ILE 8 HG13 ILE 8 -3.842 -35.128 -30.799 101 HG21 ILE 8 HG21 ILE 8 -1.622 -37.433 -28.819 102 HG22 ILE 8 HG22 ILE 8 -0.595 -37.058 -30.217 103 HG23 ILE 8 HG23 ILE 8 -0.279 -36.286 -28.664 104 HD11 ILE 8 HD11 ILE 8 -2.378 -37.682 -31.587 105 HD12 ILE 8 HD12 ILE 8 -3.813 -36.984 -32.349 106 HD13 ILE 8 HD13 ILE 8 -2.264 -36.134 -32.459 107 H ASN 9 H ASN 9 -4.979 -34.652 -28.185 108 HA ASN 9 HA ASN 9 -5.157 -36.816 -26.165 109 HB2 ASN 9 HB2 ASN 9 -4.582 -34.524 -25.109 110 HB3 ASN 9 HB3 ASN 9 -6.219 -34.035 -25.550 111 HD21 ASN 9 HD21 ASN 9 -7.717 -36.198 -23.060 112 HD22 ASN 9 HD22 ASN 9 -7.965 -35.636 -24.726 113 H ASP 10 H ASP 10 -6.066 -37.120 -28.668 114 HA ASP 10 HA ASP 10 -8.978 -36.557 -28.587 115 HB2 ASP 10 HB2 ASP 10 -7.093 -37.157 -30.883 116 HB3 ASP 10 HB3 ASP 10 -8.840 -36.982 -31.068 117 H ILE 11 H ILE 11 -7.376 -38.869 -27.420 118 HA ILE 11 HA ILE 11 -9.323 -40.984 -27.980 119 HB ILE 11 HB ILE 11 -7.550 -41.098 -29.768 120 HG12 ILE 11 HG12 ILE 11 -7.090 -43.433 -29.823 121 HG13 ILE 11 HG13 ILE 11 -7.444 -43.642 -28.118 122 HG21 ILE 11 HG21 ILE 11 -5.629 -41.875 -27.540 123 HG22 ILE 11 HG22 ILE 11 -5.292 -41.866 -29.279 124 HG23 ILE 11 HG23 ILE 11 -5.615 -40.345 -28.442 125 HD11 ILE 11 HD11 ILE 11 -9.463 -42.738 -30.222 126 HD12 ILE 11 HD12 ILE 11 -9.286 -44.395 -29.610 127 HD13 ILE 11 HD13 ILE 11 -9.819 -43.111 -28.516 128 H LYS 12 H LYS 12 -8.887 -39.481 -25.712 129 HA LYS 12 HA LYS 12 -8.301 -41.683 -23.784 130 HB2 LYS 12 HB2 LYS 12 -6.448 -39.821 -24.143 131 HB3 LYS 12 HB3 LYS 12 -7.474 -38.849 -23.107 132 HG2 LYS 12 HG2 LYS 12 -6.139 -41.510 -22.457 133 HG3 LYS 12 HG3 LYS 12 -5.699 -39.908 -21.853 134 HD2 LYS 12 HD2 LYS 12 -8.051 -39.836 -20.802 135 HD3 LYS 12 HD3 LYS 12 -8.136 -41.573 -21.118 136 HE2 LYS 12 HE2 LYS 12 -5.995 -40.152 -19.481 137 HE3 LYS 12 HE3 LYS 12 -7.405 -40.977 -18.813 138 HZ1 LYS 12 HZ1 LYS 12 -5.249 -42.299 -20.376 139 HZ2 LYS 12 HZ2 LYS 12 -5.471 -42.425 -18.767 140 HZ3 LYS 12 HZ3 LYS 12 -6.574 -43.058 -19.788 141 H LYS 13 H LYS 13 -9.716 -38.489 -24.080 142 HA LYS 13 HA LYS 13 -11.219 -37.235 -22.915 143 HB2 LYS 13 HB2 LYS 13 -12.632 -39.900 -22.713 144 HB3 LYS 13 HB3 LYS 13 -13.225 -38.498 -21.850 145 HG2 LYS 13 HG2 LYS 13 -14.414 -38.712 -23.903 146 HG3 LYS 13 HG3 LYS 13 -13.468 -37.224 -23.911 147 HD2 LYS 13 HD2 LYS 13 -11.852 -38.188 -25.467 148 HD3 LYS 13 HD3 LYS 13 -12.564 -39.796 -25.272 149 HE2 LYS 13 HE2 LYS 13 -13.284 -38.889 -27.387 150 HE3 LYS 13 HE3 LYS 13 -14.670 -39.016 -26.304 151 HZ1 LYS 13 HZ1 LYS 13 -13.177 -36.502 -26.861 152 HZ2 LYS 13 HZ2 LYS 13 -14.630 -36.891 -27.489 153 HZ3 LYS 13 HZ3 LYS 13 -14.490 -36.622 -25.889 154 H GLU 14 H GLU 14 -11.042 -36.155 -21.098 155 HA GLU 14 HA GLU 14 -10.521 -37.547 -18.515 156 HB2 GLU 14 HB2 GLU 14 -8.803 -35.301 -19.651 157 HB3 GLU 14 HB3 GLU 14 -8.748 -35.890 -17.984 158 HG2 GLU 14 HG2 GLU 14 -8.226 -38.189 -18.897 159 HG3 GLU 14 HG3 GLU 14 -7.986 -37.434 -20.481 160 H ALA 15 H ALA 15 -10.817 -36.244 -16.638 161 HA ALA 15 HA ALA 15 -12.920 -34.174 -16.901 162 HB1 ALA 15 HB1 ALA 15 -11.853 -35.677 -14.481 163 HB2 ALA 15 HB2 ALA 15 -13.246 -34.572 -14.508 164 HB3 ALA 15 HB3 ALA 15 -13.309 -36.100 -15.414 165 H ASN 16 H ASN 16 -12.834 -32.384 -15.302 166 HA ASN 16 HA ASN 16 -10.145 -31.067 -15.219 167 HB2 ASN 16 HB2 ASN 16 -12.959 -30.006 -15.658 168 HB3 ASN 16 HB3 ASN 16 -11.610 -28.955 -15.235 169 HD21 ASN 16 HD21 ASN 16 -11.769 -28.675 -18.846 170 HD22 ASN 16 HD22 ASN 16 -12.675 -28.150 -17.433 171 H ASP 17 H ASP 17 -9.723 -29.607 -13.484 172 HA ASP 17 HA ASP 17 -10.746 -30.447 -10.855 173 HB2 ASP 17 HB2 ASP 17 -8.658 -28.402 -11.693 174 HB3 ASP 17 HB3 ASP 17 -9.092 -28.755 -10.024 175 H SER 18 H SER 18 -11.742 -29.092 -9.324 176 HA SER 18 HA SER 18 -13.536 -27.058 -10.490 177 HB2 SER 18 HB2 SER 18 -14.873 -27.453 -8.441 178 HB3 SER 18 HB3 SER 18 -14.561 -28.938 -9.357 179 HG SER 18 HG SER 18 -14.194 -29.209 -7.096 180 H GLY 19 H GLY 19 -10.626 -26.786 -8.981 181 HA2 GLY 19 HA2 GLY 19 -10.992 -23.951 -8.805 182 HA3 GLY 19 HA3 GLY 19 -10.879 -24.635 -7.178 183 H VAL 20 H VAL 20 -9.169 -23.690 -9.987 184 HA VAL 20 HA VAL 20 -6.540 -24.417 -8.802 185 HB VAL 20 HB VAL 20 -7.444 -26.197 -10.339 186 HG11 VAL 20 HG11 VAL 20 -6.861 -24.210 -12.568 187 HG12 VAL 20 HG12 VAL 20 -7.318 -25.917 -12.746 188 HG13 VAL 20 HG13 VAL 20 -8.470 -24.762 -12.060 189 HG21 VAL 20 HG21 VAL 20 -5.036 -26.014 -9.800 190 HG22 VAL 20 HG22 VAL 20 -5.390 -26.759 -11.367 191 HG23 VAL 20 HG23 VAL 20 -4.797 -25.095 -11.304 192 H THR 21 H THR 21 -8.100 -21.851 -9.364 193 HA THR 21 HA THR 21 -6.057 -20.408 -11.011 194 HB THR 21 HB THR 21 -8.972 -19.773 -11.241 195 HG1 THR 21 HG1 THR 21 -9.055 -21.099 -13.044 196 HG21 THR 21 HG21 THR 21 -6.567 -19.440 -13.087 197 HG22 THR 21 HG22 THR 21 -8.237 -18.991 -13.502 198 HG23 THR 21 HG23 THR 21 -7.398 -18.137 -12.203 199 H LEU 22 H LEU 22 -5.779 -18.222 -10.687 200 HA LEU 22 HA LEU 22 -6.462 -17.271 -7.988 201 HB2 LEU 22 HB2 LEU 22 -4.456 -16.029 -8.022 202 HB3 LEU 22 HB3 LEU 22 -4.096 -17.676 -8.507 203 HG LEU 22 HG LEU 22 -4.461 -15.518 -10.625 204 HD11 LEU 22 HD11 LEU 22 -1.909 -16.133 -9.081 205 HD12 LEU 22 HD12 LEU 22 -2.037 -15.090 -10.518 206 HD13 LEU 22 HD13 LEU 22 -2.844 -14.619 -9.017 207 HD21 LEU 22 HD21 LEU 22 -4.245 -17.822 -11.476 208 HD22 LEU 22 HD22 LEU 22 -2.794 -16.902 -11.844 209 HD23 LEU 22 HD23 LEU 22 -2.776 -18.061 -10.501 210 H ALA 23 H ALA 23 -8.424 -16.944 -9.913 211 HA ALA 23 HA ALA 23 -8.541 -13.992 -10.374 212 HB1 ALA 23 HB1 ALA 23 -9.918 -16.311 -11.773 213 HB2 ALA 23 HB2 ALA 23 -10.197 -14.594 -12.129 214 HB3 ALA 23 HB3 ALA 23 -8.593 -15.309 -12.407 215 HA PRO 24 HA PRO 24 -11.759 -14.177 -7.236 216 HB2 PRO 24 HB2 PRO 24 -12.680 -11.610 -7.244 217 HB3 PRO 24 HB3 PRO 24 -11.072 -12.073 -6.608 218 HG2 PRO 24 HG2 PRO 24 -11.738 -10.966 -9.353 219 HG3 PRO 24 HG3 PRO 24 -10.466 -10.426 -8.217 220 HD2 PRO 24 HD2 PRO 24 -9.943 -12.136 -10.276 221 HD3 PRO 24 HD3 PRO 24 -9.094 -12.278 -8.717 222 H LEU 25 H LEU 25 -12.601 -12.712 -10.401 223 HA LEU 25 HA LEU 25 -15.032 -14.334 -10.576 224 HB2 LEU 25 HB2 LEU 25 -15.494 -12.101 -9.259 225 HB3 LEU 25 HB3 LEU 25 -15.441 -11.336 -10.833 226 HG LEU 25 HG LEU 25 -17.293 -13.602 -9.946 227 HD11 LEU 25 HD11 LEU 25 -17.869 -10.667 -10.523 228 HD12 LEU 25 HD12 LEU 25 -19.060 -11.898 -10.044 229 HD13 LEU 25 HD13 LEU 25 -17.788 -11.417 -8.913 230 HD21 LEU 25 HD21 LEU 25 -16.983 -13.810 -12.362 231 HD22 LEU 25 HD22 LEU 25 -18.583 -13.156 -12.023 232 HD23 LEU 25 HD23 LEU 25 -17.291 -12.069 -12.579 233 H SER 26 H SER 26 -13.526 -15.160 -12.202 234 HA SER 26 HA SER 26 -12.731 -15.424 -14.319 235 HB2 SER 26 HB2 SER 26 -15.367 -14.073 -14.972 236 HB3 SER 26 HB3 SER 26 -14.435 -15.120 -16.062 237 HG SER 26 HG SER 26 -16.103 -16.267 -14.970 238 H VAL 27 H VAL 27 -11.494 -13.237 -13.245 239 HA VAL 27 HA VAL 27 -10.717 -11.662 -15.607 240 HB VAL 27 HB VAL 27 -12.716 -10.560 -14.566 241 HG11 VAL 27 HG11 VAL 27 -10.870 -9.868 -12.253 242 HG12 VAL 27 HG12 VAL 27 -12.542 -9.322 -12.493 243 HG13 VAL 27 HG13 VAL 27 -12.212 -11.028 -12.165 244 HG21 VAL 27 HG21 VAL 27 -11.135 -9.238 -15.905 245 HG22 VAL 27 HG22 VAL 27 -11.857 -8.286 -14.603 246 HG23 VAL 27 HG23 VAL 27 -10.191 -8.865 -14.437 247 HA PRO 28 HA PRO 28 -6.905 -12.019 -13.228 248 HB2 PRO 28 HB2 PRO 28 -5.157 -10.530 -14.680 249 HB3 PRO 28 HB3 PRO 28 -5.884 -12.040 -15.295 250 HG2 PRO 28 HG2 PRO 28 -6.841 -9.200 -15.810 251 HG3 PRO 28 HG3 PRO 28 -6.487 -10.480 -17.017 252 HD2 PRO 28 HD2 PRO 28 -9.005 -10.028 -16.118 253 HD3 PRO 28 HD3 PRO 28 -8.433 -11.685 -16.450 254 H LYS 29 H LYS 29 -8.374 -10.853 -11.671 255 HA LYS 29 HA LYS 29 -8.782 -9.489 -9.961 256 HB2 LYS 29 HB2 LYS 29 -6.398 -9.972 -9.520 257 HB3 LYS 29 HB3 LYS 29 -5.963 -8.445 -10.297 258 HG2 LYS 29 HG2 LYS 29 -5.970 -7.829 -8.047 259 HG3 LYS 29 HG3 LYS 29 -7.610 -7.370 -8.527 260 HD2 LYS 29 HD2 LYS 29 -8.397 -9.598 -7.666 261 HD3 LYS 29 HD3 LYS 29 -6.734 -9.923 -7.134 262 HE2 LYS 29 HE2 LYS 29 -6.819 -7.929 -5.658 263 HE3 LYS 29 HE3 LYS 29 -8.471 -7.596 -6.196 264 HZ1 LYS 29 HZ1 LYS 29 -7.619 -10.052 -4.738 265 HZ2 LYS 29 HZ2 LYS 29 -8.484 -8.822 -4.097 266 HZ3 LYS 29 HZ3 LYS 29 -9.140 -9.756 -5.255 267 HA PRO 30 HA PRO 30 -10.187 -5.868 -12.237 268 HB2 PRO 30 HB2 PRO 30 -12.396 -5.218 -10.818 269 HB3 PRO 30 HB3 PRO 30 -12.316 -6.706 -11.814 270 HG2 PRO 30 HG2 PRO 30 -11.872 -6.438 -8.823 271 HG3 PRO 30 HG3 PRO 30 -12.887 -7.634 -9.691 272 HD2 PRO 30 HD2 PRO 30 -10.303 -8.131 -8.862 273 HD3 PRO 30 HD3 PRO 30 -11.030 -8.904 -10.299 274 H LYS 31 H LYS 31 -9.967 -3.641 -12.042 275 HA LYS 31 HA LYS 31 -8.139 -2.684 -10.040 276 HB2 LYS 31 HB2 LYS 31 -9.706 -1.205 -12.179 277 HB3 LYS 31 HB3 LYS 31 -8.448 -0.478 -11.168 278 HG2 LYS 31 HG2 LYS 31 -6.769 -2.055 -12.030 279 HG3 LYS 31 HG3 LYS 31 -8.002 -2.874 -13.007 280 HD2 LYS 31 HD2 LYS 31 -8.383 -0.775 -14.292 281 HD3 LYS 31 HD3 LYS 31 -7.170 0.042 -13.301 282 HE2 LYS 31 HE2 LYS 31 -6.129 -0.547 -15.373 283 HE3 LYS 31 HE3 LYS 31 -5.433 -1.559 -14.107 284 HZ1 LYS 31 HZ1 LYS 31 -7.559 -2.430 -16.002 285 HZ2 LYS 31 HZ2 LYS 31 -5.983 -2.823 -16.128 286 HZ3 LYS 31 HZ3 LYS 31 -6.856 -3.383 -14.871 287 H LEU 32 H LEU 32 -8.386 -1.517 -8.208 288 HA LEU 32 HA LEU 32 -11.096 -0.710 -7.315 289 HB2 LEU 32 HB2 LEU 32 -10.431 -3.040 -6.536 290 HB3 LEU 32 HB3 LEU 32 -9.011 -2.319 -5.779 291 HG LEU 32 HG LEU 32 -10.682 -0.791 -4.538 292 HD11 LEU 32 HD11 LEU 32 -12.565 -3.065 -5.303 293 HD12 LEU 32 HD12 LEU 32 -12.921 -1.764 -4.148 294 HD13 LEU 32 HD13 LEU 32 -12.707 -1.387 -5.864 295 HD21 LEU 32 HD21 LEU 32 -9.391 -2.487 -3.405 296 HD22 LEU 32 HD22 LEU 32 -11.041 -2.460 -2.758 297 HD23 LEU 32 HD23 LEU 32 -10.554 -3.747 -3.887 298 H GLU 33 H GLU 33 -11.152 1.170 -6.202 299 HA GLU 33 HA GLU 33 -8.637 2.425 -5.188 300 HB2 GLU 33 HB2 GLU 33 -10.808 3.767 -6.860 301 HB3 GLU 33 HB3 GLU 33 -9.499 4.615 -6.023 302 HG2 GLU 33 HG2 GLU 33 -7.824 3.404 -7.383 303 HG3 GLU 33 HG3 GLU 33 -9.116 2.560 -8.243 304 H GLU 34 H GLU 34 -9.545 1.265 -3.309 305 HA GLU 34 HA GLU 34 -11.589 2.888 -1.855 306 HB2 GLU 34 HB2 GLU 34 -12.395 0.684 -2.676 307 HB3 GLU 34 HB3 GLU 34 -11.173 -0.117 -1.677 308 HG2 GLU 34 HG2 GLU 34 -12.158 0.923 0.347 309 HG3 GLU 34 HG3 GLU 34 -13.314 1.800 -0.654 310 H LEU 35 H LEU 35 -10.017 4.204 -0.966 311 HA LEU 35 HA LEU 35 -8.683 3.148 1.479 312 HB2 LEU 35 HB2 LEU 35 -7.583 5.008 -0.664 313 HB3 LEU 35 HB3 LEU 35 -6.880 4.890 0.938 314 HG LEU 35 HG LEU 35 -7.188 2.288 -0.517 315 HD11 LEU 35 HD11 LEU 35 -5.043 4.244 -1.366 316 HD12 LEU 35 HD12 LEU 35 -5.273 2.568 -1.909 317 HD13 LEU 35 HD13 LEU 35 -6.467 3.796 -2.332 318 HD21 LEU 35 HD21 LEU 35 -6.133 2.449 1.713 319 HD22 LEU 35 HD22 LEU 35 -5.009 1.852 0.486 320 HD23 LEU 35 HD23 LEU 35 -4.891 3.534 1.042 321 H SER 36 H SER 36 -8.596 4.708 3.195 322 HA SER 36 HA SER 36 -10.693 6.777 3.205 323 HB2 SER 36 HB2 SER 36 -10.144 5.422 5.212 324 HB3 SER 36 HB3 SER 36 -8.538 6.174 5.262 325 HG SER 36 HG SER 36 -10.154 7.196 6.623 326 H GLU 37 H GLU 37 -10.048 9.113 3.867 327 HA GLU 37 HA GLU 37 -8.552 10.227 1.736 328 HB2 GLU 37 HB2 GLU 37 -10.308 11.396 2.972 329 HB3 GLU 37 HB3 GLU 37 -9.280 11.471 4.414 330 HG2 GLU 37 HG2 GLU 37 -7.659 12.890 3.193 331 HG3 GLU 37 HG3 GLU 37 -8.621 12.746 1.720 332 H GLN 38 H GLN 38 -7.428 9.694 5.111 333 HA GLN 38 HA GLN 38 -4.730 10.665 4.449 334 HB2 GLN 38 HB2 GLN 38 -4.109 9.943 6.688 335 HB3 GLN 38 HB3 GLN 38 -5.489 11.032 6.702 336 HG2 GLN 38 HG2 GLN 38 -7.014 9.308 7.309 337 HG3 GLN 38 HG3 GLN 38 -5.902 8.019 6.851 338 HE21 GLN 38 HE21 GLN 38 -4.016 8.106 9.874 339 HE22 GLN 38 HE22 GLN 38 -3.942 7.656 8.176 340 H GLN 39 H GLN 39 -6.347 7.512 4.585 341 HA GLN 39 HA GLN 39 -3.932 5.967 4.490 342 HB2 GLN 39 HB2 GLN 39 -6.795 5.299 3.787 343 HB3 GLN 39 HB3 GLN 39 -5.480 4.132 3.651 344 HG2 GLN 39 HG2 GLN 39 -4.931 4.470 6.062 345 HG3 GLN 39 HG3 GLN 39 -6.331 5.530 6.225 346 HE21 GLN 39 HE21 GLN 39 -7.154 1.907 7.140 347 HE22 GLN 39 HE22 GLN 39 -5.761 2.883 7.562 348 H LYS 40 H LYS 40 -6.055 7.280 1.995 349 HA LYS 40 HA LYS 40 -4.818 6.118 -0.310 350 HB2 LYS 40 HB2 LYS 40 -7.027 7.275 -0.250 351 HB3 LYS 40 HB3 LYS 40 -6.240 8.803 0.140 352 HG2 LYS 40 HG2 LYS 40 -5.080 8.778 -2.052 353 HG3 LYS 40 HG3 LYS 40 -5.886 7.256 -2.465 354 HD2 LYS 40 HD2 LYS 40 -7.326 9.872 -1.795 355 HD3 LYS 40 HD3 LYS 40 -6.942 9.331 -3.437 356 HE2 LYS 40 HE2 LYS 40 -8.294 7.264 -3.059 357 HE3 LYS 40 HE3 LYS 40 -8.728 7.854 -1.449 358 HZ1 LYS 40 HZ1 LYS 40 -9.390 9.229 -4.001 359 HZ2 LYS 40 HZ2 LYS 40 -10.445 8.394 -3.079 360 HZ3 LYS 40 HZ3 LYS 40 -9.789 9.777 -2.515 361 H ILE 41 H ILE 41 -4.071 9.151 1.480 362 HA ILE 41 HA ILE 41 -1.908 9.918 -0.254 363 HB ILE 41 HB ILE 41 -2.391 10.635 2.626 364 HG12 ILE 41 HG12 ILE 41 -3.019 12.367 0.183 365 HG13 ILE 41 HG13 ILE 41 -4.213 11.251 0.814 366 HG21 ILE 41 HG21 ILE 41 -0.594 11.969 0.563 367 HG22 ILE 41 HG22 ILE 41 -0.982 12.655 2.153 368 HG23 ILE 41 HG23 ILE 41 -0.082 11.153 2.057 369 HD11 ILE 41 HD11 ILE 41 -3.031 13.597 2.338 370 HD12 ILE 41 HD12 ILE 41 -4.684 13.410 1.720 371 HD13 ILE 41 HD13 ILE 41 -4.116 12.367 3.033 372 H ILE 42 H ILE 42 -1.924 7.977 2.835 373 HA ILE 42 HA ILE 42 0.949 7.751 2.930 374 HB ILE 42 HB ILE 42 -1.199 5.902 4.012 375 HG12 ILE 42 HG12 ILE 42 0.465 7.824 5.677 376 HG13 ILE 42 HG13 ILE 42 -0.977 8.408 4.864 377 HG21 ILE 42 HG21 ILE 42 1.802 6.021 4.577 378 HG22 ILE 42 HG22 ILE 42 0.650 5.119 5.574 379 HG23 ILE 42 HG23 ILE 42 0.895 4.651 3.895 380 HD11 ILE 42 HD11 ILE 42 -0.910 6.119 6.868 381 HD12 ILE 42 HD12 ILE 42 -1.579 7.746 7.109 382 HD13 ILE 42 HD13 ILE 42 -2.335 6.636 5.944 383 H LEU 43 H LEU 43 -1.553 5.682 1.492 384 HA LEU 43 HA LEU 43 0.113 3.635 0.444 385 HB2 LEU 43 HB2 LEU 43 -2.293 3.497 0.784 386 HB3 LEU 43 HB3 LEU 43 -2.593 4.725 -0.423 387 HG LEU 43 HG LEU 43 -3.137 2.405 -1.030 388 HD11 LEU 43 HD11 LEU 43 -1.096 3.604 -2.913 389 HD12 LEU 43 HD12 LEU 43 -2.421 2.503 -3.311 390 HD13 LEU 43 HD13 LEU 43 -2.774 4.146 -2.739 391 HD21 LEU 43 HD21 LEU 43 -1.253 1.197 -0.040 392 HD22 LEU 43 HD22 LEU 43 -1.346 0.842 -1.764 393 HD23 LEU 43 HD23 LEU 43 -0.104 1.949 -1.157 394 H ALA 44 H ALA 44 -1.135 6.598 -1.138 395 HA ALA 44 HA ALA 44 0.222 6.322 -3.610 396 HB1 ALA 44 HB1 ALA 44 -0.744 8.777 -2.100 397 HB2 ALA 44 HB2 ALA 44 -0.311 8.739 -3.825 398 HB3 ALA 44 HB3 ALA 44 -1.703 7.797 -3.239 399 H GLU 45 H GLU 45 1.172 8.338 -0.713 400 HA GLU 45 HA GLU 45 3.628 9.247 -1.828 401 HB2 GLU 45 HB2 GLU 45 2.712 8.850 1.040 402 HB3 GLU 45 HB3 GLU 45 4.270 9.555 0.639 403 HG2 GLU 45 HG2 GLU 45 1.644 10.716 -0.384 404 HG3 GLU 45 HG3 GLU 45 2.409 11.203 1.124 405 H TYR 46 H TYR 46 2.908 6.127 -0.261 406 HA TYR 46 HA TYR 46 5.643 5.338 0.092 407 HB2 TYR 46 HB2 TYR 46 3.674 4.334 1.218 408 HB3 TYR 46 HB3 TYR 46 3.133 3.659 -0.308 409 HD1 TYR 46 HD1 TYR 46 3.037 1.664 1.382 410 HD2 TYR 46 HD2 TYR 46 6.717 3.374 -0.107 411 HE1 TYR 46 HE1 TYR 46 4.231 -0.462 1.883 412 HE2 TYR 46 HE2 TYR 46 7.902 1.277 0.441 413 HH TYR 46 HH TYR 46 6.250 -1.566 1.809 414 H ILE 47 H ILE 47 3.310 4.453 -2.517 415 HA ILE 47 HA ILE 47 5.101 3.155 -4.249 416 HB ILE 47 HB ILE 47 2.439 4.564 -4.516 417 HG12 ILE 47 HG12 ILE 47 3.184 1.604 -4.555 418 HG13 ILE 47 HG13 ILE 47 2.659 2.455 -3.112 419 HG21 ILE 47 HG21 ILE 47 3.885 2.994 -6.671 420 HG22 ILE 47 HG22 ILE 47 2.145 3.355 -6.731 421 HG23 ILE 47 HG23 ILE 47 3.307 4.666 -6.766 422 HD11 ILE 47 HD11 ILE 47 0.969 1.850 -5.555 423 HD12 ILE 47 HD12 ILE 47 0.734 1.333 -3.878 424 HD13 ILE 47 HD13 ILE 47 0.502 3.039 -4.316 425 H ALA 48 H ALA 48 4.143 6.611 -4.001 426 HA ALA 48 HA ALA 48 5.456 7.456 -6.420 427 HB1 ALA 48 HB1 ALA 48 4.593 8.985 -3.933 428 HB2 ALA 48 HB2 ALA 48 5.003 9.708 -5.507 429 HB3 ALA 48 HB3 ALA 48 3.583 8.650 -5.355 430 H GLU 49 H GLU 49 6.591 7.012 -3.091 431 HA GLU 49 HA GLU 49 9.189 8.297 -3.630 432 HB2 GLU 49 HB2 GLU 49 8.077 8.539 -1.461 433 HB3 GLU 49 HB3 GLU 49 8.161 6.788 -1.200 434 HG2 GLU 49 HG2 GLU 49 10.593 6.863 -1.136 435 HG3 GLU 49 HG3 GLU 49 10.600 8.556 -1.645 436 H VAL 50 H VAL 50 7.914 4.944 -3.309 437 HA VAL 50 HA VAL 50 10.680 3.951 -3.855 438 HB VAL 50 HB VAL 50 10.320 2.052 -2.729 439 HG11 VAL 50 HG11 VAL 50 8.750 4.059 -1.096 440 HG12 VAL 50 HG12 VAL 50 9.658 2.655 -0.502 441 HG13 VAL 50 HG13 VAL 50 10.516 4.005 -1.258 442 HG21 VAL 50 HG21 VAL 50 8.151 1.293 -3.617 443 HG22 VAL 50 HG22 VAL 50 8.203 1.172 -1.867 444 HG23 VAL 50 HG23 VAL 50 7.307 2.496 -2.632 445 H GLY 51 H GLY 51 7.764 4.266 -5.536 446 HA2 GLY 51 HA2 GLY 51 7.756 4.176 -7.852 447 HA3 GLY 51 HA3 GLY 51 9.242 3.227 -7.847 448 H LEU 52 H LEU 52 6.338 2.285 -6.106 449 HA LEU 52 HA LEU 52 5.124 0.422 -6.032 450 HB2 LEU 52 HB2 LEU 52 4.589 1.711 -8.412 451 HB3 LEU 52 HB3 LEU 52 4.872 0.089 -8.987 452 HG LEU 52 HG LEU 52 2.879 0.821 -6.793 453 HD11 LEU 52 HD11 LEU 52 2.322 0.197 -9.711 454 HD12 LEU 52 HD12 LEU 52 1.138 0.623 -8.463 455 HD13 LEU 52 HD13 LEU 52 2.311 1.830 -9.003 456 HD21 LEU 52 HD21 LEU 52 3.490 -1.539 -6.660 457 HD22 LEU 52 HD22 LEU 52 1.842 -1.368 -7.272 458 HD23 LEU 52 HD23 LEU 52 3.170 -1.747 -8.393 459 H GLN 53 H GLN 53 8.109 0.050 -6.626 460 HA GLN 53 HA GLN 53 8.091 -2.824 -7.454 461 HB2 GLN 53 HB2 GLN 53 10.129 -2.453 -8.649 462 HB3 GLN 53 HB3 GLN 53 8.948 -1.240 -9.138 463 HG2 GLN 53 HG2 GLN 53 10.109 0.309 -7.386 464 HG3 GLN 53 HG3 GLN 53 11.410 -0.888 -7.397 465 HE21 GLN 53 HE21 GLN 53 10.737 1.478 -10.718 466 HE22 GLN 53 HE22 GLN 53 9.426 1.191 -9.566 467 H ASN 54 H ASN 54 8.731 -0.874 -4.848 468 HA ASN 54 HA ASN 54 10.378 -3.024 -3.562 469 HB2 ASN 54 HB2 ASN 54 10.387 -0.055 -2.951 470 HB3 ASN 54 HB3 ASN 54 11.305 -1.268 -2.082 471 HD21 ASN 54 HD21 ASN 54 12.831 0.224 -5.509 472 HD22 ASN 54 HD22 ASN 54 11.261 0.773 -4.946 473 H ILE 55 H ILE 55 7.288 -1.972 -3.696 474 HA ILE 55 HA ILE 55 6.691 -1.982 -0.834 475 HB ILE 55 HB ILE 55 4.396 -1.775 -1.359 476 HG12 ILE 55 HG12 ILE 55 5.063 -2.130 -4.315 477 HG13 ILE 55 HG13 ILE 55 4.198 -3.290 -3.297 478 HG21 ILE 55 HG21 ILE 55 5.820 0.078 -3.297 479 HG22 ILE 55 HG22 ILE 55 4.402 0.402 -2.270 480 HG23 ILE 55 HG23 ILE 55 5.982 0.197 -1.535 481 HD11 ILE 55 HD11 ILE 55 3.254 -0.515 -4.067 482 HD12 ILE 55 HD12 ILE 55 2.564 -2.067 -4.553 483 HD13 ILE 55 HD13 ILE 55 2.446 -1.544 -2.857 484 H THR 56 H THR 56 5.470 -3.511 0.305 485 HA THR 56 HA THR 56 5.020 -6.181 -0.885 486 HB THR 56 HB THR 56 5.856 -6.972 1.536 487 HG1 THR 56 HG1 THR 56 7.907 -5.753 1.826 488 HG21 THR 56 HG21 THR 56 7.848 -6.295 -0.673 489 HG22 THR 56 HG22 THR 56 8.049 -7.524 0.598 490 HG23 THR 56 HG23 THR 56 6.807 -7.737 -0.646 491 H ALA 57 H ALA 57 3.271 -7.290 0.069 492 HA ALA 57 HA ALA 57 1.207 -5.722 1.215 493 HB1 ALA 57 HB1 ALA 57 1.606 -8.751 1.153 494 HB2 ALA 57 HB2 ALA 57 0.085 -7.898 1.483 495 HB3 ALA 57 HB3 ALA 57 0.838 -7.775 -0.120 496 H ILE 58 H ILE 58 3.797 -7.575 2.670 497 HA ILE 58 HA ILE 58 2.855 -7.748 5.393 498 HB ILE 58 HB ILE 58 5.594 -7.728 4.048 499 HG12 ILE 58 HG12 ILE 58 5.698 -10.095 4.855 500 HG13 ILE 58 HG13 ILE 58 4.070 -9.957 5.511 501 HG21 ILE 58 HG21 ILE 58 4.936 -8.022 7.013 502 HG22 ILE 58 HG22 ILE 58 6.503 -8.482 6.296 503 HG23 ILE 58 HG23 ILE 58 5.982 -6.799 6.254 504 HD11 ILE 58 HD11 ILE 58 4.752 -9.696 2.549 505 HD12 ILE 58 HD12 ILE 58 4.252 -11.202 3.343 506 HD13 ILE 58 HD13 ILE 58 3.124 -9.847 3.273 507 H THR 59 H THR 59 4.746 -5.349 3.562 508 HA THR 59 HA THR 59 5.168 -3.645 5.894 509 HB THR 59 HB THR 59 5.831 -3.265 2.961 510 HG1 THR 59 HG1 THR 59 7.249 -4.659 3.370 511 HG21 THR 59 HG21 THR 59 6.867 -1.890 5.486 512 HG22 THR 59 HG22 THR 59 7.596 -1.743 3.871 513 HG23 THR 59 HG23 THR 59 5.960 -1.117 4.160 514 H LEU 60 H LEU 60 3.234 -3.439 2.854 515 HA LEU 60 HA LEU 60 1.918 -1.001 3.551 516 HB2 LEU 60 HB2 LEU 60 1.421 -3.233 1.618 517 HB3 LEU 60 HB3 LEU 60 -0.013 -2.381 2.159 518 HG LEU 60 HG LEU 60 2.300 -1.070 0.691 519 HD11 LEU 60 HD11 LEU 60 -0.593 -1.605 -0.057 520 HD12 LEU 60 HD12 LEU 60 0.637 -0.790 -1.053 521 HD13 LEU 60 HD13 LEU 60 0.809 -2.509 -0.662 522 HD21 LEU 60 HD21 LEU 60 1.333 0.506 2.339 523 HD22 LEU 60 HD22 LEU 60 0.894 0.915 0.695 524 HD23 LEU 60 HD23 LEU 60 -0.287 0.082 1.746 525 H SER 61 H SER 61 1.167 -4.360 4.471 526 HA SER 61 HA SER 61 -1.218 -3.995 5.843 527 HB2 SER 61 HB2 SER 61 -0.346 -6.175 5.557 528 HB3 SER 61 HB3 SER 61 1.096 -5.795 6.511 529 HG SER 61 HG SER 61 -0.370 -6.944 7.763 530 H LYS 62 H LYS 62 1.953 -3.025 6.737 531 HA LYS 62 HA LYS 62 1.112 -2.286 9.466 532 HB2 LYS 62 HB2 LYS 62 3.882 -2.667 8.289 533 HB3 LYS 62 HB3 LYS 62 3.571 -2.096 9.939 534 HG2 LYS 62 HG2 LYS 62 2.282 -4.160 10.433 535 HG3 LYS 62 HG3 LYS 62 2.606 -4.762 8.800 536 HD2 LYS 62 HD2 LYS 62 5.059 -4.656 9.279 537 HD3 LYS 62 HD3 LYS 62 4.674 -4.154 10.944 538 HE2 LYS 62 HE2 LYS 62 3.351 -6.261 11.238 539 HE3 LYS 62 HE3 LYS 62 3.793 -6.753 9.598 540 HZ1 LYS 62 HZ1 LYS 62 5.712 -6.314 11.828 541 HZ2 LYS 62 HZ2 LYS 62 5.259 -7.767 11.245 542 HZ3 LYS 62 HZ3 LYS 62 6.134 -6.755 10.311 543 H LYS 63 H LYS 63 2.298 -0.734 6.497 544 HA LYS 63 HA LYS 63 2.868 1.854 7.526 545 HB2 LYS 63 HB2 LYS 63 1.935 0.763 4.853 546 HB3 LYS 63 HB3 LYS 63 2.297 2.473 5.058 547 HG2 LYS 63 HG2 LYS 63 4.355 0.415 5.899 548 HG3 LYS 63 HG3 LYS 63 4.126 0.724 4.186 549 HD2 LYS 63 HD2 LYS 63 4.637 2.968 6.167 550 HD3 LYS 63 HD3 LYS 63 5.950 2.023 5.434 551 HE2 LYS 63 HE2 LYS 63 5.204 2.630 3.187 552 HE3 LYS 63 HE3 LYS 63 3.854 3.567 3.852 553 HZ1 LYS 63 HZ1 LYS 63 6.737 4.156 4.300 554 HZ2 LYS 63 HZ2 LYS 63 5.746 5.003 3.319 555 HZ3 LYS 63 HZ3 LYS 63 5.503 5.021 4.933 556 H LEU 64 H LEU 64 -0.245 0.377 6.780 557 HA LEU 64 HA LEU 64 -1.615 2.880 7.672 558 HB2 LEU 64 HB2 LEU 64 -2.818 1.036 5.606 559 HB3 LEU 64 HB3 LEU 64 -3.316 2.626 6.120 560 HG LEU 64 HG LEU 64 -0.919 3.340 5.189 561 HD11 LEU 64 HD11 LEU 64 -1.619 0.920 3.467 562 HD12 LEU 64 HD12 LEU 64 -0.286 2.078 3.212 563 HD13 LEU 64 HD13 LEU 64 -0.265 0.957 4.582 564 HD21 LEU 64 HD21 LEU 64 -3.058 4.108 4.380 565 HD22 LEU 64 HD22 LEU 64 -1.965 3.775 3.033 566 HD23 LEU 64 HD23 LEU 64 -3.284 2.635 3.412 567 H ASN 65 H ASN 65 -0.903 0.198 9.057 568 HA ASN 65 HA ASN 65 -1.797 -1.406 10.359 569 HB2 ASN 65 HB2 ASN 65 -3.149 -0.602 12.219 570 HB3 ASN 65 HB3 ASN 65 -1.772 0.419 11.870 571 HD21 ASN 65 HD21 ASN 65 -3.729 3.307 11.226 572 HD22 ASN 65 HD22 ASN 65 -2.130 2.587 11.097 573 H ILE 66 H ILE 66 -2.576 -2.167 8.130 574 HA ILE 66 HA ILE 66 -5.509 -2.770 8.168 575 HB ILE 66 HB ILE 66 -4.983 -3.155 5.608 576 HG12 ILE 66 HG12 ILE 66 -2.938 -0.975 6.185 577 HG13 ILE 66 HG13 ILE 66 -2.508 -2.605 5.880 578 HG21 ILE 66 HG21 ILE 66 -5.377 -0.419 6.858 579 HG22 ILE 66 HG22 ILE 66 -5.784 -0.868 5.188 580 HG23 ILE 66 HG23 ILE 66 -6.634 -1.638 6.531 581 HD11 ILE 66 HD11 ILE 66 -3.915 -0.756 3.925 582 HD12 ILE 66 HD12 ILE 66 -2.280 -1.416 3.812 583 HD13 ILE 66 HD13 ILE 66 -3.673 -2.498 3.639 584 H THR 67 H THR 67 -5.712 -4.852 6.493 585 HA THR 67 HA THR 67 -4.185 -7.012 7.825 586 HB THR 67 HB THR 67 -5.708 -8.523 7.212 587 HG1 THR 67 HG1 THR 67 -7.056 -8.303 5.373 588 HG21 THR 67 HG21 THR 67 -7.551 -6.132 6.761 589 HG22 THR 67 HG22 THR 67 -7.985 -7.752 7.339 590 HG23 THR 67 HG23 THR 67 -7.030 -6.683 8.381 591 H VAL 68 H VAL 68 -3.072 -8.660 6.574 592 HA VAL 68 HA VAL 68 -1.429 -7.660 4.412 593 HB VAL 68 HB VAL 68 -1.960 -10.507 5.329 594 HG11 VAL 68 HG11 VAL 68 0.239 -9.413 3.503 595 HG12 VAL 68 HG12 VAL 68 0.184 -11.058 4.171 596 HG13 VAL 68 HG13 VAL 68 -1.049 -10.544 3.021 597 HG21 VAL 68 HG21 VAL 68 -0.870 -9.114 7.067 598 HG22 VAL 68 HG22 VAL 68 0.261 -10.302 6.418 599 HG23 VAL 68 HG23 VAL 68 0.373 -8.611 5.894 600 H GLU 69 H GLU 69 -4.668 -9.115 4.428 601 HA GLU 69 HA GLU 69 -4.493 -9.879 1.574 602 HB2 GLU 69 HB2 GLU 69 -6.748 -9.972 3.616 603 HB3 GLU 69 HB3 GLU 69 -6.979 -10.252 1.887 604 HG2 GLU 69 HG2 GLU 69 -5.222 -12.060 1.993 605 HG3 GLU 69 HG3 GLU 69 -5.188 -11.865 3.747 606 H LYS 70 H LYS 70 -5.742 -7.226 3.630 607 HA LYS 70 HA LYS 70 -7.026 -5.824 1.521 608 HB2 LYS 70 HB2 LYS 70 -7.066 -5.510 4.181 609 HB3 LYS 70 HB3 LYS 70 -5.848 -4.285 3.784 610 HG2 LYS 70 HG2 LYS 70 -7.620 -3.639 1.878 611 HG3 LYS 70 HG3 LYS 70 -8.743 -4.530 2.942 612 HD2 LYS 70 HD2 LYS 70 -8.083 -3.035 4.808 613 HD3 LYS 70 HD3 LYS 70 -6.996 -2.172 3.680 614 HE2 LYS 70 HE2 LYS 70 -8.938 -1.596 2.249 615 HE3 LYS 70 HE3 LYS 70 -10.023 -2.427 3.372 616 HZ1 LYS 70 HZ1 LYS 70 -8.387 -0.029 4.017 617 HZ2 LYS 70 HZ2 LYS 70 -9.998 -0.043 3.781 618 HZ3 LYS 70 HZ3 LYS 70 -9.371 -0.802 5.080 619 H ALA 71 H ALA 71 -3.825 -5.504 2.979 620 HA ALA 71 HA ALA 71 -2.661 -3.527 1.351 621 HB1 ALA 71 HB1 ALA 71 -1.477 -5.935 2.793 622 HB2 ALA 71 HB2 ALA 71 -0.544 -4.574 2.170 623 HB3 ALA 71 HB3 ALA 71 -1.736 -4.308 3.459 624 H LYS 72 H LYS 72 -2.818 -7.076 0.825 625 HA LYS 72 HA LYS 72 -1.140 -7.082 -1.522 626 HB2 LYS 72 HB2 LYS 72 -1.403 -8.923 0.139 627 HB3 LYS 72 HB3 LYS 72 -3.083 -9.131 -0.340 628 HG2 LYS 72 HG2 LYS 72 -2.404 -9.927 -2.524 629 HG3 LYS 72 HG3 LYS 72 -0.700 -9.554 -2.189 630 HD2 LYS 72 HD2 LYS 72 -2.354 -11.471 -0.474 631 HD3 LYS 72 HD3 LYS 72 -1.430 -12.012 -1.886 632 HE2 LYS 72 HE2 LYS 72 0.658 -11.246 -0.882 633 HE3 LYS 72 HE3 LYS 72 -0.208 -10.546 0.495 634 HZ1 LYS 72 HZ1 LYS 72 -0.268 -13.434 -0.146 635 HZ2 LYS 72 HZ2 LYS 72 0.738 -12.762 0.963 636 HZ3 LYS 72 HZ3 LYS 72 -0.873 -12.740 1.201 637 H ASN 73 H ASN 73 -4.628 -6.843 -0.960 638 HA ASN 73 HA ASN 73 -5.486 -7.370 -3.549 639 HB2 ASN 73 HB2 ASN 73 -7.442 -7.028 -2.514 640 HB3 ASN 73 HB3 ASN 73 -6.635 -6.330 -1.131 641 HD21 ASN 73 HD21 ASN 73 -7.495 -2.997 -1.939 642 HD22 ASN 73 HD22 ASN 73 -6.523 -4.040 -0.910 643 H TYR 74 H TYR 74 -4.248 -4.269 -2.283 644 HA TYR 74 HA TYR 74 -4.656 -2.678 -4.592 645 HB2 TYR 74 HB2 TYR 74 -2.494 -2.432 -2.481 646 HB3 TYR 74 HB3 TYR 74 -3.031 -1.164 -3.575 647 HD1 TYR 74 HD1 TYR 74 -5.753 -0.728 -3.446 648 HD2 TYR 74 HD2 TYR 74 -3.243 -2.331 -0.336 649 HE1 TYR 74 HE1 TYR 74 -7.409 0.012 -1.739 650 HE2 TYR 74 HE2 TYR 74 -4.905 -1.570 1.388 651 HH TYR 74 HH TYR 74 -7.943 0.104 0.480 652 H ILE 75 H ILE 75 -1.871 -4.650 -3.515 653 HA ILE 75 HA ILE 75 -0.126 -3.975 -5.683 654 HB ILE 75 HB ILE 75 -0.171 -6.425 -3.874 655 HG12 ILE 75 HG12 ILE 75 1.365 -3.796 -3.642 656 HG13 ILE 75 HG13 ILE 75 -0.030 -4.220 -2.666 657 HG21 ILE 75 HG21 ILE 75 2.100 -5.303 -5.583 658 HG22 ILE 75 HG22 ILE 75 2.217 -6.682 -4.470 659 HG23 ILE 75 HG23 ILE 75 1.218 -6.812 -5.903 660 HD11 ILE 75 HD11 ILE 75 2.689 -5.557 -2.572 661 HD12 ILE 75 HD12 ILE 75 1.887 -4.592 -1.327 662 HD13 ILE 75 HD13 ILE 75 1.230 -6.181 -1.760 663 H LYS 76 H LYS 76 -2.579 -6.568 -5.327 664 HA LYS 76 HA LYS 76 -1.855 -7.945 -7.756 665 HB2 LYS 76 HB2 LYS 76 -4.306 -8.005 -5.933 666 HB3 LYS 76 HB3 LYS 76 -4.136 -9.060 -7.336 667 HG2 LYS 76 HG2 LYS 76 -2.108 -9.008 -5.076 668 HG3 LYS 76 HG3 LYS 76 -3.511 -10.087 -5.121 669 HD2 LYS 76 HD2 LYS 76 -2.728 -11.061 -7.255 670 HD3 LYS 76 HD3 LYS 76 -1.347 -9.947 -7.267 671 HE2 LYS 76 HE2 LYS 76 -0.564 -10.914 -5.112 672 HE3 LYS 76 HE3 LYS 76 -1.879 -12.098 -5.183 673 HZ1 LYS 76 HZ1 LYS 76 0.188 -11.773 -7.295 674 HZ2 LYS 76 HZ2 LYS 76 0.249 -12.917 -6.100 675 HZ3 LYS 76 HZ3 LYS 76 -0.944 -12.959 -7.228 676 H ASN 77 H ASN 77 -4.324 -5.418 -7.072 677 HA ASN 77 HA ASN 77 -5.291 -5.742 -9.834 678 HB2 ASN 77 HB2 ASN 77 -7.039 -4.421 -9.355 679 HB3 ASN 77 HB3 ASN 77 -6.852 -5.341 -7.865 680 HD21 ASN 77 HD21 ASN 77 -6.374 -2.412 -5.928 681 HD22 ASN 77 HD22 ASN 77 -6.153 -4.164 -5.937 682 H SER 78 H SER 78 -3.431 -3.402 -7.835 683 HA SER 78 HA SER 78 -3.499 -1.557 -10.041 684 HB2 SER 78 HB2 SER 78 -3.953 -1.031 -7.547 685 HB3 SER 78 HB3 SER 78 -2.190 -0.869 -7.430 686 HG SER 78 HG SER 78 -3.286 1.116 -7.940 687 H ASN 79 H ASN 79 -1.833 -3.835 -10.448 688 HA ASN 79 HA ASN 79 0.901 -3.000 -10.047 689 HB2 ASN 79 HB2 ASN 79 -0.372 -5.410 -10.139 690 HB3 ASN 79 HB3 ASN 79 0.273 -5.370 -11.787 691 HD21 ASN 79 HD21 ASN 79 2.669 -5.615 -8.485 692 HD22 ASN 79 HD22 ASN 79 0.972 -5.082 -8.407 693 H ARG 80 H ARG 80 -1.191 -3.114 -12.890 694 HA ARG 80 HA ARG 80 0.922 -2.561 -14.835 695 HB2 ARG 80 HB2 ARG 80 -2.105 -2.751 -14.923 696 HB3 ARG 80 HB3 ARG 80 -1.229 -2.056 -16.278 697 HG2 ARG 80 HG2 ARG 80 -1.667 -4.400 -16.684 698 HG3 ARG 80 HG3 ARG 80 0.064 -4.074 -16.618 699 HD2 ARG 80 HD2 ARG 80 0.165 -5.035 -14.328 700 HD3 ARG 80 HD3 ARG 80 -1.583 -5.283 -14.355 701 HE ARG 80 HE ARG 80 -1.320 -7.146 -15.709 702 HH11 ARG 80 HH11 ARG 80 -0.207 -8.830 -16.633 703 HH12 ARG 80 HH12 ARG 80 1.501 -8.691 -16.912 704 HH21 ARG 80 HH21 ARG 80 1.799 -5.530 -15.629 705 HH22 ARG 80 HH22 ARG 80 2.608 -6.886 -16.360 706 H LEU 81 H LEU 81 -0.651 -0.536 -12.644 707 HA LEU 81 HA LEU 81 -0.368 1.987 -14.048 708 HB2 LEU 81 HB2 LEU 81 -1.875 1.481 -12.135 709 HB3 LEU 81 HB3 LEU 81 -0.490 1.322 -11.067 710 HG LEU 81 HG LEU 81 -0.894 3.907 -12.602 711 HD11 LEU 81 HD11 LEU 81 -2.341 3.111 -10.039 712 HD12 LEU 81 HD12 LEU 81 -2.320 4.741 -10.758 713 HD13 LEU 81 HD13 LEU 81 -3.092 3.404 -11.622 714 HD21 LEU 81 HD21 LEU 81 1.156 3.681 -11.183 715 HD22 LEU 81 HD22 LEU 81 0.062 4.906 -10.546 716 HD23 LEU 81 HD23 LEU 81 0.136 3.302 -9.784 717 H GLY 82 H GLY 82 1.797 -0.081 -12.199 718 HA2 GLY 82 HA2 GLY 82 4.020 1.879 -12.238 719 HA3 GLY 82 HA3 GLY 82 3.994 0.315 -11.430 720 H ARG 83 H ARG 83 5.306 -1.115 -12.310 721 HA ARG 83 HA ARG 83 5.887 -1.096 -15.243 722 HB2 ARG 83 HB2 ARG 83 7.686 -0.521 -13.144 723 HB3 ARG 83 HB3 ARG 83 8.133 -2.129 -13.663 724 HG2 ARG 83 HG2 ARG 83 7.871 0.312 -15.468 725 HG3 ARG 83 HG3 ARG 83 9.370 -0.347 -14.809 726 HD2 ARG 83 HD2 ARG 83 8.838 -2.528 -15.998 727 HD3 ARG 83 HD3 ARG 83 7.532 -1.692 -16.838 728 HE ARG 83 HE ARG 83 10.426 -1.445 -17.260 729 HH11 ARG 83 HH11 ARG 83 11.231 -0.230 -18.914 730 HH12 ARG 83 HH12 ARG 83 10.200 0.881 -19.766 731 HH21 ARG 83 HH21 ARG 83 7.390 0.192 -17.926 732 HH22 ARG 83 HH22 ARG 83 8.086 1.119 -19.226 733 H THR 84 H THR 84 6.996 -3.540 -12.949 734 HA THR 84 HA THR 84 4.876 -5.430 -13.575 735 HB THR 84 HB THR 84 5.957 -5.713 -15.632 736 HG1 THR 84 HG1 THR 84 6.595 -7.865 -15.476 737 HG21 THR 84 HG21 THR 84 8.644 -6.195 -14.289 738 HG22 THR 84 HG22 THR 84 8.264 -6.324 -16.015 739 HG23 THR 84 HG23 THR 84 8.189 -4.751 -15.219 740 H ASN 85 H ASN 85 4.539 -5.808 -11.466 741 HA ASN 85 HA ASN 85 6.639 -7.106 -9.827 742 HB2 ASN 85 HB2 ASN 85 5.266 -4.459 -9.175 743 HB3 ASN 85 HB3 ASN 85 6.021 -5.463 -7.943 744 HD21 ASN 85 HD21 ASN 85 8.410 -3.210 -10.260 745 HD22 ASN 85 HD22 ASN 85 6.655 -3.078 -10.320 746 H ASN 86 H ASN 86 4.680 -8.516 -10.912 747 HA ASN 86 HA ASN 86 2.986 -9.270 -8.577 748 HB2 ASN 86 HB2 ASN 86 1.719 -8.045 -10.446 749 HB3 ASN 86 HB3 ASN 86 2.053 -9.432 -11.471 750 HD21 ASN 86 HD21 ASN 86 -1.288 -10.079 -10.227 751 HD22 ASN 86 HD22 ASN 86 -0.459 -9.105 -11.426 752 H LEU 87 H LEU 87 2.032 -11.601 -9.248 753 HA LEU 87 HA LEU 87 2.427 -13.790 -9.265 754 HB2 LEU 87 HB2 LEU 87 2.813 -12.938 -11.757 755 HB3 LEU 87 HB3 LEU 87 4.449 -13.505 -11.470 756 HG LEU 87 HG LEU 87 3.417 -15.785 -10.857 757 HD11 LEU 87 HD11 LEU 87 0.938 -14.469 -12.072 758 HD12 LEU 87 HD12 LEU 87 1.129 -16.205 -11.749 759 HD13 LEU 87 HD13 LEU 87 1.087 -15.063 -10.406 760 HD21 LEU 87 HD21 LEU 87 4.442 -15.327 -13.054 761 HD22 LEU 87 HD22 LEU 87 3.039 -16.394 -13.218 762 HD23 LEU 87 HD23 LEU 87 2.899 -14.674 -13.650 763 H LYS 88 H LYS 88 4.119 -12.195 -7.525 764 HA LYS 88 HA LYS 88 6.223 -14.210 -6.874 765 HB2 LYS 88 HB2 LYS 88 7.772 -12.468 -6.292 766 HB3 LYS 88 HB3 LYS 88 7.255 -12.289 -7.966 767 HG2 LYS 88 HG2 LYS 88 5.713 -10.437 -7.283 768 HG3 LYS 88 HG3 LYS 88 6.263 -10.624 -5.604 769 HD2 LYS 88 HD2 LYS 88 8.610 -10.160 -6.366 770 HD3 LYS 88 HD3 LYS 88 7.993 -9.875 -8.006 771 HE2 LYS 88 HE2 LYS 88 6.580 -8.015 -7.139 772 HE3 LYS 88 HE3 LYS 88 7.182 -8.321 -5.506 773 HZ1 LYS 88 HZ1 LYS 88 8.865 -7.453 -7.806 774 HZ2 LYS 88 HZ2 LYS 88 8.430 -6.519 -6.550 775 HZ3 LYS 88 HZ3 LYS 88 9.432 -7.783 -6.309 776 H THR 89 H THR 89 3.398 -13.367 -5.779 777 HA THR 89 HA THR 89 3.979 -14.199 -3.119 778 HB THR 89 HB THR 89 4.386 -11.825 -2.749 779 HG1 THR 89 HG1 THR 89 3.200 -11.801 -0.954 780 HG21 THR 89 HG21 THR 89 1.452 -11.317 -3.413 781 HG22 THR 89 HG22 THR 89 2.651 -10.144 -2.834 782 HG23 THR 89 HG23 THR 89 2.814 -10.839 -4.455 783 H ILE 90 H ILE 90 2.452 -15.556 -2.641 784 HA ILE 90 HA ILE 90 -0.365 -15.151 -3.493 785 HB ILE 90 HB ILE 90 -0.347 -17.723 -3.768 786 HG12 ILE 90 HG12 ILE 90 2.055 -17.982 -2.924 787 HG13 ILE 90 HG13 ILE 90 1.457 -18.960 -4.248 788 HG21 ILE 90 HG21 ILE 90 0.895 -15.958 -5.897 789 HG22 ILE 90 HG22 ILE 90 0.119 -17.536 -6.159 790 HG23 ILE 90 HG23 ILE 90 -0.835 -16.171 -5.560 791 HD11 ILE 90 HD11 ILE 90 3.281 -16.547 -4.625 792 HD12 ILE 90 HD12 ILE 90 3.762 -18.247 -4.636 793 HD13 ILE 90 HD13 ILE 90 2.684 -17.637 -5.896 794 H GLY 91 H GLY 91 1.462 -15.307 -0.823 795 HA2 GLY 91 HA2 GLY 91 1.028 -15.810 1.403 796 HA3 GLY 91 HA3 GLY 91 -0.649 -16.172 0.971 797 H ILE 92 H ILE 92 1.527 -17.993 -0.872 798 HA ILE 92 HA ILE 92 1.940 -20.187 -1.069 799 HB ILE 92 HB ILE 92 2.932 -20.075 1.787 800 HG12 ILE 92 HG12 ILE 92 5.167 -19.505 0.435 801 HG13 ILE 92 HG13 ILE 92 4.063 -18.813 -0.742 802 HG21 ILE 92 HG21 ILE 92 3.915 -21.576 -0.693 803 HG22 ILE 92 HG22 ILE 92 4.652 -21.630 0.923 804 HG23 ILE 92 HG23 ILE 92 3.064 -22.317 0.672 805 HD11 ILE 92 HD11 ILE 92 4.194 -18.042 2.213 806 HD12 ILE 92 HD12 ILE 92 5.051 -17.203 0.906 807 HD13 ILE 92 HD13 ILE 92 3.290 -17.189 0.940 808 H LEU 93 H LEU 93 -0.685 -19.837 -0.731 809 HA LEU 93 HA LEU 93 -2.664 -20.726 -0.216 810 HB2 LEU 93 HB2 LEU 93 -1.330 -22.521 -1.544 811 HB3 LEU 93 HB3 LEU 93 -1.276 -23.407 -0.027 812 HG LEU 93 HG LEU 93 -3.827 -23.409 -0.033 813 HD11 LEU 93 HD11 LEU 93 -3.426 -22.283 -2.840 814 HD12 LEU 93 HD12 LEU 93 -4.947 -22.943 -2.199 815 HD13 LEU 93 HD13 LEU 93 -4.267 -21.474 -1.497 816 HD21 LEU 93 HD21 LEU 93 -2.509 -25.321 -0.855 817 HD22 LEU 93 HD22 LEU 93 -4.002 -25.121 -1.784 818 HD23 LEU 93 HD23 LEU 93 -2.451 -24.594 -2.477 819 H GLN 94 H GLN 94 -1.087 -19.869 2.097 820 HA GLN 94 HA GLN 94 -2.444 -21.291 4.347 821 HB2 GLN 94 HB2 GLN 94 0.496 -20.638 3.934 822 HB3 GLN 94 HB3 GLN 94 -0.177 -20.935 5.545 823 HG2 GLN 94 HG2 GLN 94 -0.811 -23.178 5.013 824 HG3 GLN 94 HG3 GLN 94 -0.484 -22.954 3.296 825 HE21 GLN 94 HE21 GLN 94 3.055 -23.311 3.587 826 HE22 GLN 94 HE22 GLN 94 1.753 -22.619 2.602 827 H GLU 95 H GLU 95 -3.583 -19.133 3.286 828 HA GLU 95 HA GLU 95 -3.235 -16.959 5.290 829 HB2 GLU 95 HB2 GLU 95 -1.888 -16.412 3.290 830 HB3 GLU 95 HB3 GLU 95 -3.304 -16.608 2.259 831 HG2 GLU 95 HG2 GLU 95 -4.389 -14.682 3.360 832 HG3 GLU 95 HG3 GLU 95 -3.035 -14.548 4.489 833 H GLU 96 H GLU 96 -5.174 -17.095 6.314 834 HA GLU 96 HA GLU 96 -7.708 -17.160 4.773 835 HB2 GLU 96 HB2 GLU 96 -8.477 -19.169 5.884 836 HB3 GLU 96 HB3 GLU 96 -6.986 -19.507 5.039 837 HG2 GLU 96 HG2 GLU 96 -6.461 -18.703 7.834 838 HG3 GLU 96 HG3 GLU 96 -7.599 -20.035 7.749 839 H VAL 97 H VAL 97 -6.716 -15.005 6.308 840 HA VAL 97 HA VAL 97 -8.912 -14.826 8.309 841 HB VAL 97 HB VAL 97 -6.035 -14.006 8.880 842 HG11 VAL 97 HG11 VAL 97 -8.536 -13.872 10.619 843 HG12 VAL 97 HG12 VAL 97 -6.880 -13.486 11.140 844 HG13 VAL 97 HG13 VAL 97 -7.678 -12.476 9.929 845 HG21 VAL 97 HG21 VAL 97 -6.288 -16.438 9.056 846 HG22 VAL 97 HG22 VAL 97 -6.155 -15.730 10.671 847 HG23 VAL 97 HG23 VAL 97 -7.744 -16.240 10.053 848 H SER 98 H SER 98 -10.151 -13.174 7.870 849 HA SER 98 HA SER 98 -9.106 -10.507 7.444 850 HB2 SER 98 HB2 SER 98 -8.809 -11.359 5.184 851 HB3 SER 98 HB3 SER 98 -10.514 -11.833 5.104 852 HG SER 98 HG SER 98 -10.162 -9.786 4.128 853 H SER 99 H SER 99 -12.222 -11.958 6.312 854 HA SER 99 HA SER 99 -13.768 -9.901 7.545 855 HB2 SER 99 HB2 SER 99 -14.707 -12.595 6.497 856 HB3 SER 99 HB3 SER 99 -15.707 -11.157 6.778 857 HG SER 99 HG SER 99 -15.100 -11.325 4.583 858 H MET 100 H MET 100 -12.696 -12.944 8.805 859 HA MET 100 HA MET 100 -13.875 -12.257 11.427 860 HB2 MET 100 HB2 MET 100 -14.446 -14.738 9.908 861 HB3 MET 100 HB3 MET 100 -13.772 -15.045 11.508 862 HG2 MET 100 HG2 MET 100 -16.147 -13.229 10.982 863 HG3 MET 100 HG3 MET 100 -16.259 -14.921 11.471 864 HE1 MET 100 HE1 MET 100 -17.893 -14.078 13.423 865 HE2 MET 100 HE2 MET 100 -17.423 -12.890 14.659 866 HE3 MET 100 HE3 MET 100 -17.632 -12.376 12.970 867 H GLU 101 H GLU 101 -12.538 -12.365 13.036 868 HA GLU 101 HA GLU 101 -10.032 -13.906 12.947 869 HB2 GLU 101 HB2 GLU 101 -9.407 -11.735 11.942 870 HB3 GLU 101 HB3 GLU 101 -10.065 -10.881 13.341 871 HG2 GLU 101 HG2 GLU 101 -8.392 -12.033 14.806 872 HG3 GLU 101 HG3 GLU 101 -7.775 -12.901 13.405 873 H ALA 102 H ALA 102 -10.686 -15.139 14.643 874 HA ALA 102 HA ALA 102 -11.031 -13.825 17.293 875 HB1 ALA 102 HB1 ALA 102 -12.783 -16.062 16.183 876 HB2 ALA 102 HB2 ALA 102 -12.867 -15.382 17.823 877 HB3 ALA 102 HB3 ALA 102 -13.278 -14.371 16.425 878 H LYS 103 H LYS 103 -10.355 -14.985 19.063 879 HA LYS 103 HA LYS 103 -8.853 -17.550 18.644 880 HB2 LYS 103 HB2 LYS 103 -8.018 -15.131 20.295 881 HB3 LYS 103 HB3 LYS 103 -7.290 -16.737 20.438 882 HG2 LYS 103 HG2 LYS 103 -6.634 -16.676 18.054 883 HG3 LYS 103 HG3 LYS 103 -7.331 -15.053 17.894 884 HD2 LYS 103 HD2 LYS 103 -5.777 -14.194 19.609 885 HD3 LYS 103 HD3 LYS 103 -5.049 -15.794 19.788 886 HE2 LYS 103 HE2 LYS 103 -5.106 -14.187 17.189 887 HE3 LYS 103 HE3 LYS 103 -3.768 -14.162 18.339 888 HZ1 LYS 103 HZ1 LYS 103 -4.704 -16.581 16.889 889 HZ2 LYS 103 HZ2 LYS 103 -3.340 -15.748 16.573 890 HZ3 LYS 103 HZ3 LYS 103 -3.486 -16.556 17.981 891 H SER 104 H SER 104 -10.044 -19.041 19.526 892 HA SER 104 HA SER 104 -10.884 -18.906 22.340 893 HB2 SER 104 HB2 SER 104 -12.783 -17.929 20.976 894 HB3 SER 104 HB3 SER 104 -12.930 -19.498 20.163 895 HG SER 104 HG SER 104 -14.339 -19.270 21.990 896 H MET 105 H MET 105 -11.609 -21.023 23.118 897 HA MET 105 HA MET 105 -10.296 -23.285 21.657 898 HB2 MET 105 HB2 MET 105 -10.261 -22.515 24.578 899 HB3 MET 105 HB3 MET 105 -10.001 -24.189 24.091 900 HG2 MET 105 HG2 MET 105 -8.430 -21.856 22.953 901 HG3 MET 105 HG3 MET 105 -7.898 -22.801 24.343 902 HE1 MET 105 HE1 MET 105 -8.389 -25.818 23.731 903 HE2 MET 105 HE2 MET 105 -6.888 -26.228 22.879 904 HE3 MET 105 HE3 MET 105 -6.840 -25.131 24.276 905 H THR 106 H THR 106 -10.951 -25.411 22.287 906 HA THR 106 HA THR 106 -13.827 -25.805 22.862 907 HB THR 106 HB THR 106 -13.797 -25.309 20.517 908 HG1 THR 106 HG1 THR 106 -14.725 -27.186 19.774 909 HG21 THR 106 HG21 THR 106 -11.784 -27.573 20.161 910 HG22 THR 106 HG22 THR 106 -12.595 -26.676 18.859 911 HG23 THR 106 HG23 THR 106 -11.457 -25.842 19.924 912 H TRP 107 H TRP 107 -14.400 -27.883 23.187 913 HA TRP 107 HA TRP 107 -14.317 -29.778 24.424 914 HB2 TRP 107 HB2 TRP 107 -13.688 -30.275 21.942 915 HB3 TRP 107 HB3 TRP 107 -12.133 -30.751 22.592 916 HD1 TRP 107 HD1 TRP 107 -12.046 -33.199 23.468 917 HE1 TRP 107 HE1 TRP 107 -13.754 -35.076 23.903 918 HE3 TRP 107 HE3 TRP 107 -16.353 -30.516 22.825 919 HZ2 TRP 107 HZ2 TRP 107 -16.633 -35.366 23.958 920 HZ3 TRP 107 HZ3 TRP 107 -18.574 -31.616 23.078 921 HH2 TRP 107 HH2 TRP 107 -18.724 -34.033 23.642 Start of MODEL 8 1 H1 GLY -5 H1 GLY -5 -53.090 -44.738 -41.361 2 H2 GLY -5 H2 GLY -5 -53.659 -45.901 -40.356 3 H3 GLY -5 H3 GLY -5 -53.049 -46.309 -41.822 4 HA2 GLY -5 HA2 GLY -5 -51.444 -46.865 -40.145 5 HA3 GLY -5 HA3 GLY -5 -50.846 -45.548 -41.169 6 H SER -4 H SER -4 -49.652 -44.297 -39.843 7 HA SER -4 HA SER -4 -50.932 -42.973 -37.513 8 HB2 SER -4 HB2 SER -4 -48.876 -43.270 -36.178 9 HB3 SER -4 HB3 SER -4 -49.675 -44.808 -36.536 10 HG SER -4 HG SER -4 -47.427 -44.961 -36.883 11 H HIS -3 H HIS -3 -49.847 -40.981 -36.876 12 HA HIS -3 HA HIS -3 -48.812 -39.531 -39.253 13 HB2 HIS -3 HB2 HIS -3 -49.692 -38.473 -36.543 14 HB3 HIS -3 HB3 HIS -3 -49.319 -37.519 -37.976 15 HD2 HIS -3 HD2 HIS -3 -51.008 -39.484 -40.039 16 HE1 HIS -3 HE1 HIS -3 -54.374 -38.156 -37.779 17 HE2 HIS -3 HE2 HIS -3 -53.635 -39.224 -39.970 18 H MET -2 H MET -2 -47.878 -39.894 -35.833 19 HA MET -2 HA MET -2 -45.038 -39.997 -36.464 20 HB2 MET -2 HB2 MET -2 -45.578 -37.504 -36.450 21 HB3 MET -2 HB3 MET -2 -46.064 -37.675 -34.764 22 HG2 MET -2 HG2 MET -2 -43.793 -36.777 -35.005 23 HG3 MET -2 HG3 MET -2 -43.782 -38.306 -34.140 24 HE1 MET -2 HE1 MET -2 -41.152 -38.467 -34.430 25 HE2 MET -2 HE2 MET -2 -40.318 -38.303 -35.991 26 HE3 MET -2 HE3 MET -2 -41.168 -36.909 -35.290 27 H ALA -1 H ALA -1 -43.724 -40.646 -34.757 28 HA ALA -1 HA ALA -1 -45.016 -41.323 -32.214 29 HB1 ALA -1 HB1 ALA -1 -43.503 -43.361 -33.909 30 HB2 ALA -1 HB2 ALA -1 -44.133 -43.638 -32.270 31 HB3 ALA -1 HB3 ALA -1 -45.257 -43.350 -33.611 32 H SER 0 H SER 0 -43.473 -41.848 -30.490 33 HA SER 0 HA SER 0 -40.634 -41.104 -30.919 34 HB2 SER 0 HB2 SER 0 -41.831 -39.017 -30.266 35 HB3 SER 0 HB3 SER 0 -42.361 -39.815 -28.771 36 HG SER 0 HG SER 0 -40.428 -38.581 -28.492 37 H MET 1 H MET 1 -39.318 -42.453 -29.854 38 HA MET 1 HA MET 1 -40.126 -43.940 -27.443 39 HB2 MET 1 HB2 MET 1 -41.187 -45.120 -29.420 40 HB3 MET 1 HB3 MET 1 -39.579 -45.398 -30.072 41 HG2 MET 1 HG2 MET 1 -40.330 -47.375 -28.958 42 HG3 MET 1 HG3 MET 1 -39.020 -46.698 -27.993 43 HE1 MET 1 HE1 MET 1 -39.972 -48.588 -26.216 44 HE2 MET 1 HE2 MET 1 -41.619 -48.534 -25.543 45 HE3 MET 1 HE3 MET 1 -41.374 -48.937 -27.256 46 H ASP 2 H ASP 2 -38.305 -42.945 -26.484 47 HA ASP 2 HA ASP 2 -35.618 -43.480 -27.623 48 HB2 ASP 2 HB2 ASP 2 -36.547 -41.680 -25.369 49 HB3 ASP 2 HB3 ASP 2 -34.856 -41.956 -25.768 50 HA PRO 3 HA PRO 3 -34.797 -46.501 -24.373 51 HB2 PRO 3 HB2 PRO 3 -32.173 -47.030 -24.801 52 HB3 PRO 3 HB3 PRO 3 -33.412 -47.434 -26.028 53 HG2 PRO 3 HG2 PRO 3 -31.617 -44.990 -25.927 54 HG3 PRO 3 HG3 PRO 3 -31.943 -46.067 -27.319 55 HD2 PRO 3 HD2 PRO 3 -33.275 -43.680 -26.884 56 HD3 PRO 3 HD3 PRO 3 -34.010 -45.075 -27.727 57 H LEU 4 H LEU 4 -33.784 -43.361 -24.224 58 HA LEU 4 HA LEU 4 -32.142 -43.719 -21.802 59 HB2 LEU 4 HB2 LEU 4 -32.508 -41.319 -23.629 60 HB3 LEU 4 HB3 LEU 4 -31.487 -41.322 -22.198 61 HG LEU 4 HG LEU 4 -31.056 -43.100 -24.620 62 HD11 LEU 4 HD11 LEU 4 -29.551 -40.640 -23.644 63 HD12 LEU 4 HD12 LEU 4 -29.111 -41.658 -25.034 64 HD13 LEU 4 HD13 LEU 4 -30.613 -40.721 -25.068 65 HD21 LEU 4 HD21 LEU 4 -30.165 -44.190 -22.608 66 HD22 LEU 4 HD22 LEU 4 -28.839 -43.555 -23.580 67 HD23 LEU 4 HD23 LEU 4 -29.354 -42.678 -22.125 68 H ASP 5 H ASP 5 -34.763 -44.259 -21.335 69 HA ASP 5 HA ASP 5 -35.483 -42.090 -19.393 70 HB2 ASP 5 HB2 ASP 5 -37.148 -44.216 -20.773 71 HB3 ASP 5 HB3 ASP 5 -37.717 -43.393 -19.331 72 H LYS 6 H LYS 6 -33.782 -44.820 -19.393 73 HA LYS 6 HA LYS 6 -34.754 -45.784 -16.714 74 HB2 LYS 6 HB2 LYS 6 -33.733 -47.708 -18.824 75 HB3 LYS 6 HB3 LYS 6 -34.614 -48.029 -17.342 76 HG2 LYS 6 HG2 LYS 6 -36.378 -48.246 -18.754 77 HG3 LYS 6 HG3 LYS 6 -36.469 -46.503 -18.551 78 HD2 LYS 6 HD2 LYS 6 -36.610 -46.799 -20.898 79 HD3 LYS 6 HD3 LYS 6 -34.932 -46.331 -20.626 80 HE2 LYS 6 HE2 LYS 6 -34.855 -48.104 -22.188 81 HE3 LYS 6 HE3 LYS 6 -34.299 -48.785 -20.660 82 HZ1 LYS 6 HZ1 LYS 6 -37.050 -49.086 -21.763 83 HZ2 LYS 6 HZ2 LYS 6 -35.899 -50.241 -21.785 84 HZ3 LYS 6 HZ3 LYS 6 -36.527 -49.750 -20.364 85 H ILE 7 H ILE 7 -32.022 -46.216 -18.925 86 HA ILE 7 HA ILE 7 -30.134 -46.288 -16.622 87 HB ILE 7 HB ILE 7 -28.634 -47.568 -18.138 88 HG12 ILE 7 HG12 ILE 7 -29.576 -48.780 -20.049 89 HG13 ILE 7 HG13 ILE 7 -31.079 -47.871 -19.947 90 HG21 ILE 7 HG21 ILE 7 -31.368 -48.808 -17.608 91 HG22 ILE 7 HG22 ILE 7 -29.826 -49.669 -17.803 92 HG23 ILE 7 HG23 ILE 7 -30.069 -48.601 -16.414 93 HD11 ILE 7 HD11 ILE 7 -28.357 -46.637 -20.557 94 HD12 ILE 7 HD12 ILE 7 -29.551 -47.126 -21.774 95 HD13 ILE 7 HD13 ILE 7 -29.942 -45.824 -20.646 96 H ILE 8 H ILE 8 -31.208 -43.987 -18.480 97 HA ILE 8 HA ILE 8 -29.068 -42.750 -19.752 98 HB ILE 8 HB ILE 8 -31.383 -41.960 -19.807 99 HG12 ILE 8 HG12 ILE 8 -29.329 -39.841 -19.055 100 HG13 ILE 8 HG13 ILE 8 -29.550 -40.575 -20.648 101 HG21 ILE 8 HG21 ILE 8 -30.883 -40.604 -17.129 102 HG22 ILE 8 HG22 ILE 8 -32.381 -40.606 -18.084 103 HG23 ILE 8 HG23 ILE 8 -31.824 -42.094 -17.315 104 HD11 ILE 8 HD11 ILE 8 -31.510 -38.743 -19.201 105 HD12 ILE 8 HD12 ILE 8 -30.509 -38.354 -20.607 106 HD13 ILE 8 HD13 ILE 8 -31.821 -39.531 -20.766 107 H ASN 9 H ASN 9 -27.288 -41.748 -19.251 108 HA ASN 9 HA ASN 9 -26.633 -40.903 -16.468 109 HB2 ASN 9 HB2 ASN 9 -25.982 -43.309 -17.046 110 HB3 ASN 9 HB3 ASN 9 -24.830 -42.643 -18.200 111 HD21 ASN 9 HD21 ASN 9 -22.469 -41.865 -15.644 112 HD22 ASN 9 HD22 ASN 9 -22.908 -41.598 -17.326 113 H ASP 10 H ASP 10 -27.127 -39.587 -19.253 114 HA ASP 10 HA ASP 10 -24.554 -38.519 -19.878 115 HB2 ASP 10 HB2 ASP 10 -26.360 -39.173 -21.526 116 HB3 ASP 10 HB3 ASP 10 -27.274 -37.755 -21.021 117 H ILE 11 H ILE 11 -26.091 -37.731 -17.393 118 HA ILE 11 HA ILE 11 -25.020 -35.002 -17.199 119 HB ILE 11 HB ILE 11 -27.450 -34.886 -17.890 120 HG12 ILE 11 HG12 ILE 11 -26.959 -33.527 -15.220 121 HG13 ILE 11 HG13 ILE 11 -26.219 -33.027 -16.744 122 HG21 ILE 11 HG21 ILE 11 -28.059 -35.849 -15.065 123 HG22 ILE 11 HG22 ILE 11 -29.223 -35.374 -16.314 124 HG23 ILE 11 HG23 ILE 11 -28.251 -36.825 -16.538 125 HD11 ILE 11 HD11 ILE 11 -29.202 -33.085 -16.130 126 HD12 ILE 11 HD12 ILE 11 -28.167 -31.660 -16.301 127 HD13 ILE 11 HD13 ILE 11 -28.494 -32.683 -17.714 128 H LYS 12 H LYS 12 -24.357 -37.697 -16.250 129 HA LYS 12 HA LYS 12 -24.251 -37.100 -13.329 130 HB2 LYS 12 HB2 LYS 12 -25.726 -38.975 -14.003 131 HB3 LYS 12 HB3 LYS 12 -24.355 -39.827 -14.689 132 HG2 LYS 12 HG2 LYS 12 -24.411 -39.009 -11.756 133 HG3 LYS 12 HG3 LYS 12 -25.275 -40.429 -12.336 134 HD2 LYS 12 HD2 LYS 12 -23.091 -41.334 -13.255 135 HD3 LYS 12 HD3 LYS 12 -22.267 -39.984 -12.483 136 HE2 LYS 12 HE2 LYS 12 -22.040 -41.817 -11.015 137 HE3 LYS 12 HE3 LYS 12 -23.194 -40.707 -10.271 138 HZ1 LYS 12 HZ1 LYS 12 -23.936 -43.154 -11.800 139 HZ2 LYS 12 HZ2 LYS 12 -23.925 -43.043 -10.172 140 HZ3 LYS 12 HZ3 LYS 12 -24.989 -42.164 -11.037 141 H LYS 13 H LYS 13 -22.346 -38.454 -16.017 142 HA LYS 13 HA LYS 13 -19.890 -37.777 -14.540 143 HB2 LYS 13 HB2 LYS 13 -20.545 -40.291 -14.374 144 HB3 LYS 13 HB3 LYS 13 -20.140 -40.384 -16.080 145 HG2 LYS 13 HG2 LYS 13 -18.227 -41.111 -14.895 146 HG3 LYS 13 HG3 LYS 13 -17.816 -39.488 -15.465 147 HD2 LYS 13 HD2 LYS 13 -18.284 -38.567 -13.210 148 HD3 LYS 13 HD3 LYS 13 -18.839 -40.162 -12.661 149 HE2 LYS 13 HE2 LYS 13 -16.572 -41.090 -13.127 150 HE3 LYS 13 HE3 LYS 13 -16.024 -39.483 -13.622 151 HZ1 LYS 13 HZ1 LYS 13 -17.015 -40.191 -10.907 152 HZ2 LYS 13 HZ2 LYS 13 -15.455 -39.938 -11.305 153 HZ3 LYS 13 HZ3 LYS 13 -16.517 -38.700 -11.358 154 H GLU 14 H GLU 14 -18.810 -36.369 -15.657 155 HA GLU 14 HA GLU 14 -18.291 -36.545 -18.524 156 HB2 GLU 14 HB2 GLU 14 -19.378 -34.437 -19.105 157 HB3 GLU 14 HB3 GLU 14 -20.560 -35.606 -18.540 158 HG2 GLU 14 HG2 GLU 14 -20.533 -34.487 -16.278 159 HG3 GLU 14 HG3 GLU 14 -19.457 -33.258 -16.940 160 H ALA 15 H ALA 15 -17.025 -34.512 -19.251 161 HA ALA 15 HA ALA 15 -14.891 -33.960 -17.343 162 HB1 ALA 15 HB1 ALA 15 -15.414 -32.853 -20.128 163 HB2 ALA 15 HB2 ALA 15 -13.919 -32.687 -19.186 164 HB3 ALA 15 HB3 ALA 15 -14.434 -34.295 -19.742 165 H ASN 16 H ASN 16 -14.138 -31.772 -16.878 166 HA ASN 16 HA ASN 16 -16.217 -29.660 -16.715 167 HB2 ASN 16 HB2 ASN 16 -16.432 -31.066 -14.706 168 HB3 ASN 16 HB3 ASN 16 -14.714 -30.875 -14.363 169 HD21 ASN 16 HD21 ASN 16 -16.282 -28.485 -12.114 170 HD22 ASN 16 HD22 ASN 16 -16.001 -30.214 -12.260 171 H ASP 17 H ASP 17 -15.359 -27.857 -17.445 172 HA ASP 17 HA ASP 17 -12.626 -26.998 -16.672 173 HB2 ASP 17 HB2 ASP 17 -13.724 -26.933 -19.511 174 HB3 ASP 17 HB3 ASP 17 -12.245 -26.134 -18.981 175 H SER 18 H SER 18 -15.371 -26.347 -15.736 176 HA SER 18 HA SER 18 -15.980 -23.798 -16.893 177 HB2 SER 18 HB2 SER 18 -17.189 -25.140 -14.448 178 HB3 SER 18 HB3 SER 18 -17.874 -23.751 -15.315 179 HG SER 18 HG SER 18 -18.795 -25.751 -15.994 180 H GLY 19 H GLY 19 -13.607 -24.374 -14.721 181 HA2 GLY 19 HA2 GLY 19 -13.125 -21.569 -14.542 182 HA3 GLY 19 HA3 GLY 19 -13.560 -22.179 -12.941 183 H VAL 20 H VAL 20 -11.083 -21.890 -15.280 184 HA VAL 20 HA VAL 20 -9.200 -23.582 -13.699 185 HB VAL 20 HB VAL 20 -10.024 -24.470 -15.933 186 HG11 VAL 20 HG11 VAL 20 -8.148 -22.376 -17.110 187 HG12 VAL 20 HG12 VAL 20 -9.010 -23.660 -17.982 188 HG13 VAL 20 HG13 VAL 20 -9.918 -22.347 -17.217 189 HG21 VAL 20 HG21 VAL 20 -8.015 -25.359 -14.811 190 HG22 VAL 20 HG22 VAL 20 -7.948 -25.459 -16.578 191 HG23 VAL 20 HG23 VAL 20 -7.009 -24.220 -15.736 192 H THR 21 H THR 21 -9.801 -20.548 -13.927 193 HA THR 21 HA THR 21 -7.115 -19.578 -14.790 194 HB THR 21 HB THR 21 -9.588 -17.894 -14.648 195 HG1 THR 21 HG1 THR 21 -9.934 -18.415 -16.789 196 HG21 THR 21 HG21 THR 21 -7.042 -17.785 -16.327 197 HG22 THR 21 HG22 THR 21 -8.398 -16.639 -16.436 198 HG23 THR 21 HG23 THR 21 -7.425 -16.712 -14.959 199 H LEU 22 H LEU 22 -5.840 -18.308 -13.587 200 HA LEU 22 HA LEU 22 -6.255 -18.045 -10.777 201 HB2 LEU 22 HB2 LEU 22 -4.067 -17.147 -10.709 202 HB3 LEU 22 HB3 LEU 22 -4.078 -18.528 -11.783 203 HG LEU 22 HG LEU 22 -4.224 -15.697 -12.907 204 HD11 LEU 22 HD11 LEU 22 -1.715 -17.267 -12.192 205 HD12 LEU 22 HD12 LEU 22 -1.769 -15.729 -13.086 206 HD13 LEU 22 HD13 LEU 22 -2.283 -15.781 -11.397 207 HD21 LEU 22 HD21 LEU 22 -4.624 -17.392 -14.584 208 HD22 LEU 22 HD22 LEU 22 -3.002 -16.753 -14.811 209 HD23 LEU 22 HD23 LEU 22 -3.211 -18.336 -14.031 210 H ALA 23 H ALA 23 -8.387 -16.705 -11.832 211 HA ALA 23 HA ALA 23 -7.936 -13.856 -11.106 212 HB1 ALA 23 HB1 ALA 23 -9.270 -14.881 -13.651 213 HB2 ALA 23 HB2 ALA 23 -9.226 -13.191 -13.126 214 HB3 ALA 23 HB3 ALA 23 -7.716 -14.020 -13.542 215 HA PRO 24 HA PRO 24 -11.767 -14.393 -8.926 216 HB2 PRO 24 HB2 PRO 24 -12.620 -11.835 -8.554 217 HB3 PRO 24 HB3 PRO 24 -11.117 -12.460 -7.810 218 HG2 PRO 24 HG2 PRO 24 -11.386 -10.866 -10.387 219 HG3 PRO 24 HG3 PRO 24 -10.304 -10.541 -8.995 220 HD2 PRO 24 HD2 PRO 24 -9.437 -11.892 -11.192 221 HD3 PRO 24 HD3 PRO 24 -8.884 -12.339 -9.554 222 H LEU 25 H LEU 25 -11.819 -12.762 -12.022 223 HA LEU 25 HA LEU 25 -14.413 -13.859 -12.743 224 HB2 LEU 25 HB2 LEU 25 -14.599 -11.419 -11.601 225 HB3 LEU 25 HB3 LEU 25 -14.024 -10.879 -13.164 226 HG LEU 25 HG LEU 25 -16.027 -12.121 -14.194 227 HD11 LEU 25 HD11 LEU 25 -16.902 -12.252 -11.274 228 HD12 LEU 25 HD12 LEU 25 -17.925 -12.603 -12.684 229 HD13 LEU 25 HD13 LEU 25 -16.550 -13.648 -12.312 230 HD21 LEU 25 HD21 LEU 25 -16.016 -9.684 -13.840 231 HD22 LEU 25 HD22 LEU 25 -17.627 -10.364 -13.569 232 HD23 LEU 25 HD23 LEU 25 -16.611 -9.912 -12.181 233 H SER 26 H SER 26 -14.638 -12.505 -15.208 234 HA SER 26 HA SER 26 -12.409 -13.636 -16.716 235 HB2 SER 26 HB2 SER 26 -14.889 -13.786 -17.310 236 HB3 SER 26 HB3 SER 26 -14.745 -12.118 -17.892 237 HG SER 26 HG SER 26 -14.373 -13.694 -19.545 238 H VAL 27 H VAL 27 -11.284 -11.816 -15.199 239 HA VAL 27 HA VAL 27 -10.076 -9.913 -17.028 240 HB VAL 27 HB VAL 27 -12.163 -8.776 -16.275 241 HG11 VAL 27 HG11 VAL 27 -10.871 -8.538 -13.543 242 HG12 VAL 27 HG12 VAL 27 -12.440 -7.892 -14.068 243 HG13 VAL 27 HG13 VAL 27 -12.211 -9.641 -13.919 244 HG21 VAL 27 HG21 VAL 27 -10.240 -7.445 -17.023 245 HG22 VAL 27 HG22 VAL 27 -11.155 -6.612 -15.761 246 HG23 VAL 27 HG23 VAL 27 -9.613 -7.389 -15.354 247 HA PRO 28 HA PRO 28 -6.879 -11.176 -14.200 248 HB2 PRO 28 HB2 PRO 28 -4.711 -9.805 -15.106 249 HB3 PRO 28 HB3 PRO 28 -5.532 -11.066 -16.066 250 HG2 PRO 28 HG2 PRO 28 -5.964 -8.062 -16.231 251 HG3 PRO 28 HG3 PRO 28 -5.612 -9.204 -17.570 252 HD2 PRO 28 HD2 PRO 28 -8.149 -8.450 -16.966 253 HD3 PRO 28 HD3 PRO 28 -7.781 -10.120 -17.486 254 H LYS 29 H LYS 29 -8.297 -10.121 -12.621 255 HA LYS 29 HA LYS 29 -8.713 -9.055 -10.699 256 HB2 LYS 29 HB2 LYS 29 -6.417 -9.655 -10.064 257 HB3 LYS 29 HB3 LYS 29 -5.831 -8.131 -10.726 258 HG2 LYS 29 HG2 LYS 29 -5.953 -7.752 -8.401 259 HG3 LYS 29 HG3 LYS 29 -7.371 -6.940 -9.073 260 HD2 LYS 29 HD2 LYS 29 -8.784 -8.851 -8.394 261 HD3 LYS 29 HD3 LYS 29 -7.346 -9.678 -7.752 262 HE2 LYS 29 HE2 LYS 29 -6.996 -7.785 -6.165 263 HE3 LYS 29 HE3 LYS 29 -8.429 -6.978 -6.813 264 HZ1 LYS 29 HZ1 LYS 29 -8.439 -9.613 -5.428 265 HZ2 LYS 29 HZ2 LYS 29 -8.970 -8.203 -4.795 266 HZ3 LYS 29 HZ3 LYS 29 -9.763 -8.878 -6.045 267 HA PRO 30 HA PRO 30 -9.855 -5.194 -12.734 268 HB2 PRO 30 HB2 PRO 30 -12.156 -4.612 -11.401 269 HB3 PRO 30 HB3 PRO 30 -12.043 -5.931 -12.606 270 HG2 PRO 30 HG2 PRO 30 -11.869 -6.142 -9.587 271 HG3 PRO 30 HG3 PRO 30 -12.835 -7.146 -10.713 272 HD2 PRO 30 HD2 PRO 30 -10.384 -7.899 -9.738 273 HD3 PRO 30 HD3 PRO 30 -10.956 -8.392 -11.354 274 H LYS 31 H LYS 31 -9.611 -2.987 -12.271 275 HA LYS 31 HA LYS 31 -7.888 -2.426 -10.067 276 HB2 LYS 31 HB2 LYS 31 -7.637 -0.242 -10.916 277 HB3 LYS 31 HB3 LYS 31 -7.702 -1.361 -12.274 278 HG2 LYS 31 HG2 LYS 31 -10.223 -0.716 -12.444 279 HG3 LYS 31 HG3 LYS 31 -9.828 0.621 -11.358 280 HD2 LYS 31 HD2 LYS 31 -8.579 0.045 -14.076 281 HD3 LYS 31 HD3 LYS 31 -9.788 1.280 -13.762 282 HE2 LYS 31 HE2 LYS 31 -7.048 1.267 -12.409 283 HE3 LYS 31 HE3 LYS 31 -7.333 2.004 -13.983 284 HZ1 LYS 31 HZ1 LYS 31 -8.667 2.858 -11.451 285 HZ2 LYS 31 HZ2 LYS 31 -7.498 3.628 -12.280 286 HZ3 LYS 31 HZ3 LYS 31 -8.988 3.464 -12.945 287 H LEU 32 H LEU 32 -8.054 -1.242 -8.230 288 HA LEU 32 HA LEU 32 -10.722 -0.367 -7.283 289 HB2 LEU 32 HB2 LEU 32 -10.300 -2.690 -6.493 290 HB3 LEU 32 HB3 LEU 32 -8.724 -2.188 -5.876 291 HG LEU 32 HG LEU 32 -9.900 -0.567 -4.355 292 HD11 LEU 32 HD11 LEU 32 -12.371 -2.144 -5.212 293 HD12 LEU 32 HD12 LEU 32 -12.300 -1.022 -3.839 294 HD13 LEU 32 HD13 LEU 32 -12.096 -0.409 -5.484 295 HD21 LEU 32 HD21 LEU 32 -9.043 -2.664 -3.526 296 HD22 LEU 32 HD22 LEU 32 -10.574 -2.286 -2.719 297 HD23 LEU 32 HD23 LEU 32 -10.531 -3.514 -4.008 298 H GLU 33 H GLU 33 -10.661 1.489 -6.151 299 HA GLU 33 HA GLU 33 -8.151 2.579 -5.074 300 HB2 GLU 33 HB2 GLU 33 -8.382 4.684 -6.389 301 HB3 GLU 33 HB3 GLU 33 -8.053 3.265 -7.367 302 HG2 GLU 33 HG2 GLU 33 -10.682 3.194 -7.727 303 HG3 GLU 33 HG3 GLU 33 -10.612 4.869 -7.195 304 H GLU 34 H GLU 34 -9.790 1.633 -3.521 305 HA GLU 34 HA GLU 34 -11.616 3.734 -2.437 306 HB2 GLU 34 HB2 GLU 34 -12.675 1.682 -3.326 307 HB3 GLU 34 HB3 GLU 34 -11.797 0.716 -2.132 308 HG2 GLU 34 HG2 GLU 34 -12.900 1.990 -0.308 309 HG3 GLU 34 HG3 GLU 34 -13.708 3.007 -1.499 310 H LEU 35 H LEU 35 -9.931 4.767 -1.365 311 HA LEU 35 HA LEU 35 -9.177 3.619 1.292 312 HB2 LEU 35 HB2 LEU 35 -7.535 5.206 -0.709 313 HB3 LEU 35 HB3 LEU 35 -7.085 5.089 0.983 314 HG LEU 35 HG LEU 35 -7.547 2.441 -0.299 315 HD11 LEU 35 HD11 LEU 35 -5.221 4.167 -1.214 316 HD12 LEU 35 HD12 LEU 35 -5.466 2.436 -1.563 317 HD13 LEU 35 HD13 LEU 35 -6.586 3.634 -2.221 318 HD21 LEU 35 HD21 LEU 35 -6.557 2.696 1.948 319 HD22 LEU 35 HD22 LEU 35 -5.422 1.923 0.832 320 HD23 LEU 35 HD23 LEU 35 -5.206 3.630 1.255 321 H SER 36 H SER 36 -9.028 5.205 2.987 322 HA SER 36 HA SER 36 -10.937 7.402 2.780 323 HB2 SER 36 HB2 SER 36 -8.999 6.803 5.042 324 HB3 SER 36 HB3 SER 36 -10.455 7.809 5.107 325 HG SER 36 HG SER 36 -10.869 5.723 5.927 326 H GLU 37 H GLU 37 -10.317 9.677 3.534 327 HA GLU 37 HA GLU 37 -8.665 10.812 1.607 328 HB2 GLU 37 HB2 GLU 37 -10.497 11.914 2.885 329 HB3 GLU 37 HB3 GLU 37 -9.424 12.042 4.285 330 HG2 GLU 37 HG2 GLU 37 -7.895 13.494 3.010 331 HG3 GLU 37 HG3 GLU 37 -8.854 13.258 1.545 332 H GLN 38 H GLN 38 -7.661 9.979 4.937 333 HA GLN 38 HA GLN 38 -4.903 10.950 4.439 334 HB2 GLN 38 HB2 GLN 38 -6.095 11.193 6.655 335 HB3 GLN 38 HB3 GLN 38 -6.065 9.432 6.806 336 HG2 GLN 38 HG2 GLN 38 -3.478 9.642 6.554 337 HG3 GLN 38 HG3 GLN 38 -3.716 11.374 6.779 338 HE21 GLN 38 HE21 GLN 38 -4.328 8.770 9.935 339 HE22 GLN 38 HE22 GLN 38 -4.377 8.162 8.285 340 H GLN 39 H GLN 39 -6.598 7.818 4.756 341 HA GLN 39 HA GLN 39 -4.402 6.025 4.645 342 HB2 GLN 39 HB2 GLN 39 -7.244 5.894 3.679 343 HB3 GLN 39 HB3 GLN 39 -6.158 4.540 3.444 344 HG2 GLN 39 HG2 GLN 39 -6.491 5.676 6.227 345 HG3 GLN 39 HG3 GLN 39 -7.772 4.684 5.543 346 HE21 GLN 39 HE21 GLN 39 -4.821 2.692 7.221 347 HE22 GLN 39 HE22 GLN 39 -5.170 4.393 7.538 348 H LYS 40 H LYS 40 -6.215 7.561 1.933 349 HA LYS 40 HA LYS 40 -4.726 6.206 -0.102 350 HB2 LYS 40 HB2 LYS 40 -5.939 7.386 -1.641 351 HB3 LYS 40 HB3 LYS 40 -7.017 7.375 -0.245 352 HG2 LYS 40 HG2 LYS 40 -5.993 9.683 0.321 353 HG3 LYS 40 HG3 LYS 40 -5.344 9.648 -1.328 354 HD2 LYS 40 HD2 LYS 40 -8.288 9.461 -0.520 355 HD3 LYS 40 HD3 LYS 40 -7.482 10.900 -1.164 356 HE2 LYS 40 HE2 LYS 40 -7.009 9.692 -3.285 357 HE3 LYS 40 HE3 LYS 40 -7.814 8.251 -2.648 358 HZ1 LYS 40 HZ1 LYS 40 -9.138 10.875 -3.092 359 HZ2 LYS 40 HZ2 LYS 40 -9.314 9.559 -4.039 360 HZ3 LYS 40 HZ3 LYS 40 -9.877 9.538 -2.508 361 H ILE 41 H ILE 41 -4.026 9.247 1.632 362 HA ILE 41 HA ILE 41 -1.812 9.987 -0.085 363 HB ILE 41 HB ILE 41 -2.381 10.792 2.756 364 HG12 ILE 41 HG12 ILE 41 -2.938 12.433 0.232 365 HG13 ILE 41 HG13 ILE 41 -4.158 11.371 0.911 366 HG21 ILE 41 HG21 ILE 41 -0.517 12.030 0.688 367 HG22 ILE 41 HG22 ILE 41 -0.924 12.770 2.249 368 HG23 ILE 41 HG23 ILE 41 -0.046 11.252 2.216 369 HD11 ILE 41 HD11 ILE 41 -2.936 13.764 2.318 370 HD12 ILE 41 HD12 ILE 41 -4.598 13.560 1.733 371 HD13 ILE 41 HD13 ILE 41 -4.012 12.568 3.082 372 H ILE 42 H ILE 42 -2.015 8.214 3.083 373 HA ILE 42 HA ILE 42 0.806 7.804 3.369 374 HB ILE 42 HB ILE 42 -1.529 6.068 4.230 375 HG12 ILE 42 HG12 ILE 42 0.062 7.904 6.049 376 HG13 ILE 42 HG13 ILE 42 -1.310 8.522 5.136 377 HG21 ILE 42 HG21 ILE 42 1.389 6.007 5.138 378 HG22 ILE 42 HG22 ILE 42 0.072 5.113 5.914 379 HG23 ILE 42 HG23 ILE 42 0.532 4.717 4.269 380 HD11 ILE 42 HD11 ILE 42 -1.451 6.201 7.102 381 HD12 ILE 42 HD12 ILE 42 -2.050 7.848 7.349 382 HD13 ILE 42 HD13 ILE 42 -2.789 6.811 6.104 383 H LEU 43 H LEU 43 -1.673 5.874 1.713 384 HA LEU 43 HA LEU 43 0.003 3.777 0.717 385 HB2 LEU 43 HB2 LEU 43 -2.385 3.581 0.894 386 HB3 LEU 43 HB3 LEU 43 -2.666 4.977 -0.110 387 HG LEU 43 HG LEU 43 -3.211 2.748 -1.081 388 HD11 LEU 43 HD11 LEU 43 -1.250 4.285 -2.800 389 HD12 LEU 43 HD12 LEU 43 -2.645 3.324 -3.298 390 HD13 LEU 43 HD13 LEU 43 -2.895 4.844 -2.417 391 HD21 LEU 43 HD21 LEU 43 -1.485 1.346 -0.412 392 HD22 LEU 43 HD22 LEU 43 -1.355 1.471 -2.165 393 HD23 LEU 43 HD23 LEU 43 -0.200 2.344 -1.126 394 H ALA 44 H ALA 44 -1.049 6.855 -0.828 395 HA ALA 44 HA ALA 44 0.367 6.468 -3.255 396 HB1 ALA 44 HB1 ALA 44 -0.605 8.979 -1.851 397 HB2 ALA 44 HB2 ALA 44 -0.098 8.898 -3.554 398 HB3 ALA 44 HB3 ALA 44 -1.527 7.990 -3.009 399 H GLU 45 H GLU 45 1.316 8.463 -0.367 400 HA GLU 45 HA GLU 45 3.766 9.402 -1.461 401 HB2 GLU 45 HB2 GLU 45 2.840 8.957 1.400 402 HB3 GLU 45 HB3 GLU 45 4.377 9.716 1.010 403 HG2 GLU 45 HG2 GLU 45 1.704 10.789 0.012 404 HG3 GLU 45 HG3 GLU 45 2.482 11.306 1.503 405 H TYR 46 H TYR 46 3.056 6.234 -0.119 406 HA TYR 46 HA TYR 46 5.827 5.463 0.307 407 HB2 TYR 46 HB2 TYR 46 3.954 4.487 1.527 408 HB3 TYR 46 HB3 TYR 46 3.232 3.911 0.037 409 HD1 TYR 46 HD1 TYR 46 3.020 1.773 1.204 410 HD2 TYR 46 HD2 TYR 46 6.887 3.459 0.271 411 HE1 TYR 46 HE1 TYR 46 4.094 -0.443 1.590 412 HE2 TYR 46 HE2 TYR 46 7.941 1.245 0.660 413 HH TYR 46 HH TYR 46 6.044 -1.601 1.699 414 H ILE 47 H ILE 47 3.418 4.497 -2.189 415 HA ILE 47 HA ILE 47 5.082 3.205 -4.059 416 HB ILE 47 HB ILE 47 2.479 4.692 -4.145 417 HG12 ILE 47 HG12 ILE 47 3.185 1.734 -4.361 418 HG13 ILE 47 HG13 ILE 47 2.869 2.492 -2.823 419 HG21 ILE 47 HG21 ILE 47 3.720 3.078 -6.415 420 HG22 ILE 47 HG22 ILE 47 2.028 3.626 -6.360 421 HG23 ILE 47 HG23 ILE 47 3.316 4.807 -6.451 422 HD11 ILE 47 HD11 ILE 47 0.809 2.281 -5.054 423 HD12 ILE 47 HD12 ILE 47 0.864 1.346 -3.552 424 HD13 ILE 47 HD13 ILE 47 0.582 3.095 -3.501 425 H ALA 48 H ALA 48 4.273 6.699 -3.682 426 HA ALA 48 HA ALA 48 5.582 7.597 -6.073 427 HB1 ALA 48 HB1 ALA 48 4.874 9.015 -3.475 428 HB2 ALA 48 HB2 ALA 48 5.278 9.816 -5.013 429 HB3 ALA 48 HB3 ALA 48 3.809 8.823 -4.884 430 H GLU 49 H GLU 49 6.866 6.733 -2.916 431 HA GLU 49 HA GLU 49 9.447 8.095 -3.416 432 HB2 GLU 49 HB2 GLU 49 8.269 8.177 -1.195 433 HB3 GLU 49 HB3 GLU 49 8.534 6.440 -1.040 434 HG2 GLU 49 HG2 GLU 49 10.198 7.553 0.245 435 HG3 GLU 49 HG3 GLU 49 11.019 6.872 -1.144 436 H VAL 50 H VAL 50 8.085 4.756 -3.449 437 HA VAL 50 HA VAL 50 10.848 3.758 -4.066 438 HB VAL 50 HB VAL 50 10.441 1.756 -2.943 439 HG11 VAL 50 HG11 VAL 50 9.391 3.934 -1.099 440 HG12 VAL 50 HG12 VAL 50 10.234 2.442 -0.642 441 HG13 VAL 50 HG13 VAL 50 11.102 3.703 -1.536 442 HG21 VAL 50 HG21 VAL 50 8.095 1.290 -3.411 443 HG22 VAL 50 HG22 VAL 50 8.403 1.219 -1.686 444 HG23 VAL 50 HG23 VAL 50 7.570 2.624 -2.383 445 H GLY 51 H GLY 51 7.603 3.890 -5.275 446 HA2 GLY 51 HA2 GLY 51 6.842 3.186 -7.365 447 HA3 GLY 51 HA3 GLY 51 8.284 2.203 -7.609 448 H LEU 52 H LEU 52 5.328 1.604 -7.812 449 HA LEU 52 HA LEU 52 4.488 0.100 -5.593 450 HB2 LEU 52 HB2 LEU 52 3.329 1.197 -7.761 451 HB3 LEU 52 HB3 LEU 52 3.366 -0.442 -8.359 452 HG LEU 52 HG LEU 52 2.130 0.281 -5.666 453 HD11 LEU 52 HD11 LEU 52 0.822 0.293 -8.400 454 HD12 LEU 52 HD12 LEU 52 -0.012 0.515 -6.835 455 HD13 LEU 52 HD13 LEU 52 1.171 1.709 -7.380 456 HD21 LEU 52 HD21 LEU 52 2.262 -2.074 -5.832 457 HD22 LEU 52 HD22 LEU 52 0.604 -1.667 -6.244 458 HD23 LEU 52 HD23 LEU 52 1.766 -2.074 -7.535 459 H GLN 53 H GLN 53 6.793 -0.759 -7.658 460 HA GLN 53 HA GLN 53 6.433 -3.717 -7.677 461 HB2 GLN 53 HB2 GLN 53 8.538 -1.878 -8.880 462 HB3 GLN 53 HB3 GLN 53 8.531 -3.639 -9.053 463 HG2 GLN 53 HG2 GLN 53 6.423 -3.610 -10.244 464 HG3 GLN 53 HG3 GLN 53 6.192 -1.885 -9.941 465 HE21 GLN 53 HE21 GLN 53 8.494 -0.788 -12.422 466 HE22 GLN 53 HE22 GLN 53 7.743 -0.351 -10.887 467 H ASN 54 H ASN 54 7.954 -1.287 -5.759 468 HA ASN 54 HA ASN 54 9.802 -3.271 -4.507 469 HB2 ASN 54 HB2 ASN 54 9.967 -0.243 -4.505 470 HB3 ASN 54 HB3 ASN 54 11.174 -1.352 -3.862 471 HD21 ASN 54 HD21 ASN 54 11.350 -0.361 -7.733 472 HD22 ASN 54 HD22 ASN 54 10.443 0.524 -6.502 473 H ILE 55 H ILE 55 6.894 -1.820 -3.895 474 HA ILE 55 HA ILE 55 7.070 -1.832 -0.966 475 HB ILE 55 HB ILE 55 4.728 -1.498 -0.910 476 HG12 ILE 55 HG12 ILE 55 4.627 -2.043 -3.895 477 HG13 ILE 55 HG13 ILE 55 3.956 -3.062 -2.618 478 HG21 ILE 55 HG21 ILE 55 5.670 0.219 -3.234 479 HG22 ILE 55 HG22 ILE 55 4.551 0.641 -1.911 480 HG23 ILE 55 HG23 ILE 55 6.256 0.406 -1.574 481 HD11 ILE 55 HD11 ILE 55 3.022 -0.302 -3.432 482 HD12 ILE 55 HD12 ILE 55 2.130 -1.829 -3.511 483 HD13 ILE 55 HD13 ILE 55 2.502 -1.110 -1.933 484 H THR 56 H THR 56 5.873 -3.325 0.383 485 HA THR 56 HA THR 56 5.359 -6.019 -0.776 486 HB THR 56 HB THR 56 6.161 -6.723 1.673 487 HG1 THR 56 HG1 THR 56 7.935 -5.476 2.308 488 HG21 THR 56 HG21 THR 56 8.173 -5.965 -0.495 489 HG22 THR 56 HG22 THR 56 8.437 -7.135 0.820 490 HG23 THR 56 HG23 THR 56 7.243 -7.479 -0.442 491 H ALA 57 H ALA 57 3.620 -7.158 0.109 492 HA ALA 57 HA ALA 57 1.460 -5.679 1.185 493 HB1 ALA 57 HB1 ALA 57 1.993 -8.690 1.189 494 HB2 ALA 57 HB2 ALA 57 0.426 -7.901 1.445 495 HB3 ALA 57 HB3 ALA 57 1.226 -7.778 -0.128 496 H ILE 58 H ILE 58 4.074 -7.438 2.747 497 HA ILE 58 HA ILE 58 3.056 -7.599 5.434 498 HB ILE 58 HB ILE 58 5.850 -7.484 4.216 499 HG12 ILE 58 HG12 ILE 58 6.001 -9.846 5.026 500 HG13 ILE 58 HG13 ILE 58 4.344 -9.769 5.612 501 HG21 ILE 58 HG21 ILE 58 5.069 -7.821 7.156 502 HG22 ILE 58 HG22 ILE 58 6.682 -8.209 6.507 503 HG23 ILE 58 HG23 ILE 58 6.095 -6.551 6.463 504 HD11 ILE 58 HD11 ILE 58 5.139 -9.484 2.681 505 HD12 ILE 58 HD12 ILE 58 4.665 -11.007 3.457 506 HD13 ILE 58 HD13 ILE 58 3.489 -9.698 3.337 507 H THR 59 H THR 59 5.098 -5.180 3.749 508 HA THR 59 HA THR 59 5.267 -3.447 6.074 509 HB THR 59 HB THR 59 6.110 -3.166 3.179 510 HG1 THR 59 HG1 THR 59 8.043 -3.799 3.933 511 HG21 THR 59 HG21 THR 59 6.826 -1.443 5.593 512 HG22 THR 59 HG22 THR 59 7.631 -1.389 4.002 513 HG23 THR 59 HG23 THR 59 5.930 -0.919 4.145 514 H LEU 60 H LEU 60 3.500 -3.340 2.934 515 HA LEU 60 HA LEU 60 2.164 -0.898 3.414 516 HB2 LEU 60 HB2 LEU 60 2.434 -2.178 1.237 517 HB3 LEU 60 HB3 LEU 60 1.240 -3.319 1.812 518 HG LEU 60 HG LEU 60 -0.404 -1.336 1.965 519 HD11 LEU 60 HD11 LEU 60 1.821 -0.003 0.357 520 HD12 LEU 60 HD12 LEU 60 0.215 0.662 0.662 521 HD13 LEU 60 HD13 LEU 60 1.315 0.469 2.008 522 HD21 LEU 60 HD21 LEU 60 -0.462 -2.903 0.092 523 HD22 LEU 60 HD22 LEU 60 -0.797 -1.257 -0.465 524 HD23 LEU 60 HD23 LEU 60 0.795 -1.995 -0.752 525 H SER 61 H SER 61 1.256 -4.245 4.384 526 HA SER 61 HA SER 61 -1.191 -3.782 5.618 527 HB2 SER 61 HB2 SER 61 -0.319 -5.973 5.357 528 HB3 SER 61 HB3 SER 61 1.068 -5.618 6.399 529 HG SER 61 HG SER 61 -0.465 -6.745 7.571 530 H LYS 62 H LYS 62 1.947 -2.833 6.596 531 HA LYS 62 HA LYS 62 1.058 -2.074 9.310 532 HB2 LYS 62 HB2 LYS 62 3.840 -2.605 8.219 533 HB3 LYS 62 HB3 LYS 62 3.528 -1.941 9.830 534 HG2 LYS 62 HG2 LYS 62 2.139 -3.919 10.399 535 HG3 LYS 62 HG3 LYS 62 2.483 -4.624 8.810 536 HD2 LYS 62 HD2 LYS 62 4.912 -4.612 9.337 537 HD3 LYS 62 HD3 LYS 62 4.547 -3.919 10.936 538 HE2 LYS 62 HE2 LYS 62 3.139 -5.917 11.454 539 HE3 LYS 62 HE3 LYS 62 3.558 -6.610 9.882 540 HZ1 LYS 62 HZ1 LYS 62 5.500 -5.994 12.052 541 HZ2 LYS 62 HZ2 LYS 62 4.982 -7.486 11.647 542 HZ3 LYS 62 HZ3 LYS 62 5.896 -6.631 10.599 543 H LYS 63 H LYS 63 2.219 -0.556 6.342 544 HA LYS 63 HA LYS 63 2.754 2.089 7.351 545 HB2 LYS 63 HB2 LYS 63 1.612 0.988 4.741 546 HB3 LYS 63 HB3 LYS 63 1.979 2.695 4.959 547 HG2 LYS 63 HG2 LYS 63 4.062 0.474 5.139 548 HG3 LYS 63 HG3 LYS 63 3.672 1.393 3.699 549 HD2 LYS 63 HD2 LYS 63 4.292 3.503 4.971 550 HD3 LYS 63 HD3 LYS 63 4.887 2.443 6.276 551 HE2 LYS 63 HE2 LYS 63 6.405 1.323 4.656 552 HE3 LYS 63 HE3 LYS 63 5.804 2.372 3.364 553 HZ1 LYS 63 HZ1 LYS 63 7.251 3.313 5.786 554 HZ2 LYS 63 HZ2 LYS 63 7.889 3.211 4.288 555 HZ3 LYS 63 HZ3 LYS 63 6.696 4.283 4.593 556 H LEU 64 H LEU 64 -0.163 0.414 6.439 557 HA LEU 64 HA LEU 64 -1.907 2.771 6.968 558 HB2 LEU 64 HB2 LEU 64 -1.974 0.329 5.191 559 HB3 LEU 64 HB3 LEU 64 -3.388 1.367 5.354 560 HG LEU 64 HG LEU 64 -0.737 2.591 4.551 561 HD11 LEU 64 HD11 LEU 64 -2.596 1.103 2.654 562 HD12 LEU 64 HD12 LEU 64 -1.150 2.059 2.219 563 HD13 LEU 64 HD13 LEU 64 -0.981 0.569 3.165 564 HD21 LEU 64 HD21 LEU 64 -2.739 4.011 4.977 565 HD22 LEU 64 HD22 LEU 64 -2.185 4.069 3.289 566 HD23 LEU 64 HD23 LEU 64 -3.620 3.115 3.714 567 H ASN 65 H ASN 65 -1.012 0.187 8.724 568 HA ASN 65 HA ASN 65 -1.891 -1.340 10.122 569 HB2 ASN 65 HB2 ASN 65 -3.260 -0.427 11.927 570 HB3 ASN 65 HB3 ASN 65 -1.860 0.544 11.529 571 HD21 ASN 65 HD21 ASN 65 -3.737 3.436 10.735 572 HD22 ASN 65 HD22 ASN 65 -2.162 2.665 10.624 573 H ILE 66 H ILE 66 -2.625 -2.375 8.084 574 HA ILE 66 HA ILE 66 -5.540 -3.054 8.157 575 HB ILE 66 HB ILE 66 -4.964 -3.504 5.562 576 HG12 ILE 66 HG12 ILE 66 -3.399 -0.985 6.012 577 HG13 ILE 66 HG13 ILE 66 -2.539 -2.479 5.989 578 HG21 ILE 66 HG21 ILE 66 -5.703 -0.832 6.799 579 HG22 ILE 66 HG22 ILE 66 -5.993 -1.309 5.115 580 HG23 ILE 66 HG23 ILE 66 -6.799 -2.186 6.429 581 HD11 ILE 66 HD11 ILE 66 -4.152 -1.275 3.704 582 HD12 ILE 66 HD12 ILE 66 -2.411 -1.624 3.769 583 HD13 ILE 66 HD13 ILE 66 -3.587 -2.955 3.687 584 H THR 67 H THR 67 -5.534 -5.165 6.391 585 HA THR 67 HA THR 67 -3.944 -7.252 7.784 586 HB THR 67 HB THR 67 -5.365 -8.844 7.111 587 HG1 THR 67 HG1 THR 67 -6.698 -8.690 5.284 588 HG21 THR 67 HG21 THR 67 -7.336 -6.538 6.789 589 HG22 THR 67 HG22 THR 67 -7.678 -8.204 7.293 590 HG23 THR 67 HG23 THR 67 -6.759 -7.138 8.369 591 H VAL 68 H VAL 68 -2.705 -8.794 6.574 592 HA VAL 68 HA VAL 68 -1.046 -7.694 4.484 593 HB VAL 68 HB VAL 68 -1.444 -10.567 5.392 594 HG11 VAL 68 HG11 VAL 68 0.733 -9.350 3.626 595 HG12 VAL 68 HG12 VAL 68 0.787 -10.979 4.333 596 HG13 VAL 68 HG13 VAL 68 -0.449 -10.588 3.139 597 HG21 VAL 68 HG21 VAL 68 -0.531 -9.114 7.168 598 HG22 VAL 68 HG22 VAL 68 0.715 -10.207 6.568 599 HG23 VAL 68 HG23 VAL 68 0.713 -8.507 6.050 600 H GLU 69 H GLU 69 -4.157 -9.387 4.347 601 HA GLU 69 HA GLU 69 -3.757 -10.125 1.502 602 HB2 GLU 69 HB2 GLU 69 -6.095 -10.428 3.450 603 HB3 GLU 69 HB3 GLU 69 -6.203 -10.801 1.734 604 HG2 GLU 69 HG2 GLU 69 -5.824 -12.850 2.888 605 HG3 GLU 69 HG3 GLU 69 -4.406 -12.464 1.923 606 H LYS 70 H LYS 70 -5.414 -7.640 3.501 607 HA LYS 70 HA LYS 70 -6.804 -6.459 1.318 608 HB2 LYS 70 HB2 LYS 70 -7.258 -6.260 3.835 609 HB3 LYS 70 HB3 LYS 70 -5.974 -5.050 3.883 610 HG2 LYS 70 HG2 LYS 70 -7.805 -4.502 1.669 611 HG3 LYS 70 HG3 LYS 70 -8.727 -4.782 3.159 612 HD2 LYS 70 HD2 LYS 70 -7.344 -3.053 4.281 613 HD3 LYS 70 HD3 LYS 70 -6.523 -2.738 2.725 614 HE2 LYS 70 HE2 LYS 70 -8.811 -2.283 1.729 615 HE3 LYS 70 HE3 LYS 70 -9.507 -2.460 3.346 616 HZ1 LYS 70 HZ1 LYS 70 -7.553 -0.399 2.483 617 HZ2 LYS 70 HZ2 LYS 70 -9.121 -0.140 2.839 618 HZ3 LYS 70 HZ3 LYS 70 -8.091 -0.554 4.038 619 H ALA 71 H ALA 71 -3.733 -5.761 2.874 620 HA ALA 71 HA ALA 71 -2.738 -3.681 1.225 621 HB1 ALA 71 HB1 ALA 71 -1.314 -5.965 2.659 622 HB2 ALA 71 HB2 ALA 71 -0.542 -4.507 2.032 623 HB3 ALA 71 HB3 ALA 71 -1.727 -4.383 3.341 624 H LYS 72 H LYS 72 -2.595 -7.248 0.756 625 HA LYS 72 HA LYS 72 -0.964 -7.202 -1.604 626 HB2 LYS 72 HB2 LYS 72 -1.210 -9.038 0.070 627 HB3 LYS 72 HB3 LYS 72 -2.842 -9.336 -0.554 628 HG2 LYS 72 HG2 LYS 72 -1.848 -9.947 -2.745 629 HG3 LYS 72 HG3 LYS 72 -0.240 -9.500 -2.135 630 HD2 LYS 72 HD2 LYS 72 -0.475 -11.917 -1.989 631 HD3 LYS 72 HD3 LYS 72 -0.469 -11.237 -0.339 632 HE2 LYS 72 HE2 LYS 72 -2.832 -11.412 -0.140 633 HE3 LYS 72 HE3 LYS 72 -3.021 -11.855 -1.845 634 HZ1 LYS 72 HZ1 LYS 72 -1.635 -13.519 0.204 635 HZ2 LYS 72 HZ2 LYS 72 -3.115 -13.829 -0.410 636 HZ3 LYS 72 HZ3 LYS 72 -1.802 -13.924 -1.370 637 H ASN 73 H ASN 73 -4.432 -6.990 -1.056 638 HA ASN 73 HA ASN 73 -5.257 -7.542 -3.660 639 HB2 ASN 73 HB2 ASN 73 -7.214 -7.398 -2.611 640 HB3 ASN 73 HB3 ASN 73 -6.465 -6.665 -1.213 641 HD21 ASN 73 HD21 ASN 73 -7.578 -3.380 -1.981 642 HD22 ASN 73 HD22 ASN 73 -6.447 -4.331 -1.021 643 H TYR 74 H TYR 74 -3.965 -4.487 -2.388 644 HA TYR 74 HA TYR 74 -4.383 -2.890 -4.753 645 HB2 TYR 74 HB2 TYR 74 -2.259 -2.639 -2.613 646 HB3 TYR 74 HB3 TYR 74 -2.732 -1.405 -3.774 647 HD1 TYR 74 HD1 TYR 74 -5.403 -0.831 -3.735 648 HD2 TYR 74 HD2 TYR 74 -3.089 -2.455 -0.484 649 HE1 TYR 74 HE1 TYR 74 -7.087 0.031 -2.114 650 HE2 TYR 74 HE2 TYR 74 -4.790 -1.600 1.146 651 HH TYR 74 HH TYR 74 -7.742 0.115 0.051 652 H ILE 75 H ILE 75 -1.656 -4.875 -3.539 653 HA ILE 75 HA ILE 75 0.063 -4.358 -5.763 654 HB ILE 75 HB ILE 75 0.062 -6.656 -3.770 655 HG12 ILE 75 HG12 ILE 75 1.562 -3.994 -3.783 656 HG13 ILE 75 HG13 ILE 75 0.171 -4.342 -2.761 657 HG21 ILE 75 HG21 ILE 75 2.256 -5.650 -5.645 658 HG22 ILE 75 HG22 ILE 75 2.493 -6.851 -4.357 659 HG23 ILE 75 HG23 ILE 75 1.453 -7.234 -5.715 660 HD11 ILE 75 HD11 ILE 75 2.913 -5.604 -2.541 661 HD12 ILE 75 HD12 ILE 75 2.068 -4.560 -1.388 662 HD13 ILE 75 HD13 ILE 75 1.461 -6.198 -1.694 663 H LYS 76 H LYS 76 -2.636 -6.624 -5.481 664 HA LYS 76 HA LYS 76 -1.903 -8.107 -7.903 665 HB2 LYS 76 HB2 LYS 76 -4.412 -8.037 -6.183 666 HB3 LYS 76 HB3 LYS 76 -4.222 -9.092 -7.574 667 HG2 LYS 76 HG2 LYS 76 -2.271 -9.236 -5.246 668 HG3 LYS 76 HG3 LYS 76 -3.844 -10.008 -5.199 669 HD2 LYS 76 HD2 LYS 76 -2.459 -11.736 -5.883 670 HD3 LYS 76 HD3 LYS 76 -3.239 -11.214 -7.361 671 HE2 LYS 76 HE2 LYS 76 -0.980 -11.625 -7.916 672 HE3 LYS 76 HE3 LYS 76 -1.140 -9.874 -7.905 673 HZ1 LYS 76 HZ1 LYS 76 -0.006 -11.525 -5.701 674 HZ2 LYS 76 HZ2 LYS 76 0.864 -10.614 -6.733 675 HZ3 LYS 76 HZ3 LYS 76 -0.132 -9.893 -5.657 676 H ASN 77 H ASN 77 -4.106 -5.332 -7.201 677 HA ASN 77 HA ASN 77 -5.085 -5.526 -9.989 678 HB2 ASN 77 HB2 ASN 77 -6.847 -4.249 -9.434 679 HB3 ASN 77 HB3 ASN 77 -6.639 -5.194 -7.962 680 HD21 ASN 77 HD21 ASN 77 -6.117 -2.300 -5.993 681 HD22 ASN 77 HD22 ASN 77 -6.039 -4.067 -6.011 682 H SER 78 H SER 78 -3.252 -3.307 -7.860 683 HA SER 78 HA SER 78 -3.411 -1.207 -9.794 684 HB2 SER 78 HB2 SER 78 -1.797 -1.234 -7.225 685 HB3 SER 78 HB3 SER 78 -2.363 0.178 -8.120 686 HG SER 78 HG SER 78 -4.562 -0.768 -7.700 687 H ASN 79 H ASN 79 -1.170 -3.733 -9.598 688 HA ASN 79 HA ASN 79 1.278 -2.313 -9.699 689 HB2 ASN 79 HB2 ASN 79 2.344 -4.427 -10.086 690 HB3 ASN 79 HB3 ASN 79 1.042 -4.635 -8.921 691 HD21 ASN 79 HD21 ASN 79 -0.667 -7.002 -10.890 692 HD22 ASN 79 HD22 ASN 79 -0.428 -6.233 -9.320 693 H ARG 80 H ARG 80 2.771 -1.882 -11.251 694 HA ARG 80 HA ARG 80 3.414 -0.723 -13.085 695 HB2 ARG 80 HB2 ARG 80 2.177 -3.122 -14.491 696 HB3 ARG 80 HB3 ARG 80 3.121 -1.883 -15.299 697 HG2 ARG 80 HG2 ARG 80 4.722 -3.439 -14.967 698 HG3 ARG 80 HG3 ARG 80 4.995 -2.374 -13.595 699 HD2 ARG 80 HD2 ARG 80 3.778 -3.996 -12.133 700 HD3 ARG 80 HD3 ARG 80 3.498 -5.041 -13.524 701 HE ARG 80 HE ARG 80 6.059 -4.543 -12.107 702 HH11 ARG 80 HH11 ARG 80 7.847 -5.682 -12.583 703 HH12 ARG 80 HH12 ARG 80 7.832 -6.857 -13.869 704 HH21 ARG 80 HH21 ARG 80 4.635 -6.126 -14.892 705 HH22 ARG 80 HH22 ARG 80 6.078 -7.060 -15.189 706 H LEU 81 H LEU 81 0.726 0.004 -12.028 707 HA LEU 81 HA LEU 81 0.050 1.891 -14.234 708 HB2 LEU 81 HB2 LEU 81 -1.496 0.013 -14.491 709 HB3 LEU 81 HB3 LEU 81 -1.903 0.064 -12.777 710 HG LEU 81 HG LEU 81 -2.993 2.272 -13.073 711 HD11 LEU 81 HD11 LEU 81 -2.342 1.884 -16.026 712 HD12 LEU 81 HD12 LEU 81 -3.470 3.093 -15.374 713 HD13 LEU 81 HD13 LEU 81 -1.747 3.189 -14.973 714 HD21 LEU 81 HD21 LEU 81 -4.289 0.211 -13.266 715 HD22 LEU 81 HD22 LEU 81 -4.926 1.469 -14.342 716 HD23 LEU 81 HD23 LEU 81 -3.950 0.141 -15.013 717 H GLY 82 H GLY 82 -0.462 1.059 -10.774 718 HA2 GLY 82 HA2 GLY 82 -0.496 2.498 -8.934 719 HA3 GLY 82 HA3 GLY 82 -0.305 3.892 -10.002 720 H ARG 83 H ARG 83 -2.199 4.548 -11.257 721 HA ARG 83 HA ARG 83 -4.880 3.922 -10.067 722 HB2 ARG 83 HB2 ARG 83 -3.546 6.637 -10.022 723 HB3 ARG 83 HB3 ARG 83 -5.305 6.430 -9.948 724 HG2 ARG 83 HG2 ARG 83 -5.120 5.012 -7.963 725 HG3 ARG 83 HG3 ARG 83 -3.357 5.132 -7.992 726 HD2 ARG 83 HD2 ARG 83 -5.220 7.511 -7.728 727 HD3 ARG 83 HD3 ARG 83 -4.538 6.654 -6.349 728 HE ARG 83 HE ARG 83 -3.183 8.567 -8.079 729 HH11 ARG 83 HH11 ARG 83 -1.063 9.117 -7.723 730 HH12 ARG 83 HH12 ARG 83 -0.076 8.156 -6.666 731 HH21 ARG 83 HH21 ARG 83 -2.540 5.897 -5.900 732 HH22 ARG 83 HH22 ARG 83 -0.876 6.364 -5.679 733 H THR 84 H THR 84 -3.681 6.410 -12.334 734 HA THR 84 HA THR 84 -4.813 5.122 -14.672 735 HB THR 84 HB THR 84 -6.908 5.714 -13.834 736 HG1 THR 84 HG1 THR 84 -7.635 7.089 -15.431 737 HG21 THR 84 HG21 THR 84 -6.066 8.604 -13.426 738 HG22 THR 84 HG22 THR 84 -7.694 7.926 -13.235 739 HG23 THR 84 HG23 THR 84 -6.400 7.410 -12.150 740 H ASN 85 H ASN 85 -2.687 5.431 -15.345 741 HA ASN 85 HA ASN 85 -1.986 8.175 -16.259 742 HB2 ASN 85 HB2 ASN 85 -0.236 6.355 -14.542 743 HB3 ASN 85 HB3 ASN 85 0.374 7.743 -15.426 744 HD21 ASN 85 HD21 ASN 85 -1.427 8.354 -11.878 745 HD22 ASN 85 HD22 ASN 85 -1.114 6.736 -12.504 746 H ASN 86 H ASN 86 -0.943 8.268 -18.174 747 HA ASN 86 HA ASN 86 0.191 5.857 -19.452 748 HB2 ASN 86 HB2 ASN 86 -2.210 5.842 -20.075 749 HB3 ASN 86 HB3 ASN 86 -2.089 7.514 -20.625 750 HD21 ASN 86 HD21 ASN 86 -1.334 6.329 -23.863 751 HD22 ASN 86 HD22 ASN 86 -2.259 7.439 -22.859 752 H LEU 87 H LEU 87 1.633 6.328 -21.144 753 HA LEU 87 HA LEU 87 3.385 7.365 -22.050 754 HB2 LEU 87 HB2 LEU 87 1.254 8.355 -23.205 755 HB3 LEU 87 HB3 LEU 87 1.681 9.839 -22.370 756 HG LEU 87 HG LEU 87 3.956 9.726 -23.566 757 HD11 LEU 87 HD11 LEU 87 2.511 7.570 -25.170 758 HD12 LEU 87 HD12 LEU 87 4.047 8.347 -25.616 759 HD13 LEU 87 HD13 LEU 87 3.964 7.328 -24.176 760 HD21 LEU 87 HD21 LEU 87 2.128 11.190 -24.315 761 HD22 LEU 87 HD22 LEU 87 3.032 10.543 -25.693 762 HD23 LEU 87 HD23 LEU 87 1.441 9.863 -25.278 763 H LYS 88 H LYS 88 3.040 7.763 -19.131 764 HA LYS 88 HA LYS 88 5.116 9.849 -18.660 765 HB2 LYS 88 HB2 LYS 88 3.793 10.925 -16.934 766 HB3 LYS 88 HB3 LYS 88 2.903 10.918 -18.454 767 HG2 LYS 88 HG2 LYS 88 1.674 8.834 -17.601 768 HG3 LYS 88 HG3 LYS 88 2.426 9.111 -16.039 769 HD2 LYS 88 HD2 LYS 88 0.691 11.172 -17.485 770 HD3 LYS 88 HD3 LYS 88 0.077 9.988 -16.335 771 HE2 LYS 88 HE2 LYS 88 1.871 10.918 -14.692 772 HE3 LYS 88 HE3 LYS 88 1.993 12.287 -15.807 773 HZ1 LYS 88 HZ1 LYS 88 -0.472 11.350 -14.430 774 HZ2 LYS 88 HZ2 LYS 88 0.360 12.711 -14.057 775 HZ3 LYS 88 HZ3 LYS 88 -0.431 12.613 -15.484 776 H THR 89 H THR 89 4.756 6.745 -18.381 777 HA THR 89 HA THR 89 6.396 6.425 -16.054 778 HB THR 89 HB THR 89 4.229 6.500 -14.913 779 HG1 THR 89 HG1 THR 89 4.547 4.557 -13.838 780 HG21 THR 89 HG21 THR 89 3.470 3.954 -16.404 781 HG22 THR 89 HG22 THR 89 2.530 4.814 -15.167 782 HG23 THR 89 HG23 THR 89 2.775 5.552 -16.759 783 H ILE 90 H ILE 90 7.764 4.930 -16.563 784 HA ILE 90 HA ILE 90 7.060 2.643 -18.323 785 HB ILE 90 HB ILE 90 9.384 3.004 -19.312 786 HG12 ILE 90 HG12 ILE 90 10.095 4.744 -17.585 787 HG13 ILE 90 HG13 ILE 90 10.587 4.899 -19.257 788 HG21 ILE 90 HG21 ILE 90 7.223 5.008 -20.021 789 HG22 ILE 90 HG22 ILE 90 8.583 4.512 -21.052 790 HG23 ILE 90 HG23 ILE 90 7.348 3.333 -20.586 791 HD11 ILE 90 HD11 ILE 90 8.354 6.538 -17.985 792 HD12 ILE 90 HD12 ILE 90 10.013 7.064 -18.283 793 HD13 ILE 90 HD13 ILE 90 8.959 6.683 -19.649 794 H GLY 91 H GLY 91 8.013 3.212 -15.283 795 HA2 GLY 91 HA2 GLY 91 9.108 1.840 -13.707 796 HA3 GLY 91 HA3 GLY 91 9.702 0.800 -15.009 797 H ILE 92 H ILE 92 10.561 3.652 -16.147 798 HA ILE 92 HA ILE 92 12.548 4.627 -16.566 799 HB ILE 92 HB ILE 92 13.029 4.590 -13.568 800 HG12 ILE 92 HG12 ILE 92 12.194 7.066 -13.899 801 HG13 ILE 92 HG13 ILE 92 11.367 6.450 -15.324 802 HG21 ILE 92 HG21 ILE 92 14.064 6.405 -15.801 803 HG22 ILE 92 HG22 ILE 92 14.415 6.574 -14.068 804 HG23 ILE 92 HG23 ILE 92 15.020 5.175 -14.944 805 HD11 ILE 92 HD11 ILE 92 10.981 5.374 -12.487 806 HD12 ILE 92 HD12 ILE 92 9.981 6.636 -13.227 807 HD13 ILE 92 HD13 ILE 92 9.968 5.011 -13.906 808 H LEU 93 H LEU 93 13.116 2.978 -17.797 809 HA LEU 93 HA LEU 93 14.122 0.507 -17.141 810 HB2 LEU 93 HB2 LEU 93 14.576 2.226 -19.610 811 HB3 LEU 93 HB3 LEU 93 15.209 0.595 -19.450 812 HG LEU 93 HG LEU 93 12.881 -0.273 -19.107 813 HD11 LEU 93 HD11 LEU 93 12.095 2.540 -20.004 814 HD12 LEU 93 HD12 LEU 93 11.014 1.130 -19.980 815 HD13 LEU 93 HD13 LEU 93 11.658 1.745 -18.466 816 HD21 LEU 93 HD21 LEU 93 14.059 -0.393 -21.274 817 HD22 LEU 93 HD22 LEU 93 12.320 -0.160 -21.501 818 HD23 LEU 93 HD23 LEU 93 13.432 1.213 -21.711 819 H GLN 94 H GLN 94 15.557 0.317 -15.670 820 HA GLN 94 HA GLN 94 18.377 1.269 -16.135 821 HB2 GLN 94 HB2 GLN 94 18.607 1.563 -13.743 822 HB3 GLN 94 HB3 GLN 94 17.234 2.485 -14.349 823 HG2 GLN 94 HG2 GLN 94 15.763 0.466 -13.589 824 HG3 GLN 94 HG3 GLN 94 17.194 -0.091 -12.721 825 HE21 GLN 94 HE21 GLN 94 15.139 3.252 -11.433 826 HE22 GLN 94 HE22 GLN 94 14.910 2.645 -13.086 827 H GLU 95 H GLU 95 16.473 -1.502 -15.857 828 HA GLU 95 HA GLU 95 18.224 -3.285 -14.497 829 HB2 GLU 95 HB2 GLU 95 16.166 -4.026 -16.614 830 HB3 GLU 95 HB3 GLU 95 16.837 -5.047 -15.347 831 HG2 GLU 95 HG2 GLU 95 14.880 -4.550 -14.327 832 HG3 GLU 95 HG3 GLU 95 15.797 -3.176 -13.732 833 H GLU 96 H GLU 96 19.626 -4.913 -15.215 834 HA GLU 96 HA GLU 96 20.902 -4.473 -17.873 835 HB2 GLU 96 HB2 GLU 96 22.325 -4.204 -15.880 836 HB3 GLU 96 HB3 GLU 96 21.982 -5.871 -15.401 837 HG2 GLU 96 HG2 GLU 96 23.018 -6.694 -17.502 838 HG3 GLU 96 HG3 GLU 96 23.269 -5.034 -18.043 839 H VAL 97 H VAL 97 19.883 -5.595 -19.316 840 HA VAL 97 HA VAL 97 19.888 -8.561 -19.059 841 HB VAL 97 HB VAL 97 17.644 -6.942 -20.325 842 HG11 VAL 97 HG11 VAL 97 18.051 -9.953 -20.075 843 HG12 VAL 97 HG12 VAL 97 16.560 -9.166 -20.640 844 HG13 VAL 97 HG13 VAL 97 18.043 -9.014 -21.582 845 HG21 VAL 97 HG21 VAL 97 17.417 -6.941 -17.884 846 HG22 VAL 97 HG22 VAL 97 16.201 -7.998 -18.603 847 HG23 VAL 97 HG23 VAL 97 17.645 -8.704 -17.839 848 H SER 98 H SER 98 21.607 -8.956 -20.279 849 HA SER 98 HA SER 98 21.317 -8.930 -23.115 850 HB2 SER 98 HB2 SER 98 21.978 -6.598 -23.037 851 HB3 SER 98 HB3 SER 98 23.411 -6.984 -22.075 852 HG SER 98 HG SER 98 23.834 -6.743 -24.352 853 H SER 99 H SER 99 24.337 -8.653 -21.183 854 HA SER 99 HA SER 99 25.355 -11.135 -22.347 855 HB2 SER 99 HB2 SER 99 26.702 -9.063 -22.027 856 HB3 SER 99 HB3 SER 99 26.609 -9.304 -20.272 857 HG SER 99 HG SER 99 28.535 -10.173 -21.231 858 H MET 100 H MET 100 24.118 -10.140 -19.194 859 HA MET 100 HA MET 100 24.177 -12.970 -18.230 860 HB2 MET 100 HB2 MET 100 24.733 -10.423 -16.673 861 HB3 MET 100 HB3 MET 100 24.389 -11.970 -15.906 862 HG2 MET 100 HG2 MET 100 26.633 -11.883 -17.914 863 HG3 MET 100 HG3 MET 100 26.859 -11.071 -16.379 864 HE1 MET 100 HE1 MET 100 26.237 -14.502 -18.156 865 HE2 MET 100 HE2 MET 100 26.333 -15.664 -16.814 866 HE3 MET 100 HE3 MET 100 24.912 -14.619 -16.966 867 H GLU 101 H GLU 101 22.262 -13.758 -17.905 868 HA GLU 101 HA GLU 101 20.137 -12.230 -16.598 869 HB2 GLU 101 HB2 GLU 101 19.819 -11.775 -19.029 870 HB3 GLU 101 HB3 GLU 101 19.646 -13.494 -19.341 871 HG2 GLU 101 HG2 GLU 101 17.872 -11.941 -17.405 872 HG3 GLU 101 HG3 GLU 101 17.531 -12.046 -19.124 873 H ALA 102 H ALA 102 20.035 -13.623 -14.888 874 HA ALA 102 HA ALA 102 19.210 -16.418 -15.405 875 HB1 ALA 102 HB1 ALA 102 21.578 -15.707 -13.624 876 HB2 ALA 102 HB2 ALA 102 20.900 -17.332 -13.861 877 HB3 ALA 102 HB3 ALA 102 21.676 -16.495 -15.214 878 H LYS 103 H LYS 103 19.659 -14.009 -12.971 879 HA LYS 103 HA LYS 103 17.277 -14.934 -11.419 880 HB2 LYS 103 HB2 LYS 103 20.080 -14.528 -10.283 881 HB3 LYS 103 HB3 LYS 103 18.641 -14.684 -9.282 882 HG2 LYS 103 HG2 LYS 103 19.660 -16.842 -11.163 883 HG3 LYS 103 HG3 LYS 103 19.932 -16.771 -9.427 884 HD2 LYS 103 HD2 LYS 103 17.530 -16.915 -8.969 885 HD3 LYS 103 HD3 LYS 103 17.152 -16.949 -10.690 886 HE2 LYS 103 HE2 LYS 103 18.835 -19.045 -9.256 887 HE3 LYS 103 HE3 LYS 103 17.100 -19.178 -9.560 888 HZ1 LYS 103 HZ1 LYS 103 19.198 -19.005 -11.650 889 HZ2 LYS 103 HZ2 LYS 103 18.280 -20.308 -11.302 890 HZ3 LYS 103 HZ3 LYS 103 17.596 -18.979 -11.964 891 H SER 104 H SER 104 17.421 -12.721 -13.142 892 HA SER 104 HA SER 104 17.529 -10.320 -11.421 893 HB2 SER 104 HB2 SER 104 17.242 -9.117 -13.582 894 HB3 SER 104 HB3 SER 104 18.656 -10.182 -13.529 895 HG SER 104 HG SER 104 17.404 -10.383 -15.478 896 H MET 105 H MET 105 15.132 -12.520 -11.961 897 HA MET 105 HA MET 105 12.857 -10.828 -12.511 898 HB2 MET 105 HB2 MET 105 13.129 -13.633 -11.367 899 HB3 MET 105 HB3 MET 105 11.574 -12.863 -11.713 900 HG2 MET 105 HG2 MET 105 12.209 -12.582 -14.076 901 HG3 MET 105 HG3 MET 105 13.751 -13.393 -13.765 902 HE1 MET 105 HE1 MET 105 13.200 -15.011 -15.822 903 HE2 MET 105 HE2 MET 105 11.704 -15.963 -15.947 904 HE3 MET 105 HE3 MET 105 11.638 -14.191 -16.049 905 H THR 106 H THR 106 11.075 -10.405 -11.153 906 HA THR 106 HA THR 106 11.618 -10.155 -8.223 907 HB THR 106 HB THR 106 11.370 -7.989 -9.376 908 HG1 THR 106 HG1 THR 106 9.973 -7.195 -7.836 909 HG21 THR 106 HG21 THR 106 8.460 -8.813 -9.790 910 HG22 THR 106 HG22 THR 106 9.164 -7.212 -10.090 911 HG23 THR 106 HG23 THR 106 9.658 -8.590 -11.084 912 H TRP 107 H TRP 107 9.540 -10.159 -6.946 913 HA TRP 107 HA TRP 107 8.267 -12.783 -7.534 914 HB2 TRP 107 HB2 TRP 107 9.724 -12.407 -5.499 915 HB3 TRP 107 HB3 TRP 107 8.444 -11.388 -4.856 916 HD1 TRP 107 HD1 TRP 107 6.265 -12.622 -3.972 917 HE1 TRP 107 HE1 TRP 107 5.715 -15.069 -3.400 918 HE3 TRP 107 HE3 TRP 107 10.226 -14.897 -6.286 919 HZ2 TRP 107 HZ2 TRP 107 6.853 -17.680 -3.892 920 HZ3 TRP 107 HZ3 TRP 107 10.469 -17.370 -6.221 921 HH2 TRP 107 HH2 TRP 107 8.793 -18.768 -5.031 Start of MODEL 9 1 H1 GLY -5 H1 GLY -5 -15.633 -34.638 29.903 2 H2 GLY -5 H2 GLY -5 -15.620 -33.058 30.335 3 H3 GLY -5 H3 GLY -5 -14.234 -33.930 30.365 4 HA2 GLY -5 HA2 GLY -5 -15.773 -33.241 27.946 5 HA3 GLY -5 HA3 GLY -5 -14.252 -32.482 28.444 6 H SER -4 H SER -4 -13.792 -33.251 26.142 7 HA SER -4 HA SER -4 -12.460 -35.923 26.227 8 HB2 SER -4 HB2 SER -4 -13.201 -36.328 23.897 9 HB3 SER -4 HB3 SER -4 -14.512 -36.327 25.089 10 HG SER -4 HG SER -4 -15.092 -35.128 23.238 11 H HIS -3 H HIS -3 -12.743 -33.416 23.701 12 HA HIS -3 HA HIS -3 -9.857 -32.750 23.911 13 HB2 HIS -3 HB2 HIS -3 -10.117 -34.828 22.488 14 HB3 HIS -3 HB3 HIS -3 -11.038 -33.870 21.336 15 HD2 HIS -3 HD2 HIS -3 -7.569 -33.497 23.150 16 HE1 HIS -3 HE1 HIS -3 -6.971 -32.524 19.040 17 HE2 HIS -3 HE2 HIS -3 -5.835 -32.759 21.307 18 H MET -2 H MET -2 -11.385 -30.919 24.694 19 HA MET -2 HA MET -2 -11.406 -28.852 22.577 20 HB2 MET -2 HB2 MET -2 -13.712 -29.850 22.629 21 HB3 MET -2 HB3 MET -2 -13.832 -29.403 24.335 22 HG2 MET -2 HG2 MET -2 -13.587 -27.009 23.715 23 HG3 MET -2 HG3 MET -2 -13.371 -27.471 22.026 24 HE1 MET -2 HE1 MET -2 -15.828 -26.989 25.014 25 HE2 MET -2 HE2 MET -2 -17.362 -27.634 24.392 26 HE3 MET -2 HE3 MET -2 -16.032 -28.742 24.784 27 H ALA -1 H ALA -1 -10.848 -26.881 23.235 28 HA ALA -1 HA ALA -1 -10.941 -26.168 26.065 29 HB1 ALA -1 HB1 ALA -1 -8.328 -26.140 24.478 30 HB2 ALA -1 HB2 ALA -1 -8.547 -25.498 26.120 31 HB3 ALA -1 HB3 ALA -1 -8.715 -27.239 25.822 32 H SER 0 H SER 0 -10.681 -23.978 26.515 33 HA SER 0 HA SER 0 -10.899 -21.965 24.340 34 HB2 SER 0 HB2 SER 0 -13.003 -22.576 26.452 35 HB3 SER 0 HB3 SER 0 -12.955 -21.061 25.523 36 HG SER 0 HG SER 0 -14.364 -22.638 24.598 37 H MET 1 H MET 1 -10.468 -19.828 25.057 38 HA MET 1 HA MET 1 -9.809 -19.378 27.911 39 HB2 MET 1 HB2 MET 1 -7.758 -20.157 26.585 40 HB3 MET 1 HB3 MET 1 -7.820 -18.611 25.739 41 HG2 MET 1 HG2 MET 1 -7.648 -18.967 28.764 42 HG3 MET 1 HG3 MET 1 -6.254 -18.762 27.713 43 HE1 MET 1 HE1 MET 1 -5.488 -16.883 29.464 44 HE2 MET 1 HE2 MET 1 -6.467 -15.450 29.847 45 HE3 MET 1 HE3 MET 1 -7.011 -17.060 30.367 46 H ASP 2 H ASP 2 -10.923 -17.708 28.515 47 HA ASP 2 HA ASP 2 -12.441 -16.015 28.425 48 HB2 ASP 2 HB2 ASP 2 -9.853 -14.730 27.527 49 HB3 ASP 2 HB3 ASP 2 -11.265 -13.834 28.085 50 HA PRO 3 HA PRO 3 -13.161 -15.884 23.831 51 HB2 PRO 3 HB2 PRO 3 -15.157 -17.665 23.388 52 HB3 PRO 3 HB3 PRO 3 -13.485 -18.215 23.727 53 HG2 PRO 3 HG2 PRO 3 -15.765 -17.900 25.709 54 HG3 PRO 3 HG3 PRO 3 -14.757 -19.353 25.436 55 HD2 PRO 3 HD2 PRO 3 -14.169 -17.559 27.413 56 HD3 PRO 3 HD3 PRO 3 -12.894 -18.380 26.467 57 H LEU 4 H LEU 4 -15.041 -15.038 26.446 58 HA LEU 4 HA LEU 4 -16.912 -13.485 24.771 59 HB2 LEU 4 HB2 LEU 4 -18.834 -14.084 25.915 60 HB3 LEU 4 HB3 LEU 4 -18.046 -15.569 25.428 61 HG LEU 4 HG LEU 4 -17.889 -14.426 28.267 62 HD11 LEU 4 HD11 LEU 4 -19.726 -16.557 27.101 63 HD12 LEU 4 HD12 LEU 4 -19.618 -16.093 28.818 64 HD13 LEU 4 HD13 LEU 4 -20.216 -14.931 27.623 65 HD21 LEU 4 HD21 LEU 4 -16.104 -16.030 27.794 66 HD22 LEU 4 HD22 LEU 4 -17.297 -16.744 28.880 67 HD23 LEU 4 HD23 LEU 4 -17.299 -17.192 27.162 68 H ASP 5 H ASP 5 -14.525 -12.752 26.359 69 HA ASP 5 HA ASP 5 -15.722 -10.982 28.422 70 HB2 ASP 5 HB2 ASP 5 -12.923 -12.059 27.965 71 HB3 ASP 5 HB3 ASP 5 -13.374 -11.020 29.316 72 H LYS 6 H LYS 6 -14.887 -10.532 25.372 73 HA LYS 6 HA LYS 6 -13.676 -7.834 25.777 74 HB2 LYS 6 HB2 LYS 6 -11.915 -8.235 24.255 75 HB3 LYS 6 HB3 LYS 6 -11.897 -9.458 25.504 76 HG2 LYS 6 HG2 LYS 6 -12.755 -9.833 22.608 77 HG3 LYS 6 HG3 LYS 6 -11.262 -10.361 23.360 78 HD2 LYS 6 HD2 LYS 6 -12.733 -11.835 24.910 79 HD3 LYS 6 HD3 LYS 6 -14.052 -11.469 23.786 80 HE2 LYS 6 HE2 LYS 6 -13.283 -13.455 22.915 81 HE3 LYS 6 HE3 LYS 6 -12.426 -12.277 21.917 82 HZ1 LYS 6 HZ1 LYS 6 -11.332 -13.707 24.289 83 HZ2 LYS 6 HZ2 LYS 6 -10.921 -14.001 22.732 84 HZ3 LYS 6 HZ3 LYS 6 -10.489 -12.589 23.429 85 H ILE 7 H ILE 7 -15.620 -9.764 23.576 86 HA ILE 7 HA ILE 7 -16.469 -7.277 22.169 87 HB ILE 7 HB ILE 7 -16.459 -8.548 20.001 88 HG12 ILE 7 HG12 ILE 7 -14.839 -10.420 19.757 89 HG13 ILE 7 HG13 ILE 7 -14.723 -10.556 21.506 90 HG21 ILE 7 HG21 ILE 7 -13.716 -8.174 21.244 91 HG22 ILE 7 HG22 ILE 7 -14.143 -8.135 19.526 92 HG23 ILE 7 HG23 ILE 7 -14.749 -6.877 20.610 93 HD11 ILE 7 HD11 ILE 7 -17.293 -10.958 19.923 94 HD12 ILE 7 HD12 ILE 7 -16.197 -12.257 20.427 95 HD13 ILE 7 HD13 ILE 7 -17.036 -11.306 21.655 96 H ILE 8 H ILE 8 -17.651 -9.274 24.195 97 HA ILE 8 HA ILE 8 -19.342 -11.097 23.187 98 HB ILE 8 HB ILE 8 -18.805 -10.909 25.491 99 HG12 ILE 8 HG12 ILE 8 -21.822 -10.941 25.071 100 HG13 ILE 8 HG13 ILE 8 -20.718 -12.283 24.764 101 HG21 ILE 8 HG21 ILE 8 -20.842 -8.696 25.901 102 HG22 ILE 8 HG22 ILE 8 -19.738 -9.407 27.087 103 HG23 ILE 8 HG23 ILE 8 -19.094 -8.413 25.785 104 HD11 ILE 8 HD11 ILE 8 -21.348 -11.046 27.477 105 HD12 ILE 8 HD12 ILE 8 -21.837 -12.637 26.875 106 HD13 ILE 8 HD13 ILE 8 -20.125 -12.310 27.201 107 H ASN 9 H ASN 9 -20.678 -11.014 21.584 108 HA ASN 9 HA ASN 9 -23.264 -9.708 21.855 109 HB2 ASN 9 HB2 ASN 9 -21.909 -7.872 20.855 110 HB3 ASN 9 HB3 ASN 9 -21.400 -8.958 19.552 111 HD21 ASN 9 HD21 ASN 9 -25.246 -7.516 19.570 112 HD22 ASN 9 HD22 ASN 9 -24.402 -7.715 21.102 113 H ASP 10 H ASP 10 -24.277 -11.698 21.671 114 HA ASP 10 HA ASP 10 -24.367 -12.777 18.941 115 HB2 ASP 10 HB2 ASP 10 -22.580 -14.022 20.279 116 HB3 ASP 10 HB3 ASP 10 -23.860 -14.576 21.349 117 H ILE 11 H ILE 11 -26.105 -11.480 21.100 118 HA ILE 11 HA ILE 11 -28.587 -12.975 20.602 119 HB ILE 11 HB ILE 11 -27.360 -14.125 22.499 120 HG12 ILE 11 HG12 ILE 11 -30.120 -13.160 23.302 121 HG13 ILE 11 HG13 ILE 11 -29.802 -14.361 22.048 122 HG21 ILE 11 HG21 ILE 11 -28.155 -11.722 24.184 123 HG22 ILE 11 HG22 ILE 11 -27.298 -13.181 24.712 124 HG23 ILE 11 HG23 ILE 11 -26.508 -12.056 23.610 125 HD11 ILE 11 HD11 ILE 11 -29.085 -14.612 24.998 126 HD12 ILE 11 HD12 ILE 11 -30.352 -15.481 24.121 127 HD13 ILE 11 HD13 ILE 11 -28.648 -15.793 23.738 128 H LYS 12 H LYS 12 -27.683 -10.397 19.947 129 HA LYS 12 HA LYS 12 -29.962 -8.819 21.017 130 HB2 LYS 12 HB2 LYS 12 -28.017 -8.324 22.449 131 HB3 LYS 12 HB3 LYS 12 -27.057 -7.901 21.030 132 HG2 LYS 12 HG2 LYS 12 -28.583 -5.992 20.570 133 HG3 LYS 12 HG3 LYS 12 -29.543 -6.429 22.002 134 HD2 LYS 12 HD2 LYS 12 -27.587 -6.007 23.460 135 HD3 LYS 12 HD3 LYS 12 -26.563 -5.757 22.040 136 HE2 LYS 12 HE2 LYS 12 -27.060 -3.592 22.807 137 HE3 LYS 12 HE3 LYS 12 -28.036 -3.849 21.356 138 HZ1 LYS 12 HZ1 LYS 12 -29.031 -4.088 24.156 139 HZ2 LYS 12 HZ2 LYS 12 -29.328 -2.828 23.167 140 HZ3 LYS 12 HZ3 LYS 12 -29.951 -4.295 22.820 141 H LYS 13 H LYS 13 -27.376 -9.021 18.635 142 HA LYS 13 HA LYS 13 -29.145 -8.026 16.512 143 HB2 LYS 13 HB2 LYS 13 -26.415 -6.874 17.197 144 HB3 LYS 13 HB3 LYS 13 -27.020 -6.845 15.541 145 HG2 LYS 13 HG2 LYS 13 -29.054 -5.641 16.266 146 HG3 LYS 13 HG3 LYS 13 -28.424 -5.582 17.927 147 HD2 LYS 13 HD2 LYS 13 -26.544 -4.200 17.239 148 HD3 LYS 13 HD3 LYS 13 -26.908 -4.465 15.532 149 HE2 LYS 13 HE2 LYS 13 -27.624 -2.252 16.099 150 HE3 LYS 13 HE3 LYS 13 -29.038 -3.244 15.746 151 HZ1 LYS 13 HZ1 LYS 13 -28.077 -2.553 18.474 152 HZ2 LYS 13 HZ2 LYS 13 -29.359 -1.876 17.729 153 HZ3 LYS 13 HZ3 LYS 13 -29.412 -3.450 18.145 154 H GLU 14 H GLU 14 -28.516 -8.591 14.400 155 HA GLU 14 HA GLU 14 -26.442 -10.619 13.940 156 HB2 GLU 14 HB2 GLU 14 -28.426 -11.924 14.676 157 HB3 GLU 14 HB3 GLU 14 -29.395 -11.175 13.404 158 HG2 GLU 14 HG2 GLU 14 -28.016 -12.245 11.676 159 HG3 GLU 14 HG3 GLU 14 -26.907 -12.866 12.904 160 H ALA 15 H ALA 15 -25.865 -10.762 11.717 161 HA ALA 15 HA ALA 15 -27.239 -9.008 9.764 162 HB1 ALA 15 HB1 ALA 15 -24.250 -8.871 10.344 163 HB2 ALA 15 HB2 ALA 15 -25.128 -7.981 9.079 164 HB3 ALA 15 HB3 ALA 15 -25.451 -7.631 10.787 165 H ASN 16 H ASN 16 -26.109 -9.255 7.572 166 HA ASN 16 HA ASN 16 -25.517 -12.121 6.961 167 HB2 ASN 16 HB2 ASN 16 -27.540 -10.239 5.679 168 HB3 ASN 16 HB3 ASN 16 -27.037 -11.766 4.954 169 HD21 ASN 16 HD21 ASN 16 -29.841 -11.836 7.858 170 HD22 ASN 16 HD22 ASN 16 -29.180 -10.320 7.265 171 H ASP 17 H ASP 17 -24.483 -12.465 4.904 172 HA ASP 17 HA ASP 17 -23.420 -10.142 3.451 173 HB2 ASP 17 HB2 ASP 17 -21.176 -10.663 3.550 174 HB3 ASP 17 HB3 ASP 17 -21.686 -10.878 5.214 175 H SER 18 H SER 18 -22.529 -10.695 1.356 176 HA SER 18 HA SER 18 -23.539 -13.233 0.168 177 HB2 SER 18 HB2 SER 18 -24.293 -11.908 -1.793 178 HB3 SER 18 HB3 SER 18 -25.160 -11.524 -0.304 179 HG SER 18 HG SER 18 -24.544 -9.629 -1.434 180 H GLY 19 H GLY 19 -20.869 -12.772 1.054 181 HA2 GLY 19 HA2 GLY 19 -18.791 -13.357 0.284 182 HA3 GLY 19 HA3 GLY 19 -19.448 -13.555 -1.351 183 H VAL 20 H VAL 20 -19.207 -10.787 0.856 184 HA VAL 20 HA VAL 20 -17.966 -9.101 -1.269 185 HB VAL 20 HB VAL 20 -20.119 -8.346 -0.816 186 HG11 VAL 20 HG11 VAL 20 -19.555 -8.298 2.174 187 HG12 VAL 20 HG12 VAL 20 -21.010 -7.691 1.366 188 HG13 VAL 20 HG13 VAL 20 -20.640 -9.417 1.322 189 HG21 VAL 20 HG21 VAL 20 -18.368 -6.595 -0.989 190 HG22 VAL 20 HG22 VAL 20 -19.771 -6.080 -0.036 191 HG23 VAL 20 HG23 VAL 20 -18.270 -6.537 0.788 192 H THR 21 H THR 21 -15.834 -9.068 -1.010 193 HA THR 21 HA THR 21 -14.716 -7.950 1.437 194 HB THR 21 HB THR 21 -13.002 -10.204 0.957 195 HG1 THR 21 HG1 THR 21 -14.391 -11.853 1.665 196 HG21 THR 21 HG21 THR 21 -14.867 -9.561 3.277 197 HG22 THR 21 HG22 THR 21 -13.428 -10.611 3.334 198 HG23 THR 21 HG23 THR 21 -13.247 -8.868 3.046 199 H LEU 22 H LEU 22 -12.321 -7.820 1.364 200 HA LEU 22 HA LEU 22 -11.701 -6.354 -1.114 201 HB2 LEU 22 HB2 LEU 22 -10.539 -6.284 1.701 202 HB3 LEU 22 HB3 LEU 22 -10.161 -5.122 0.438 203 HG LEU 22 HG LEU 22 -13.067 -5.456 1.219 204 HD11 LEU 22 HD11 LEU 22 -11.029 -3.981 2.906 205 HD12 LEU 22 HD12 LEU 22 -12.799 -3.836 3.043 206 HD13 LEU 22 HD13 LEU 22 -12.016 -5.390 3.366 207 HD21 LEU 22 HD21 LEU 22 -12.438 -3.960 -0.633 208 HD22 LEU 22 HD22 LEU 22 -13.140 -3.068 0.726 209 HD23 LEU 22 HD23 LEU 22 -11.383 -3.038 0.458 210 H ALA 23 H ALA 23 -11.344 -9.108 -1.289 211 HA ALA 23 HA ALA 23 -8.456 -9.581 -1.616 212 HB1 ALA 23 HB1 ALA 23 -10.170 -10.915 0.544 213 HB2 ALA 23 HB2 ALA 23 -8.511 -11.404 0.131 214 HB3 ALA 23 HB3 ALA 23 -8.821 -9.799 0.822 215 HA PRO 24 HA PRO 24 -10.009 -12.769 -4.421 216 HB2 PRO 24 HB2 PRO 24 -7.964 -14.623 -4.452 217 HB3 PRO 24 HB3 PRO 24 -7.838 -13.001 -5.154 218 HG2 PRO 24 HG2 PRO 24 -6.982 -13.845 -2.369 219 HG3 PRO 24 HG3 PRO 24 -6.000 -13.015 -3.627 220 HD2 PRO 24 HD2 PRO 24 -7.201 -11.566 -1.728 221 HD3 PRO 24 HD3 PRO 24 -7.284 -11.018 -3.436 222 H LEU 25 H LEU 25 -11.452 -12.958 -2.111 223 HA LEU 25 HA LEU 25 -11.465 -15.777 -1.211 224 HB2 LEU 25 HB2 LEU 25 -11.774 -13.905 0.427 225 HB3 LEU 25 HB3 LEU 25 -13.256 -13.454 -0.415 226 HG LEU 25 HG LEU 25 -14.153 -15.793 0.085 227 HD11 LEU 25 HD11 LEU 25 -11.704 -15.910 1.902 228 HD12 LEU 25 HD12 LEU 25 -13.079 -17.030 1.952 229 HD13 LEU 25 HD13 LEU 25 -12.041 -16.989 0.529 230 HD21 LEU 25 HD21 LEU 25 -14.835 -13.887 1.428 231 HD22 LEU 25 HD22 LEU 25 -14.628 -15.299 2.466 232 HD23 LEU 25 HD23 LEU 25 -13.377 -14.035 2.447 233 H SER 26 H SER 26 -12.223 -17.082 -2.728 234 HA SER 26 HA SER 26 -13.432 -18.007 -4.379 235 HB2 SER 26 HB2 SER 26 -15.082 -17.907 -2.377 236 HB3 SER 26 HB3 SER 26 -15.949 -16.703 -3.345 237 HG SER 26 HG SER 26 -16.697 -18.858 -3.711 238 H VAL 27 H VAL 27 -12.159 -15.676 -5.078 239 HA VAL 27 HA VAL 27 -13.455 -15.102 -7.624 240 HB VAL 27 HB VAL 27 -14.474 -13.503 -6.000 241 HG11 VAL 27 HG11 VAL 27 -11.757 -12.138 -5.875 242 HG12 VAL 27 HG12 VAL 27 -13.276 -11.586 -5.151 243 HG13 VAL 27 HG13 VAL 27 -12.510 -13.057 -4.548 244 HG21 VAL 27 HG21 VAL 27 -14.388 -12.956 -8.393 245 HG22 VAL 27 HG22 VAL 27 -14.274 -11.508 -7.389 246 HG23 VAL 27 HG23 VAL 27 -12.814 -12.149 -8.165 247 HA PRO 28 HA PRO 28 -9.028 -14.960 -8.450 248 HB2 PRO 28 HB2 PRO 28 -8.939 -14.346 -11.096 249 HB3 PRO 28 HB3 PRO 28 -9.611 -15.881 -10.484 250 HG2 PRO 28 HG2 PRO 28 -11.151 -13.358 -11.190 251 HG3 PRO 28 HG3 PRO 28 -11.449 -15.030 -11.772 252 HD2 PRO 28 HD2 PRO 28 -12.810 -13.998 -9.668 253 HD3 PRO 28 HD3 PRO 28 -12.302 -15.708 -9.680 254 H LYS 29 H LYS 29 -9.421 -13.091 -6.867 255 HA LYS 29 HA LYS 29 -8.860 -11.106 -5.974 256 HB2 LYS 29 HB2 LYS 29 -6.708 -11.443 -6.625 257 HB3 LYS 29 HB3 LYS 29 -6.988 -11.180 -8.315 258 HG2 LYS 29 HG2 LYS 29 -7.487 -8.750 -6.659 259 HG3 LYS 29 HG3 LYS 29 -5.883 -9.406 -6.527 260 HD2 LYS 29 HD2 LYS 29 -5.891 -7.756 -8.182 261 HD3 LYS 29 HD3 LYS 29 -5.511 -9.297 -8.933 262 HE2 LYS 29 HE2 LYS 29 -8.245 -7.971 -9.074 263 HE3 LYS 29 HE3 LYS 29 -6.914 -7.610 -10.183 264 HZ1 LYS 29 HZ1 LYS 29 -8.234 -10.264 -9.901 265 HZ2 LYS 29 HZ2 LYS 29 -8.293 -9.285 -11.184 266 HZ3 LYS 29 HZ3 LYS 29 -6.880 -10.006 -10.800 267 HA PRO 30 HA PRO 30 -11.759 -8.171 -7.816 268 HB2 PRO 30 HB2 PRO 30 -12.159 -6.526 -5.714 269 HB3 PRO 30 HB3 PRO 30 -12.760 -8.210 -5.714 270 HG2 PRO 30 HG2 PRO 30 -10.186 -7.172 -4.466 271 HG3 PRO 30 HG3 PRO 30 -11.459 -8.181 -3.704 272 HD2 PRO 30 HD2 PRO 30 -9.189 -9.239 -4.816 273 HD3 PRO 30 HD3 PRO 30 -10.761 -10.100 -4.874 274 H LYS 31 H LYS 31 -11.788 -5.892 -8.360 275 HA LYS 31 HA LYS 31 -9.102 -4.504 -8.382 276 HB2 LYS 31 HB2 LYS 31 -11.352 -4.413 -10.430 277 HB3 LYS 31 HB3 LYS 31 -9.922 -3.374 -10.430 278 HG2 LYS 31 HG2 LYS 31 -8.465 -5.386 -10.659 279 HG3 LYS 31 HG3 LYS 31 -9.916 -6.410 -10.730 280 HD2 LYS 31 HD2 LYS 31 -10.695 -5.171 -12.736 281 HD3 LYS 31 HD3 LYS 31 -9.253 -4.137 -12.661 282 HE2 LYS 31 HE2 LYS 31 -7.808 -6.137 -12.970 283 HE3 LYS 31 HE3 LYS 31 -9.251 -7.162 -13.059 284 HZ1 LYS 31 HZ1 LYS 31 -8.601 -4.973 -14.962 285 HZ2 LYS 31 HZ2 LYS 31 -8.446 -6.565 -15.276 286 HZ3 LYS 31 HZ3 LYS 31 -9.927 -5.923 -15.045 287 H LEU 32 H LEU 32 -9.155 -3.044 -6.771 288 HA LEU 32 HA LEU 32 -11.280 -0.995 -6.776 289 HB2 LEU 32 HB2 LEU 32 -11.599 -1.208 -4.376 290 HB3 LEU 32 HB3 LEU 32 -12.038 -2.662 -5.258 291 HG LEU 32 HG LEU 32 -9.315 -3.033 -4.441 292 HD11 LEU 32 HD11 LEU 32 -11.092 -2.093 -2.158 293 HD12 LEU 32 HD12 LEU 32 -9.505 -2.876 -1.997 294 HD13 LEU 32 HD13 LEU 32 -9.623 -1.283 -2.763 295 HD21 LEU 32 HD21 LEU 32 -10.908 -4.816 -4.757 296 HD22 LEU 32 HD22 LEU 32 -10.313 -4.869 -3.093 297 HD23 LEU 32 HD23 LEU 32 -11.932 -4.213 -3.422 298 H GLU 33 H GLU 33 -10.759 0.966 -6.093 299 HA GLU 33 HA GLU 33 -8.086 1.625 -4.991 300 HB2 GLU 33 HB2 GLU 33 -9.268 2.527 -7.640 301 HB3 GLU 33 HB3 GLU 33 -8.248 3.644 -6.751 302 HG2 GLU 33 HG2 GLU 33 -7.282 0.861 -7.474 303 HG3 GLU 33 HG3 GLU 33 -7.129 2.242 -8.548 304 H GLU 34 H GLU 34 -9.842 1.462 -3.317 305 HA GLU 34 HA GLU 34 -11.015 4.175 -2.794 306 HB2 GLU 34 HB2 GLU 34 -12.418 1.502 -2.478 307 HB3 GLU 34 HB3 GLU 34 -12.967 3.023 -1.751 308 HG2 GLU 34 HG2 GLU 34 -13.016 4.051 -4.051 309 HG3 GLU 34 HG3 GLU 34 -12.661 2.459 -4.728 310 H LEU 35 H LEU 35 -9.553 4.839 -1.429 311 HA LEU 35 HA LEU 35 -9.378 3.588 1.285 312 HB2 LEU 35 HB2 LEU 35 -7.291 5.257 -0.185 313 HB3 LEU 35 HB3 LEU 35 -7.200 4.718 1.474 314 HG LEU 35 HG LEU 35 -7.573 2.306 0.234 315 HD11 LEU 35 HD11 LEU 35 -5.840 3.963 -1.657 316 HD12 LEU 35 HD12 LEU 35 -6.098 2.207 -1.730 317 HD13 LEU 35 HD13 LEU 35 -7.444 3.307 -2.046 318 HD21 LEU 35 HD21 LEU 35 -5.830 2.734 1.870 319 HD22 LEU 35 HD22 LEU 35 -5.102 2.011 0.439 320 HD23 LEU 35 HD23 LEU 35 -4.942 3.760 0.717 321 H SER 36 H SER 36 -9.049 5.175 3.023 322 HA SER 36 HA SER 36 -10.879 7.489 2.830 323 HB2 SER 36 HB2 SER 36 -10.658 6.103 4.899 324 HB3 SER 36 HB3 SER 36 -9.001 6.711 5.089 325 HG SER 36 HG SER 36 -10.610 7.917 6.276 326 H GLU 37 H GLU 37 -9.992 9.739 3.539 327 HA GLU 37 HA GLU 37 -8.233 10.592 1.505 328 HB2 GLU 37 HB2 GLU 37 -9.890 12.002 2.664 329 HB3 GLU 37 HB3 GLU 37 -8.879 12.011 4.118 330 HG2 GLU 37 HG2 GLU 37 -7.079 13.165 2.875 331 HG3 GLU 37 HG3 GLU 37 -8.018 13.059 1.384 332 H GLN 38 H GLN 38 -7.402 10.043 4.962 333 HA GLN 38 HA GLN 38 -4.597 10.733 4.581 334 HB2 GLN 38 HB2 GLN 38 -5.909 10.887 6.756 335 HB3 GLN 38 HB3 GLN 38 -5.865 9.122 6.830 336 HG2 GLN 38 HG2 GLN 38 -3.265 9.396 6.635 337 HG3 GLN 38 HG3 GLN 38 -3.551 11.097 6.987 338 HE21 GLN 38 HE21 GLN 38 -4.064 8.245 9.927 339 HE22 GLN 38 HE22 GLN 38 -3.981 7.759 8.239 340 H GLN 39 H GLN 39 -6.416 7.668 4.760 341 HA GLN 39 HA GLN 39 -4.295 5.788 4.558 342 HB2 GLN 39 HB2 GLN 39 -7.169 5.782 3.669 343 HB3 GLN 39 HB3 GLN 39 -6.131 4.387 3.445 344 HG2 GLN 39 HG2 GLN 39 -6.427 5.621 6.199 345 HG3 GLN 39 HG3 GLN 39 -7.691 4.582 5.557 346 HE21 GLN 39 HE21 GLN 39 -5.001 2.590 7.452 347 HE22 GLN 39 HE22 GLN 39 -5.681 4.174 7.845 348 H LYS 40 H LYS 40 -6.113 7.482 1.976 349 HA LYS 40 HA LYS 40 -4.793 6.290 -0.269 350 HB2 LYS 40 HB2 LYS 40 -6.978 7.524 -0.273 351 HB3 LYS 40 HB3 LYS 40 -6.121 9.031 0.045 352 HG2 LYS 40 HG2 LYS 40 -4.887 8.764 -2.109 353 HG3 LYS 40 HG3 LYS 40 -5.800 7.284 -2.438 354 HD2 LYS 40 HD2 LYS 40 -7.010 10.056 -2.005 355 HD3 LYS 40 HD3 LYS 40 -6.686 9.328 -3.589 356 HE2 LYS 40 HE2 LYS 40 -8.245 7.456 -3.026 357 HE3 LYS 40 HE3 LYS 40 -8.611 8.240 -1.482 358 HZ1 LYS 40 HZ1 LYS 40 -9.128 9.426 -4.158 359 HZ2 LYS 40 HZ2 LYS 40 -10.265 8.804 -3.168 360 HZ3 LYS 40 HZ3 LYS 40 -9.459 10.155 -2.734 361 H ILE 41 H ILE 41 -4.046 9.342 1.538 362 HA ILE 41 HA ILE 41 -1.816 10.036 -0.137 363 HB ILE 41 HB ILE 41 -2.343 10.735 2.738 364 HG12 ILE 41 HG12 ILE 41 -2.722 12.554 0.307 365 HG13 ILE 41 HG13 ILE 41 -4.014 11.490 0.818 366 HG21 ILE 41 HG21 ILE 41 -0.359 11.971 0.789 367 HG22 ILE 41 HG22 ILE 41 -0.796 12.683 2.354 368 HG23 ILE 41 HG23 ILE 41 0.016 11.131 2.309 369 HD11 ILE 41 HD11 ILE 41 -2.797 13.712 2.502 370 HD12 ILE 41 HD12 ILE 41 -4.407 13.665 1.764 371 HD13 ILE 41 HD13 ILE 41 -4.008 12.541 3.078 372 H ILE 42 H ILE 42 -1.932 8.066 2.922 373 HA ILE 42 HA ILE 42 0.937 7.745 3.031 374 HB ILE 42 HB ILE 42 -1.273 5.989 4.119 375 HG12 ILE 42 HG12 ILE 42 0.421 7.855 5.800 376 HG13 ILE 42 HG13 ILE 42 -1.004 8.474 4.972 377 HG21 ILE 42 HG21 ILE 42 1.730 6.021 4.675 378 HG22 ILE 42 HG22 ILE 42 0.560 5.153 5.686 379 HG23 ILE 42 HG23 ILE 42 0.784 4.672 4.011 380 HD11 ILE 42 HD11 ILE 42 -1.025 6.132 6.921 381 HD12 ILE 42 HD12 ILE 42 -1.602 7.777 7.233 382 HD13 ILE 42 HD13 ILE 42 -2.424 6.759 6.024 383 H LEU 43 H LEU 43 -1.649 5.770 1.572 384 HA LEU 43 HA LEU 43 -0.025 3.668 0.535 385 HB2 LEU 43 HB2 LEU 43 -2.445 3.596 0.789 386 HB3 LEU 43 HB3 LEU 43 -2.674 4.886 -0.368 387 HG LEU 43 HG LEU 43 -3.270 2.590 -1.091 388 HD11 LEU 43 HD11 LEU 43 -1.258 3.957 -2.887 389 HD12 LEU 43 HD12 LEU 43 -2.487 2.780 -3.362 390 HD13 LEU 43 HD13 LEU 43 -2.974 4.357 -2.718 391 HD21 LEU 43 HD21 LEU 43 -1.446 1.316 -0.147 392 HD22 LEU 43 HD22 LEU 43 -1.470 1.068 -1.896 393 HD23 LEU 43 HD23 LEU 43 -0.241 2.123 -1.171 394 H ALA 44 H ALA 44 -1.058 6.748 -0.965 395 HA ALA 44 HA ALA 44 0.286 6.386 -3.450 396 HB1 ALA 44 HB1 ALA 44 -0.643 8.882 -1.980 397 HB2 ALA 44 HB2 ALA 44 -0.200 8.806 -3.702 398 HB3 ALA 44 HB3 ALA 44 -1.614 7.904 -3.109 399 H GLU 45 H GLU 45 1.257 8.355 -0.528 400 HA GLU 45 HA GLU 45 3.663 9.253 -1.722 401 HB2 GLU 45 HB2 GLU 45 4.132 10.290 0.275 402 HB3 GLU 45 HB3 GLU 45 2.386 10.169 0.269 403 HG2 GLU 45 HG2 GLU 45 2.751 9.559 2.419 404 HG3 GLU 45 HG3 GLU 45 2.821 7.967 1.686 405 H TYR 46 H TYR 46 3.008 6.174 -0.212 406 HA TYR 46 HA TYR 46 5.760 5.363 0.140 407 HB2 TYR 46 HB2 TYR 46 3.839 4.418 1.354 408 HB3 TYR 46 HB3 TYR 46 3.165 3.795 -0.141 409 HD1 TYR 46 HD1 TYR 46 2.990 1.718 1.277 410 HD2 TYR 46 HD2 TYR 46 6.783 3.360 0.004 411 HE1 TYR 46 HE1 TYR 46 4.112 -0.446 1.798 412 HE2 TYR 46 HE2 TYR 46 7.895 1.221 0.585 413 HH TYR 46 HH TYR 46 6.086 -1.582 1.862 414 H ILE 47 H ILE 47 3.312 4.438 -2.325 415 HA ILE 47 HA ILE 47 4.975 3.046 -4.110 416 HB ILE 47 HB ILE 47 2.320 4.462 -4.195 417 HG12 ILE 47 HG12 ILE 47 3.088 1.507 -4.301 418 HG13 ILE 47 HG13 ILE 47 2.672 2.357 -2.821 419 HG21 ILE 47 HG21 ILE 47 3.550 2.904 -6.485 420 HG22 ILE 47 HG22 ILE 47 1.814 3.278 -6.376 421 HG23 ILE 47 HG23 ILE 47 2.975 4.581 -6.513 422 HD11 ILE 47 HD11 ILE 47 0.784 1.756 -5.121 423 HD12 ILE 47 HD12 ILE 47 0.728 1.160 -3.457 424 HD13 ILE 47 HD13 ILE 47 0.416 2.877 -3.792 425 H ALA 48 H ALA 48 4.088 6.518 -3.943 426 HA ALA 48 HA ALA 48 5.240 7.271 -6.465 427 HB1 ALA 48 HB1 ALA 48 4.703 8.860 -3.920 428 HB2 ALA 48 HB2 ALA 48 5.030 9.558 -5.525 429 HB3 ALA 48 HB3 ALA 48 3.559 8.598 -5.255 430 H GLU 49 H GLU 49 6.622 6.907 -3.204 431 HA GLU 49 HA GLU 49 9.199 8.087 -4.004 432 HB2 GLU 49 HB2 GLU 49 8.144 8.394 -1.740 433 HB3 GLU 49 HB3 GLU 49 8.420 6.679 -1.428 434 HG2 GLU 49 HG2 GLU 49 10.165 7.899 -0.364 435 HG3 GLU 49 HG3 GLU 49 10.894 7.084 -1.735 436 H VAL 50 H VAL 50 7.892 4.780 -3.390 437 HA VAL 50 HA VAL 50 10.585 3.693 -4.093 438 HB VAL 50 HB VAL 50 10.300 1.891 -2.793 439 HG11 VAL 50 HG11 VAL 50 8.831 3.999 -1.191 440 HG12 VAL 50 HG12 VAL 50 9.781 2.636 -0.574 441 HG13 VAL 50 HG13 VAL 50 10.587 3.941 -1.461 442 HG21 VAL 50 HG21 VAL 50 8.070 1.104 -3.482 443 HG22 VAL 50 HG22 VAL 50 8.248 1.102 -1.736 444 HG23 VAL 50 HG23 VAL 50 7.309 2.387 -2.522 445 H GLY 51 H GLY 51 7.573 4.048 -5.536 446 HA2 GLY 51 HA2 GLY 51 7.418 3.928 -7.839 447 HA3 GLY 51 HA3 GLY 51 8.847 2.899 -7.912 448 H LEU 52 H LEU 52 6.062 2.071 -5.961 449 HA LEU 52 HA LEU 52 4.796 0.247 -5.796 450 HB2 LEU 52 HB2 LEU 52 4.095 1.527 -8.137 451 HB3 LEU 52 HB3 LEU 52 4.318 -0.095 -8.727 452 HG LEU 52 HG LEU 52 2.492 0.656 -6.397 453 HD11 LEU 52 HD11 LEU 52 1.846 0.183 -9.328 454 HD12 LEU 52 HD12 LEU 52 0.642 0.361 -8.027 455 HD13 LEU 52 HD13 LEU 52 1.698 1.713 -8.427 456 HD21 LEU 52 HD21 LEU 52 3.054 -1.700 -6.288 457 HD22 LEU 52 HD22 LEU 52 1.389 -1.525 -6.840 458 HD23 LEU 52 HD23 LEU 52 2.678 -1.914 -8.009 459 H GLN 53 H GLN 53 7.717 -0.162 -6.712 460 HA GLN 53 HA GLN 53 7.597 -3.064 -7.457 461 HB2 GLN 53 HB2 GLN 53 9.466 -2.726 -8.900 462 HB3 GLN 53 HB3 GLN 53 8.243 -1.515 -9.269 463 HG2 GLN 53 HG2 GLN 53 9.628 0.059 -7.689 464 HG3 GLN 53 HG3 GLN 53 10.904 -1.154 -7.843 465 HE21 GLN 53 HE21 GLN 53 9.845 1.198 -11.079 466 HE22 GLN 53 HE22 GLN 53 8.702 0.941 -9.775 467 H ASN 54 H ASN 54 8.530 -1.034 -4.993 468 HA ASN 54 HA ASN 54 10.294 -3.141 -3.813 469 HB2 ASN 54 HB2 ASN 54 10.446 -0.144 -3.378 470 HB3 ASN 54 HB3 ASN 54 11.435 -1.336 -2.554 471 HD21 ASN 54 HD21 ASN 54 12.582 0.014 -6.171 472 HD22 ASN 54 HD22 ASN 54 11.110 0.614 -5.409 473 H ILE 55 H ILE 55 7.241 -2.034 -3.696 474 HA ILE 55 HA ILE 55 6.913 -1.904 -0.786 475 HB ILE 55 HB ILE 55 4.577 -1.742 -1.093 476 HG12 ILE 55 HG12 ILE 55 4.938 -2.193 -4.086 477 HG13 ILE 55 HG13 ILE 55 4.211 -3.331 -2.945 478 HG21 ILE 55 HG21 ILE 55 5.764 0.051 -3.234 479 HG22 ILE 55 HG22 ILE 55 4.435 0.390 -2.096 480 HG23 ILE 55 HG23 ILE 55 6.076 0.248 -1.499 481 HD11 ILE 55 HD11 ILE 55 3.120 -0.609 -3.718 482 HD12 ILE 55 HD12 ILE 55 2.423 -2.199 -4.049 483 HD13 ILE 55 HD13 ILE 55 2.472 -1.587 -2.381 484 H THR 56 H THR 56 5.778 -3.439 0.496 485 HA THR 56 HA THR 56 5.430 -6.169 -0.623 486 HB THR 56 HB THR 56 6.274 -6.777 1.859 487 HG1 THR 56 HG1 THR 56 8.040 -5.479 2.410 488 HG21 THR 56 HG21 THR 56 8.240 -6.068 -0.369 489 HG22 THR 56 HG22 THR 56 8.541 -7.185 0.982 490 HG23 THR 56 HG23 THR 56 7.335 -7.594 -0.249 491 H ALA 57 H ALA 57 3.659 -7.284 0.251 492 HA ALA 57 HA ALA 57 1.533 -5.758 1.303 493 HB1 ALA 57 HB1 ALA 57 1.990 -8.774 1.347 494 HB2 ALA 57 HB2 ALA 57 0.438 -7.934 1.565 495 HB3 ALA 57 HB3 ALA 57 1.277 -7.847 0.004 496 H ILE 58 H ILE 58 4.114 -7.470 2.941 497 HA ILE 58 HA ILE 58 3.026 -7.578 5.619 498 HB ILE 58 HB ILE 58 5.846 -7.508 4.454 499 HG12 ILE 58 HG12 ILE 58 5.968 -9.860 5.304 500 HG13 ILE 58 HG13 ILE 58 4.298 -9.765 5.851 501 HG21 ILE 58 HG21 ILE 58 4.990 -7.794 7.383 502 HG22 ILE 58 HG22 ILE 58 6.617 -8.205 6.783 503 HG23 ILE 58 HG23 ILE 58 6.042 -6.543 6.702 504 HD11 ILE 58 HD11 ILE 58 5.153 -9.526 2.934 505 HD12 ILE 58 HD12 ILE 58 4.672 -11.040 3.721 506 HD13 ILE 58 HD13 ILE 58 3.492 -9.738 3.562 507 H THR 59 H THR 59 5.079 -5.226 3.867 508 HA THR 59 HA THR 59 5.238 -3.418 6.155 509 HB THR 59 HB THR 59 6.107 -3.174 3.265 510 HG1 THR 59 HG1 THR 59 8.038 -3.780 4.039 511 HG21 THR 59 HG21 THR 59 6.762 -1.428 5.686 512 HG22 THR 59 HG22 THR 59 7.586 -1.360 4.107 513 HG23 THR 59 HG23 THR 59 5.874 -0.921 4.230 514 H LEU 60 H LEU 60 3.514 -3.453 3.008 515 HA LEU 60 HA LEU 60 2.120 -1.034 3.350 516 HB2 LEU 60 HB2 LEU 60 2.471 -2.510 1.271 517 HB3 LEU 60 HB3 LEU 60 1.190 -3.540 1.886 518 HG LEU 60 HG LEU 60 -0.362 -1.521 1.766 519 HD11 LEU 60 HD11 LEU 60 2.071 -0.333 0.355 520 HD12 LEU 60 HD12 LEU 60 0.453 0.357 0.319 521 HD13 LEU 60 HD13 LEU 60 1.310 0.283 1.852 522 HD21 LEU 60 HD21 LEU 60 -0.275 -3.204 -0.029 523 HD22 LEU 60 HD22 LEU 60 -0.564 -1.585 -0.687 524 HD23 LEU 60 HD23 LEU 60 1.047 -2.325 -0.806 525 H SER 61 H SER 61 1.239 -4.359 4.498 526 HA SER 61 HA SER 61 -1.249 -3.623 5.593 527 HB2 SER 61 HB2 SER 61 -1.325 -5.620 6.741 528 HB3 SER 61 HB3 SER 61 -0.478 -5.959 5.246 529 HG SER 61 HG SER 61 0.498 -6.875 7.163 530 H LYS 62 H LYS 62 1.850 -2.876 6.610 531 HA LYS 62 HA LYS 62 1.024 -2.145 9.358 532 HB2 LYS 62 HB2 LYS 62 3.670 -2.943 8.179 533 HB3 LYS 62 HB3 LYS 62 3.603 -2.045 9.705 534 HG2 LYS 62 HG2 LYS 62 2.277 -3.711 10.788 535 HG3 LYS 62 HG3 LYS 62 1.891 -4.519 9.272 536 HD2 LYS 62 HD2 LYS 62 3.487 -5.822 10.538 537 HD3 LYS 62 HD3 LYS 62 4.133 -5.296 8.992 538 HE2 LYS 62 HE2 LYS 62 5.898 -5.124 10.561 539 HE3 LYS 62 HE3 LYS 62 5.414 -3.484 10.132 540 HZ1 LYS 62 HZ1 LYS 62 4.595 -4.920 12.612 541 HZ2 LYS 62 HZ2 LYS 62 5.717 -3.740 12.540 542 HZ3 LYS 62 HZ3 LYS 62 4.153 -3.390 12.236 543 H LYS 63 H LYS 63 2.189 -0.616 6.397 544 HA LYS 63 HA LYS 63 2.760 2.015 7.465 545 HB2 LYS 63 HB2 LYS 63 1.787 0.940 4.777 546 HB3 LYS 63 HB3 LYS 63 2.165 2.639 5.020 547 HG2 LYS 63 HG2 LYS 63 4.232 0.453 5.502 548 HG3 LYS 63 HG3 LYS 63 3.926 1.154 3.917 549 HD2 LYS 63 HD2 LYS 63 4.442 3.417 4.883 550 HD3 LYS 63 HD3 LYS 63 4.901 2.596 6.401 551 HE2 LYS 63 HE2 LYS 63 6.587 1.264 5.147 552 HE3 LYS 63 HE3 LYS 63 6.133 2.097 3.653 553 HZ1 LYS 63 HZ1 LYS 63 7.292 3.415 6.056 554 HZ2 LYS 63 HZ2 LYS 63 8.096 3.106 4.671 555 HZ3 LYS 63 HZ3 LYS 63 6.873 4.186 4.676 556 H LEU 64 H LEU 64 -0.114 0.353 6.464 557 HA LEU 64 HA LEU 64 -1.909 2.696 6.953 558 HB2 LEU 64 HB2 LEU 64 -1.918 0.271 5.126 559 HB3 LEU 64 HB3 LEU 64 -3.304 1.340 5.242 560 HG LEU 64 HG LEU 64 -0.584 2.474 4.511 561 HD11 LEU 64 HD11 LEU 64 -2.518 1.174 2.560 562 HD12 LEU 64 HD12 LEU 64 -1.041 2.085 2.159 563 HD13 LEU 64 HD13 LEU 64 -0.920 0.549 3.019 564 HD21 LEU 64 HD21 LEU 64 -2.476 4.009 4.971 565 HD22 LEU 64 HD22 LEU 64 -1.958 4.053 3.272 566 HD23 LEU 64 HD23 LEU 64 -3.431 3.188 3.714 567 H ASN 65 H ASN 65 -1.033 0.002 8.611 568 HA ASN 65 HA ASN 65 -2.005 -1.306 10.217 569 HB2 ASN 65 HB2 ASN 65 -2.014 0.783 11.324 570 HB3 ASN 65 HB3 ASN 65 -3.412 1.360 10.437 571 HD21 ASN 65 HD21 ASN 65 -5.559 0.498 12.995 572 HD22 ASN 65 HD22 ASN 65 -5.101 1.559 11.659 573 H ILE 66 H ILE 66 -2.644 -2.590 8.261 574 HA ILE 66 HA ILE 66 -5.552 -3.240 8.222 575 HB ILE 66 HB ILE 66 -4.939 -3.564 5.609 576 HG12 ILE 66 HG12 ILE 66 -3.571 -0.931 6.107 577 HG13 ILE 66 HG13 ILE 66 -2.594 -2.357 6.099 578 HG21 ILE 66 HG21 ILE 66 -5.905 -1.028 6.979 579 HG22 ILE 66 HG22 ILE 66 -6.080 -1.347 5.253 580 HG23 ILE 66 HG23 ILE 66 -6.885 -2.408 6.426 581 HD11 ILE 66 HD11 ILE 66 -4.231 -1.204 3.818 582 HD12 ILE 66 HD12 ILE 66 -2.492 -1.557 3.875 583 HD13 ILE 66 HD13 ILE 66 -3.664 -2.884 3.782 584 H THR 67 H THR 67 -5.786 -5.333 6.693 585 HA THR 67 HA THR 67 -3.998 -7.386 7.818 586 HB THR 67 HB THR 67 -5.378 -9.022 7.018 587 HG1 THR 67 HG1 THR 67 -6.995 -8.595 5.433 588 HG21 THR 67 HG21 THR 67 -7.391 -6.760 7.340 589 HG22 THR 67 HG22 THR 67 -7.643 -8.495 7.621 590 HG23 THR 67 HG23 THR 67 -6.576 -7.578 8.698 591 H VAL 68 H VAL 68 -2.817 -8.923 6.513 592 HA VAL 68 HA VAL 68 -1.250 -7.763 4.379 593 HB VAL 68 HB VAL 68 -1.589 -10.654 5.258 594 HG11 VAL 68 HG11 VAL 68 0.530 -9.440 3.432 595 HG12 VAL 68 HG12 VAL 68 0.567 -11.082 4.101 596 HG13 VAL 68 HG13 VAL 68 -0.692 -10.640 2.948 597 HG21 VAL 68 HG21 VAL 68 -0.586 -9.163 6.986 598 HG22 VAL 68 HG22 VAL 68 0.604 -10.300 6.349 599 HG23 VAL 68 HG23 VAL 68 0.621 -8.614 5.798 600 H GLU 69 H GLU 69 -4.379 -9.414 4.334 601 HA GLU 69 HA GLU 69 -4.111 -10.180 1.487 602 HB2 GLU 69 HB2 GLU 69 -6.440 -10.365 3.443 603 HB3 GLU 69 HB3 GLU 69 -6.466 -10.925 1.763 604 HG2 GLU 69 HG2 GLU 69 -4.569 -12.469 2.257 605 HG3 GLU 69 HG3 GLU 69 -4.610 -11.968 3.949 606 H LYS 70 H LYS 70 -5.729 -7.751 3.522 607 HA LYS 70 HA LYS 70 -7.115 -6.432 1.425 608 HB2 LYS 70 HB2 LYS 70 -7.587 -6.374 3.878 609 HB3 LYS 70 HB3 LYS 70 -6.171 -5.365 4.133 610 HG2 LYS 70 HG2 LYS 70 -8.513 -4.612 2.346 611 HG3 LYS 70 HG3 LYS 70 -8.444 -4.295 4.086 612 HD2 LYS 70 HD2 LYS 70 -6.246 -3.024 3.568 613 HD3 LYS 70 HD3 LYS 70 -6.810 -2.988 1.894 614 HE2 LYS 70 HE2 LYS 70 -8.538 -2.112 4.257 615 HE3 LYS 70 HE3 LYS 70 -7.430 -0.999 3.461 616 HZ1 LYS 70 HZ1 LYS 70 -9.610 -2.412 2.025 617 HZ2 LYS 70 HZ2 LYS 70 -9.699 -0.869 2.561 618 HZ3 LYS 70 HZ3 LYS 70 -8.614 -1.256 1.410 619 H ALA 71 H ALA 71 -4.021 -5.786 3.005 620 HA ALA 71 HA ALA 71 -3.065 -3.663 1.388 621 HB1 ALA 71 HB1 ALA 71 -1.504 -5.933 2.713 622 HB2 ALA 71 HB2 ALA 71 -0.851 -4.373 2.189 623 HB3 ALA 71 HB3 ALA 71 -2.025 -4.439 3.510 624 H LYS 72 H LYS 72 -2.685 -7.236 0.856 625 HA LYS 72 HA LYS 72 -1.008 -6.921 -1.446 626 HB2 LYS 72 HB2 LYS 72 -0.986 -8.875 0.077 627 HB3 LYS 72 HB3 LYS 72 -2.630 -9.298 -0.400 628 HG2 LYS 72 HG2 LYS 72 -1.921 -9.850 -2.623 629 HG3 LYS 72 HG3 LYS 72 -0.300 -9.184 -2.354 630 HD2 LYS 72 HD2 LYS 72 -1.426 -11.510 -0.723 631 HD3 LYS 72 HD3 LYS 72 -0.548 -11.741 -2.249 632 HE2 LYS 72 HE2 LYS 72 1.408 -10.518 -1.276 633 HE3 LYS 72 HE3 LYS 72 0.539 -10.392 0.262 634 HZ1 LYS 72 HZ1 LYS 72 1.309 -12.945 -1.057 635 HZ2 LYS 72 HZ2 LYS 72 2.042 -12.303 0.248 636 HZ3 LYS 72 HZ3 LYS 72 0.502 -12.833 0.359 637 H ASN 73 H ASN 73 -4.508 -7.122 -1.013 638 HA ASN 73 HA ASN 73 -5.250 -7.650 -3.617 639 HB2 ASN 73 HB2 ASN 73 -7.265 -7.358 -2.699 640 HB3 ASN 73 HB3 ASN 73 -6.524 -6.696 -1.254 641 HD21 ASN 73 HD21 ASN 73 -7.444 -3.349 -2.019 642 HD22 ASN 73 HD22 ASN 73 -6.578 -4.412 -0.916 643 H TYR 74 H TYR 74 -4.220 -4.472 -2.293 644 HA TYR 74 HA TYR 74 -4.624 -2.938 -4.636 645 HB2 TYR 74 HB2 TYR 74 -2.483 -2.612 -2.510 646 HB3 TYR 74 HB3 TYR 74 -3.040 -1.368 -3.618 647 HD1 TYR 74 HD1 TYR 74 -3.039 -2.086 -0.371 648 HD2 TYR 74 HD2 TYR 74 -5.966 -1.396 -3.484 649 HE1 TYR 74 HE1 TYR 74 -4.609 -1.136 1.312 650 HE2 TYR 74 HE2 TYR 74 -7.520 -0.411 -1.782 651 HH TYR 74 HH TYR 74 -6.564 -0.029 1.630 652 H ILE 75 H ILE 75 -1.777 -4.796 -3.488 653 HA ILE 75 HA ILE 75 -0.020 -4.091 -5.640 654 HB ILE 75 HB ILE 75 0.112 -6.610 -3.943 655 HG12 ILE 75 HG12 ILE 75 1.029 -3.785 -3.232 656 HG13 ILE 75 HG13 ILE 75 -0.218 -4.715 -2.417 657 HG21 ILE 75 HG21 ILE 75 2.297 -4.910 -5.241 658 HG22 ILE 75 HG22 ILE 75 2.543 -6.411 -4.319 659 HG23 ILE 75 HG23 ILE 75 1.712 -6.470 -5.857 660 HD11 ILE 75 HD11 ILE 75 2.747 -5.276 -2.355 661 HD12 ILE 75 HD12 ILE 75 1.668 -4.811 -1.030 662 HD13 ILE 75 HD13 ILE 75 1.499 -6.413 -1.781 663 H LYS 76 H LYS 76 -2.567 -6.514 -5.364 664 HA LYS 76 HA LYS 76 -1.870 -7.988 -7.809 665 HB2 LYS 76 HB2 LYS 76 -4.216 -8.077 -5.959 666 HB3 LYS 76 HB3 LYS 76 -3.914 -9.164 -7.332 667 HG2 LYS 76 HG2 LYS 76 -1.885 -8.961 -5.115 668 HG3 LYS 76 HG3 LYS 76 -3.341 -9.950 -4.953 669 HD2 LYS 76 HD2 LYS 76 -2.734 -11.187 -7.021 670 HD3 LYS 76 HD3 LYS 76 -1.251 -10.216 -7.164 671 HE2 LYS 76 HE2 LYS 76 -0.464 -11.062 -4.987 672 HE3 LYS 76 HE3 LYS 76 -1.975 -11.956 -4.761 673 HZ1 LYS 76 HZ1 LYS 76 -0.009 -12.475 -6.932 674 HZ2 LYS 76 HZ2 LYS 76 -0.212 -13.402 -5.605 675 HZ3 LYS 76 HZ3 LYS 76 -1.403 -13.299 -6.712 676 H ASN 77 H ASN 77 -3.921 -5.170 -7.206 677 HA ASN 77 HA ASN 77 -4.916 -5.431 -10.027 678 HB2 ASN 77 HB2 ASN 77 -6.848 -4.063 -9.303 679 HB3 ASN 77 HB3 ASN 77 -6.752 -5.650 -8.566 680 HD21 ASN 77 HD21 ASN 77 -7.334 -4.231 -5.448 681 HD22 ASN 77 HD22 ASN 77 -7.836 -5.374 -6.664 682 H SER 78 H SER 78 -3.747 -3.013 -7.680 683 HA SER 78 HA SER 78 -3.777 -0.924 -9.615 684 HB2 SER 78 HB2 SER 78 -4.024 -0.856 -7.056 685 HB3 SER 78 HB3 SER 78 -2.252 -0.811 -7.006 686 HG SER 78 HG SER 78 -3.671 1.218 -7.137 687 H ASN 79 H ASN 79 -1.456 -3.350 -9.321 688 HA ASN 79 HA ASN 79 0.966 -1.959 -9.680 689 HB2 ASN 79 HB2 ASN 79 1.928 -4.108 -10.243 690 HB3 ASN 79 HB3 ASN 79 0.784 -4.285 -8.922 691 HD21 ASN 79 HD21 ASN 79 -1.129 -6.662 -10.688 692 HD22 ASN 79 HD22 ASN 79 -0.598 -5.986 -9.145 693 H ARG 80 H ARG 80 -1.466 -2.106 -12.001 694 HA ARG 80 HA ARG 80 0.219 -1.832 -14.398 695 HB2 ARG 80 HB2 ARG 80 -2.728 -1.600 -13.731 696 HB3 ARG 80 HB3 ARG 80 -2.133 -0.886 -15.221 697 HG2 ARG 80 HG2 ARG 80 -3.031 -3.137 -15.558 698 HG3 ARG 80 HG3 ARG 80 -1.353 -2.971 -16.075 699 HD2 ARG 80 HD2 ARG 80 -0.552 -4.155 -14.126 700 HD3 ARG 80 HD3 ARG 80 -2.173 -4.218 -13.420 701 HE ARG 80 HE ARG 80 -2.651 -5.435 -15.775 702 HH11 ARG 80 HH11 ARG 80 -2.338 -7.502 -16.485 703 HH12 ARG 80 HH12 ARG 80 -1.121 -8.500 -15.748 704 HH21 ARG 80 HH21 ARG 80 -0.069 -6.126 -13.504 705 HH22 ARG 80 HH22 ARG 80 0.162 -7.740 -14.143 706 H LEU 81 H LEU 81 -0.855 0.391 -11.917 707 HA LEU 81 HA LEU 81 -0.716 2.710 -13.691 708 HB2 LEU 81 HB2 LEU 81 -1.732 2.100 -10.981 709 HB3 LEU 81 HB3 LEU 81 -0.969 3.674 -11.076 710 HG LEU 81 HG LEU 81 -3.123 2.768 -13.028 711 HD11 LEU 81 HD11 LEU 81 -3.368 4.483 -10.517 712 HD12 LEU 81 HD12 LEU 81 -4.659 4.171 -11.704 713 HD13 LEU 81 HD13 LEU 81 -4.014 2.841 -10.727 714 HD21 LEU 81 HD21 LEU 81 -1.699 4.637 -13.852 715 HD22 LEU 81 HD22 LEU 81 -3.323 5.212 -13.456 716 HD23 LEU 81 HD23 LEU 81 -1.972 5.518 -12.339 717 H GLY 82 H GLY 82 1.197 1.728 -10.809 718 HA2 GLY 82 HA2 GLY 82 2.976 4.006 -11.124 719 HA3 GLY 82 HA3 GLY 82 3.143 2.713 -9.944 720 H ARG 83 H ARG 83 4.918 4.121 -12.088 721 HA ARG 83 HA ARG 83 6.357 1.681 -13.036 722 HB2 ARG 83 HB2 ARG 83 5.562 4.030 -14.794 723 HB3 ARG 83 HB3 ARG 83 6.746 2.808 -15.248 724 HG2 ARG 83 HG2 ARG 83 3.804 2.274 -14.653 725 HG3 ARG 83 HG3 ARG 83 4.512 2.431 -16.251 726 HD2 ARG 83 HD2 ARG 83 5.227 0.266 -14.233 727 HD3 ARG 83 HD3 ARG 83 4.130 0.077 -15.600 728 HE ARG 83 HE ARG 83 6.347 0.931 -16.884 729 HH11 ARG 83 HH11 ARG 83 8.044 -0.257 -17.671 730 HH12 ARG 83 HH12 ARG 83 8.458 -1.777 -16.937 731 HH21 ARG 83 HH21 ARG 83 5.998 -1.661 -14.551 732 HH22 ARG 83 HH22 ARG 83 7.339 -2.555 -15.213 733 H THR 84 H THR 84 7.325 4.901 -14.019 734 HA THR 84 HA THR 84 9.538 4.978 -12.070 735 HB THR 84 HB THR 84 10.244 3.251 -13.564 736 HG1 THR 84 HG1 THR 84 12.233 4.108 -14.095 737 HG21 THR 84 HG21 THR 84 10.130 5.215 -15.881 738 HG22 THR 84 HG22 THR 84 10.830 3.587 -15.899 739 HG23 THR 84 HG23 THR 84 9.095 3.790 -15.647 740 H ASN 85 H ASN 85 7.849 6.839 -11.973 741 HA ASN 85 HA ASN 85 8.650 9.099 -13.764 742 HB2 ASN 85 HB2 ASN 85 5.986 8.495 -12.432 743 HB3 ASN 85 HB3 ASN 85 6.338 9.925 -13.396 744 HD21 ASN 85 HD21 ASN 85 5.287 6.585 -15.333 745 HD22 ASN 85 HD22 ASN 85 5.176 6.727 -13.585 746 H ASN 86 H ASN 86 9.668 8.261 -10.906 747 HA ASN 86 HA ASN 86 9.371 10.941 -9.600 748 HB2 ASN 86 HB2 ASN 86 8.520 9.034 -8.315 749 HB3 ASN 86 HB3 ASN 86 10.096 8.243 -8.412 750 HD21 ASN 86 HD21 ASN 86 11.575 10.286 -5.891 751 HD22 ASN 86 HD22 ASN 86 11.931 9.315 -7.321 752 H LEU 87 H LEU 87 10.914 12.085 -10.654 753 HA LEU 87 HA LEU 87 13.762 11.418 -10.269 754 HB2 LEU 87 HB2 LEU 87 12.264 11.343 -12.797 755 HB3 LEU 87 HB3 LEU 87 13.469 12.600 -12.861 756 HG LEU 87 HG LEU 87 14.355 10.649 -13.851 757 HD11 LEU 87 HD11 LEU 87 15.698 10.832 -11.122 758 HD12 LEU 87 HD12 LEU 87 16.404 10.277 -12.646 759 HD13 LEU 87 HD13 LEU 87 15.944 11.973 -12.466 760 HD21 LEU 87 HD21 LEU 87 12.912 8.967 -12.686 761 HD22 LEU 87 HD22 LEU 87 14.616 8.504 -12.836 762 HD23 LEU 87 HD23 LEU 87 13.999 9.081 -11.282 763 H LYS 88 H LYS 88 15.129 13.357 -10.795 764 HA LYS 88 HA LYS 88 13.818 15.876 -9.834 765 HB2 LYS 88 HB2 LYS 88 15.635 16.081 -8.190 766 HB3 LYS 88 HB3 LYS 88 14.671 14.629 -7.943 767 HG2 LYS 88 HG2 LYS 88 16.370 13.211 -8.916 768 HG3 LYS 88 HG3 LYS 88 17.315 14.603 -9.466 769 HD2 LYS 88 HD2 LYS 88 17.674 15.282 -7.079 770 HD3 LYS 88 HD3 LYS 88 16.770 13.847 -6.551 771 HE2 LYS 88 HE2 LYS 88 18.416 12.384 -7.688 772 HE3 LYS 88 HE3 LYS 88 19.297 13.803 -8.263 773 HZ1 LYS 88 HZ1 LYS 88 18.955 13.061 -5.405 774 HZ2 LYS 88 HZ2 LYS 88 20.322 12.875 -6.272 775 HZ3 LYS 88 HZ3 LYS 88 19.772 14.372 -5.941 776 H THR 89 H THR 89 15.164 15.007 -12.504 777 HA THR 89 HA THR 89 16.897 17.411 -12.783 778 HB THR 89 HB THR 89 18.240 15.396 -12.388 779 HG1 THR 89 HG1 THR 89 19.663 15.799 -14.087 780 HG21 THR 89 HG21 THR 89 17.301 14.430 -15.120 781 HG22 THR 89 HG22 THR 89 18.551 13.702 -14.092 782 HG23 THR 89 HG23 THR 89 16.870 13.717 -13.555 783 H ILE 90 H ILE 90 14.355 17.633 -13.387 784 HA ILE 90 HA ILE 90 13.870 16.876 -16.178 785 HB ILE 90 HB ILE 90 11.550 17.666 -15.674 786 HG12 ILE 90 HG12 ILE 90 12.125 19.156 -13.717 787 HG13 ILE 90 HG13 ILE 90 10.688 18.163 -13.643 788 HG21 ILE 90 HG21 ILE 90 12.778 15.436 -13.992 789 HG22 ILE 90 HG22 ILE 90 11.042 15.605 -14.351 790 HG23 ILE 90 HG23 ILE 90 12.198 15.318 -15.663 791 HD11 ILE 90 HD11 ILE 90 13.259 17.639 -12.102 792 HD12 ILE 90 HD12 ILE 90 11.712 18.203 -11.474 793 HD13 ILE 90 HD13 ILE 90 11.838 16.567 -12.112 794 H GLY 91 H GLY 91 15.433 19.446 -15.067 795 HA2 GLY 91 HA2 GLY 91 15.847 21.583 -15.847 796 HA3 GLY 91 HA3 GLY 91 14.848 21.223 -17.262 797 H ILE 92 H ILE 92 13.025 20.629 -14.545 798 HA ILE 92 HA ILE 92 11.191 21.585 -13.611 799 HB ILE 92 HB ILE 92 13.116 23.898 -13.252 800 HG12 ILE 92 HG12 ILE 92 14.092 21.696 -12.530 801 HG13 ILE 92 HG13 ILE 92 13.885 22.853 -11.237 802 HG21 ILE 92 HG21 ILE 92 10.600 23.156 -11.710 803 HG22 ILE 92 HG22 ILE 92 11.889 24.168 -11.022 804 HG23 ILE 92 HG23 ILE 92 11.025 24.718 -12.442 805 HD11 ILE 92 HD11 ILE 92 11.945 20.563 -11.764 806 HD12 ILE 92 HD12 ILE 92 13.295 20.513 -10.615 807 HD13 ILE 92 HD13 ILE 92 11.961 21.645 -10.357 808 H LEU 93 H LEU 93 11.185 21.646 -16.377 809 HA LEU 93 HA LEU 93 10.271 22.511 -18.223 810 HB2 LEU 93 HB2 LEU 93 8.365 21.890 -16.586 811 HB3 LEU 93 HB3 LEU 93 8.109 23.620 -16.423 812 HG LEU 93 HG LEU 93 7.664 23.724 -18.923 813 HD11 LEU 93 HD11 LEU 93 7.813 20.686 -18.699 814 HD12 LEU 93 HD12 LEU 93 7.152 21.587 -20.081 815 HD13 LEU 93 HD13 LEU 93 8.866 21.719 -19.691 816 HD21 LEU 93 HD21 LEU 93 5.838 23.537 -17.277 817 HD22 LEU 93 HD22 LEU 93 5.450 22.681 -18.777 818 HD23 LEU 93 HD23 LEU 93 5.957 21.764 -17.338 819 H GLN 94 H GLN 94 12.237 24.319 -17.084 820 HA GLN 94 HA GLN 94 11.350 26.890 -18.320 821 HB2 GLN 94 HB2 GLN 94 12.384 28.151 -16.566 822 HB3 GLN 94 HB3 GLN 94 11.137 27.085 -15.926 823 HG2 GLN 94 HG2 GLN 94 12.810 25.540 -15.054 824 HG3 GLN 94 HG3 GLN 94 14.109 26.415 -15.864 825 HE21 GLN 94 HE21 GLN 94 14.631 28.035 -12.769 826 HE22 GLN 94 HE22 GLN 94 15.269 26.947 -13.998 827 H GLU 95 H GLU 95 13.070 24.649 -19.375 828 HA GLU 95 HA GLU 95 15.751 25.765 -19.648 829 HB2 GLU 95 HB2 GLU 95 14.368 23.565 -21.230 830 HB3 GLU 95 HB3 GLU 95 16.088 23.970 -21.288 831 HG2 GLU 95 HG2 GLU 95 16.242 23.455 -18.827 832 HG3 GLU 95 HG3 GLU 95 14.566 22.894 -18.880 833 H GLU 96 H GLU 96 16.736 26.607 -21.509 834 HA GLU 96 HA GLU 96 15.044 27.425 -23.828 835 HB2 GLU 96 HB2 GLU 96 16.956 29.242 -22.302 836 HB3 GLU 96 HB3 GLU 96 16.255 29.593 -23.887 837 HG2 GLU 96 HG2 GLU 96 13.971 29.479 -22.884 838 HG3 GLU 96 HG3 GLU 96 14.697 29.232 -21.293 839 H VAL 97 H VAL 97 15.813 26.285 -25.431 840 HA VAL 97 HA VAL 97 18.688 26.452 -26.093 841 HB VAL 97 HB VAL 97 17.142 23.819 -26.108 842 HG11 VAL 97 HG11 VAL 97 20.055 24.393 -26.800 843 HG12 VAL 97 HG12 VAL 97 19.290 22.793 -26.748 844 HG13 VAL 97 HG13 VAL 97 18.779 23.959 -27.967 845 HG21 VAL 97 HG21 VAL 97 17.799 24.328 -23.809 846 HG22 VAL 97 HG22 VAL 97 18.811 23.035 -24.446 847 HG23 VAL 97 HG23 VAL 97 19.460 24.685 -24.333 848 H SER 98 H SER 98 18.896 27.114 -28.150 849 HA SER 98 HA SER 98 16.651 26.795 -30.074 850 HB2 SER 98 HB2 SER 98 17.664 29.028 -29.597 851 HB3 SER 98 HB3 SER 98 19.167 28.459 -30.348 852 HG SER 98 HG SER 98 17.767 29.560 -31.833 853 H SER 99 H SER 99 16.910 24.570 -30.444 854 HA SER 99 HA SER 99 17.640 22.664 -31.476 855 HB2 SER 99 HB2 SER 99 18.264 24.723 -33.612 856 HB3 SER 99 HB3 SER 99 18.058 22.979 -33.877 857 HG SER 99 HG SER 99 16.119 24.178 -34.253 858 H MET 100 H MET 100 19.358 22.310 -29.909 859 HA MET 100 HA MET 100 21.450 21.806 -29.216 860 HB2 MET 100 HB2 MET 100 21.827 21.212 -32.155 861 HB3 MET 100 HB3 MET 100 23.104 20.962 -30.968 862 HG2 MET 100 HG2 MET 100 20.354 19.685 -30.775 863 HG3 MET 100 HG3 MET 100 21.781 18.923 -31.476 864 HE1 MET 100 HE1 MET 100 21.710 16.789 -29.981 865 HE2 MET 100 HE2 MET 100 21.515 16.819 -28.217 866 HE3 MET 100 HE3 MET 100 20.189 17.371 -29.263 867 H GLU 101 H GLU 101 21.091 24.201 -28.872 868 HA GLU 101 HA GLU 101 23.058 26.051 -29.960 869 HB2 GLU 101 HB2 GLU 101 20.827 26.662 -29.041 870 HB3 GLU 101 HB3 GLU 101 21.376 26.208 -27.426 871 HG2 GLU 101 HG2 GLU 101 23.172 27.945 -27.594 872 HG3 GLU 101 HG3 GLU 101 22.553 28.400 -29.187 873 H ALA 102 H ALA 102 25.098 25.220 -29.740 874 HA ALA 102 HA ALA 102 26.235 24.900 -27.006 875 HB1 ALA 102 HB1 ALA 102 26.575 22.980 -29.352 876 HB2 ALA 102 HB2 ALA 102 27.384 22.852 -27.775 877 HB3 ALA 102 HB3 ALA 102 25.624 22.670 -27.883 878 H LYS 103 H LYS 103 28.548 25.015 -26.916 879 HA LYS 103 HA LYS 103 29.844 26.676 -29.059 880 HB2 LYS 103 HB2 LYS 103 29.982 26.990 -26.034 881 HB3 LYS 103 HB3 LYS 103 30.984 27.877 -27.170 882 HG2 LYS 103 HG2 LYS 103 27.935 28.015 -27.041 883 HG3 LYS 103 HG3 LYS 103 29.018 29.153 -26.275 884 HD2 LYS 103 HD2 LYS 103 28.823 28.674 -29.282 885 HD3 LYS 103 HD3 LYS 103 28.050 29.987 -28.416 886 HE2 LYS 103 HE2 LYS 103 31.070 29.553 -28.546 887 HE3 LYS 103 HE3 LYS 103 30.161 30.624 -29.607 888 HZ1 LYS 103 HZ1 LYS 103 30.339 30.931 -26.658 889 HZ2 LYS 103 HZ2 LYS 103 31.097 31.860 -27.761 890 HZ3 LYS 103 HZ3 LYS 103 29.473 31.900 -27.650 891 H SER 104 H SER 104 31.149 25.285 -30.019 892 HA SER 104 HA SER 104 33.540 24.410 -28.562 893 HB2 SER 104 HB2 SER 104 32.021 22.436 -28.386 894 HB3 SER 104 HB3 SER 104 31.913 22.385 -30.156 895 HG SER 104 HG SER 104 33.540 20.975 -29.315 896 H MET 105 H MET 105 35.237 24.994 -29.787 897 HA MET 105 HA MET 105 35.294 24.793 -32.708 898 HB2 MET 105 HB2 MET 105 34.067 27.027 -31.986 899 HB3 MET 105 HB3 MET 105 35.688 27.567 -31.532 900 HG2 MET 105 HG2 MET 105 36.451 27.179 -33.855 901 HG3 MET 105 HG3 MET 105 34.860 26.537 -34.275 902 HE1 MET 105 HE1 MET 105 34.548 28.081 -36.326 903 HE2 MET 105 HE2 MET 105 34.860 29.831 -36.314 904 HE3 MET 105 HE3 MET 105 36.198 28.689 -36.052 905 H THR 106 H THR 106 37.396 24.828 -33.520 906 HA THR 106 HA THR 106 39.668 24.765 -31.695 907 HB THR 106 HB THR 106 39.717 25.086 -34.699 908 HG1 THR 106 HG1 THR 106 39.766 22.832 -34.790 909 HG21 THR 106 HG21 THR 106 41.702 23.834 -32.744 910 HG22 THR 106 HG22 THR 106 41.843 23.762 -34.514 911 HG23 THR 106 HG23 THR 106 41.941 25.320 -33.695 912 H TRP 107 H TRP 107 41.260 26.250 -31.433 913 HA TRP 107 HA TRP 107 40.384 29.055 -31.790 914 HB2 TRP 107 HB2 TRP 107 40.761 27.948 -29.503 915 HB3 TRP 107 HB3 TRP 107 42.479 28.098 -29.839 916 HD1 TRP 107 HD1 TRP 107 43.539 30.455 -29.455 917 HE1 TRP 107 HE1 TRP 107 42.685 32.721 -28.589 918 HE3 TRP 107 HE3 TRP 107 38.507 29.509 -29.560 919 HZ2 TRP 107 HZ2 TRP 107 40.139 33.965 -28.024 920 HZ3 TRP 107 HZ3 TRP 107 36.884 31.261 -28.852 921 HH2 TRP 107 HH2 TRP 107 37.687 33.486 -28.087 Start of MODEL 10 1 H1 GLY -5 H1 GLY -5 -40.502 -13.581 -35.489 2 H2 GLY -5 H2 GLY -5 -40.652 -12.033 -35.999 3 H3 GLY -5 H3 GLY -5 -39.914 -13.139 -36.954 4 HA2 GLY -5 HA2 GLY -5 -42.771 -13.158 -36.203 5 HA3 GLY -5 HA3 GLY -5 -42.126 -12.673 -37.780 6 H SER -4 H SER -4 -43.015 -15.327 -35.736 7 HA SER -4 HA SER -4 -42.463 -17.325 -37.877 8 HB2 SER -4 HB2 SER -4 -41.686 -17.670 -34.951 9 HB3 SER -4 HB3 SER -4 -41.542 -18.891 -36.229 10 HG SER -4 HG SER -4 -39.557 -17.808 -35.851 11 H HIS -3 H HIS -3 -43.655 -19.319 -37.609 12 HA HIS -3 HA HIS -3 -46.108 -19.136 -35.899 13 HB2 HIS -3 HB2 HIS -3 -45.975 -20.144 -38.763 14 HB3 HIS -3 HB3 HIS -3 -47.407 -20.060 -37.742 15 HD2 HIS -3 HD2 HIS -3 -48.000 -17.354 -36.889 16 HE1 HIS -3 HE1 HIS -3 -46.552 -15.686 -40.541 17 HE2 HIS -3 HE2 HIS -3 -47.951 -15.237 -38.461 18 H MET -2 H MET -2 -46.875 -21.020 -35.029 19 HA MET -2 HA MET -2 -46.679 -23.019 -33.967 20 HB2 MET -2 HB2 MET -2 -45.948 -24.045 -36.736 21 HB3 MET -2 HB3 MET -2 -46.637 -24.984 -35.404 22 HG2 MET -2 HG2 MET -2 -48.696 -23.621 -35.492 23 HG3 MET -2 HG3 MET -2 -47.996 -22.653 -36.792 24 HE1 MET -2 HE1 MET -2 -49.536 -26.095 -35.754 25 HE2 MET -2 HE2 MET -2 -49.403 -27.054 -37.245 26 HE3 MET -2 HE3 MET -2 -47.945 -26.665 -36.314 27 H ALA -1 H ALA -1 -44.454 -21.513 -33.527 28 HA ALA -1 HA ALA -1 -42.410 -23.557 -32.987 29 HB1 ALA -1 HB1 ALA -1 -41.941 -21.072 -34.712 30 HB2 ALA -1 HB2 ALA -1 -40.688 -22.241 -34.231 31 HB3 ALA -1 HB3 ALA -1 -42.008 -22.740 -35.315 32 H SER 0 H SER 0 -40.445 -22.569 -31.971 33 HA SER 0 HA SER 0 -41.051 -20.392 -30.040 34 HB2 SER 0 HB2 SER 0 -40.243 -21.808 -28.214 35 HB3 SER 0 HB3 SER 0 -41.666 -22.526 -29.015 36 HG SER 0 HG SER 0 -40.017 -24.076 -28.626 37 H MET 1 H MET 1 -39.162 -19.697 -28.834 38 HA MET 1 HA MET 1 -36.510 -20.132 -30.135 39 HB2 MET 1 HB2 MET 1 -37.742 -17.463 -29.347 40 HB3 MET 1 HB3 MET 1 -36.038 -17.701 -29.756 41 HG2 MET 1 HG2 MET 1 -36.644 -18.490 -31.995 42 HG3 MET 1 HG3 MET 1 -38.358 -18.295 -31.637 43 HE1 MET 1 HE1 MET 1 -38.778 -15.569 -30.233 44 HE2 MET 1 HE2 MET 1 -38.953 -14.486 -31.629 45 HE3 MET 1 HE3 MET 1 -39.681 -16.106 -31.668 46 H ASP 2 H ASP 2 -34.905 -20.528 -28.741 47 HA ASP 2 HA ASP 2 -35.146 -19.846 -25.866 48 HB2 ASP 2 HB2 ASP 2 -36.183 -22.121 -26.379 49 HB3 ASP 2 HB3 ASP 2 -34.566 -22.670 -26.823 50 HA PRO 3 HA PRO 3 -30.772 -19.279 -26.728 51 HB2 PRO 3 HB2 PRO 3 -29.886 -18.243 -24.371 52 HB3 PRO 3 HB3 PRO 3 -31.047 -17.363 -25.413 53 HG2 PRO 3 HG2 PRO 3 -31.666 -19.112 -23.007 54 HG3 PRO 3 HG3 PRO 3 -32.251 -17.451 -23.343 55 HD2 PRO 3 HD2 PRO 3 -33.728 -19.674 -23.946 56 HD3 PRO 3 HD3 PRO 3 -33.766 -18.207 -24.966 57 H LEU 4 H LEU 4 -31.833 -21.743 -24.745 58 HA LEU 4 HA LEU 4 -29.087 -22.650 -24.072 59 HB2 LEU 4 HB2 LEU 4 -31.749 -23.538 -22.921 60 HB3 LEU 4 HB3 LEU 4 -30.174 -24.105 -22.409 61 HG LEU 4 HG LEU 4 -31.176 -21.257 -22.120 62 HD11 LEU 4 HD11 LEU 4 -30.653 -23.437 -20.061 63 HD12 LEU 4 HD12 LEU 4 -31.182 -21.773 -19.723 64 HD13 LEU 4 HD13 LEU 4 -32.250 -22.875 -20.605 65 HD21 LEU 4 HD21 LEU 4 -28.741 -21.221 -22.403 66 HD22 LEU 4 HD22 LEU 4 -29.147 -20.933 -20.712 67 HD23 LEU 4 HD23 LEU 4 -28.559 -22.532 -21.211 68 H ASP 5 H ASP 5 -29.942 -22.938 -26.773 69 HA ASP 5 HA ASP 5 -29.773 -25.911 -27.024 70 HB2 ASP 5 HB2 ASP 5 -30.493 -23.695 -28.963 71 HB3 ASP 5 HB3 ASP 5 -30.004 -25.272 -29.553 72 H LYS 6 H LYS 6 -27.640 -23.524 -26.625 73 HA LYS 6 HA LYS 6 -25.601 -24.639 -28.544 74 HB2 LYS 6 HB2 LYS 6 -25.704 -21.690 -27.853 75 HB3 LYS 6 HB3 LYS 6 -24.850 -22.517 -29.144 76 HG2 LYS 6 HG2 LYS 6 -26.569 -21.748 -30.412 77 HG3 LYS 6 HG3 LYS 6 -27.355 -23.212 -29.843 78 HD2 LYS 6 HD2 LYS 6 -28.992 -21.565 -29.438 79 HD3 LYS 6 HD3 LYS 6 -28.228 -21.757 -27.860 80 HE2 LYS 6 HE2 LYS 6 -28.483 -19.421 -28.191 81 HE3 LYS 6 HE3 LYS 6 -26.763 -19.760 -28.383 82 HZ1 LYS 6 HZ1 LYS 6 -28.694 -19.393 -30.622 83 HZ2 LYS 6 HZ2 LYS 6 -27.601 -18.287 -30.134 84 HZ3 LYS 6 HZ3 LYS 6 -27.096 -19.681 -30.808 85 H ILE 7 H ILE 7 -25.717 -22.468 -25.746 86 HA ILE 7 HA ILE 7 -23.135 -23.581 -24.771 87 HB ILE 7 HB ILE 7 -22.906 -21.444 -23.529 88 HG12 ILE 7 HG12 ILE 7 -24.147 -19.462 -24.268 89 HG13 ILE 7 HG13 ILE 7 -25.238 -20.445 -25.236 90 HG21 ILE 7 HG21 ILE 7 -23.201 -21.211 -26.555 91 HG22 ILE 7 HG22 ILE 7 -22.195 -20.191 -25.502 92 HG23 ILE 7 HG23 ILE 7 -21.814 -21.908 -25.692 93 HD11 ILE 7 HD11 ILE 7 -24.982 -20.627 -22.202 94 HD12 ILE 7 HD12 ILE 7 -26.200 -19.670 -23.066 95 HD13 ILE 7 HD13 ILE 7 -26.210 -21.430 -23.218 96 H ILE 8 H ILE 8 -26.150 -24.367 -24.260 97 HA ILE 8 HA ILE 8 -26.654 -24.216 -21.520 98 HB ILE 8 HB ILE 8 -28.216 -25.051 -23.185 99 HG12 ILE 8 HG12 ILE 8 -27.765 -26.834 -20.758 100 HG13 ILE 8 HG13 ILE 8 -28.667 -25.317 -20.821 101 HG21 ILE 8 HG21 ILE 8 -26.856 -27.761 -23.070 102 HG22 ILE 8 HG22 ILE 8 -28.242 -27.272 -24.060 103 HG23 ILE 8 HG23 ILE 8 -26.645 -26.610 -24.405 104 HD11 ILE 8 HD11 ILE 8 -29.450 -27.958 -22.127 105 HD12 ILE 8 HD12 ILE 8 -30.202 -27.182 -20.727 106 HD13 ILE 8 HD13 ILE 8 -30.342 -26.431 -22.325 107 H ASN 9 H ASN 9 -25.697 -24.918 -19.760 108 HA ASN 9 HA ASN 9 -24.141 -27.461 -19.674 109 HB2 ASN 9 HB2 ASN 9 -22.805 -25.222 -20.257 110 HB3 ASN 9 HB3 ASN 9 -22.941 -24.925 -18.529 111 HD21 ASN 9 HD21 ASN 9 -20.709 -27.729 -17.775 112 HD22 ASN 9 HD22 ASN 9 -22.250 -27.082 -17.205 113 H ASP 10 H ASP 10 -26.553 -25.717 -18.261 114 HA ASP 10 HA ASP 10 -25.585 -25.874 -15.565 115 HB2 ASP 10 HB2 ASP 10 -28.242 -24.851 -16.652 116 HB3 ASP 10 HB3 ASP 10 -27.623 -24.550 -15.028 117 H ILE 11 H ILE 11 -26.535 -28.327 -17.051 118 HA ILE 11 HA ILE 11 -27.997 -29.628 -14.842 119 HB ILE 11 HB ILE 11 -29.620 -28.553 -16.448 120 HG12 ILE 11 HG12 ILE 11 -31.233 -30.295 -16.650 121 HG13 ILE 11 HG13 ILE 11 -30.042 -31.556 -16.395 122 HG21 ILE 11 HG21 ILE 11 -28.707 -30.670 -18.433 123 HG22 ILE 11 HG22 ILE 11 -30.037 -29.517 -18.640 124 HG23 ILE 11 HG23 ILE 11 -28.375 -28.926 -18.545 125 HD11 ILE 11 HD11 ILE 11 -30.775 -29.417 -14.343 126 HD12 ILE 11 HD12 ILE 11 -31.434 -31.065 -14.383 127 HD13 ILE 11 HD13 ILE 11 -29.710 -30.820 -14.069 128 H LYS 12 H LYS 12 -25.306 -29.862 -15.993 129 HA LYS 12 HA LYS 12 -25.373 -32.832 -16.387 130 HB2 LYS 12 HB2 LYS 12 -23.502 -30.847 -17.744 131 HB3 LYS 12 HB3 LYS 12 -23.332 -32.606 -17.791 132 HG2 LYS 12 HG2 LYS 12 -25.639 -32.757 -18.815 133 HG3 LYS 12 HG3 LYS 12 -25.681 -30.995 -18.878 134 HD2 LYS 12 HD2 LYS 12 -25.055 -31.863 -21.057 135 HD3 LYS 12 HD3 LYS 12 -23.723 -30.953 -20.356 136 HE2 LYS 12 HE2 LYS 12 -22.842 -32.918 -21.447 137 HE3 LYS 12 HE3 LYS 12 -22.589 -33.065 -19.711 138 HZ1 LYS 12 HZ1 LYS 12 -24.731 -34.425 -21.262 139 HZ2 LYS 12 HZ2 LYS 12 -23.394 -35.127 -20.627 140 HZ3 LYS 12 HZ3 LYS 12 -24.543 -34.547 -19.639 141 H LYS 13 H LYS 13 -23.508 -30.206 -14.924 142 HA LYS 13 HA LYS 13 -21.696 -30.185 -13.525 143 HB2 LYS 13 HB2 LYS 13 -23.668 -30.856 -12.092 144 HB3 LYS 13 HB3 LYS 13 -23.125 -32.522 -12.205 145 HG2 LYS 13 HG2 LYS 13 -22.450 -31.617 -10.096 146 HG3 LYS 13 HG3 LYS 13 -20.993 -31.880 -11.042 147 HD2 LYS 13 HD2 LYS 13 -20.919 -29.434 -11.582 148 HD3 LYS 13 HD3 LYS 13 -22.390 -29.202 -10.604 149 HE2 LYS 13 HE2 LYS 13 -21.176 -30.150 -8.628 150 HE3 LYS 13 HE3 LYS 13 -19.720 -30.318 -9.618 151 HZ1 LYS 13 HZ1 LYS 13 -21.068 -27.746 -8.977 152 HZ2 LYS 13 HZ2 LYS 13 -19.666 -28.268 -8.330 153 HZ3 LYS 13 HZ3 LYS 13 -19.735 -27.889 -9.914 154 H GLU 14 H GLU 14 -20.850 -31.173 -15.751 155 HA GLU 14 HA GLU 14 -19.335 -33.701 -15.241 156 HB2 GLU 14 HB2 GLU 14 -21.235 -33.661 -16.916 157 HB3 GLU 14 HB3 GLU 14 -20.238 -32.616 -17.927 158 HG2 GLU 14 HG2 GLU 14 -18.464 -34.441 -17.890 159 HG3 GLU 14 HG3 GLU 14 -19.586 -35.447 -16.977 160 H ALA 15 H ALA 15 -17.880 -32.042 -14.128 161 HA ALA 15 HA ALA 15 -15.673 -31.313 -15.966 162 HB1 ALA 15 HB1 ALA 15 -16.915 -29.375 -13.964 163 HB2 ALA 15 HB2 ALA 15 -15.470 -29.079 -14.955 164 HB3 ALA 15 HB3 ALA 15 -17.050 -29.270 -15.735 165 H ASN 16 H ASN 16 -13.690 -30.723 -14.790 166 HA ASN 16 HA ASN 16 -13.322 -32.288 -12.269 167 HB2 ASN 16 HB2 ASN 16 -12.619 -33.368 -14.482 168 HB3 ASN 16 HB3 ASN 16 -11.355 -32.145 -14.582 169 HD21 ASN 16 HD21 ASN 16 -9.494 -33.615 -11.816 170 HD22 ASN 16 HD22 ASN 16 -9.924 -32.041 -12.501 171 H ASP 17 H ASP 17 -13.897 -29.841 -11.724 172 HA ASP 17 HA ASP 17 -11.338 -28.459 -11.067 173 HB2 ASP 17 HB2 ASP 17 -12.447 -27.442 -13.095 174 HB3 ASP 17 HB3 ASP 17 -13.838 -27.056 -12.084 175 H SER 18 H SER 18 -11.286 -27.435 -9.084 176 HA SER 18 HA SER 18 -13.706 -27.473 -7.364 177 HB2 SER 18 HB2 SER 18 -12.182 -29.546 -7.098 178 HB3 SER 18 HB3 SER 18 -11.055 -28.450 -6.284 179 HG SER 18 HG SER 18 -12.534 -29.503 -4.840 180 H GLY 19 H GLY 19 -12.458 -25.276 -8.750 181 HA2 GLY 19 HA2 GLY 19 -12.260 -23.052 -8.321 182 HA3 GLY 19 HA3 GLY 19 -12.564 -23.360 -6.600 183 H VAL 20 H VAL 20 -10.034 -24.003 -9.007 184 HA VAL 20 HA VAL 20 -7.886 -23.455 -7.056 185 HB VAL 20 HB VAL 20 -8.087 -25.619 -8.267 186 HG11 VAL 20 HG11 VAL 20 -7.274 -24.045 -10.743 187 HG12 VAL 20 HG12 VAL 20 -7.464 -25.807 -10.613 188 HG13 VAL 20 HG13 VAL 20 -8.875 -24.751 -10.439 189 HG21 VAL 20 HG21 VAL 20 -5.898 -24.888 -7.344 190 HG22 VAL 20 HG22 VAL 20 -5.794 -26.007 -8.714 191 HG23 VAL 20 HG23 VAL 20 -5.457 -24.288 -8.962 192 H THR 21 H THR 21 -9.478 -21.575 -9.023 193 HA THR 21 HA THR 21 -7.363 -20.335 -10.580 194 HB THR 21 HB THR 21 -10.045 -19.061 -10.447 195 HG1 THR 21 HG1 THR 21 -10.901 -20.648 -11.794 196 HG21 THR 21 HG21 THR 21 -8.199 -19.921 -12.723 197 HG22 THR 21 HG22 THR 21 -9.715 -19.010 -12.915 198 HG23 THR 21 HG23 THR 21 -8.345 -18.270 -12.080 199 H LEU 22 H LEU 22 -7.005 -18.034 -10.741 200 HA LEU 22 HA LEU 22 -6.904 -16.687 -8.101 201 HB2 LEU 22 HB2 LEU 22 -4.769 -15.823 -8.692 202 HB3 LEU 22 HB3 LEU 22 -4.749 -17.569 -8.861 203 HG LEU 22 HG LEU 22 -5.266 -15.921 -11.349 204 HD11 LEU 22 HD11 LEU 22 -2.520 -16.322 -10.096 205 HD12 LEU 22 HD12 LEU 22 -2.846 -15.674 -11.721 206 HD13 LEU 22 HD13 LEU 22 -3.372 -14.773 -10.293 207 HD21 LEU 22 HD21 LEU 22 -5.278 -18.407 -11.509 208 HD22 LEU 22 HD22 LEU 22 -3.940 -17.699 -12.415 209 HD23 LEU 22 HD23 LEU 22 -3.638 -18.448 -10.833 210 H ALA 23 H ALA 23 -9.112 -16.316 -9.722 211 HA ALA 23 HA ALA 23 -8.908 -13.434 -10.500 212 HB1 ALA 23 HB1 ALA 23 -10.332 -15.700 -11.947 213 HB2 ALA 23 HB2 ALA 23 -10.478 -13.980 -12.357 214 HB3 ALA 23 HB3 ALA 23 -8.907 -14.795 -12.508 215 HA PRO 24 HA PRO 24 -12.342 -13.325 -7.612 216 HB2 PRO 24 HB2 PRO 24 -13.029 -10.688 -7.684 217 HB3 PRO 24 HB3 PRO 24 -11.508 -11.283 -6.954 218 HG2 PRO 24 HG2 PRO 24 -11.915 -10.136 -9.731 219 HG3 PRO 24 HG3 PRO 24 -10.661 -9.711 -8.527 220 HD2 PRO 24 HD2 PRO 24 -10.205 -11.479 -10.565 221 HD3 PRO 24 HD3 PRO 24 -9.434 -11.672 -8.971 222 H LEU 25 H LEU 25 -12.830 -11.902 -10.858 223 HA LEU 25 HA LEU 25 -15.415 -13.243 -11.136 224 HB2 LEU 25 HB2 LEU 25 -15.881 -11.039 -9.926 225 HB3 LEU 25 HB3 LEU 25 -15.279 -10.209 -11.357 226 HG LEU 25 HG LEU 25 -17.122 -11.319 -12.702 227 HD11 LEU 25 HD11 LEU 25 -18.086 -12.211 -9.949 228 HD12 LEU 25 HD12 LEU 25 -19.043 -12.268 -11.446 229 HD13 LEU 25 HD13 LEU 25 -17.603 -13.276 -11.289 230 HD21 LEU 25 HD21 LEU 25 -17.362 -9.036 -11.807 231 HD22 LEU 25 HD22 LEU 25 -18.912 -9.891 -11.816 232 HD23 LEU 25 HD23 LEU 25 -18.019 -9.690 -10.290 233 H SER 26 H SER 26 -13.805 -14.254 -12.636 234 HA SER 26 HA SER 26 -12.946 -14.642 -14.717 235 HB2 SER 26 HB2 SER 26 -15.436 -13.091 -15.488 236 HB3 SER 26 HB3 SER 26 -14.534 -14.187 -16.560 237 HG SER 26 HG SER 26 -16.326 -15.226 -15.553 238 H VAL 27 H VAL 27 -11.596 -12.554 -13.596 239 HA VAL 27 HA VAL 27 -10.584 -11.028 -15.902 240 HB VAL 27 HB VAL 27 -12.545 -9.792 -14.964 241 HG11 VAL 27 HG11 VAL 27 -10.810 -9.297 -12.517 242 HG12 VAL 27 HG12 VAL 27 -12.406 -8.598 -12.856 243 HG13 VAL 27 HG13 VAL 27 -12.252 -10.333 -12.552 244 HG21 VAL 27 HG21 VAL 27 -10.790 -8.563 -16.168 245 HG22 VAL 27 HG22 VAL 27 -11.522 -7.585 -14.891 246 HG23 VAL 27 HG23 VAL 27 -9.917 -8.290 -14.634 247 HA PRO 28 HA PRO 28 -6.942 -11.711 -13.345 248 HB2 PRO 28 HB2 PRO 28 -5.005 -10.359 -14.686 249 HB3 PRO 28 HB3 PRO 28 -5.831 -11.786 -15.366 250 HG2 PRO 28 HG2 PRO 28 -6.516 -8.865 -15.858 251 HG3 PRO 28 HG3 PRO 28 -6.212 -10.145 -17.077 252 HD2 PRO 28 HD2 PRO 28 -8.724 -9.499 -16.288 253 HD3 PRO 28 HD3 PRO 28 -8.276 -11.193 -16.630 254 H LYS 29 H LYS 29 -8.430 -10.398 -11.872 255 HA LYS 29 HA LYS 29 -8.803 -9.002 -10.166 256 HB2 LYS 29 HB2 LYS 29 -6.433 -9.770 -9.694 257 HB3 LYS 29 HB3 LYS 29 -5.904 -8.185 -10.249 258 HG2 LYS 29 HG2 LYS 29 -6.060 -7.743 -7.977 259 HG3 LYS 29 HG3 LYS 29 -7.732 -7.352 -8.431 260 HD2 LYS 29 HD2 LYS 29 -8.356 -9.711 -7.859 261 HD3 LYS 29 HD3 LYS 29 -6.669 -9.986 -7.371 262 HE2 LYS 29 HE2 LYS 29 -6.890 -8.182 -5.659 263 HE3 LYS 29 HE3 LYS 29 -8.580 -7.952 -6.125 264 HZ1 LYS 29 HZ1 LYS 29 -7.461 -10.477 -5.003 265 HZ2 LYS 29 HZ2 LYS 29 -8.392 -9.417 -4.182 266 HZ3 LYS 29 HZ3 LYS 29 -9.021 -10.252 -5.428 267 HA PRO 30 HA PRO 30 -9.613 -5.323 -12.613 268 HB2 PRO 30 HB2 PRO 30 -11.814 -4.350 -11.364 269 HB3 PRO 30 HB3 PRO 30 -11.851 -5.872 -12.310 270 HG2 PRO 30 HG2 PRO 30 -11.565 -5.553 -9.304 271 HG3 PRO 30 HG3 PRO 30 -12.668 -6.642 -10.202 272 HD2 PRO 30 HD2 PRO 30 -10.238 -7.447 -9.195 273 HD3 PRO 30 HD3 PRO 30 -10.944 -8.144 -10.680 274 H LYS 31 H LYS 31 -9.044 -3.158 -12.516 275 HA LYS 31 HA LYS 31 -7.412 -2.332 -10.308 276 HB2 LYS 31 HB2 LYS 31 -7.041 -0.260 -11.524 277 HB3 LYS 31 HB3 LYS 31 -6.779 -1.702 -12.500 278 HG2 LYS 31 HG2 LYS 31 -9.041 -1.361 -13.551 279 HG3 LYS 31 HG3 LYS 31 -9.199 0.153 -12.638 280 HD2 LYS 31 HD2 LYS 31 -7.137 1.015 -13.709 281 HD3 LYS 31 HD3 LYS 31 -6.972 -0.478 -14.638 282 HE2 LYS 31 HE2 LYS 31 -9.349 1.436 -14.798 283 HE3 LYS 31 HE3 LYS 31 -7.970 1.455 -15.899 284 HZ1 LYS 31 HZ1 LYS 31 -9.862 -0.814 -15.587 285 HZ2 LYS 31 HZ2 LYS 31 -9.782 0.199 -16.859 286 HZ3 LYS 31 HZ3 LYS 31 -8.549 -0.824 -16.566 287 H LEU 32 H LEU 32 -7.781 -1.195 -8.531 288 HA LEU 32 HA LEU 32 -10.340 0.268 -8.187 289 HB2 LEU 32 HB2 LEU 32 -11.021 -0.993 -6.299 290 HB3 LEU 32 HB3 LEU 32 -10.664 -2.114 -7.602 291 HG LEU 32 HG LEU 32 -8.264 -2.172 -6.311 292 HD11 LEU 32 HD11 LEU 32 -10.329 -1.747 -4.105 293 HD12 LEU 32 HD12 LEU 32 -8.648 -2.272 -3.882 294 HD13 LEU 32 HD13 LEU 32 -8.989 -0.647 -4.484 295 HD21 LEU 32 HD21 LEU 32 -9.633 -4.131 -6.876 296 HD22 LEU 32 HD22 LEU 32 -9.037 -4.239 -5.215 297 HD23 LEU 32 HD23 LEU 32 -10.729 -3.776 -5.522 298 H GLU 33 H GLU 33 -10.495 1.681 -6.514 299 HA GLU 33 HA GLU 33 -8.190 2.288 -4.746 300 HB2 GLU 33 HB2 GLU 33 -9.370 4.090 -6.867 301 HB3 GLU 33 HB3 GLU 33 -8.943 4.809 -5.327 302 HG2 GLU 33 HG2 GLU 33 -6.982 3.208 -7.011 303 HG3 GLU 33 HG3 GLU 33 -7.175 4.953 -7.101 304 H GLU 34 H GLU 34 -9.276 1.672 -2.890 305 HA GLU 34 HA GLU 34 -11.684 3.223 -2.129 306 HB2 GLU 34 HB2 GLU 34 -12.337 1.003 -3.097 307 HB3 GLU 34 HB3 GLU 34 -11.443 0.202 -1.795 308 HG2 GLU 34 HG2 GLU 34 -12.865 1.338 -0.126 309 HG3 GLU 34 HG3 GLU 34 -13.672 2.244 -1.404 310 H LEU 35 H LEU 35 -10.106 4.457 -1.041 311 HA LEU 35 HA LEU 35 -9.188 3.391 1.597 312 HB2 LEU 35 HB2 LEU 35 -7.790 5.168 -0.438 313 HB3 LEU 35 HB3 LEU 35 -7.233 5.009 1.216 314 HG LEU 35 HG LEU 35 -7.601 2.438 -0.300 315 HD11 LEU 35 HD11 LEU 35 -5.219 4.224 -0.843 316 HD12 LEU 35 HD12 LEU 35 -5.523 2.582 -1.457 317 HD13 LEU 35 HD13 LEU 35 -6.547 3.920 -1.984 318 HD21 LEU 35 HD21 LEU 35 -6.749 2.490 2.037 319 HD22 LEU 35 HD22 LEU 35 -5.562 1.823 0.904 320 HD23 LEU 35 HD23 LEU 35 -5.365 3.477 1.492 321 H SER 36 H SER 36 -9.061 4.992 3.274 322 HA SER 36 HA SER 36 -11.008 7.210 3.135 323 HB2 SER 36 HB2 SER 36 -10.648 5.866 5.209 324 HB3 SER 36 HB3 SER 36 -9.006 6.533 5.319 325 HG SER 36 HG SER 36 -10.615 7.693 6.560 326 H GLU 37 H GLU 37 -10.159 9.483 3.822 327 HA GLU 37 HA GLU 37 -8.492 10.425 1.731 328 HB2 GLU 37 HB2 GLU 37 -10.176 11.765 2.933 329 HB3 GLU 37 HB3 GLU 37 -9.158 11.769 4.381 330 HG2 GLU 37 HG2 GLU 37 -7.399 13.009 3.158 331 HG3 GLU 37 HG3 GLU 37 -8.349 12.920 1.672 332 H GLN 38 H GLN 38 -7.587 9.854 5.166 333 HA GLN 38 HA GLN 38 -4.811 10.635 4.762 334 HB2 GLN 38 HB2 GLN 38 -6.089 10.707 6.957 335 HB3 GLN 38 HB3 GLN 38 -6.007 8.941 6.988 336 HG2 GLN 38 HG2 GLN 38 -3.419 9.258 6.785 337 HG3 GLN 38 HG3 GLN 38 -3.723 10.956 7.146 338 HE21 GLN 38 HE21 GLN 38 -4.189 8.087 10.080 339 HE22 GLN 38 HE22 GLN 38 -4.137 7.608 8.387 340 H GLN 39 H GLN 39 -6.542 7.510 4.866 341 HA GLN 39 HA GLN 39 -4.323 5.737 4.631 342 HB2 GLN 39 HB2 GLN 39 -7.188 5.552 3.705 343 HB3 GLN 39 HB3 GLN 39 -6.063 4.212 3.585 344 HG2 GLN 39 HG2 GLN 39 -6.539 5.514 6.279 345 HG3 GLN 39 HG3 GLN 39 -7.719 4.395 5.616 346 HE21 GLN 39 HE21 GLN 39 -4.582 2.777 7.458 347 HE22 GLN 39 HE22 GLN 39 -5.013 4.476 7.604 348 H LYS 40 H LYS 40 -6.247 7.395 2.098 349 HA LYS 40 HA LYS 40 -4.919 6.285 -0.188 350 HB2 LYS 40 HB2 LYS 40 -7.099 7.440 -0.254 351 HB3 LYS 40 HB3 LYS 40 -6.333 8.962 0.202 352 HG2 LYS 40 HG2 LYS 40 -5.019 8.958 -1.890 353 HG3 LYS 40 HG3 LYS 40 -5.737 7.414 -2.366 354 HD2 LYS 40 HD2 LYS 40 -7.361 9.930 -1.787 355 HD3 LYS 40 HD3 LYS 40 -6.724 9.576 -3.387 356 HE2 LYS 40 HE2 LYS 40 -8.523 7.619 -1.892 357 HE3 LYS 40 HE3 LYS 40 -9.164 8.932 -2.881 358 HZ1 LYS 40 HZ1 LYS 40 -7.401 6.747 -3.907 359 HZ2 LYS 40 HZ2 LYS 40 -8.997 6.938 -4.197 360 HZ3 LYS 40 HZ3 LYS 40 -7.932 8.022 -4.782 361 H ILE 41 H ILE 41 -4.199 9.265 1.713 362 HA ILE 41 HA ILE 41 -1.967 10.037 0.071 363 HB ILE 41 HB ILE 41 -2.539 10.689 2.950 364 HG12 ILE 41 HG12 ILE 41 -2.985 12.516 0.534 365 HG13 ILE 41 HG13 ILE 41 -4.243 11.412 1.043 366 HG21 ILE 41 HG21 ILE 41 -0.614 12.019 1.004 367 HG22 ILE 41 HG22 ILE 41 -1.058 12.681 2.589 368 HG23 ILE 41 HG23 ILE 41 -0.197 11.156 2.500 369 HD11 ILE 41 HD11 ILE 41 -3.085 13.656 2.737 370 HD12 ILE 41 HD12 ILE 41 -4.697 13.562 2.007 371 HD13 ILE 41 HD13 ILE 41 -4.255 12.444 3.311 372 H ILE 42 H ILE 42 -2.103 7.964 3.069 373 HA ILE 42 HA ILE 42 0.760 7.665 3.221 374 HB ILE 42 HB ILE 42 -1.405 5.763 4.159 375 HG12 ILE 42 HG12 ILE 42 0.149 7.650 5.968 376 HG13 ILE 42 HG13 ILE 42 -1.277 8.245 5.136 377 HG21 ILE 42 HG21 ILE 42 1.573 5.986 4.822 378 HG22 ILE 42 HG22 ILE 42 0.434 4.988 5.738 379 HG23 ILE 42 HG23 ILE 42 0.757 4.610 4.051 380 HD11 ILE 42 HD11 ILE 42 -1.246 5.818 6.977 381 HD12 ILE 42 HD12 ILE 42 -1.888 7.427 7.351 382 HD13 ILE 42 HD13 ILE 42 -2.651 6.434 6.082 383 H LEU 43 H LEU 43 -1.744 5.714 1.613 384 HA LEU 43 HA LEU 43 -0.086 3.703 0.478 385 HB2 LEU 43 HB2 LEU 43 -2.516 3.604 0.608 386 HB3 LEU 43 HB3 LEU 43 -2.696 4.986 -0.440 387 HG LEU 43 HG LEU 43 -3.257 2.767 -1.381 388 HD11 LEU 43 HD11 LEU 43 -1.122 4.202 -2.979 389 HD12 LEU 43 HD12 LEU 43 -2.404 3.146 -3.584 390 HD13 LEU 43 HD13 LEU 43 -2.819 4.691 -2.827 391 HD21 LEU 43 HD21 LEU 43 -1.586 1.353 -0.489 392 HD22 LEU 43 HD22 LEU 43 -1.427 1.319 -2.245 393 HD23 LEU 43 HD23 LEU 43 -0.257 2.243 -1.274 394 H ALA 44 H ALA 44 -1.096 6.868 -0.856 395 HA ALA 44 HA ALA 44 0.364 6.693 -3.286 396 HB1 ALA 44 HB1 ALA 44 -0.637 9.080 -1.688 397 HB2 ALA 44 HB2 ALA 44 -0.136 9.125 -3.395 398 HB3 ALA 44 HB3 ALA 44 -1.561 8.176 -2.908 399 H GLU 45 H GLU 45 1.232 8.524 -0.247 400 HA GLU 45 HA GLU 45 3.726 9.480 -1.201 401 HB2 GLU 45 HB2 GLU 45 2.730 8.861 1.603 402 HB3 GLU 45 HB3 GLU 45 4.325 9.553 1.283 403 HG2 GLU 45 HG2 GLU 45 3.223 11.413 0.003 404 HG3 GLU 45 HG3 GLU 45 1.662 10.833 0.573 405 H TYR 46 H TYR 46 2.954 6.239 0.006 406 HA TYR 46 HA TYR 46 5.700 5.439 0.418 407 HB2 TYR 46 HB2 TYR 46 3.792 4.401 1.531 408 HB3 TYR 46 HB3 TYR 46 3.134 3.878 -0.010 409 HD1 TYR 46 HD1 TYR 46 2.931 1.695 1.083 410 HD2 TYR 46 HD2 TYR 46 6.789 3.486 0.378 411 HE1 TYR 46 HE1 TYR 46 4.023 -0.525 1.398 412 HE2 TYR 46 HE2 TYR 46 7.869 1.269 0.676 413 HH TYR 46 HH TYR 46 5.993 -1.652 1.513 414 H ILE 47 H ILE 47 3.380 4.591 -2.223 415 HA ILE 47 HA ILE 47 5.163 3.390 -4.055 416 HB ILE 47 HB ILE 47 2.532 4.809 -4.201 417 HG12 ILE 47 HG12 ILE 47 3.305 1.884 -4.588 418 HG13 ILE 47 HG13 ILE 47 2.979 2.526 -2.998 419 HG21 ILE 47 HG21 ILE 47 3.945 3.373 -6.489 420 HG22 ILE 47 HG22 ILE 47 2.227 3.837 -6.490 421 HG23 ILE 47 HG23 ILE 47 3.459 5.081 -6.452 422 HD11 ILE 47 HD11 ILE 47 0.926 2.481 -5.243 423 HD12 ILE 47 HD12 ILE 47 0.988 1.408 -3.833 424 HD13 ILE 47 HD13 ILE 47 0.696 3.141 -3.621 425 H ALA 48 H ALA 48 4.282 6.849 -3.547 426 HA ALA 48 HA ALA 48 5.677 7.884 -5.832 427 HB1 ALA 48 HB1 ALA 48 4.840 9.175 -3.210 428 HB2 ALA 48 HB2 ALA 48 5.305 10.045 -4.691 429 HB3 ALA 48 HB3 ALA 48 3.841 9.038 -4.675 430 H GLU 49 H GLU 49 6.824 6.873 -2.667 431 HA GLU 49 HA GLU 49 9.418 8.272 -3.002 432 HB2 GLU 49 HB2 GLU 49 8.204 8.404 -0.868 433 HB3 GLU 49 HB3 GLU 49 8.333 6.647 -0.675 434 HG2 GLU 49 HG2 GLU 49 10.766 6.805 -0.533 435 HG3 GLU 49 HG3 GLU 49 10.722 8.517 -0.968 436 H VAL 50 H VAL 50 8.093 4.930 -3.201 437 HA VAL 50 HA VAL 50 10.896 3.998 -3.741 438 HB VAL 50 HB VAL 50 10.473 1.927 -2.753 439 HG11 VAL 50 HG11 VAL 50 9.351 3.995 -0.827 440 HG12 VAL 50 HG12 VAL 50 10.185 2.482 -0.425 441 HG13 VAL 50 HG13 VAL 50 11.074 3.793 -1.220 442 HG21 VAL 50 HG21 VAL 50 8.121 1.509 -3.336 443 HG22 VAL 50 HG22 VAL 50 8.420 1.268 -1.625 444 HG23 VAL 50 HG23 VAL 50 7.589 2.731 -2.183 445 H GLY 51 H GLY 51 7.726 4.182 -5.108 446 HA2 GLY 51 HA2 GLY 51 7.056 3.556 -7.249 447 HA3 GLY 51 HA3 GLY 51 8.528 2.619 -7.482 448 H LEU 52 H LEU 52 5.571 1.975 -7.816 449 HA LEU 52 HA LEU 52 4.716 0.329 -5.719 450 HB2 LEU 52 HB2 LEU 52 3.572 1.487 -7.843 451 HB3 LEU 52 HB3 LEU 52 3.725 -0.097 -8.560 452 HG LEU 52 HG LEU 52 2.375 0.279 -5.854 453 HD11 LEU 52 HD11 LEU 52 1.080 0.563 -8.577 454 HD12 LEU 52 HD12 LEU 52 0.258 0.635 -6.995 455 HD13 LEU 52 HD13 LEU 52 1.414 1.895 -7.443 456 HD21 LEU 52 HD21 LEU 52 2.612 -2.051 -6.420 457 HD22 LEU 52 HD22 LEU 52 0.936 -1.609 -6.669 458 HD23 LEU 52 HD23 LEU 52 2.018 -1.768 -8.076 459 H GLN 53 H GLN 53 7.022 -0.342 -7.911 460 HA GLN 53 HA GLN 53 6.846 -3.281 -8.114 461 HB2 GLN 53 HB2 GLN 53 8.985 -1.256 -8.875 462 HB3 GLN 53 HB3 GLN 53 9.130 -2.989 -9.176 463 HG2 GLN 53 HG2 GLN 53 7.304 -3.015 -10.713 464 HG3 GLN 53 HG3 GLN 53 6.755 -1.407 -10.240 465 HE21 GLN 53 HE21 GLN 53 9.185 0.356 -12.180 466 HE22 GLN 53 HE22 GLN 53 8.161 0.469 -10.755 467 H ASN 54 H ASN 54 8.064 -1.034 -5.773 468 HA ASN 54 HA ASN 54 9.863 -3.101 -4.578 469 HB2 ASN 54 HB2 ASN 54 9.981 -0.075 -4.348 470 HB3 ASN 54 HB3 ASN 54 11.140 -1.211 -3.660 471 HD21 ASN 54 HD21 ASN 54 11.685 0.017 -7.417 472 HD22 ASN 54 HD22 ASN 54 10.638 0.811 -6.234 473 H ILE 55 H ILE 55 6.904 -1.723 -4.005 474 HA ILE 55 HA ILE 55 6.973 -1.886 -1.079 475 HB ILE 55 HB ILE 55 4.647 -1.480 -1.073 476 HG12 ILE 55 HG12 ILE 55 4.615 -1.920 -4.074 477 HG13 ILE 55 HG13 ILE 55 3.874 -2.962 -2.856 478 HG21 ILE 55 HG21 ILE 55 5.702 0.281 -3.315 479 HG22 ILE 55 HG22 ILE 55 4.581 0.701 -1.995 480 HG23 ILE 55 HG23 ILE 55 6.272 0.387 -1.643 481 HD11 ILE 55 HD11 ILE 55 3.061 -0.120 -3.535 482 HD12 ILE 55 HD12 ILE 55 2.155 -1.605 -3.855 483 HD13 ILE 55 HD13 ILE 55 2.393 -1.066 -2.177 484 H THR 56 H THR 56 5.722 -3.395 0.182 485 HA THR 56 HA THR 56 5.088 -6.015 -1.077 486 HB THR 56 HB THR 56 5.972 -6.946 1.236 487 HG1 THR 56 HG1 THR 56 7.998 -5.742 1.647 488 HG21 THR 56 HG21 THR 56 7.950 -6.069 -0.915 489 HG22 THR 56 HG22 THR 56 8.180 -7.385 0.260 490 HG23 THR 56 HG23 THR 56 6.937 -7.528 -0.991 491 H ALA 57 H ALA 57 3.318 -7.095 -0.168 492 HA ALA 57 HA ALA 57 1.294 -5.549 1.040 493 HB1 ALA 57 HB1 ALA 57 1.670 -8.583 0.972 494 HB2 ALA 57 HB2 ALA 57 0.156 -7.715 1.305 495 HB3 ALA 57 HB3 ALA 57 0.904 -7.607 -0.300 496 H ILE 58 H ILE 58 3.841 -7.501 2.461 497 HA ILE 58 HA ILE 58 2.921 -7.703 5.179 498 HB ILE 58 HB ILE 58 5.662 -7.676 3.837 499 HG12 ILE 58 HG12 ILE 58 5.735 -10.067 4.566 500 HG13 ILE 58 HG13 ILE 58 4.109 -9.930 5.226 501 HG21 ILE 58 HG21 ILE 58 5.008 -8.074 6.792 502 HG22 ILE 58 HG22 ILE 58 6.569 -8.512 6.050 503 HG23 ILE 58 HG23 ILE 58 6.058 -6.827 6.082 504 HD11 ILE 58 HD11 ILE 58 4.792 -9.582 2.274 505 HD12 ILE 58 HD12 ILE 58 4.280 -11.108 3.019 506 HD13 ILE 58 HD13 ILE 58 3.164 -9.742 2.995 507 H THR 59 H THR 59 4.763 -5.227 3.402 508 HA THR 59 HA THR 59 5.291 -3.628 5.795 509 HB THR 59 HB THR 59 6.000 -3.300 2.860 510 HG1 THR 59 HG1 THR 59 7.334 -4.769 3.285 511 HG21 THR 59 HG21 THR 59 7.124 -1.955 5.347 512 HG22 THR 59 HG22 THR 59 7.804 -1.851 3.697 513 HG23 THR 59 HG23 THR 59 6.192 -1.178 4.031 514 H LEU 60 H LEU 60 3.423 -3.383 2.750 515 HA LEU 60 HA LEU 60 2.203 -0.882 3.282 516 HB2 LEU 60 HB2 LEU 60 2.305 -2.181 1.091 517 HB3 LEU 60 HB3 LEU 60 1.109 -3.281 1.740 518 HG LEU 60 HG LEU 60 -0.499 -1.322 1.912 519 HD11 LEU 60 HD11 LEU 60 1.611 0.090 0.237 520 HD12 LEU 60 HD12 LEU 60 0.034 0.723 0.742 521 HD13 LEU 60 HD13 LEU 60 1.268 0.470 1.950 522 HD21 LEU 60 HD21 LEU 60 -0.546 -2.857 -0.006 523 HD22 LEU 60 HD22 LEU 60 -0.910 -1.199 -0.519 524 HD23 LEU 60 HD23 LEU 60 0.691 -1.901 -0.831 525 H SER 61 H SER 61 1.267 -4.200 4.276 526 HA SER 61 HA SER 61 -1.065 -3.655 5.716 527 HB2 SER 61 HB2 SER 61 -0.339 -5.895 5.321 528 HB3 SER 61 HB3 SER 61 1.130 -5.634 6.278 529 HG SER 61 HG SER 61 -0.396 -6.706 7.521 530 H LYS 62 H LYS 62 2.163 -2.913 6.509 531 HA LYS 62 HA LYS 62 1.448 -2.219 9.292 532 HB2 LYS 62 HB2 LYS 62 4.141 -2.736 8.004 533 HB3 LYS 62 HB3 LYS 62 3.948 -2.123 9.656 534 HG2 LYS 62 HG2 LYS 62 2.572 -4.086 10.263 535 HG3 LYS 62 HG3 LYS 62 2.740 -4.733 8.625 536 HD2 LYS 62 HD2 LYS 62 5.225 -4.802 8.942 537 HD3 LYS 62 HD3 LYS 62 4.987 -4.241 10.617 538 HE2 LYS 62 HE2 LYS 62 3.527 -6.241 11.032 539 HE3 LYS 62 HE3 LYS 62 3.852 -6.798 9.386 540 HZ1 LYS 62 HZ1 LYS 62 5.904 -6.444 11.510 541 HZ2 LYS 62 HZ2 LYS 62 5.327 -7.875 10.985 542 HZ3 LYS 62 HZ3 LYS 62 6.221 -6.943 9.986 543 H LYS 63 H LYS 63 2.535 -0.587 6.309 544 HA LYS 63 HA LYS 63 3.049 1.965 7.538 545 HB2 LYS 63 HB2 LYS 63 2.388 0.976 4.734 546 HB3 LYS 63 HB3 LYS 63 2.667 2.688 5.110 547 HG2 LYS 63 HG2 LYS 63 4.851 1.507 6.326 548 HG3 LYS 63 HG3 LYS 63 4.607 0.394 4.977 549 HD2 LYS 63 HD2 LYS 63 5.013 2.089 3.365 550 HD3 LYS 63 HD3 LYS 63 4.666 3.392 4.503 551 HE2 LYS 63 HE2 LYS 63 6.974 3.457 4.261 552 HE3 LYS 63 HE3 LYS 63 6.645 2.708 5.844 553 HZ1 LYS 63 HZ1 LYS 63 7.355 1.200 3.381 554 HZ2 LYS 63 HZ2 LYS 63 8.407 1.569 4.574 555 HZ3 LYS 63 HZ3 LYS 63 7.165 0.567 4.890 556 H LEU 64 H LEU 64 0.088 0.443 6.370 557 HA LEU 64 HA LEU 64 -1.467 2.880 7.125 558 HB2 LEU 64 HB2 LEU 64 -2.102 0.523 5.318 559 HB3 LEU 64 HB3 LEU 64 -3.253 1.777 5.759 560 HG LEU 64 HG LEU 64 -1.243 3.372 4.899 561 HD11 LEU 64 HD11 LEU 64 -1.103 0.909 3.110 562 HD12 LEU 64 HD12 LEU 64 -0.313 2.483 2.811 563 HD13 LEU 64 HD13 LEU 64 0.196 1.471 4.168 564 HD21 LEU 64 HD21 LEU 64 -3.577 3.452 4.156 565 HD22 LEU 64 HD22 LEU 64 -2.446 3.575 2.809 566 HD23 LEU 64 HD23 LEU 64 -3.306 2.041 3.102 567 H ASN 65 H ASN 65 -0.628 0.094 8.677 568 HA ASN 65 HA ASN 65 -1.483 -1.235 10.282 569 HB2 ASN 65 HB2 ASN 65 -3.274 1.119 10.987 570 HB3 ASN 65 HB3 ASN 65 -2.825 -0.217 12.035 571 HD21 ASN 65 HD21 ASN 65 -0.292 2.923 11.615 572 HD22 ASN 65 HD22 ASN 65 -1.809 2.852 10.728 573 H ILE 66 H ILE 66 -2.385 -1.981 7.936 574 HA ILE 66 HA ILE 66 -5.323 -2.540 8.139 575 HB ILE 66 HB ILE 66 -5.174 -3.003 5.704 576 HG12 ILE 66 HG12 ILE 66 -2.326 -1.938 5.951 577 HG13 ILE 66 HG13 ILE 66 -2.950 -3.461 5.308 578 HG21 ILE 66 HG21 ILE 66 -4.479 -0.169 6.489 579 HG22 ILE 66 HG22 ILE 66 -5.377 -0.708 5.053 580 HG23 ILE 66 HG23 ILE 66 -6.075 -0.938 6.656 581 HD11 ILE 66 HD11 ILE 66 -3.354 -0.767 3.977 582 HD12 ILE 66 HD12 ILE 66 -2.136 -1.967 3.561 583 HD13 ILE 66 HD13 ILE 66 -3.868 -2.355 3.359 584 H THR 67 H THR 67 -5.597 -4.720 6.564 585 HA THR 67 HA THR 67 -4.040 -6.860 7.891 586 HB THR 67 HB THR 67 -5.515 -8.430 6.812 587 HG1 THR 67 HG1 THR 67 -7.315 -7.534 5.609 588 HG21 THR 67 HG21 THR 67 -7.235 -6.174 7.922 589 HG22 THR 67 HG22 THR 67 -7.638 -7.902 7.840 590 HG23 THR 67 HG23 THR 67 -6.340 -7.348 8.911 591 H VAL 68 H VAL 68 -2.938 -8.496 6.576 592 HA VAL 68 HA VAL 68 -1.422 -7.506 4.330 593 HB VAL 68 HB VAL 68 -1.972 -10.321 5.331 594 HG11 VAL 68 HG11 VAL 68 -0.043 -9.454 3.136 595 HG12 VAL 68 HG12 VAL 68 -0.035 -11.041 3.937 596 HG13 VAL 68 HG13 VAL 68 -1.426 -10.567 2.962 597 HG21 VAL 68 HG21 VAL 68 -0.606 -8.903 6.828 598 HG22 VAL 68 HG22 VAL 68 0.388 -10.164 6.097 599 HG23 VAL 68 HG23 VAL 68 0.483 -8.502 5.479 600 H GLU 69 H GLU 69 -4.721 -8.755 4.467 601 HA GLU 69 HA GLU 69 -4.647 -9.688 1.688 602 HB2 GLU 69 HB2 GLU 69 -5.930 -10.689 3.737 603 HB3 GLU 69 HB3 GLU 69 -7.135 -9.452 3.408 604 HG2 GLU 69 HG2 GLU 69 -6.066 -11.498 1.402 605 HG3 GLU 69 HG3 GLU 69 -7.513 -11.742 2.372 606 H LYS 70 H LYS 70 -5.985 -6.904 3.582 607 HA LYS 70 HA LYS 70 -6.782 -5.708 1.070 608 HB2 LYS 70 HB2 LYS 70 -8.312 -4.467 2.038 609 HB3 LYS 70 HB3 LYS 70 -8.242 -5.771 3.188 610 HG2 LYS 70 HG2 LYS 70 -8.371 -3.991 4.579 611 HG3 LYS 70 HG3 LYS 70 -6.625 -4.205 4.534 612 HD2 LYS 70 HD2 LYS 70 -6.318 -2.152 3.528 613 HD3 LYS 70 HD3 LYS 70 -7.648 -2.394 2.398 614 HE2 LYS 70 HE2 LYS 70 -9.278 -1.817 4.157 615 HE3 LYS 70 HE3 LYS 70 -7.955 -1.500 5.289 616 HZ1 LYS 70 HZ1 LYS 70 -8.285 -0.090 2.687 617 HZ2 LYS 70 HZ2 LYS 70 -8.793 0.519 4.120 618 HZ3 LYS 70 HZ3 LYS 70 -7.199 0.286 3.851 619 H ALA 71 H ALA 71 -3.960 -6.025 2.404 620 HA ALA 71 HA ALA 71 -2.906 -3.506 1.202 621 HB1 ALA 71 HB1 ALA 71 -1.490 -5.859 2.548 622 HB2 ALA 71 HB2 ALA 71 -0.732 -4.376 1.967 623 HB3 ALA 71 HB3 ALA 71 -1.872 -4.314 3.321 624 H LYS 72 H LYS 72 -2.920 -7.081 0.749 625 HA LYS 72 HA LYS 72 -1.245 -6.990 -1.578 626 HB2 LYS 72 HB2 LYS 72 -1.351 -8.861 0.082 627 HB3 LYS 72 HB3 LYS 72 -3.032 -9.165 -0.348 628 HG2 LYS 72 HG2 LYS 72 -2.362 -9.864 -2.593 629 HG3 LYS 72 HG3 LYS 72 -0.666 -9.485 -2.241 630 HD2 LYS 72 HD2 LYS 72 -2.344 -11.513 -0.680 631 HD3 LYS 72 HD3 LYS 72 -1.321 -11.938 -2.063 632 HE2 LYS 72 HE2 LYS 72 0.669 -11.026 -0.847 633 HE3 LYS 72 HE3 LYS 72 -0.359 -10.692 0.554 634 HZ1 LYS 72 HZ1 LYS 72 0.124 -13.390 -0.603 635 HZ2 LYS 72 HZ2 LYS 72 0.775 -12.829 0.781 636 HZ3 LYS 72 HZ3 LYS 72 -0.834 -13.088 0.685 637 H ASN 73 H ASN 73 -4.715 -6.901 -1.075 638 HA ASN 73 HA ASN 73 -5.541 -7.637 -3.646 639 HB2 ASN 73 HB2 ASN 73 -7.598 -6.417 -3.195 640 HB3 ASN 73 HB3 ASN 73 -7.090 -7.276 -1.744 641 HD21 ASN 73 HD21 ASN 73 -8.044 -3.667 -1.005 642 HD22 ASN 73 HD22 ASN 73 -8.860 -4.883 -1.987 643 H TYR 74 H TYR 74 -4.284 -4.473 -2.572 644 HA TYR 74 HA TYR 74 -4.737 -2.956 -4.930 645 HB2 TYR 74 HB2 TYR 74 -2.587 -2.659 -2.810 646 HB3 TYR 74 HB3 TYR 74 -3.071 -1.442 -3.978 647 HD1 TYR 74 HD1 TYR 74 -5.961 -1.305 -3.895 648 HD2 TYR 74 HD2 TYR 74 -3.167 -2.010 -0.671 649 HE1 TYR 74 HE1 TYR 74 -7.634 -0.438 -2.274 650 HE2 TYR 74 HE2 TYR 74 -4.796 -0.973 0.925 651 HH TYR 74 HH TYR 74 -8.099 -0.004 -0.067 652 H ILE 75 H ILE 75 -1.890 -4.761 -3.714 653 HA ILE 75 HA ILE 75 -0.220 -4.222 -5.970 654 HB ILE 75 HB ILE 75 -0.122 -6.499 -3.950 655 HG12 ILE 75 HG12 ILE 75 1.306 -3.794 -3.944 656 HG13 ILE 75 HG13 ILE 75 -0.105 -4.162 -2.958 657 HG21 ILE 75 HG21 ILE 75 2.065 -5.382 -5.774 658 HG22 ILE 75 HG22 ILE 75 2.282 -6.650 -4.548 659 HG23 ILE 75 HG23 ILE 75 1.278 -6.967 -5.952 660 HD11 ILE 75 HD11 ILE 75 2.618 -5.453 -2.669 661 HD12 ILE 75 HD12 ILE 75 1.802 -4.338 -1.562 662 HD13 ILE 75 HD13 ILE 75 1.137 -5.960 -1.815 663 H LYS 76 H LYS 76 -2.506 -6.888 -5.324 664 HA LYS 76 HA LYS 76 -1.952 -8.484 -7.625 665 HB2 LYS 76 HB2 LYS 76 -4.320 -8.162 -5.755 666 HB3 LYS 76 HB3 LYS 76 -4.408 -9.242 -7.138 667 HG2 LYS 76 HG2 LYS 76 -2.115 -9.496 -5.176 668 HG3 LYS 76 HG3 LYS 76 -3.701 -10.201 -4.832 669 HD2 LYS 76 HD2 LYS 76 -3.652 -11.482 -6.922 670 HD3 LYS 76 HD3 LYS 76 -2.077 -10.813 -7.352 671 HE2 LYS 76 HE2 LYS 76 -2.582 -12.390 -4.787 672 HE3 LYS 76 HE3 LYS 76 -2.167 -13.169 -6.315 673 HZ1 LYS 76 HZ1 LYS 76 -0.445 -11.169 -4.950 674 HZ2 LYS 76 HZ2 LYS 76 -0.183 -12.782 -4.992 675 HZ3 LYS 76 HZ3 LYS 76 -0.097 -11.916 -6.362 676 H ASN 77 H ASN 77 -3.971 -5.529 -7.357 677 HA ASN 77 HA ASN 77 -4.834 -6.036 -10.148 678 HB2 ASN 77 HB2 ASN 77 -6.392 -4.338 -9.992 679 HB3 ASN 77 HB3 ASN 77 -6.624 -5.416 -8.631 680 HD21 ASN 77 HD21 ASN 77 -6.249 -2.827 -6.267 681 HD22 ASN 77 HD22 ASN 77 -6.169 -4.572 -6.440 682 H SER 78 H SER 78 -2.916 -3.726 -8.169 683 HA SER 78 HA SER 78 -2.547 -1.978 -10.415 684 HB2 SER 78 HB2 SER 78 -1.298 -1.926 -7.655 685 HB3 SER 78 HB3 SER 78 -1.105 -0.654 -8.869 686 HG SER 78 HG SER 78 -2.831 -0.222 -7.410 687 H ASN 79 H ASN 79 -0.663 -4.732 -9.547 688 HA ASN 79 HA ASN 79 1.938 -3.844 -10.002 689 HB2 ASN 79 HB2 ASN 79 2.554 -6.158 -10.336 690 HB3 ASN 79 HB3 ASN 79 1.393 -6.010 -9.026 691 HD21 ASN 79 HD21 ASN 79 -1.070 -8.002 -10.622 692 HD22 ASN 79 HD22 ASN 79 -0.655 -6.963 -9.257 693 H ARG 80 H ARG 80 3.395 -3.855 -11.647 694 HA ARG 80 HA ARG 80 4.278 -3.166 -13.606 695 HB2 ARG 80 HB2 ARG 80 2.135 -4.888 -14.908 696 HB3 ARG 80 HB3 ARG 80 3.437 -4.088 -15.758 697 HG2 ARG 80 HG2 ARG 80 4.042 -6.338 -15.526 698 HG3 ARG 80 HG3 ARG 80 5.118 -5.414 -14.475 699 HD2 ARG 80 HD2 ARG 80 4.030 -6.215 -12.503 700 HD3 ARG 80 HD3 ARG 80 2.596 -6.697 -13.422 701 HE ARG 80 HE ARG 80 5.257 -8.076 -13.634 702 HH11 ARG 80 HH11 ARG 80 5.235 -10.213 -14.167 703 HH12 ARG 80 HH12 ARG 80 3.732 -11.092 -14.211 704 HH21 ARG 80 HH21 ARG 80 1.785 -8.460 -13.204 705 HH22 ARG 80 HH22 ARG 80 1.817 -10.099 -13.811 706 H LEU 81 H LEU 81 0.845 -2.616 -13.410 707 HA LEU 81 HA LEU 81 0.745 -0.614 -15.493 708 HB2 LEU 81 HB2 LEU 81 -0.977 -2.369 -14.826 709 HB3 LEU 81 HB3 LEU 81 -1.325 -1.422 -13.398 710 HG LEU 81 HG LEU 81 -2.973 -1.231 -15.207 711 HD11 LEU 81 HD11 LEU 81 -1.681 1.485 -14.824 712 HD12 LEU 81 HD12 LEU 81 -3.374 1.107 -15.159 713 HD13 LEU 81 HD13 LEU 81 -2.672 0.658 -13.596 714 HD21 LEU 81 HD21 LEU 81 -1.415 -1.400 -17.133 715 HD22 LEU 81 HD22 LEU 81 -2.557 -0.050 -17.267 716 HD23 LEU 81 HD23 LEU 81 -0.871 0.266 -16.815 717 H GLY 82 H GLY 82 0.569 -0.478 -11.898 718 HA2 GLY 82 HA2 GLY 82 0.197 2.423 -11.916 719 HA3 GLY 82 HA3 GLY 82 0.396 1.400 -10.500 720 H ARG 83 H ARG 83 1.712 3.971 -11.840 721 HA ARG 83 HA ARG 83 4.554 3.379 -11.146 722 HB2 ARG 83 HB2 ARG 83 3.661 4.602 -13.796 723 HB3 ARG 83 HB3 ARG 83 5.334 4.394 -13.248 724 HG2 ARG 83 HG2 ARG 83 4.888 1.900 -13.074 725 HG3 ARG 83 HG3 ARG 83 3.339 2.198 -13.885 726 HD2 ARG 83 HD2 ARG 83 4.602 3.208 -15.799 727 HD3 ARG 83 HD3 ARG 83 6.109 2.710 -14.986 728 HE ARG 83 HE ARG 83 4.244 0.496 -15.197 729 HH11 ARG 83 HH11 ARG 83 4.503 -1.132 -16.511 730 HH12 ARG 83 HH12 ARG 83 5.563 -1.038 -17.907 731 HH21 ARG 83 HH21 ARG 83 6.504 2.227 -17.251 732 HH22 ARG 83 HH22 ARG 83 6.697 0.857 -18.313 733 H THR 84 H THR 84 5.854 5.496 -11.580 734 HA THR 84 HA THR 84 4.657 7.450 -9.673 735 HB THR 84 HB THR 84 6.178 5.737 -8.791 736 HG1 THR 84 HG1 THR 84 7.407 7.155 -7.578 737 HG21 THR 84 HG21 THR 84 8.375 7.149 -10.353 738 HG22 THR 84 HG22 THR 84 8.588 5.873 -9.137 739 HG23 THR 84 HG23 THR 84 7.767 5.507 -10.660 740 H ASN 85 H ASN 85 4.818 7.804 -12.649 741 HA ASN 85 HA ASN 85 6.722 10.062 -12.911 742 HB2 ASN 85 HB2 ASN 85 4.978 8.626 -14.948 743 HB3 ASN 85 HB3 ASN 85 5.989 10.020 -15.312 744 HD21 ASN 85 HD21 ASN 85 7.747 6.381 -14.962 745 HD22 ASN 85 HD22 ASN 85 6.014 6.567 -14.739 746 H ASN 86 H ASN 86 6.179 12.112 -12.648 747 HA ASN 86 HA ASN 86 3.489 13.159 -13.234 748 HB2 ASN 86 HB2 ASN 86 3.464 12.171 -10.873 749 HB3 ASN 86 HB3 ASN 86 4.645 13.396 -10.421 750 HD21 ASN 86 HD21 ASN 86 2.193 16.086 -10.690 751 HD22 ASN 86 HD22 ASN 86 3.889 15.731 -11.061 752 H LEU 87 H LEU 87 5.173 14.007 -14.854 753 HA LEU 87 HA LEU 87 6.504 16.493 -13.868 754 HB2 LEU 87 HB2 LEU 87 7.637 14.131 -15.325 755 HB3 LEU 87 HB3 LEU 87 8.137 15.724 -15.872 756 HG LEU 87 HG LEU 87 8.726 16.210 -13.378 757 HD11 LEU 87 HD11 LEU 87 8.766 13.152 -13.381 758 HD12 LEU 87 HD12 LEU 87 9.515 14.194 -12.151 759 HD13 LEU 87 HD13 LEU 87 7.767 14.189 -12.338 760 HD21 LEU 87 HD21 LEU 87 10.371 16.009 -15.192 761 HD22 LEU 87 HD22 LEU 87 10.968 15.247 -13.713 762 HD23 LEU 87 HD23 LEU 87 10.346 14.236 -15.039 763 H LYS 88 H LYS 88 7.041 18.004 -15.529 764 HA LYS 88 HA LYS 88 4.928 18.277 -17.637 765 HB2 LYS 88 HB2 LYS 88 4.654 20.623 -16.842 766 HB3 LYS 88 HB3 LYS 88 4.180 19.417 -15.656 767 HG2 LYS 88 HG2 LYS 88 6.095 19.741 -14.315 768 HG3 LYS 88 HG3 LYS 88 6.980 20.604 -15.572 769 HD2 LYS 88 HD2 LYS 88 4.431 21.665 -14.292 770 HD3 LYS 88 HD3 LYS 88 6.035 22.007 -13.646 771 HE2 LYS 88 HE2 LYS 88 5.199 22.693 -16.503 772 HE3 LYS 88 HE3 LYS 88 5.014 23.799 -15.141 773 HZ1 LYS 88 HZ1 LYS 88 7.613 22.699 -16.071 774 HZ2 LYS 88 HZ2 LYS 88 7.084 24.222 -16.304 775 HZ3 LYS 88 HZ3 LYS 88 7.419 23.707 -14.796 776 H THR 89 H THR 89 7.990 17.816 -17.683 777 HA THR 89 HA THR 89 8.678 19.980 -19.612 778 HB THR 89 HB THR 89 9.519 20.518 -17.371 779 HG1 THR 89 HG1 THR 89 11.588 21.012 -18.036 780 HG21 THR 89 HG21 THR 89 11.294 18.056 -17.634 781 HG22 THR 89 HG22 THR 89 11.430 19.325 -16.400 782 HG23 THR 89 HG23 THR 89 9.991 18.299 -16.455 783 H ILE 90 H ILE 90 7.712 17.683 -20.490 784 HA ILE 90 HA ILE 90 9.879 15.783 -20.998 785 HB ILE 90 HB ILE 90 8.049 14.381 -21.922 786 HG12 ILE 90 HG12 ILE 90 6.452 16.289 -22.473 787 HG13 ILE 90 HG13 ILE 90 5.828 14.778 -21.854 788 HG21 ILE 90 HG21 ILE 90 7.779 15.381 -19.056 789 HG22 ILE 90 HG22 ILE 90 7.138 13.840 -19.676 790 HG23 ILE 90 HG23 ILE 90 8.885 14.130 -19.651 791 HD11 ILE 90 HD11 ILE 90 6.071 17.341 -20.228 792 HD12 ILE 90 HD12 ILE 90 4.605 16.648 -20.922 793 HD13 ILE 90 HD13 ILE 90 5.448 15.783 -19.633 794 H GLY 91 H GLY 91 9.215 18.479 -22.630 795 HA2 GLY 91 HA2 GLY 91 9.549 19.222 -24.796 796 HA3 GLY 91 HA3 GLY 91 10.285 17.659 -25.183 797 H ILE 92 H ILE 92 7.240 17.153 -23.926 798 HA ILE 92 HA ILE 92 5.379 16.209 -24.750 799 HB ILE 92 HB ILE 92 5.144 18.650 -26.523 800 HG12 ILE 92 HG12 ILE 92 3.807 19.396 -24.299 801 HG13 ILE 92 HG13 ILE 92 4.969 18.350 -23.498 802 HG21 ILE 92 HG21 ILE 92 3.074 16.953 -25.038 803 HG22 ILE 92 HG22 ILE 92 2.733 18.402 -26.006 804 HG23 ILE 92 HG23 ILE 92 3.325 16.954 -26.792 805 HD11 ILE 92 HD11 ILE 92 5.653 20.712 -25.316 806 HD12 ILE 92 HD12 ILE 92 5.592 20.760 -23.542 807 HD13 ILE 92 HD13 ILE 92 6.811 19.772 -24.347 808 H LEU 93 H LEU 93 7.547 15.038 -25.767 809 HA LEU 93 HA LEU 93 8.391 13.655 -27.275 810 HB2 LEU 93 HB2 LEU 93 6.003 12.788 -26.622 811 HB3 LEU 93 HB3 LEU 93 5.579 13.173 -28.281 812 HG LEU 93 HG LEU 93 7.407 11.556 -29.034 813 HD11 LEU 93 HD11 LEU 93 7.466 10.875 -26.058 814 HD12 LEU 93 HD12 LEU 93 8.208 9.913 -27.353 815 HD13 LEU 93 HD13 LEU 93 8.819 11.532 -27.006 816 HD21 LEU 93 HD21 LEU 93 5.035 10.893 -28.899 817 HD22 LEU 93 HD22 LEU 93 6.106 9.547 -28.477 818 HD23 LEU 93 HD23 LEU 93 5.250 10.435 -27.195 819 H GLN 94 H GLN 94 8.120 16.425 -28.285 820 HA GLN 94 HA GLN 94 8.281 15.980 -31.244 821 HB2 GLN 94 HB2 GLN 94 6.511 17.897 -29.693 822 HB3 GLN 94 HB3 GLN 94 6.890 18.143 -31.403 823 HG2 GLN 94 HG2 GLN 94 5.838 16.116 -32.083 824 HG3 GLN 94 HG3 GLN 94 5.662 15.543 -30.424 825 HE21 GLN 94 HE21 GLN 94 2.821 17.572 -29.659 826 HE22 GLN 94 HE22 GLN 94 4.228 16.760 -28.959 827 H GLU 95 H GLU 95 10.573 16.092 -29.966 828 HA GLU 95 HA GLU 95 11.649 18.861 -30.008 829 HB2 GLU 95 HB2 GLU 95 12.774 16.189 -29.114 830 HB3 GLU 95 HB3 GLU 95 13.715 17.677 -29.102 831 HG2 GLU 95 HG2 GLU 95 11.086 17.397 -27.587 832 HG3 GLU 95 HG3 GLU 95 12.648 16.987 -26.902 833 H GLU 96 H GLU 96 11.013 16.902 -32.460 834 HA GLU 96 HA GLU 96 13.670 16.965 -33.782 835 HB2 GLU 96 HB2 GLU 96 12.035 14.871 -33.305 836 HB3 GLU 96 HB3 GLU 96 11.420 15.310 -34.882 837 HG2 GLU 96 HG2 GLU 96 14.314 14.672 -34.135 838 HG3 GLU 96 HG3 GLU 96 13.192 13.570 -34.914 839 H VAL 97 H VAL 97 12.902 19.379 -33.832 840 HA VAL 97 HA VAL 97 12.205 19.916 -36.664 841 HB VAL 97 HB VAL 97 10.952 21.391 -34.304 842 HG11 VAL 97 HG11 VAL 97 10.509 21.800 -37.293 843 HG12 VAL 97 HG12 VAL 97 9.627 22.608 -35.984 844 HG13 VAL 97 HG13 VAL 97 11.340 22.933 -36.200 845 HG21 VAL 97 HG21 VAL 97 9.835 19.236 -34.640 846 HG22 VAL 97 HG22 VAL 97 8.786 20.545 -35.184 847 HG23 VAL 97 HG23 VAL 97 9.668 19.564 -36.379 848 H SER 98 H SER 98 13.388 21.558 -37.576 849 HA SER 98 HA SER 98 15.102 23.265 -35.809 850 HB2 SER 98 HB2 SER 98 16.376 21.378 -36.763 851 HB3 SER 98 HB3 SER 98 15.985 21.951 -38.393 852 HG SER 98 HG SER 98 18.033 22.716 -37.620 853 H SER 99 H SER 99 14.262 23.061 -39.324 854 HA SER 99 HA SER 99 13.489 25.959 -39.280 855 HB2 SER 99 HB2 SER 99 15.401 24.612 -41.225 856 HB3 SER 99 HB3 SER 99 14.711 26.232 -41.427 857 HG SER 99 HG SER 99 16.803 26.267 -40.460 858 H MET 100 H MET 100 11.367 25.775 -39.649 859 HA MET 100 HA MET 100 9.357 25.243 -40.542 860 HB2 MET 100 HB2 MET 100 10.843 25.359 -43.182 861 HB3 MET 100 HB3 MET 100 9.097 25.518 -42.940 862 HG2 MET 100 HG2 MET 100 9.502 27.517 -41.504 863 HG3 MET 100 HG3 MET 100 11.219 27.430 -41.897 864 HE1 MET 100 HE1 MET 100 11.294 26.731 -45.035 865 HE2 MET 100 HE2 MET 100 11.339 28.382 -45.682 866 HE3 MET 100 HE3 MET 100 12.270 27.979 -44.223 867 H GLU 101 H GLU 101 10.822 22.988 -39.656 868 HA GLU 101 HA GLU 101 10.402 20.825 -41.608 869 HB2 GLU 101 HB2 GLU 101 12.547 21.325 -40.445 870 HB3 GLU 101 HB3 GLU 101 11.809 20.855 -38.916 871 HG2 GLU 101 HG2 GLU 101 11.638 18.553 -39.635 872 HG3 GLU 101 HG3 GLU 101 12.013 18.996 -41.309 873 H ALA 102 H ALA 102 8.459 22.141 -39.358 874 HA ALA 102 HA ALA 102 7.354 19.777 -38.046 875 HB1 ALA 102 HB1 ALA 102 6.335 22.646 -38.227 876 HB2 ALA 102 HB2 ALA 102 5.738 21.391 -37.121 877 HB3 ALA 102 HB3 ALA 102 7.397 21.994 -36.956 878 H LYS 103 H LYS 103 5.115 19.129 -38.220 879 HA LYS 103 HA LYS 103 3.945 19.313 -40.976 880 HB2 LYS 103 HB2 LYS 103 3.634 17.208 -38.800 881 HB3 LYS 103 HB3 LYS 103 2.670 17.245 -40.273 882 HG2 LYS 103 HG2 LYS 103 5.716 17.041 -40.251 883 HG3 LYS 103 HG3 LYS 103 4.626 15.655 -40.300 884 HD2 LYS 103 HD2 LYS 103 3.649 16.422 -42.415 885 HD3 LYS 103 HD3 LYS 103 4.695 17.845 -42.436 886 HE2 LYS 103 HE2 LYS 103 5.725 14.975 -42.401 887 HE3 LYS 103 HE3 LYS 103 5.423 15.888 -43.881 888 HZ1 LYS 103 HZ1 LYS 103 7.358 16.693 -41.774 889 HZ2 LYS 103 HZ2 LYS 103 7.741 16.061 -43.228 890 HZ3 LYS 103 HZ3 LYS 103 7.052 17.535 -43.142 891 H SER 104 H SER 104 2.269 20.541 -41.241 892 HA SER 104 HA SER 104 0.163 20.893 -39.222 893 HB2 SER 104 HB2 SER 104 0.350 23.352 -39.222 894 HB3 SER 104 HB3 SER 104 1.780 22.582 -38.524 895 HG SER 104 HG SER 104 2.334 24.267 -39.980 896 H MET 105 H MET 105 -1.615 22.295 -40.068 897 HA MET 105 HA MET 105 -1.933 22.247 -43.031 898 HB2 MET 105 HB2 MET 105 -3.817 20.969 -41.002 899 HB3 MET 105 HB3 MET 105 -4.226 21.269 -42.693 900 HG2 MET 105 HG2 MET 105 -2.310 19.869 -43.411 901 HG3 MET 105 HG3 MET 105 -1.963 19.492 -41.720 902 HE1 MET 105 HE1 MET 105 -1.957 16.936 -42.200 903 HE2 MET 105 HE2 MET 105 -3.256 16.080 -43.059 904 HE3 MET 105 HE3 MET 105 -2.264 17.278 -43.918 905 H THR 106 H THR 106 -4.058 23.274 -43.647 906 HA THR 106 HA THR 106 -4.886 25.521 -41.897 907 HB THR 106 HB THR 106 -3.179 26.362 -43.468 908 HG1 THR 106 HG1 THR 106 -4.401 28.116 -44.094 909 HG21 THR 106 HG21 THR 106 -5.218 25.752 -45.655 910 HG22 THR 106 HG22 THR 106 -3.694 26.646 -45.840 911 HG23 THR 106 HG23 THR 106 -3.659 24.923 -45.441 912 H TRP 107 H TRP 107 -6.835 26.589 -42.733 913 HA TRP 107 HA TRP 107 -8.836 24.504 -43.463 914 HB2 TRP 107 HB2 TRP 107 -9.068 26.724 -41.425 915 HB3 TRP 107 HB3 TRP 107 -10.411 25.733 -41.975 916 HD1 TRP 107 HD1 TRP 107 -10.724 23.398 -40.925 917 HE1 TRP 107 HE1 TRP 107 -9.558 22.051 -39.071 918 HE3 TRP 107 HE3 TRP 107 -6.564 26.300 -40.332 919 HZ2 TRP 107 HZ2 TRP 107 -7.101 22.201 -37.552 920 HZ3 TRP 107 HZ3 TRP 107 -4.801 25.667 -38.687 921 HH2 TRP 107 HH2 TRP 107 -5.063 23.624 -37.294 Start of MODEL 11 1 H1 GLY -5 H1 GLY -5 -64.177 -17.577 -4.632 2 H2 GLY -5 H2 GLY -5 -65.435 -18.455 -5.205 3 H3 GLY -5 H3 GLY -5 -65.039 -18.531 -3.617 4 HA2 GLY -5 HA2 GLY -5 -67.004 -17.190 -3.880 5 HA3 GLY -5 HA3 GLY -5 -65.642 -16.219 -3.292 6 H SER -4 H SER -4 -66.106 -14.244 -4.162 7 HA SER -4 HA SER -4 -66.321 -14.007 -7.140 8 HB2 SER -4 HB2 SER -4 -68.459 -13.708 -5.692 9 HB3 SER -4 HB3 SER -4 -67.756 -12.145 -5.247 10 HG SER -4 HG SER -4 -69.140 -12.036 -7.098 11 H HIS -3 H HIS -3 -64.057 -13.633 -5.063 12 HA HIS -3 HA HIS -3 -63.307 -10.795 -5.500 13 HB2 HIS -3 HB2 HIS -3 -62.180 -12.967 -3.699 14 HB3 HIS -3 HB3 HIS -3 -61.502 -11.349 -3.851 15 HD2 HIS -3 HD2 HIS -3 -62.555 -9.432 -2.444 16 HE1 HIS -3 HE1 HIS -3 -65.954 -11.495 -0.896 17 HE2 HIS -3 HE2 HIS -3 -64.601 -9.340 -0.784 18 H MET -2 H MET -2 -61.258 -10.177 -6.259 19 HA MET -2 HA MET -2 -59.587 -12.135 -7.739 20 HB2 MET -2 HB2 MET -2 -61.322 -11.319 -9.324 21 HB3 MET -2 HB3 MET -2 -60.832 -9.652 -9.002 22 HG2 MET -2 HG2 MET -2 -58.580 -10.143 -9.907 23 HG3 MET -2 HG3 MET -2 -59.054 -11.826 -10.183 24 HE1 MET -2 HE1 MET -2 -58.192 -11.608 -12.689 25 HE2 MET -2 HE2 MET -2 -58.730 -10.338 -13.811 26 HE3 MET -2 HE3 MET -2 -57.748 -9.910 -12.393 27 H ALA -1 H ALA -1 -57.603 -11.870 -7.095 28 HA ALA -1 HA ALA -1 -56.357 -9.245 -6.970 29 HB1 ALA -1 HB1 ALA -1 -56.538 -11.015 -4.476 30 HB2 ALA -1 HB2 ALA -1 -55.586 -9.521 -4.613 31 HB3 ALA -1 HB3 ALA -1 -57.353 -9.450 -4.691 32 H SER 0 H SER 0 -54.054 -9.333 -6.626 33 HA SER 0 HA SER 0 -52.700 -11.894 -7.364 34 HB2 SER 0 HB2 SER 0 -52.634 -9.249 -8.852 35 HB3 SER 0 HB3 SER 0 -51.433 -10.543 -9.090 36 HG SER 0 HG SER 0 -53.159 -10.635 -10.618 37 H MET 1 H MET 1 -50.956 -12.196 -6.164 38 HA MET 1 HA MET 1 -49.109 -9.992 -5.506 39 HB2 MET 1 HB2 MET 1 -50.259 -11.879 -3.398 40 HB3 MET 1 HB3 MET 1 -48.824 -10.873 -3.176 41 HG2 MET 1 HG2 MET 1 -50.197 -8.842 -3.604 42 HG3 MET 1 HG3 MET 1 -51.638 -9.863 -3.691 43 HE1 MET 1 HE1 MET 1 -52.774 -8.265 -1.912 44 HE2 MET 1 HE2 MET 1 -52.074 -7.901 -0.318 45 HE3 MET 1 HE3 MET 1 -51.285 -7.299 -1.792 46 H ASP 2 H ASP 2 -47.012 -10.635 -5.666 47 HA ASP 2 HA ASP 2 -46.387 -13.545 -6.021 48 HB2 ASP 2 HB2 ASP 2 -45.500 -11.260 -7.813 49 HB3 ASP 2 HB3 ASP 2 -45.017 -12.946 -7.969 50 HA PRO 3 HA PRO 3 -43.178 -11.386 -3.373 51 HB2 PRO 3 HB2 PRO 3 -43.634 -12.321 -0.865 52 HB3 PRO 3 HB3 PRO 3 -44.635 -11.023 -1.584 53 HG2 PRO 3 HG2 PRO 3 -45.231 -14.001 -1.522 54 HG3 PRO 3 HG3 PRO 3 -46.296 -12.660 -0.992 55 HD2 PRO 3 HD2 PRO 3 -46.508 -13.745 -3.487 56 HD3 PRO 3 HD3 PRO 3 -46.727 -11.995 -3.192 57 H LEU 4 H LEU 4 -43.767 -14.511 -4.271 58 HA LEU 4 HA LEU 4 -41.086 -15.434 -3.429 59 HB2 LEU 4 HB2 LEU 4 -41.779 -17.532 -2.706 60 HB3 LEU 4 HB3 LEU 4 -42.642 -16.311 -1.800 61 HG LEU 4 HG LEU 4 -43.903 -17.855 -4.122 62 HD11 LEU 4 HD11 LEU 4 -44.009 -18.387 -1.125 63 HD12 LEU 4 HD12 LEU 4 -44.943 -19.246 -2.376 64 HD13 LEU 4 HD13 LEU 4 -43.179 -19.389 -2.333 65 HD21 LEU 4 HD21 LEU 4 -45.114 -15.801 -3.572 66 HD22 LEU 4 HD22 LEU 4 -46.023 -17.204 -3.012 67 HD23 LEU 4 HD23 LEU 4 -45.096 -16.237 -1.843 68 H ASP 5 H ASP 5 -41.836 -14.397 -5.971 69 HA ASP 5 HA ASP 5 -41.409 -16.781 -7.720 70 HB2 ASP 5 HB2 ASP 5 -42.549 -14.024 -8.153 71 HB3 ASP 5 HB3 ASP 5 -41.844 -14.882 -9.510 72 H LYS 6 H LYS 6 -39.458 -14.791 -6.132 73 HA LYS 6 HA LYS 6 -37.463 -14.475 -8.362 74 HB2 LYS 6 HB2 LYS 6 -37.853 -12.338 -6.238 75 HB3 LYS 6 HB3 LYS 6 -36.965 -12.270 -7.752 76 HG2 LYS 6 HG2 LYS 6 -38.833 -11.173 -8.452 77 HG3 LYS 6 HG3 LYS 6 -39.367 -12.812 -8.789 78 HD2 LYS 6 HD2 LYS 6 -41.209 -12.132 -7.606 79 HD3 LYS 6 HD3 LYS 6 -40.237 -12.625 -6.205 80 HE2 LYS 6 HE2 LYS 6 -39.391 -10.224 -6.076 81 HE3 LYS 6 HE3 LYS 6 -40.494 -9.823 -7.398 82 HZ1 LYS 6 HZ1 LYS 6 -41.235 -10.733 -4.682 83 HZ2 LYS 6 HZ2 LYS 6 -41.620 -9.313 -5.388 84 HZ3 LYS 6 HZ3 LYS 6 -42.321 -10.707 -5.907 85 H ILE 7 H ILE 7 -37.618 -14.094 -4.838 86 HA ILE 7 HA ILE 7 -34.883 -15.244 -4.583 87 HB ILE 7 HB ILE 7 -34.774 -14.038 -2.419 88 HG12 ILE 7 HG12 ILE 7 -36.262 -12.119 -2.016 89 HG13 ILE 7 HG13 ILE 7 -37.318 -12.608 -3.331 90 HG21 ILE 7 HG21 ILE 7 -35.315 -12.307 -4.868 91 HG22 ILE 7 HG22 ILE 7 -34.334 -11.870 -3.454 92 HG23 ILE 7 HG23 ILE 7 -33.807 -13.178 -4.523 93 HD11 ILE 7 HD11 ILE 7 -36.810 -14.273 -0.824 94 HD12 ILE 7 HD12 ILE 7 -38.175 -13.163 -1.050 95 HD13 ILE 7 HD13 ILE 7 -38.033 -14.586 -2.085 96 H ILE 8 H ILE 8 -37.743 -16.527 -4.572 97 HA ILE 8 HA ILE 8 -38.284 -17.792 -2.191 98 HB ILE 8 HB ILE 8 -39.685 -17.973 -4.089 99 HG12 ILE 8 HG12 ILE 8 -38.843 -20.735 -3.115 100 HG13 ILE 8 HG13 ILE 8 -39.897 -19.606 -2.260 101 HG21 ILE 8 HG21 ILE 8 -37.808 -20.003 -5.361 102 HG22 ILE 8 HG22 ILE 8 -39.323 -19.362 -6.024 103 HG23 ILE 8 HG23 ILE 8 -37.921 -18.309 -5.873 104 HD11 ILE 8 HD11 ILE 8 -40.505 -21.010 -4.896 105 HD12 ILE 8 HD12 ILE 8 -41.235 -21.315 -3.313 106 HD13 ILE 8 HD13 ILE 8 -41.545 -19.778 -4.140 107 H ASN 9 H ASN 9 -37.293 -19.075 -0.846 108 HA ASN 9 HA ASN 9 -35.450 -21.220 -1.746 109 HB2 ASN 9 HB2 ASN 9 -34.231 -18.986 -1.298 110 HB3 ASN 9 HB3 ASN 9 -34.654 -19.205 0.397 111 HD21 ASN 9 HD21 ASN 9 -31.831 -21.303 0.848 112 HD22 ASN 9 HD22 ASN 9 -33.034 -20.250 1.578 113 H ASP 10 H ASP 10 -38.114 -20.587 0.070 114 HA ASP 10 HA ASP 10 -37.252 -21.919 2.470 115 HB2 ASP 10 HB2 ASP 10 -38.733 -19.873 2.351 116 HB3 ASP 10 HB3 ASP 10 -40.020 -20.897 1.720 117 H ILE 11 H ILE 11 -37.725 -23.369 -0.143 118 HA ILE 11 HA ILE 11 -38.768 -25.873 0.984 119 HB ILE 11 HB ILE 11 -40.723 -24.606 0.080 120 HG12 ILE 11 HG12 ILE 11 -40.308 -27.197 -1.444 121 HG13 ILE 11 HG13 ILE 11 -40.668 -27.097 0.281 122 HG21 ILE 11 HG21 ILE 11 -39.550 -25.056 -2.691 123 HG22 ILE 11 HG22 ILE 11 -41.088 -24.276 -2.285 124 HG23 ILE 11 HG23 ILE 11 -39.574 -23.499 -1.836 125 HD11 ILE 11 HD11 ILE 11 -42.442 -26.109 -1.990 126 HD12 ILE 11 HD12 ILE 11 -42.709 -27.514 -0.949 127 HD13 ILE 11 HD13 ILE 11 -42.785 -25.882 -0.256 128 H LYS 12 H LYS 12 -36.213 -25.076 0.430 129 HA LYS 12 HA LYS 12 -35.479 -26.889 -1.828 130 HB2 LYS 12 HB2 LYS 12 -35.241 -24.414 -2.240 131 HB3 LYS 12 HB3 LYS 12 -34.019 -24.363 -0.963 132 HG2 LYS 12 HG2 LYS 12 -32.730 -26.126 -2.306 133 HG3 LYS 12 HG3 LYS 12 -33.883 -25.868 -3.618 134 HD2 LYS 12 HD2 LYS 12 -32.108 -23.738 -2.341 135 HD3 LYS 12 HD3 LYS 12 -31.762 -24.559 -3.866 136 HE2 LYS 12 HE2 LYS 12 -33.660 -23.569 -4.964 137 HE3 LYS 12 HE3 LYS 12 -34.324 -22.971 -3.437 138 HZ1 LYS 12 HZ1 LYS 12 -31.777 -22.018 -4.616 139 HZ2 LYS 12 HZ2 LYS 12 -33.198 -21.203 -4.649 140 HZ3 LYS 12 HZ3 LYS 12 -32.460 -21.489 -3.216 141 H LYS 13 H LYS 13 -34.225 -25.598 1.239 142 HA LYS 13 HA LYS 13 -32.428 -26.172 2.543 143 HB2 LYS 13 HB2 LYS 13 -34.369 -27.740 3.142 144 HB3 LYS 13 HB3 LYS 13 -33.476 -29.005 2.295 145 HG2 LYS 13 HG2 LYS 13 -31.484 -28.396 3.862 146 HG3 LYS 13 HG3 LYS 13 -32.640 -27.409 4.762 147 HD2 LYS 13 HD2 LYS 13 -34.031 -29.432 5.177 148 HD3 LYS 13 HD3 LYS 13 -32.882 -30.406 4.229 149 HE2 LYS 13 HE2 LYS 13 -31.058 -29.722 5.821 150 HE3 LYS 13 HE3 LYS 13 -32.265 -28.880 6.800 151 HZ1 LYS 13 HZ1 LYS 13 -32.250 -31.799 6.230 152 HZ2 LYS 13 HZ2 LYS 13 -31.842 -31.112 7.650 153 HZ3 LYS 13 HZ3 LYS 13 -33.384 -31.033 7.124 154 H GLU 14 H GLU 14 -31.262 -25.674 0.301 155 HA GLU 14 HA GLU 14 -29.134 -27.722 0.003 156 HB2 GLU 14 HB2 GLU 14 -30.992 -28.040 -1.738 157 HB3 GLU 14 HB3 GLU 14 -30.467 -26.503 -2.437 158 HG2 GLU 14 HG2 GLU 14 -28.258 -27.435 -2.915 159 HG3 GLU 14 HG3 GLU 14 -28.637 -28.900 -2.004 160 H ALA 15 H ALA 15 -27.170 -26.929 -0.973 161 HA ALA 15 HA ALA 15 -26.517 -24.216 -0.128 162 HB1 ALA 15 HB1 ALA 15 -24.799 -26.373 -1.412 163 HB2 ALA 15 HB2 ALA 15 -24.232 -24.923 -0.560 164 HB3 ALA 15 HB3 ALA 15 -25.080 -26.194 0.342 165 H ASN 16 H ASN 16 -24.614 -23.333 -1.696 166 HA ASN 16 HA ASN 16 -25.786 -22.801 -4.373 167 HB2 ASN 16 HB2 ASN 16 -25.420 -20.447 -4.054 168 HB3 ASN 16 HB3 ASN 16 -26.384 -21.072 -2.717 169 HD21 ASN 16 HD21 ASN 16 -23.972 -18.751 -1.216 170 HD22 ASN 16 HD22 ASN 16 -25.346 -18.656 -2.309 171 H ASP 17 H ASP 17 -24.237 -21.600 -5.799 172 HA ASP 17 HA ASP 17 -21.447 -22.657 -5.618 173 HB2 ASP 17 HB2 ASP 17 -23.375 -22.901 -7.959 174 HB3 ASP 17 HB3 ASP 17 -21.653 -23.265 -8.044 175 H SER 18 H SER 18 -22.088 -20.066 -4.916 176 HA SER 18 HA SER 18 -21.533 -18.327 -7.174 177 HB2 SER 18 HB2 SER 18 -21.832 -16.493 -5.497 178 HB3 SER 18 HB3 SER 18 -23.194 -17.620 -5.569 179 HG SER 18 HG SER 18 -22.500 -17.124 -3.402 180 H GLY 19 H GLY 19 -19.453 -20.122 -6.633 181 HA2 GLY 19 HA2 GLY 19 -17.201 -18.369 -5.835 182 HA3 GLY 19 HA3 GLY 19 -17.135 -20.118 -6.061 183 H VAL 20 H VAL 20 -16.827 -20.940 -8.089 184 HA VAL 20 HA VAL 20 -15.777 -21.233 -10.016 185 HB VAL 20 HB VAL 20 -17.412 -18.838 -10.775 186 HG11 VAL 20 HG11 VAL 20 -15.863 -20.745 -12.595 187 HG12 VAL 20 HG12 VAL 20 -17.113 -19.608 -13.149 188 HG13 VAL 20 HG13 VAL 20 -15.618 -18.992 -12.449 189 HG21 VAL 20 HG21 VAL 20 -18.704 -20.812 -10.092 190 HG22 VAL 20 HG22 VAL 20 -18.864 -20.536 -11.827 191 HG23 VAL 20 HG23 VAL 20 -17.791 -21.823 -11.236 192 H THR 21 H THR 21 -13.738 -21.196 -10.350 193 HA THR 21 HA THR 21 -11.553 -20.566 -10.514 194 HB THR 21 HB THR 21 -12.332 -17.925 -11.668 195 HG1 THR 21 HG1 THR 21 -12.874 -18.970 -13.586 196 HG21 THR 21 HG21 THR 21 -10.434 -20.138 -12.586 197 HG22 THR 21 HG22 THR 21 -10.689 -18.586 -13.412 198 HG23 THR 21 HG23 THR 21 -9.928 -18.618 -11.825 199 H LEU 22 H LEU 22 -10.306 -17.939 -10.305 200 HA LEU 22 HA LEU 22 -10.900 -17.121 -7.519 201 HB2 LEU 22 HB2 LEU 22 -8.573 -16.880 -6.998 202 HB3 LEU 22 HB3 LEU 22 -8.935 -18.544 -7.386 203 HG LEU 22 HG LEU 22 -7.852 -16.800 -9.611 204 HD11 LEU 22 HD11 LEU 22 -6.142 -17.953 -7.368 205 HD12 LEU 22 HD12 LEU 22 -5.538 -17.234 -8.881 206 HD13 LEU 22 HD13 LEU 22 -6.405 -16.228 -7.712 207 HD21 LEU 22 HD21 LEU 22 -8.417 -19.211 -10.027 208 HD22 LEU 22 HD22 LEU 22 -6.699 -18.867 -10.251 209 HD23 LEU 22 HD23 LEU 22 -7.258 -19.675 -8.771 210 H ALA 23 H ALA 23 -11.965 -16.010 -9.783 211 HA ALA 23 HA ALA 23 -10.661 -13.343 -10.046 212 HB1 ALA 23 HB1 ALA 23 -12.624 -14.827 -11.837 213 HB2 ALA 23 HB2 ALA 23 -12.019 -13.183 -12.122 214 HB3 ALA 23 HB3 ALA 23 -10.892 -14.554 -12.141 215 HA PRO 24 HA PRO 24 -14.119 -11.862 -7.626 216 HB2 PRO 24 HB2 PRO 24 -13.925 -9.154 -7.967 217 HB3 PRO 24 HB3 PRO 24 -12.753 -10.114 -7.014 218 HG2 PRO 24 HG2 PRO 24 -12.509 -9.207 -9.897 219 HG3 PRO 24 HG3 PRO 24 -11.299 -9.062 -8.579 220 HD2 PRO 24 HD2 PRO 24 -11.216 -11.095 -10.393 221 HD3 PRO 24 HD3 PRO 24 -10.773 -11.358 -8.681 222 H LEU 25 H LEU 25 -13.874 -10.735 -11.013 223 HA LEU 25 HA LEU 25 -16.747 -11.230 -11.377 224 HB2 LEU 25 HB2 LEU 25 -16.414 -8.806 -10.557 225 HB3 LEU 25 HB3 LEU 25 -15.619 -8.500 -12.096 226 HG LEU 25 HG LEU 25 -17.773 -9.181 -13.264 227 HD11 LEU 25 HD11 LEU 25 -18.872 -9.211 -10.419 228 HD12 LEU 25 HD12 LEU 25 -19.852 -9.213 -11.902 229 HD13 LEU 25 HD13 LEU 25 -18.814 -10.590 -11.538 230 HD21 LEU 25 HD21 LEU 25 -17.239 -6.819 -12.802 231 HD22 LEU 25 HD22 LEU 25 -18.980 -7.123 -12.701 232 HD23 LEU 25 HD23 LEU 25 -18.024 -6.946 -11.211 233 H SER 26 H SER 26 -15.137 -12.901 -12.430 234 HA SER 26 HA SER 26 -14.320 -13.894 -14.301 235 HB2 SER 26 HB2 SER 26 -16.819 -13.431 -14.726 236 HB3 SER 26 HB3 SER 26 -16.268 -12.225 -15.896 237 HG SER 26 HG SER 26 -16.613 -14.299 -16.853 238 H VAL 27 H VAL 27 -12.699 -11.857 -13.519 239 HA VAL 27 HA VAL 27 -11.231 -11.109 -15.945 240 HB VAL 27 HB VAL 27 -13.013 -9.378 -15.581 241 HG11 VAL 27 HG11 VAL 27 -11.411 -8.545 -13.150 242 HG12 VAL 27 HG12 VAL 27 -12.851 -7.749 -13.810 243 HG13 VAL 27 HG13 VAL 27 -12.993 -9.352 -13.076 244 HG21 VAL 27 HG21 VAL 27 -10.970 -8.791 -16.810 245 HG22 VAL 27 HG22 VAL 27 -11.602 -7.421 -15.892 246 HG23 VAL 27 HG23 VAL 27 -10.184 -8.293 -15.284 247 HA PRO 28 HA PRO 28 -8.059 -11.930 -12.950 248 HB2 PRO 28 HB2 PRO 28 -5.774 -11.134 -14.215 249 HB3 PRO 28 HB3 PRO 28 -6.763 -12.521 -14.744 250 HG2 PRO 28 HG2 PRO 28 -6.871 -9.676 -15.804 251 HG3 PRO 28 HG3 PRO 28 -6.700 -11.198 -16.740 252 HD2 PRO 28 HD2 PRO 28 -9.107 -10.027 -16.406 253 HD3 PRO 28 HD3 PRO 28 -8.950 -11.802 -16.344 254 H LYS 29 H LYS 29 -9.243 -10.330 -11.678 255 HA LYS 29 HA LYS 29 -9.313 -8.822 -10.003 256 HB2 LYS 29 HB2 LYS 29 -7.439 -10.188 -9.302 257 HB3 LYS 29 HB3 LYS 29 -6.303 -9.124 -10.118 258 HG2 LYS 29 HG2 LYS 29 -6.352 -8.813 -7.677 259 HG3 LYS 29 HG3 LYS 29 -6.719 -7.341 -8.549 260 HD2 LYS 29 HD2 LYS 29 -9.085 -7.542 -8.014 261 HD3 LYS 29 HD3 LYS 29 -8.825 -9.162 -7.311 262 HE2 LYS 29 HE2 LYS 29 -7.300 -8.125 -5.605 263 HE3 LYS 29 HE3 LYS 29 -7.636 -6.534 -6.297 264 HZ1 LYS 29 HZ1 LYS 29 -9.611 -8.320 -4.978 265 HZ2 LYS 29 HZ2 LYS 29 -9.080 -6.864 -4.434 266 HZ3 LYS 29 HZ3 LYS 29 -10.024 -6.942 -5.759 267 HA PRO 30 HA PRO 30 -8.855 -5.274 -12.751 268 HB2 PRO 30 HB2 PRO 30 -11.265 -4.086 -12.453 269 HB3 PRO 30 HB3 PRO 30 -11.089 -5.674 -13.263 270 HG2 PRO 30 HG2 PRO 30 -11.895 -5.121 -10.392 271 HG3 PRO 30 HG3 PRO 30 -12.671 -6.230 -11.566 272 HD2 PRO 30 HD2 PRO 30 -10.811 -7.007 -9.663 273 HD3 PRO 30 HD3 PRO 30 -11.050 -7.875 -11.198 274 H LYS 31 H LYS 31 -8.534 -3.052 -12.617 275 HA LYS 31 HA LYS 31 -7.216 -1.983 -10.404 276 HB2 LYS 31 HB2 LYS 31 -7.279 0.141 -11.624 277 HB3 LYS 31 HB3 LYS 31 -6.918 -1.225 -12.673 278 HG2 LYS 31 HG2 LYS 31 -9.523 -1.182 -13.194 279 HG3 LYS 31 HG3 LYS 31 -9.437 0.457 -12.545 280 HD2 LYS 31 HD2 LYS 31 -7.753 1.052 -14.257 281 HD3 LYS 31 HD3 LYS 31 -7.735 -0.632 -14.834 282 HE2 LYS 31 HE2 LYS 31 -10.218 -0.429 -15.288 283 HE3 LYS 31 HE3 LYS 31 -10.103 1.291 -14.901 284 HZ1 LYS 31 HZ1 LYS 31 -8.633 -0.081 -17.096 285 HZ2 LYS 31 HZ2 LYS 31 -9.920 0.899 -17.291 286 HZ3 LYS 31 HZ3 LYS 31 -8.508 1.513 -16.747 287 H LEU 32 H LEU 32 -7.697 -0.919 -8.592 288 HA LEU 32 HA LEU 32 -10.532 -0.276 -7.942 289 HB2 LEU 32 HB2 LEU 32 -9.948 -2.634 -7.426 290 HB3 LEU 32 HB3 LEU 32 -8.516 -2.086 -6.560 291 HG LEU 32 HG LEU 32 -9.973 -0.926 -4.920 292 HD11 LEU 32 HD11 LEU 32 -12.197 -2.480 -6.323 293 HD12 LEU 32 HD12 LEU 32 -12.360 -1.613 -4.781 294 HD13 LEU 32 HD13 LEU 32 -12.051 -0.711 -6.269 295 HD21 LEU 32 HD21 LEU 32 -9.010 -3.123 -4.444 296 HD22 LEU 32 HD22 LEU 32 -10.631 -3.006 -3.744 297 HD23 LEU 32 HD23 LEU 32 -10.380 -3.924 -5.243 298 H GLU 33 H GLU 33 -10.862 1.301 -6.413 299 HA GLU 33 HA GLU 33 -8.610 2.413 -4.846 300 HB2 GLU 33 HB2 GLU 33 -10.474 4.119 -6.557 301 HB3 GLU 33 HB3 GLU 33 -9.381 4.713 -5.305 302 HG2 GLU 33 HG2 GLU 33 -7.468 3.683 -6.638 303 HG3 GLU 33 HG3 GLU 33 -8.622 3.401 -7.943 304 H GLU 34 H GLU 34 -9.309 2.097 -2.792 305 HA GLU 34 HA GLU 34 -11.938 3.077 -1.977 306 HB2 GLU 34 HB2 GLU 34 -12.668 0.924 -1.004 307 HB3 GLU 34 HB3 GLU 34 -12.528 0.854 -2.763 308 HG2 GLU 34 HG2 GLU 34 -10.567 -0.473 -2.696 309 HG3 GLU 34 HG3 GLU 34 -10.260 -0.131 -1.003 310 H LEU 35 H LEU 35 -9.974 4.352 -1.316 311 HA LEU 35 HA LEU 35 -9.020 3.584 1.420 312 HB2 LEU 35 HB2 LEU 35 -7.866 5.388 -0.731 313 HB3 LEU 35 HB3 LEU 35 -7.166 5.203 0.867 314 HG LEU 35 HG LEU 35 -7.638 2.665 -0.702 315 HD11 LEU 35 HD11 LEU 35 -5.319 4.511 -1.308 316 HD12 LEU 35 HD12 LEU 35 -5.614 2.879 -1.953 317 HD13 LEU 35 HD13 LEU 35 -6.712 4.205 -2.379 318 HD21 LEU 35 HD21 LEU 35 -6.695 2.577 1.570 319 HD22 LEU 35 HD22 LEU 35 -5.530 2.016 0.361 320 HD23 LEU 35 HD23 LEU 35 -5.349 3.635 1.052 321 H SER 36 H SER 36 -8.947 5.147 3.065 322 HA SER 36 HA SER 36 -10.926 7.334 3.010 323 HB2 SER 36 HB2 SER 36 -10.476 5.989 5.052 324 HB3 SER 36 HB3 SER 36 -8.822 6.631 5.092 325 HG SER 36 HG SER 36 -10.363 7.788 6.428 326 H GLU 37 H GLU 37 -10.121 9.611 3.657 327 HA GLU 37 HA GLU 37 -8.489 10.654 1.583 328 HB2 GLU 37 HB2 GLU 37 -10.187 11.921 2.859 329 HB3 GLU 37 HB3 GLU 37 -9.153 11.880 4.292 330 HG2 GLU 37 HG2 GLU 37 -7.426 13.197 3.104 331 HG3 GLU 37 HG3 GLU 37 -8.395 13.164 1.630 332 H GLN 38 H GLN 38 -7.571 9.906 4.962 333 HA GLN 38 HA GLN 38 -4.788 10.731 4.613 334 HB2 GLN 38 HB2 GLN 38 -6.060 10.711 6.809 335 HB3 GLN 38 HB3 GLN 38 -6.055 8.946 6.739 336 HG2 GLN 38 HG2 GLN 38 -3.463 9.134 6.614 337 HG3 GLN 38 HG3 GLN 38 -3.678 10.832 7.033 338 HE21 GLN 38 HE21 GLN 38 -4.341 7.896 9.857 339 HE22 GLN 38 HE22 GLN 38 -4.248 7.464 8.155 340 H GLN 39 H GLN 39 -6.539 7.596 4.513 341 HA GLN 39 HA GLN 39 -4.183 5.987 4.256 342 HB2 GLN 39 HB2 GLN 39 -7.072 5.471 3.523 343 HB3 GLN 39 HB3 GLN 39 -5.785 4.284 3.279 344 HG2 GLN 39 HG2 GLN 39 -5.200 4.434 5.704 345 HG3 GLN 39 HG3 GLN 39 -6.606 5.470 5.960 346 HE21 GLN 39 HE21 GLN 39 -7.441 1.817 6.630 347 HE22 GLN 39 HE22 GLN 39 -6.085 2.800 7.151 348 H LYS 40 H LYS 40 -6.210 7.583 1.794 349 HA LYS 40 HA LYS 40 -4.892 6.533 -0.529 350 HB2 LYS 40 HB2 LYS 40 -7.021 7.727 -0.640 351 HB3 LYS 40 HB3 LYS 40 -6.296 9.192 0.026 352 HG2 LYS 40 HG2 LYS 40 -4.906 9.478 -1.970 353 HG3 LYS 40 HG3 LYS 40 -5.518 7.973 -2.664 354 HD2 LYS 40 HD2 LYS 40 -7.325 10.309 -1.895 355 HD3 LYS 40 HD3 LYS 40 -6.532 10.239 -3.461 356 HE2 LYS 40 HE2 LYS 40 -8.328 7.993 -2.447 357 HE3 LYS 40 HE3 LYS 40 -8.952 9.393 -3.321 358 HZ1 LYS 40 HZ1 LYS 40 -6.916 7.525 -4.422 359 HZ2 LYS 40 HZ2 LYS 40 -8.478 7.565 -4.856 360 HZ3 LYS 40 HZ3 LYS 40 -7.519 8.825 -5.195 361 H ILE 41 H ILE 41 -4.096 9.384 1.531 362 HA ILE 41 HA ILE 41 -1.824 10.158 -0.057 363 HB ILE 41 HB ILE 41 -2.419 10.747 2.831 364 HG12 ILE 41 HG12 ILE 41 -2.812 12.647 0.466 365 HG13 ILE 41 HG13 ILE 41 -4.094 11.555 0.942 366 HG21 ILE 41 HG21 ILE 41 -0.443 12.083 0.942 367 HG22 ILE 41 HG22 ILE 41 -0.891 12.717 2.538 368 HG23 ILE 41 HG23 ILE 41 -0.061 11.176 2.423 369 HD11 ILE 41 HD11 ILE 41 -2.902 13.726 2.701 370 HD12 ILE 41 HD12 ILE 41 -4.512 13.682 1.963 371 HD13 ILE 41 HD13 ILE 41 -4.096 12.518 3.233 372 H ILE 42 H ILE 42 -2.055 8.047 2.912 373 HA ILE 42 HA ILE 42 0.798 7.679 3.098 374 HB ILE 42 HB ILE 42 -1.432 5.807 3.953 375 HG12 ILE 42 HG12 ILE 42 0.138 7.616 5.825 376 HG13 ILE 42 HG13 ILE 42 -1.283 8.239 5.002 377 HG21 ILE 42 HG21 ILE 42 1.540 5.914 4.671 378 HG22 ILE 42 HG22 ILE 42 0.356 4.929 5.536 379 HG23 ILE 42 HG23 ILE 42 0.692 4.590 3.843 380 HD11 ILE 42 HD11 ILE 42 -1.278 5.773 6.789 381 HD12 ILE 42 HD12 ILE 42 -1.904 7.377 7.199 382 HD13 ILE 42 HD13 ILE 42 -2.674 6.426 5.905 383 H LEU 43 H LEU 43 -1.739 5.853 1.416 384 HA LEU 43 HA LEU 43 -0.158 3.781 0.318 385 HB2 LEU 43 HB2 LEU 43 -2.620 3.857 0.478 386 HB3 LEU 43 HB3 LEU 43 -2.697 5.132 -0.712 387 HG LEU 43 HG LEU 43 -3.383 2.840 -1.402 388 HD11 LEU 43 HD11 LEU 43 -1.134 4.007 -3.066 389 HD12 LEU 43 HD12 LEU 43 -2.431 2.939 -3.624 390 HD13 LEU 43 HD13 LEU 43 -2.812 4.574 -3.044 391 HD21 LEU 43 HD21 LEU 43 -1.715 1.519 -0.272 392 HD22 LEU 43 HD22 LEU 43 -1.657 1.187 -2.008 393 HD23 LEU 43 HD23 LEU 43 -0.400 2.200 -1.262 394 H ALA 44 H ALA 44 -1.023 6.974 -1.059 395 HA ALA 44 HA ALA 44 0.515 6.757 -3.447 396 HB1 ALA 44 HB1 ALA 44 -0.457 9.158 -1.853 397 HB2 ALA 44 HB2 ALA 44 0.118 9.209 -3.538 398 HB3 ALA 44 HB3 ALA 44 -1.362 8.307 -3.128 399 H GLU 45 H GLU 45 1.328 8.534 -0.362 400 HA GLU 45 HA GLU 45 3.863 9.450 -1.242 401 HB2 GLU 45 HB2 GLU 45 2.739 8.884 1.522 402 HB3 GLU 45 HB3 GLU 45 4.333 9.584 1.286 403 HG2 GLU 45 HG2 GLU 45 1.809 10.854 0.147 404 HG3 GLU 45 HG3 GLU 45 2.463 11.229 1.737 405 H TYR 46 H TYR 46 3.004 6.257 -0.015 406 HA TYR 46 HA TYR 46 5.722 5.390 0.501 407 HB2 TYR 46 HB2 TYR 46 3.765 4.446 1.591 408 HB3 TYR 46 HB3 TYR 46 3.104 3.937 0.047 409 HD1 TYR 46 HD1 TYR 46 2.739 1.827 1.227 410 HD2 TYR 46 HD2 TYR 46 6.723 3.285 0.409 411 HE1 TYR 46 HE1 TYR 46 3.657 -0.471 1.515 412 HE2 TYR 46 HE2 TYR 46 7.620 0.982 0.711 413 HH TYR 46 HH TYR 46 5.459 -1.763 1.507 414 H ILE 47 H ILE 47 3.448 4.638 -2.234 415 HA ILE 47 HA ILE 47 5.279 3.384 -3.978 416 HB ILE 47 HB ILE 47 2.734 4.954 -4.290 417 HG12 ILE 47 HG12 ILE 47 3.327 1.991 -4.720 418 HG13 ILE 47 HG13 ILE 47 2.927 2.626 -3.140 419 HG21 ILE 47 HG21 ILE 47 4.256 3.550 -6.520 420 HG22 ILE 47 HG22 ILE 47 2.553 4.038 -6.635 421 HG23 ILE 47 HG23 ILE 47 3.794 5.261 -6.450 422 HD11 ILE 47 HD11 ILE 47 1.094 2.747 -5.573 423 HD12 ILE 47 HD12 ILE 47 0.898 1.750 -4.115 424 HD13 ILE 47 HD13 ILE 47 0.774 3.517 -4.020 425 H ALA 48 H ALA 48 4.520 6.873 -3.475 426 HA ALA 48 HA ALA 48 6.077 7.881 -5.655 427 HB1 ALA 48 HB1 ALA 48 5.233 9.155 -3.023 428 HB2 ALA 48 HB2 ALA 48 5.778 10.030 -4.472 429 HB3 ALA 48 HB3 ALA 48 4.262 9.101 -4.510 430 H GLU 49 H GLU 49 7.073 6.682 -2.519 431 HA GLU 49 HA GLU 49 9.749 7.947 -2.710 432 HB2 GLU 49 HB2 GLU 49 8.462 8.031 -0.609 433 HB3 GLU 49 HB3 GLU 49 8.504 6.264 -0.507 434 HG2 GLU 49 HG2 GLU 49 10.933 6.295 -0.272 435 HG3 GLU 49 HG3 GLU 49 10.988 8.026 -0.622 436 H VAL 50 H VAL 50 8.245 4.726 -3.195 437 HA VAL 50 HA VAL 50 10.999 3.630 -3.661 438 HB VAL 50 HB VAL 50 10.419 1.564 -2.717 439 HG11 VAL 50 HG11 VAL 50 9.403 3.662 -0.767 440 HG12 VAL 50 HG12 VAL 50 10.128 2.088 -0.387 441 HG13 VAL 50 HG13 VAL 50 11.118 3.355 -1.134 442 HG21 VAL 50 HG21 VAL 50 8.075 1.291 -3.344 443 HG22 VAL 50 HG22 VAL 50 8.296 1.060 -1.618 444 HG23 VAL 50 HG23 VAL 50 7.583 2.566 -2.230 445 H GLY 51 H GLY 51 7.828 3.963 -5.027 446 HA2 GLY 51 HA2 GLY 51 7.200 3.470 -7.220 447 HA3 GLY 51 HA3 GLY 51 8.567 2.379 -7.418 448 H LEU 52 H LEU 52 5.565 2.107 -7.836 449 HA LEU 52 HA LEU 52 4.384 0.461 -5.945 450 HB2 LEU 52 HB2 LEU 52 3.215 1.715 -7.725 451 HB3 LEU 52 HB3 LEU 52 3.986 0.728 -8.960 452 HG LEU 52 HG LEU 52 2.658 -1.232 -8.288 453 HD11 LEU 52 HD11 LEU 52 1.287 0.675 -6.348 454 HD12 LEU 52 HD12 LEU 52 0.813 -0.998 -6.682 455 HD13 LEU 52 HD13 LEU 52 2.350 -0.665 -5.881 456 HD21 LEU 52 HD21 LEU 52 1.822 0.287 -9.998 457 HD22 LEU 52 HD22 LEU 52 0.480 -0.353 -9.041 458 HD23 LEU 52 HD23 LEU 52 1.040 1.303 -8.754 459 H GLN 53 H GLN 53 6.774 -0.368 -8.047 460 HA GLN 53 HA GLN 53 6.297 -3.276 -8.193 461 HB2 GLN 53 HB2 GLN 53 8.767 -1.710 -9.048 462 HB3 GLN 53 HB3 GLN 53 8.397 -3.392 -9.407 463 HG2 GLN 53 HG2 GLN 53 7.791 -2.400 -11.385 464 HG3 GLN 53 HG3 GLN 53 6.234 -2.473 -10.566 465 HE21 GLN 53 HE21 GLN 53 8.051 1.186 -11.216 466 HE22 GLN 53 HE22 GLN 53 9.026 -0.275 -11.269 467 H ASN 54 H ASN 54 7.852 -1.128 -5.967 468 HA ASN 54 HA ASN 54 9.559 -3.305 -4.849 469 HB2 ASN 54 HB2 ASN 54 9.925 -0.303 -4.630 470 HB3 ASN 54 HB3 ASN 54 11.069 -1.537 -4.118 471 HD21 ASN 54 HD21 ASN 54 11.399 -0.143 -7.807 472 HD22 ASN 54 HD22 ASN 54 10.589 0.668 -6.462 473 H ILE 55 H ILE 55 6.790 -1.627 -4.094 474 HA ILE 55 HA ILE 55 7.002 -1.699 -1.190 475 HB ILE 55 HB ILE 55 4.610 -1.453 -1.124 476 HG12 ILE 55 HG12 ILE 55 4.592 -1.774 -4.144 477 HG13 ILE 55 HG13 ILE 55 3.897 -2.890 -2.961 478 HG21 ILE 55 HG21 ILE 55 5.610 0.434 -3.278 479 HG22 ILE 55 HG22 ILE 55 4.438 0.743 -1.965 480 HG23 ILE 55 HG23 ILE 55 6.126 0.496 -1.584 481 HD11 ILE 55 HD11 ILE 55 2.976 -0.065 -3.576 482 HD12 ILE 55 HD12 ILE 55 2.096 -1.596 -3.804 483 HD13 ILE 55 HD13 ILE 55 2.414 -1.016 -2.160 484 H THR 56 H THR 56 5.923 -3.176 0.201 485 HA THR 56 HA THR 56 5.318 -5.870 -0.923 486 HB THR 56 HB THR 56 6.024 -6.446 1.653 487 HG1 THR 56 HG1 THR 56 7.969 -5.334 2.080 488 HG21 THR 56 HG21 THR 56 7.966 -6.193 -0.677 489 HG22 THR 56 HG22 THR 56 8.218 -7.181 0.793 490 HG23 THR 56 HG23 THR 56 6.909 -7.585 -0.324 491 H ALA 57 H ALA 57 3.588 -7.014 -0.062 492 HA ALA 57 HA ALA 57 1.421 -5.598 1.114 493 HB1 ALA 57 HB1 ALA 57 2.025 -8.593 1.042 494 HB2 ALA 57 HB2 ALA 57 0.447 -7.839 1.351 495 HB3 ALA 57 HB3 ALA 57 1.205 -7.678 -0.243 496 H ILE 58 H ILE 58 4.176 -7.274 2.525 497 HA ILE 58 HA ILE 58 3.251 -7.533 5.235 498 HB ILE 58 HB ILE 58 6.082 -7.072 4.185 499 HG12 ILE 58 HG12 ILE 58 5.352 -8.990 3.011 500 HG13 ILE 58 HG13 ILE 58 6.378 -9.539 4.321 501 HG21 ILE 58 HG21 ILE 58 5.025 -8.193 6.814 502 HG22 ILE 58 HG22 ILE 58 6.735 -8.235 6.309 503 HG23 ILE 58 HG23 ILE 58 5.922 -6.685 6.570 504 HD11 ILE 58 HD11 ILE 58 3.335 -9.687 4.226 505 HD12 ILE 58 HD12 ILE 58 4.481 -11.023 4.050 506 HD13 ILE 58 HD13 ILE 58 4.332 -10.195 5.616 507 H THR 59 H THR 59 5.268 -5.039 3.628 508 HA THR 59 HA THR 59 5.285 -3.301 5.948 509 HB THR 59 HB THR 59 6.124 -2.960 3.064 510 HG1 THR 59 HG1 THR 59 8.116 -3.379 3.872 511 HG21 THR 59 HG21 THR 59 6.700 -1.162 5.472 512 HG22 THR 59 HG22 THR 59 7.482 -1.040 3.873 513 HG23 THR 59 HG23 THR 59 5.754 -0.711 4.036 514 H LEU 60 H LEU 60 3.442 -3.354 2.876 515 HA LEU 60 HA LEU 60 1.991 -0.952 3.344 516 HB2 LEU 60 HB2 LEU 60 2.271 -2.268 1.168 517 HB3 LEU 60 HB3 LEU 60 1.089 -3.398 1.780 518 HG LEU 60 HG LEU 60 -0.579 -1.447 1.862 519 HD11 LEU 60 HD11 LEU 60 1.606 -0.057 0.259 520 HD12 LEU 60 HD12 LEU 60 -0.018 0.549 0.605 521 HD13 LEU 60 HD13 LEU 60 1.121 0.379 1.925 522 HD21 LEU 60 HD21 LEU 60 -0.508 -3.051 -0.023 523 HD22 LEU 60 HD22 LEU 60 -0.930 -1.417 -0.565 524 HD23 LEU 60 HD23 LEU 60 0.708 -2.051 -0.833 525 H SER 61 H SER 61 1.278 -4.326 4.366 526 HA SER 61 HA SER 61 -1.160 -3.973 5.659 527 HB2 SER 61 HB2 SER 61 -0.156 -6.132 5.381 528 HB3 SER 61 HB3 SER 61 1.193 -5.692 6.441 529 HG SER 61 HG SER 61 -0.274 -6.868 7.623 530 H LYS 62 H LYS 62 1.998 -2.912 6.593 531 HA LYS 62 HA LYS 62 1.083 -2.174 9.301 532 HB2 LYS 62 HB2 LYS 62 3.879 -2.382 8.138 533 HB3 LYS 62 HB3 LYS 62 3.523 -1.801 9.774 534 HG2 LYS 62 HG2 LYS 62 2.378 -3.932 10.307 535 HG3 LYS 62 HG3 LYS 62 2.750 -4.551 8.689 536 HD2 LYS 62 HD2 LYS 62 5.182 -4.239 9.159 537 HD3 LYS 62 HD3 LYS 62 4.784 -3.746 10.811 538 HE2 LYS 62 HE2 LYS 62 4.083 -6.441 9.545 539 HE3 LYS 62 HE3 LYS 62 5.497 -6.152 10.562 540 HZ1 LYS 62 HZ1 LYS 62 2.678 -5.870 11.459 541 HZ2 LYS 62 HZ2 LYS 62 3.694 -7.076 11.868 542 HZ3 LYS 62 HZ3 LYS 62 3.989 -5.560 12.388 543 H LYS 63 H LYS 63 2.230 -0.590 6.346 544 HA LYS 63 HA LYS 63 2.653 2.049 7.304 545 HB2 LYS 63 HB2 LYS 63 1.735 0.857 4.670 546 HB3 LYS 63 HB3 LYS 63 2.011 2.587 4.833 547 HG2 LYS 63 HG2 LYS 63 4.214 0.655 5.611 548 HG3 LYS 63 HG3 LYS 63 3.866 0.955 3.909 549 HD2 LYS 63 HD2 LYS 63 4.204 3.404 4.311 550 HD3 LYS 63 HD3 LYS 63 4.681 3.013 5.987 551 HE2 LYS 63 HE2 LYS 63 6.493 1.551 5.102 552 HE3 LYS 63 HE3 LYS 63 6.014 1.959 3.449 553 HZ1 LYS 63 HZ1 LYS 63 7.022 3.903 5.461 554 HZ2 LYS 63 HZ2 LYS 63 7.873 3.333 4.193 555 HZ3 LYS 63 HZ3 LYS 63 6.573 4.287 3.937 556 H LEU 64 H LEU 64 -0.362 0.460 6.275 557 HA LEU 64 HA LEU 64 -1.899 2.865 7.160 558 HB2 LEU 64 HB2 LEU 64 -2.885 0.822 5.156 559 HB3 LEU 64 HB3 LEU 64 -3.585 2.357 5.604 560 HG LEU 64 HG LEU 64 -1.156 3.223 4.741 561 HD11 LEU 64 HD11 LEU 64 -1.803 0.829 2.956 562 HD12 LEU 64 HD12 LEU 64 -0.507 2.027 2.719 563 HD13 LEU 64 HD13 LEU 64 -0.448 0.888 4.076 564 HD21 LEU 64 HD21 LEU 64 -3.346 3.989 3.976 565 HD22 LEU 64 HD22 LEU 64 -2.214 3.762 2.645 566 HD23 LEU 64 HD23 LEU 64 -3.501 2.560 2.925 567 H ASN 65 H ASN 65 -1.007 0.381 8.744 568 HA ASN 65 HA ASN 65 -1.782 -1.174 10.176 569 HB2 ASN 65 HB2 ASN 65 -3.185 -0.282 11.971 570 HB3 ASN 65 HB3 ASN 65 -1.848 0.756 11.528 571 HD21 ASN 65 HD21 ASN 65 -3.905 3.501 10.642 572 HD22 ASN 65 HD22 ASN 65 -2.284 2.826 10.561 573 H ILE 66 H ILE 66 -2.506 -2.272 8.121 574 HA ILE 66 HA ILE 66 -5.390 -3.057 8.245 575 HB ILE 66 HB ILE 66 -4.888 -3.455 5.656 576 HG12 ILE 66 HG12 ILE 66 -3.142 -1.024 6.127 577 HG13 ILE 66 HG13 ILE 66 -2.452 -2.582 5.932 578 HG21 ILE 66 HG21 ILE 66 -5.571 -0.808 6.971 579 HG22 ILE 66 HG22 ILE 66 -5.878 -1.199 5.273 580 HG23 ILE 66 HG23 ILE 66 -6.681 -2.131 6.541 581 HD11 ILE 66 HD11 ILE 66 -4.113 -1.099 3.858 582 HD12 ILE 66 HD12 ILE 66 -2.396 -1.510 3.786 583 HD13 ILE 66 HD13 ILE 66 -3.611 -2.797 3.687 584 H THR 67 H THR 67 -5.248 -5.163 6.423 585 HA THR 67 HA THR 67 -3.543 -7.170 7.827 586 HB THR 67 HB THR 67 -4.964 -8.858 7.175 587 HG1 THR 67 HG1 THR 67 -6.611 -8.582 5.675 588 HG21 THR 67 HG21 THR 67 -6.952 -6.582 7.580 589 HG22 THR 67 HG22 THR 67 -7.180 -8.306 7.937 590 HG23 THR 67 HG23 THR 67 -6.034 -7.355 8.899 591 H VAL 68 H VAL 68 -2.480 -8.808 6.500 592 HA VAL 68 HA VAL 68 -1.015 -7.725 4.254 593 HB VAL 68 HB VAL 68 -1.347 -10.611 5.163 594 HG11 VAL 68 HG11 VAL 68 0.723 -9.372 3.292 595 HG12 VAL 68 HG12 VAL 68 0.779 -11.024 3.939 596 HG13 VAL 68 HG13 VAL 68 -0.515 -10.567 2.833 597 HG21 VAL 68 HG21 VAL 68 -0.293 -9.197 6.899 598 HG22 VAL 68 HG22 VAL 68 0.897 -10.280 6.179 599 HG23 VAL 68 HG23 VAL 68 0.864 -8.571 5.699 600 H GLU 69 H GLU 69 -4.147 -9.373 4.469 601 HA GLU 69 HA GLU 69 -4.145 -10.174 1.642 602 HB2 GLU 69 HB2 GLU 69 -6.378 -10.149 3.731 603 HB3 GLU 69 HB3 GLU 69 -6.470 -10.805 2.106 604 HG2 GLU 69 HG2 GLU 69 -6.126 -12.693 3.378 605 HG3 GLU 69 HG3 GLU 69 -4.540 -12.359 2.696 606 H LYS 70 H LYS 70 -5.521 -7.600 3.710 607 HA LYS 70 HA LYS 70 -7.060 -6.356 1.694 608 HB2 LYS 70 HB2 LYS 70 -7.230 -6.216 4.214 609 HB3 LYS 70 HB3 LYS 70 -5.867 -5.106 4.219 610 HG2 LYS 70 HG2 LYS 70 -8.474 -4.651 2.721 611 HG3 LYS 70 HG3 LYS 70 -8.214 -4.220 4.413 612 HD2 LYS 70 HD2 LYS 70 -6.267 -2.745 3.585 613 HD3 LYS 70 HD3 LYS 70 -6.976 -2.937 1.963 614 HE2 LYS 70 HE2 LYS 70 -9.143 -2.110 2.772 615 HE3 LYS 70 HE3 LYS 70 -8.542 -2.048 4.435 616 HZ1 LYS 70 HZ1 LYS 70 -7.554 -0.366 2.198 617 HZ2 LYS 70 HZ2 LYS 70 -8.564 0.139 3.375 618 HZ3 LYS 70 HZ3 LYS 70 -7.027 -0.266 3.749 619 H ALA 71 H ALA 71 -3.883 -5.700 2.995 620 HA ALA 71 HA ALA 71 -2.929 -3.669 1.269 621 HB1 ALA 71 HB1 ALA 71 -1.474 -5.957 2.667 622 HB2 ALA 71 HB2 ALA 71 -0.701 -4.541 1.959 623 HB3 ALA 71 HB3 ALA 71 -1.805 -4.344 3.330 624 H LYS 72 H LYS 72 -2.642 -7.280 0.818 625 HA LYS 72 HA LYS 72 -1.157 -7.031 -1.633 626 HB2 LYS 72 HB2 LYS 72 -1.002 -8.945 -0.080 627 HB3 LYS 72 HB3 LYS 72 -2.699 -9.342 -0.352 628 HG2 LYS 72 HG2 LYS 72 -2.264 -9.987 -2.620 629 HG3 LYS 72 HG3 LYS 72 -0.596 -9.391 -2.551 630 HD2 LYS 72 HD2 LYS 72 -1.653 -11.556 -0.676 631 HD3 LYS 72 HD3 LYS 72 -1.013 -11.961 -2.266 632 HE2 LYS 72 HE2 LYS 72 0.579 -10.423 -0.165 633 HE3 LYS 72 HE3 LYS 72 0.566 -12.182 -0.273 634 HZ1 LYS 72 HZ1 LYS 72 1.470 -10.394 -2.469 635 HZ2 LYS 72 HZ2 LYS 72 2.443 -11.264 -1.488 636 HZ3 LYS 72 HZ3 LYS 72 1.450 -12.031 -2.519 637 H ASN 73 H ASN 73 -4.574 -7.116 -0.875 638 HA ASN 73 HA ASN 73 -5.553 -7.651 -3.430 639 HB2 ASN 73 HB2 ASN 73 -7.376 -7.632 -2.133 640 HB3 ASN 73 HB3 ASN 73 -6.596 -6.679 -0.893 641 HD21 ASN 73 HD21 ASN 73 -8.099 -3.641 -1.803 642 HD22 ASN 73 HD22 ASN 73 -6.813 -4.405 -0.865 643 H TYR 74 H TYR 74 -4.121 -4.622 -2.257 644 HA TYR 74 HA TYR 74 -4.792 -3.020 -4.568 645 HB2 TYR 74 HB2 TYR 74 -2.545 -2.709 -2.549 646 HB3 TYR 74 HB3 TYR 74 -3.010 -1.535 -3.767 647 HD1 TYR 74 HD1 TYR 74 -5.648 -0.937 -3.760 648 HD2 TYR 74 HD2 TYR 74 -3.311 -2.304 -0.404 649 HE1 TYR 74 HE1 TYR 74 -7.325 0.045 -2.209 650 HE2 TYR 74 HE2 TYR 74 -5.007 -1.312 1.161 651 HH TYR 74 HH TYR 74 -7.991 0.267 -0.073 652 H ILE 75 H ILE 75 -1.904 -4.840 -3.482 653 HA ILE 75 HA ILE 75 -0.314 -4.238 -5.755 654 HB ILE 75 HB ILE 75 -0.136 -6.519 -3.751 655 HG12 ILE 75 HG12 ILE 75 1.249 -3.791 -3.826 656 HG13 ILE 75 HG13 ILE 75 -0.120 -4.174 -2.788 657 HG21 ILE 75 HG21 ILE 75 2.003 -5.436 -5.644 658 HG22 ILE 75 HG22 ILE 75 2.269 -6.645 -4.368 659 HG23 ILE 75 HG23 ILE 75 1.245 -7.045 -5.728 660 HD11 ILE 75 HD11 ILE 75 2.649 -5.381 -2.569 661 HD12 ILE 75 HD12 ILE 75 1.830 -4.283 -1.450 662 HD13 ILE 75 HD13 ILE 75 1.213 -5.931 -1.665 663 H LYS 76 H LYS 76 -2.778 -6.722 -5.353 664 HA LYS 76 HA LYS 76 -2.059 -8.210 -7.756 665 HB2 LYS 76 HB2 LYS 76 -4.452 -8.252 -5.880 666 HB3 LYS 76 HB3 LYS 76 -4.287 -9.333 -7.264 667 HG2 LYS 76 HG2 LYS 76 -2.151 -9.222 -5.115 668 HG3 LYS 76 HG3 LYS 76 -3.588 -10.239 -4.978 669 HD2 LYS 76 HD2 LYS 76 -2.997 -11.357 -7.127 670 HD3 LYS 76 HD3 LYS 76 -1.529 -10.363 -7.230 671 HE2 LYS 76 HE2 LYS 76 -0.705 -11.312 -5.112 672 HE3 LYS 76 HE3 LYS 76 -2.186 -12.265 -4.933 673 HZ1 LYS 76 HZ1 LYS 76 -0.230 -12.584 -7.153 674 HZ2 LYS 76 HZ2 LYS 76 -0.353 -13.575 -5.868 675 HZ3 LYS 76 HZ3 LYS 76 -1.577 -13.489 -6.944 676 H ASN 77 H ASN 77 -4.117 -5.375 -7.239 677 HA ASN 77 HA ASN 77 -5.069 -5.694 -10.059 678 HB2 ASN 77 HB2 ASN 77 -6.598 -4.017 -9.751 679 HB3 ASN 77 HB3 ASN 77 -6.878 -5.165 -8.443 680 HD21 ASN 77 HD21 ASN 77 -6.245 -2.690 -5.966 681 HD22 ASN 77 HD22 ASN 77 -6.197 -4.428 -6.208 682 H SER 78 H SER 78 -3.450 -3.418 -7.823 683 HA SER 78 HA SER 78 -2.588 -1.791 -10.115 684 HB2 SER 78 HB2 SER 78 -2.469 -1.302 -7.114 685 HB3 SER 78 HB3 SER 78 -1.767 -0.215 -8.321 686 HG SER 78 HG SER 78 -4.502 -1.018 -8.345 687 H ASN 79 H ASN 79 -0.999 -2.794 -11.109 688 HA ASN 79 HA ASN 79 1.489 -3.395 -9.576 689 HB2 ASN 79 HB2 ASN 79 -0.197 -5.381 -9.891 690 HB3 ASN 79 HB3 ASN 79 0.342 -5.403 -11.565 691 HD21 ASN 79 HD21 ASN 79 2.756 -6.607 -8.506 692 HD22 ASN 79 HD22 ASN 79 1.143 -5.901 -8.268 693 H ARG 80 H ARG 80 0.278 -3.735 -12.937 694 HA ARG 80 HA ARG 80 2.791 -2.549 -14.008 695 HB2 ARG 80 HB2 ARG 80 0.423 -3.775 -15.478 696 HB3 ARG 80 HB3 ARG 80 1.995 -3.374 -16.156 697 HG2 ARG 80 HG2 ARG 80 1.371 -5.615 -14.186 698 HG3 ARG 80 HG3 ARG 80 1.824 -5.741 -15.882 699 HD2 ARG 80 HD2 ARG 80 4.012 -4.473 -15.102 700 HD3 ARG 80 HD3 ARG 80 3.565 -5.061 -13.500 701 HE ARG 80 HE ARG 80 4.385 -6.630 -15.889 702 HH11 ARG 80 HH11 ARG 80 4.928 -8.745 -15.718 703 HH12 ARG 80 HH12 ARG 80 4.701 -9.590 -14.216 704 HH21 ARG 80 HH21 ARG 80 3.407 -6.929 -12.489 705 HH22 ARG 80 HH22 ARG 80 3.861 -8.606 -12.473 706 H LEU 81 H LEU 81 -0.384 -1.526 -13.284 707 HA LEU 81 HA LEU 81 -0.638 0.425 -15.408 708 HB2 LEU 81 HB2 LEU 81 -2.447 -0.944 -14.349 709 HB3 LEU 81 HB3 LEU 81 -2.346 0.059 -12.909 710 HG LEU 81 HG LEU 81 -2.841 1.323 -15.633 711 HD11 LEU 81 HD11 LEU 81 -4.959 0.055 -13.848 712 HD12 LEU 81 HD12 LEU 81 -5.264 1.042 -15.298 713 HD13 LEU 81 HD13 LEU 81 -4.458 -0.523 -15.455 714 HD21 LEU 81 HD21 LEU 81 -2.549 2.889 -13.723 715 HD22 LEU 81 HD22 LEU 81 -4.204 2.925 -14.316 716 HD23 LEU 81 HD23 LEU 81 -3.817 2.038 -12.826 717 H GLY 82 H GLY 82 0.361 0.604 -11.996 718 HA2 GLY 82 HA2 GLY 82 1.420 2.408 -10.875 719 HA3 GLY 82 HA3 GLY 82 1.200 3.422 -12.292 720 H ARG 83 H ARG 83 0.642 4.845 -10.312 721 HA ARG 83 HA ARG 83 -2.326 5.068 -10.175 722 HB2 ARG 83 HB2 ARG 83 -0.436 5.277 -7.783 723 HB3 ARG 83 HB3 ARG 83 -2.125 5.771 -7.755 724 HG2 ARG 83 HG2 ARG 83 -1.202 2.921 -8.336 725 HG3 ARG 83 HG3 ARG 83 -1.629 3.503 -6.743 726 HD2 ARG 83 HD2 ARG 83 -3.653 3.911 -8.938 727 HD3 ARG 83 HD3 ARG 83 -3.388 2.274 -8.359 728 HE ARG 83 HE ARG 83 -4.266 4.605 -6.681 729 HH11 ARG 83 HH11 ARG 83 -5.408 4.164 -4.834 730 HH12 ARG 83 HH12 ARG 83 -5.773 2.514 -4.416 731 HH21 ARG 83 HH21 ARG 83 -4.300 1.108 -7.149 732 HH22 ARG 83 HH22 ARG 83 -5.365 0.895 -5.800 733 H THR 84 H THR 84 -2.962 6.997 -10.766 734 HA THR 84 HA THR 84 -2.884 9.089 -11.637 735 HB THR 84 HB THR 84 -3.558 9.287 -9.345 736 HG1 THR 84 HG1 THR 84 -3.379 11.500 -9.251 737 HG21 THR 84 HG21 THR 84 -0.709 10.128 -8.708 738 HG22 THR 84 HG22 THR 84 -2.120 10.398 -7.661 739 HG23 THR 84 HG23 THR 84 -1.615 8.750 -8.041 740 H ASN 85 H ASN 85 -0.760 7.841 -12.726 741 HA ASN 85 HA ASN 85 1.156 10.057 -13.231 742 HB2 ASN 85 HB2 ASN 85 1.814 7.270 -12.219 743 HB3 ASN 85 HB3 ASN 85 2.921 8.078 -13.317 744 HD21 ASN 85 HD21 ASN 85 2.745 9.378 -9.472 745 HD22 ASN 85 HD22 ASN 85 1.546 8.222 -10.047 746 H ASN 86 H ASN 86 2.141 10.024 -15.259 747 HA ASN 86 HA ASN 86 1.458 7.884 -17.196 748 HB2 ASN 86 HB2 ASN 86 -0.272 9.619 -17.503 749 HB3 ASN 86 HB3 ASN 86 0.971 10.851 -17.719 750 HD21 ASN 86 HD21 ASN 86 1.821 9.745 -21.055 751 HD22 ASN 86 HD22 ASN 86 2.441 10.591 -19.640 752 H LEU 87 H LEU 87 3.517 7.138 -17.334 753 HA LEU 87 HA LEU 87 5.502 8.866 -18.674 754 HB2 LEU 87 HB2 LEU 87 5.703 8.704 -16.021 755 HB3 LEU 87 HB3 LEU 87 6.330 7.098 -16.347 756 HG LEU 87 HG LEU 87 8.135 8.224 -17.794 757 HD11 LEU 87 HD11 LEU 87 7.014 10.734 -16.469 758 HD12 LEU 87 HD12 LEU 87 8.543 10.630 -17.369 759 HD13 LEU 87 HD13 LEU 87 7.009 10.391 -18.210 760 HD21 LEU 87 HD21 LEU 87 8.559 7.476 -15.485 761 HD22 LEU 87 HD22 LEU 87 9.439 8.969 -15.845 762 HD23 LEU 87 HD23 LEU 87 7.958 9.029 -14.861 763 H LYS 88 H LYS 88 3.751 6.523 -19.370 764 HA LYS 88 HA LYS 88 5.762 4.472 -20.219 765 HB2 LYS 88 HB2 LYS 88 3.975 2.881 -20.188 766 HB3 LYS 88 HB3 LYS 88 3.934 3.771 -18.667 767 HG2 LYS 88 HG2 LYS 88 2.094 5.246 -19.712 768 HG3 LYS 88 HG3 LYS 88 2.109 4.146 -21.092 769 HD2 LYS 88 HD2 LYS 88 0.302 3.496 -19.714 770 HD3 LYS 88 HD3 LYS 88 1.551 2.253 -19.519 771 HE2 LYS 88 HE2 LYS 88 2.258 3.287 -17.379 772 HE3 LYS 88 HE3 LYS 88 1.100 4.605 -17.614 773 HZ1 LYS 88 HZ1 LYS 88 0.381 1.748 -17.287 774 HZ2 LYS 88 HZ2 LYS 88 0.203 2.905 -16.138 775 HZ3 LYS 88 HZ3 LYS 88 -0.693 2.967 -17.505 776 H THR 89 H THR 89 3.948 7.021 -21.438 777 HA THR 89 HA THR 89 4.378 6.281 -24.197 778 HB THR 89 HB THR 89 2.227 5.178 -23.753 779 HG1 THR 89 HG1 THR 89 1.205 6.121 -25.511 780 HG21 THR 89 HG21 THR 89 0.999 7.935 -23.366 781 HG22 THR 89 HG22 THR 89 0.204 6.349 -23.259 782 HG23 THR 89 HG23 THR 89 1.367 6.846 -22.012 783 H ILE 90 H ILE 90 5.239 8.013 -24.985 784 HA ILE 90 HA ILE 90 4.137 10.707 -24.439 785 HB ILE 90 HB ILE 90 6.587 11.446 -24.420 786 HG12 ILE 90 HG12 ILE 90 7.505 9.182 -25.164 787 HG13 ILE 90 HG13 ILE 90 8.370 10.150 -23.991 788 HG21 ILE 90 HG21 ILE 90 5.573 9.900 -22.007 789 HG22 ILE 90 HG22 ILE 90 6.808 11.174 -22.009 790 HG23 ILE 90 HG23 ILE 90 5.139 11.556 -22.460 791 HD11 ILE 90 HD11 ILE 90 6.704 7.699 -23.275 792 HD12 ILE 90 HD12 ILE 90 8.460 7.776 -23.432 793 HD13 ILE 90 HD13 ILE 90 7.659 8.695 -22.154 794 H GLY 91 H GLY 91 4.291 8.667 -26.814 795 HA2 GLY 91 HA2 GLY 91 4.425 8.809 -29.144 796 HA3 GLY 91 HA3 GLY 91 4.907 10.509 -29.008 797 H ILE 92 H ILE 92 7.036 9.326 -27.050 798 HA ILE 92 HA ILE 92 9.257 9.408 -27.062 799 HB ILE 92 HB ILE 92 9.224 7.648 -29.536 800 HG12 ILE 92 HG12 ILE 92 9.923 5.980 -27.528 801 HG13 ILE 92 HG13 ILE 92 8.920 7.067 -26.573 802 HG21 ILE 92 HG21 ILE 92 11.386 8.252 -27.463 803 HG22 ILE 92 HG22 ILE 92 11.508 7.073 -28.787 804 HG23 ILE 92 HG23 ILE 92 11.376 8.791 -29.161 805 HD11 ILE 92 HD11 ILE 92 8.031 5.568 -29.083 806 HD12 ILE 92 HD12 ILE 92 7.717 5.062 -27.414 807 HD13 ILE 92 HD13 ILE 92 6.981 6.545 -28.031 808 H LEU 93 H LEU 93 9.528 11.499 -27.223 809 HA LEU 93 HA LEU 93 9.000 13.087 -29.496 810 HB2 LEU 93 HB2 LEU 93 8.815 13.690 -27.060 811 HB3 LEU 93 HB3 LEU 93 10.571 13.775 -26.984 812 HG LEU 93 HG LEU 93 10.483 15.646 -28.711 813 HD11 LEU 93 HD11 LEU 93 7.485 15.467 -28.183 814 HD12 LEU 93 HD12 LEU 93 8.313 16.796 -29.025 815 HD13 LEU 93 HD13 LEU 93 8.294 15.183 -29.741 816 HD21 LEU 93 HD21 LEU 93 10.659 16.096 -26.295 817 HD22 LEU 93 HD22 LEU 93 9.693 17.334 -27.113 818 HD23 LEU 93 HD23 LEU 93 8.887 16.072 -26.152 819 H GLN 94 H GLN 94 10.377 11.729 -30.956 820 HA GLN 94 HA GLN 94 12.990 13.084 -31.499 821 HB2 GLN 94 HB2 GLN 94 12.566 10.066 -31.423 822 HB3 GLN 94 HB3 GLN 94 14.005 10.887 -32.043 823 HG2 GLN 94 HG2 GLN 94 14.291 11.956 -29.761 824 HG3 GLN 94 HG3 GLN 94 13.037 10.859 -29.166 825 HE21 GLN 94 HE21 GLN 94 15.193 7.951 -29.395 826 HE22 GLN 94 HE22 GLN 94 13.504 8.434 -29.436 827 H GLU 95 H GLU 95 10.816 13.906 -32.806 828 HA GLU 95 HA GLU 95 10.951 12.658 -35.537 829 HB2 GLU 95 HB2 GLU 95 8.563 13.925 -34.150 830 HB3 GLU 95 HB3 GLU 95 8.625 13.405 -35.842 831 HG2 GLU 95 HG2 GLU 95 9.158 11.075 -35.061 832 HG3 GLU 95 HG3 GLU 95 8.893 11.609 -33.398 833 H GLU 96 H GLU 96 12.840 14.130 -35.759 834 HA GLU 96 HA GLU 96 11.973 16.651 -37.049 835 HB2 GLU 96 HB2 GLU 96 12.741 16.886 -34.491 836 HB3 GLU 96 HB3 GLU 96 14.350 16.814 -35.184 837 HG2 GLU 96 HG2 GLU 96 12.130 18.786 -35.900 838 HG3 GLU 96 HG3 GLU 96 13.483 19.116 -34.829 839 H VAL 97 H VAL 97 12.709 16.585 -39.034 840 HA VAL 97 HA VAL 97 15.482 15.773 -39.585 841 HB VAL 97 HB VAL 97 13.117 14.624 -41.134 842 HG11 VAL 97 HG11 VAL 97 16.112 14.193 -41.528 843 HG12 VAL 97 HG12 VAL 97 14.821 13.319 -42.374 844 HG13 VAL 97 HG13 VAL 97 15.018 15.047 -42.644 845 HG21 VAL 97 HG21 VAL 97 13.394 13.389 -39.041 846 HG22 VAL 97 HG22 VAL 97 13.954 12.406 -40.393 847 HG23 VAL 97 HG23 VAL 97 15.139 13.215 -39.344 848 H SER 98 H SER 98 16.447 17.170 -40.975 849 HA SER 98 HA SER 98 14.780 19.243 -42.304 850 HB2 SER 98 HB2 SER 98 17.786 19.079 -41.928 851 HB3 SER 98 HB3 SER 98 16.892 20.432 -42.649 852 HG SER 98 HG SER 98 17.323 20.779 -40.423 853 H SER 99 H SER 99 17.405 16.993 -43.250 854 HA SER 99 HA SER 99 16.288 16.619 -45.928 855 HB2 SER 99 HB2 SER 99 17.459 18.783 -46.216 856 HB3 SER 99 HB3 SER 99 18.962 18.058 -45.628 857 HG SER 99 HG SER 99 18.819 18.105 -47.933 858 H MET 100 H MET 100 19.352 16.317 -44.063 859 HA MET 100 HA MET 100 19.648 13.509 -45.023 860 HB2 MET 100 HB2 MET 100 21.223 15.498 -45.767 861 HB3 MET 100 HB3 MET 100 21.951 15.267 -44.179 862 HG2 MET 100 HG2 MET 100 23.207 14.035 -45.799 863 HG3 MET 100 HG3 MET 100 22.364 12.852 -44.806 864 HE1 MET 100 HE1 MET 100 23.028 11.029 -46.670 865 HE2 MET 100 HE2 MET 100 22.639 11.208 -48.395 866 HE3 MET 100 HE3 MET 100 23.807 12.306 -47.633 867 H GLU 101 H GLU 101 18.394 14.634 -42.428 868 HA GLU 101 HA GLU 101 20.230 13.718 -40.352 869 HB2 GLU 101 HB2 GLU 101 18.471 15.754 -40.407 870 HB3 GLU 101 HB3 GLU 101 17.474 14.572 -39.589 871 HG2 GLU 101 HG2 GLU 101 20.236 15.573 -38.780 872 HG3 GLU 101 HG3 GLU 101 18.710 15.982 -38.017 873 H ALA 102 H ALA 102 19.892 11.580 -41.806 874 HA ALA 102 HA ALA 102 18.265 9.696 -40.189 875 HB1 ALA 102 HB1 ALA 102 18.091 9.947 -43.226 876 HB2 ALA 102 HB2 ALA 102 17.301 8.699 -42.236 877 HB3 ALA 102 HB3 ALA 102 16.819 10.398 -42.068 878 H LYS 103 H LYS 103 18.881 7.489 -40.403 879 HA LYS 103 HA LYS 103 21.760 7.102 -40.896 880 HB2 LYS 103 HB2 LYS 103 19.570 5.348 -39.731 881 HB3 LYS 103 HB3 LYS 103 21.198 4.749 -39.994 882 HG2 LYS 103 HG2 LYS 103 20.928 7.301 -38.405 883 HG3 LYS 103 HG3 LYS 103 20.359 5.810 -37.667 884 HD2 LYS 103 HD2 LYS 103 22.637 6.246 -36.988 885 HD3 LYS 103 HD3 LYS 103 22.544 4.754 -37.927 886 HE2 LYS 103 HE2 LYS 103 23.405 5.939 -39.923 887 HE3 LYS 103 HE3 LYS 103 23.447 7.460 -39.014 888 HZ1 LYS 103 HZ1 LYS 103 25.044 5.036 -38.364 889 HZ2 LYS 103 HZ2 LYS 103 25.629 6.387 -39.066 890 HZ3 LYS 103 HZ3 LYS 103 25.089 6.440 -37.528 891 H SER 104 H SER 104 22.679 6.145 -42.538 892 HA SER 104 HA SER 104 21.410 3.998 -44.047 893 HB2 SER 104 HB2 SER 104 21.919 4.953 -46.261 894 HB3 SER 104 HB3 SER 104 20.691 5.892 -45.401 895 HG SER 104 HG SER 104 22.270 7.236 -46.381 896 H MET 105 H MET 105 22.980 2.709 -45.195 897 HA MET 105 HA MET 105 25.837 3.325 -44.915 898 HB2 MET 105 HB2 MET 105 24.926 2.335 -42.649 899 HB3 MET 105 HB3 MET 105 24.883 0.795 -43.511 900 HG2 MET 105 HG2 MET 105 27.308 1.047 -44.022 901 HG3 MET 105 HG3 MET 105 27.307 2.611 -43.195 902 HE1 MET 105 HE1 MET 105 29.154 2.212 -41.487 903 HE2 MET 105 HE2 MET 105 29.378 0.693 -40.594 904 HE3 MET 105 HE3 MET 105 29.507 0.706 -42.368 905 H THR 106 H THR 106 23.747 0.488 -45.221 906 HA THR 106 HA THR 106 24.410 -0.232 -47.937 907 HB THR 106 HB THR 106 26.519 -0.847 -46.721 908 HG1 THR 106 HG1 THR 106 26.647 -2.835 -47.660 909 HG21 THR 106 HG21 THR 106 24.829 -2.953 -45.308 910 HG22 THR 106 HG22 THR 106 26.595 -2.781 -45.257 911 HG23 THR 106 HG23 THR 106 25.571 -1.536 -44.531 912 H TRP 107 H TRP 107 23.746 -2.774 -47.965 913 HA TRP 107 HA TRP 107 20.871 -2.668 -47.186 914 HB2 TRP 107 HB2 TRP 107 21.614 -2.699 -49.638 915 HB3 TRP 107 HB3 TRP 107 21.993 -4.397 -49.392 916 HD1 TRP 107 HD1 TRP 107 19.817 -5.950 -48.611 917 HE1 TRP 107 HE1 TRP 107 17.341 -5.790 -49.283 918 HE3 TRP 107 HE3 TRP 107 19.757 -1.122 -50.326 919 HZ2 TRP 107 HZ2 TRP 107 15.562 -3.812 -50.407 920 HZ3 TRP 107 HZ3 TRP 107 17.653 -0.124 -51.192 921 HH2 TRP 107 HH2 TRP 107 15.553 -1.454 -51.236 Start of MODEL 12 1 H1 GLY -5 H1 GLY -5 -14.851 -50.894 40.557 2 H2 GLY -5 H2 GLY -5 -13.442 -51.451 39.935 3 H3 GLY -5 H3 GLY -5 -14.870 -51.983 39.332 4 HA2 GLY -5 HA2 GLY -5 -13.866 -49.213 39.140 5 HA3 GLY -5 HA3 GLY -5 -13.857 -50.400 37.824 6 H SER -4 H SER -4 -15.565 -47.843 39.144 7 HA SER -4 HA SER -4 -17.988 -48.481 37.542 8 HB2 SER -4 HB2 SER -4 -18.192 -49.036 40.078 9 HB3 SER -4 HB3 SER -4 -18.265 -47.282 40.305 10 HG SER -4 HG SER -4 -20.348 -48.252 40.049 11 H HIS -3 H HIS -3 -15.671 -46.728 37.090 12 HA HIS -3 HA HIS -3 -16.976 -44.047 36.891 13 HB2 HIS -3 HB2 HIS -3 -14.175 -44.606 37.953 14 HB3 HIS -3 HB3 HIS -3 -14.881 -43.016 37.680 15 HD2 HIS -3 HD2 HIS -3 -16.671 -42.108 39.462 16 HE1 HIS -3 HE1 HIS -3 -16.205 -45.226 42.337 17 HE2 HIS -3 HE2 HIS -3 -17.202 -42.922 41.914 18 H MET -2 H MET -2 -16.403 -42.816 35.157 19 HA MET -2 HA MET -2 -14.076 -43.435 33.496 20 HB2 MET -2 HB2 MET -2 -15.878 -44.913 32.563 21 HB3 MET -2 HB3 MET -2 -16.868 -43.476 32.269 22 HG2 MET -2 HG2 MET -2 -15.192 -42.615 30.695 23 HG3 MET -2 HG3 MET -2 -14.081 -43.917 31.125 24 HE1 MET -2 HE1 MET -2 -17.327 -42.886 29.200 25 HE2 MET -2 HE2 MET -2 -17.920 -44.435 28.565 26 HE3 MET -2 HE3 MET -2 -18.023 -44.095 30.304 27 H ALA -1 H ALA -1 -13.216 -41.704 32.592 28 HA ALA -1 HA ALA -1 -14.726 -39.214 32.320 29 HB1 ALA -1 HB1 ALA -1 -12.241 -39.456 34.080 30 HB2 ALA -1 HB2 ALA -1 -13.074 -37.937 33.677 31 HB3 ALA -1 HB3 ALA -1 -13.898 -39.162 34.655 32 H SER 0 H SER 0 -13.280 -37.461 31.350 33 HA SER 0 HA SER 0 -11.078 -38.481 29.640 34 HB2 SER 0 HB2 SER 0 -13.182 -38.554 28.303 35 HB3 SER 0 HB3 SER 0 -13.382 -36.810 28.573 36 HG SER 0 HG SER 0 -12.305 -37.373 26.577 37 H MET 1 H MET 1 -9.513 -36.992 29.167 38 HA MET 1 HA MET 1 -9.666 -34.284 30.428 39 HB2 MET 1 HB2 MET 1 -7.391 -36.292 30.751 40 HB3 MET 1 HB3 MET 1 -7.367 -34.600 31.245 41 HG2 MET 1 HG2 MET 1 -7.807 -35.696 33.215 42 HG3 MET 1 HG3 MET 1 -9.403 -35.144 32.719 43 HE1 MET 1 HE1 MET 1 -10.455 -36.756 34.563 44 HE2 MET 1 HE2 MET 1 -10.063 -38.485 34.701 45 HE3 MET 1 HE3 MET 1 -8.812 -37.266 35.021 46 H ASP 2 H ASP 2 -9.556 -32.970 28.764 47 HA ASP 2 HA ASP 2 -9.026 -32.006 26.765 48 HB2 ASP 2 HB2 ASP 2 -6.268 -32.497 27.922 49 HB3 ASP 2 HB3 ASP 2 -6.654 -31.333 26.651 50 HA PRO 3 HA PRO 3 -7.997 -35.870 24.369 51 HB2 PRO 3 HB2 PRO 3 -10.354 -36.323 23.058 52 HB3 PRO 3 HB3 PRO 3 -10.106 -36.791 24.768 53 HG2 PRO 3 HG2 PRO 3 -11.387 -34.240 23.713 54 HG3 PRO 3 HG3 PRO 3 -12.059 -35.391 24.913 55 HD2 PRO 3 HD2 PRO 3 -10.741 -33.148 25.692 56 HD3 PRO 3 HD3 PRO 3 -10.539 -34.690 26.578 57 H LEU 4 H LEU 4 -8.489 -32.724 23.596 58 HA LEU 4 HA LEU 4 -7.999 -33.111 20.688 59 HB2 LEU 4 HB2 LEU 4 -9.119 -30.698 22.157 60 HB3 LEU 4 HB3 LEU 4 -8.826 -30.789 20.424 61 HG LEU 4 HG LEU 4 -10.840 -32.486 21.938 62 HD11 LEU 4 HD11 LEU 4 -11.200 -30.180 19.981 63 HD12 LEU 4 HD12 LEU 4 -12.498 -31.136 20.734 64 HD13 LEU 4 HD13 LEU 4 -11.465 -30.107 21.737 65 HD21 LEU 4 HD21 LEU 4 -10.016 -33.733 19.992 66 HD22 LEU 4 HD22 LEU 4 -11.639 -33.125 19.666 67 HD23 LEU 4 HD23 LEU 4 -10.233 -32.304 18.952 68 H ASP 5 H ASP 5 -5.898 -33.493 22.526 69 HA ASP 5 HA ASP 5 -4.087 -31.216 21.865 70 HB2 ASP 5 HB2 ASP 5 -4.537 -32.753 24.269 71 HB3 ASP 5 HB3 ASP 5 -2.905 -33.063 23.736 72 H LYS 6 H LYS 6 -4.820 -33.971 20.447 73 HA LYS 6 HA LYS 6 -2.000 -34.843 19.858 74 HB2 LYS 6 HB2 LYS 6 -4.355 -36.743 19.734 75 HB3 LYS 6 HB3 LYS 6 -2.640 -37.079 19.840 76 HG2 LYS 6 HG2 LYS 6 -3.084 -37.479 22.017 77 HG3 LYS 6 HG3 LYS 6 -2.947 -35.734 22.171 78 HD2 LYS 6 HD2 LYS 6 -4.945 -36.349 23.335 79 HD3 LYS 6 HD3 LYS 6 -5.454 -35.575 21.839 80 HE2 LYS 6 HE2 LYS 6 -6.881 -37.447 22.171 81 HE3 LYS 6 HE3 LYS 6 -5.829 -37.839 20.815 82 HZ1 LYS 6 HZ1 LYS 6 -5.437 -38.795 23.608 83 HZ2 LYS 6 HZ2 LYS 6 -6.029 -39.692 22.383 84 HZ3 LYS 6 HZ3 LYS 6 -4.480 -39.191 22.342 85 H ILE 7 H ILE 7 -5.225 -35.087 18.460 86 HA ILE 7 HA ILE 7 -4.129 -34.773 15.700 87 HB ILE 7 HB ILE 7 -5.818 -36.475 14.965 88 HG12 ILE 7 HG12 ILE 7 -6.576 -38.169 16.593 89 HG13 ILE 7 HG13 ILE 7 -6.013 -37.178 17.933 90 HG21 ILE 7 HG21 ILE 7 -3.706 -37.499 16.900 91 HG22 ILE 7 HG22 ILE 7 -4.418 -38.363 15.526 92 HG23 ILE 7 HG23 ILE 7 -3.404 -36.944 15.239 93 HD11 ILE 7 HD11 ILE 7 -8.196 -36.351 15.972 94 HD12 ILE 7 HD12 ILE 7 -8.477 -37.093 17.558 95 HD13 ILE 7 HD13 ILE 7 -7.725 -35.496 17.467 96 H ILE 8 H ILE 8 -5.676 -33.028 17.724 97 HA ILE 8 HA ILE 8 -8.173 -32.283 16.957 98 HB ILE 8 HB ILE 8 -6.929 -31.236 18.742 99 HG12 ILE 8 HG12 ILE 8 -8.137 -29.270 16.751 100 HG13 ILE 8 HG13 ILE 8 -8.988 -30.203 17.984 101 HG21 ILE 8 HG21 ILE 8 -5.508 -29.464 16.723 102 HG22 ILE 8 HG22 ILE 8 -5.283 -29.518 18.482 103 HG23 ILE 8 HG23 ILE 8 -4.753 -30.874 17.489 104 HD11 ILE 8 HD11 ILE 8 -7.035 -27.905 18.423 105 HD12 ILE 8 HD12 ILE 8 -8.778 -27.924 18.726 106 HD13 ILE 8 HD13 ILE 8 -7.699 -28.902 19.737 107 H ASN 9 H ASN 9 -9.221 -31.677 15.231 108 HA ASN 9 HA ASN 9 -8.000 -29.978 13.129 109 HB2 ASN 9 HB2 ASN 9 -7.775 -32.571 12.742 110 HB3 ASN 9 HB3 ASN 9 -9.489 -32.509 12.355 111 HD21 ASN 9 HD21 ASN 9 -8.878 -30.787 9.225 112 HD22 ASN 9 HD22 ASN 9 -10.038 -30.840 10.559 113 H ASP 10 H ASP 10 -10.192 -29.763 15.270 114 HA ASP 10 HA ASP 10 -12.584 -29.559 13.677 115 HB2 ASP 10 HB2 ASP 10 -12.451 -30.488 16.026 116 HB3 ASP 10 HB3 ASP 10 -12.167 -28.850 16.608 117 H ILE 11 H ILE 11 -10.272 -27.617 13.485 118 HA ILE 11 HA ILE 11 -11.857 -25.176 13.033 119 HB ILE 11 HB ILE 11 -10.918 -25.179 15.380 120 HG12 ILE 11 HG12 ILE 11 -9.877 -22.841 13.749 121 HG13 ILE 11 HG13 ILE 11 -11.577 -23.104 14.151 122 HG21 ILE 11 HG21 ILE 11 -8.201 -24.781 14.065 123 HG22 ILE 11 HG22 ILE 11 -8.563 -24.813 15.800 124 HG23 ILE 11 HG23 ILE 11 -8.743 -26.282 14.846 125 HD11 ILE 11 HD11 ILE 11 -9.301 -22.665 16.130 126 HD12 ILE 11 HD12 ILE 11 -10.605 -21.541 15.722 127 HD13 ILE 11 HD13 ILE 11 -10.982 -23.047 16.580 128 H LYS 12 H LYS 12 -10.637 -27.168 11.346 129 HA LYS 12 HA LYS 12 -9.168 -25.275 9.561 130 HB2 LYS 12 HB2 LYS 12 -7.543 -26.742 10.696 131 HB3 LYS 12 HB3 LYS 12 -8.404 -28.175 10.119 132 HG2 LYS 12 HG2 LYS 12 -7.887 -27.568 7.781 133 HG3 LYS 12 HG3 LYS 12 -7.097 -26.076 8.328 134 HD2 LYS 12 HD2 LYS 12 -5.386 -27.380 9.512 135 HD3 LYS 12 HD3 LYS 12 -6.219 -28.900 9.100 136 HE2 LYS 12 HE2 LYS 12 -5.914 -28.444 6.701 137 HE3 LYS 12 HE3 LYS 12 -5.126 -26.904 7.068 138 HZ1 LYS 12 HZ1 LYS 12 -4.078 -29.576 7.850 139 HZ2 LYS 12 HZ2 LYS 12 -3.491 -28.652 6.640 140 HZ3 LYS 12 HZ3 LYS 12 -3.351 -28.150 8.186 141 H LYS 13 H LYS 13 -11.017 -28.276 9.721 142 HA LYS 13 HA LYS 13 -12.166 -29.531 8.149 143 HB2 LYS 13 HB2 LYS 13 -13.047 -26.779 7.203 144 HB3 LYS 13 HB3 LYS 13 -13.877 -28.315 6.888 145 HG2 LYS 13 HG2 LYS 13 -14.102 -28.634 9.374 146 HG3 LYS 13 HG3 LYS 13 -13.531 -26.978 9.597 147 HD2 LYS 13 HD2 LYS 13 -16.025 -27.785 8.015 148 HD3 LYS 13 HD3 LYS 13 -15.995 -27.253 9.687 149 HE2 LYS 13 HE2 LYS 13 -16.610 -25.319 8.635 150 HE3 LYS 13 HE3 LYS 13 -14.878 -25.079 8.848 151 HZ1 LYS 13 HZ1 LYS 13 -16.195 -25.994 6.334 152 HZ2 LYS 13 HZ2 LYS 13 -15.659 -24.482 6.608 153 HZ3 LYS 13 HZ3 LYS 13 -14.591 -25.704 6.495 154 H GLU 14 H GLU 14 -12.834 -28.683 5.390 155 HA GLU 14 HA GLU 14 -10.217 -28.649 3.985 156 HB2 GLU 14 HB2 GLU 14 -12.469 -30.638 3.463 157 HB3 GLU 14 HB3 GLU 14 -11.142 -30.316 2.342 158 HG2 GLU 14 HG2 GLU 14 -9.502 -30.981 4.095 159 HG3 GLU 14 HG3 GLU 14 -10.841 -31.426 5.159 160 H ALA 15 H ALA 15 -10.524 -28.152 1.627 161 HA ALA 15 HA ALA 15 -12.851 -26.379 1.068 162 HB1 ALA 15 HB1 ALA 15 -9.916 -25.648 0.725 163 HB2 ALA 15 HB2 ALA 15 -11.313 -24.648 0.264 164 HB3 ALA 15 HB3 ALA 15 -11.007 -25.006 1.977 165 H ASN 16 H ASN 16 -12.867 -25.637 -1.221 166 HA ASN 16 HA ASN 16 -11.774 -27.533 -3.219 167 HB2 ASN 16 HB2 ASN 16 -13.899 -28.513 -2.457 168 HB3 ASN 16 HB3 ASN 16 -14.732 -26.982 -2.720 169 HD21 ASN 16 HD21 ASN 16 -15.194 -27.572 -6.191 170 HD22 ASN 16 HD22 ASN 16 -15.507 -26.523 -4.818 171 H ASP 17 H ASP 17 -11.624 -26.692 -5.298 172 HA ASP 17 HA ASP 17 -12.773 -24.067 -5.963 173 HB2 ASP 17 HB2 ASP 17 -10.533 -23.597 -4.921 174 HB3 ASP 17 HB3 ASP 17 -9.777 -24.580 -6.176 175 H SER 18 H SER 18 -13.118 -23.801 -8.164 176 HA SER 18 HA SER 18 -12.725 -26.232 -9.855 177 HB2 SER 18 HB2 SER 18 -14.953 -24.173 -9.968 178 HB3 SER 18 HB3 SER 18 -14.825 -25.647 -10.946 179 HG SER 18 HG SER 18 -16.202 -25.924 -9.131 180 H GLY 19 H GLY 19 -11.133 -23.456 -9.679 181 HA2 GLY 19 HA2 GLY 19 -9.861 -23.734 -12.088 182 HA3 GLY 19 HA3 GLY 19 -11.169 -22.617 -12.484 183 H VAL 20 H VAL 20 -8.249 -23.069 -10.570 184 HA VAL 20 HA VAL 20 -8.225 -20.332 -9.555 185 HB VAL 20 HB VAL 20 -7.418 -22.030 -8.119 186 HG11 VAL 20 HG11 VAL 20 -5.137 -22.616 -10.050 187 HG12 VAL 20 HG12 VAL 20 -5.377 -23.301 -8.435 188 HG13 VAL 20 HG13 VAL 20 -6.515 -23.691 -9.728 189 HG21 VAL 20 HG21 VAL 20 -6.410 -19.772 -7.972 190 HG22 VAL 20 HG22 VAL 20 -5.315 -21.048 -7.419 191 HG23 VAL 20 HG23 VAL 20 -5.071 -20.310 -9.013 192 H THR 21 H THR 21 -7.627 -18.613 -10.635 193 HA THR 21 HA THR 21 -5.092 -18.537 -12.012 194 HB THR 21 HB THR 21 -6.882 -17.264 -13.911 195 HG1 THR 21 HG1 THR 21 -7.773 -19.086 -14.840 196 HG21 THR 21 HG21 THR 21 -4.944 -19.606 -14.126 197 HG22 THR 21 HG22 THR 21 -5.563 -18.634 -15.487 198 HG23 THR 21 HG23 THR 21 -4.505 -17.891 -14.272 199 H LEU 22 H LEU 22 -4.724 -16.319 -13.012 200 HA LEU 22 HA LEU 22 -4.919 -14.472 -10.794 201 HB2 LEU 22 HB2 LEU 22 -3.519 -14.313 -13.499 202 HB3 LEU 22 HB3 LEU 22 -3.176 -13.253 -12.137 203 HG LEU 22 HG LEU 22 -2.806 -16.270 -11.928 204 HD11 LEU 22 HD11 LEU 22 -0.791 -14.228 -12.903 205 HD12 LEU 22 HD12 LEU 22 -0.436 -15.916 -12.455 206 HD13 LEU 22 HD13 LEU 22 -1.509 -15.582 -13.823 207 HD21 LEU 22 HD21 LEU 22 -2.835 -14.992 -9.813 208 HD22 LEU 22 HD22 LEU 22 -1.227 -15.652 -10.153 209 HD23 LEU 22 HD23 LEU 22 -1.551 -13.926 -10.438 210 H ALA 23 H ALA 23 -7.405 -14.789 -12.034 211 HA ALA 23 HA ALA 23 -8.010 -12.151 -13.250 212 HB1 ALA 23 HB1 ALA 23 -8.280 -14.840 -14.658 213 HB2 ALA 23 HB2 ALA 23 -8.901 -13.292 -15.281 214 HB3 ALA 23 HB3 ALA 23 -7.154 -13.536 -15.069 215 HA PRO 24 HA PRO 24 -11.629 -13.497 -10.833 216 HB2 PRO 24 HB2 PRO 24 -12.593 -11.096 -10.035 217 HB3 PRO 24 HB3 PRO 24 -11.074 -11.780 -9.380 218 HG2 PRO 24 HG2 PRO 24 -11.386 -9.743 -11.611 219 HG3 PRO 24 HG3 PRO 24 -10.324 -9.654 -10.174 220 HD2 PRO 24 HD2 PRO 24 -9.448 -10.538 -12.621 221 HD3 PRO 24 HD3 PRO 24 -8.797 -11.199 -11.093 222 H LEU 25 H LEU 25 -11.761 -11.181 -13.524 223 HA LEU 25 HA LEU 25 -14.372 -12.222 -14.403 224 HB2 LEU 25 HB2 LEU 25 -14.785 -10.347 -12.718 225 HB3 LEU 25 HB3 LEU 25 -13.968 -9.259 -13.838 226 HG LEU 25 HG LEU 25 -15.745 -9.793 -15.564 227 HD11 LEU 25 HD11 LEU 25 -17.064 -11.240 -13.227 228 HD12 LEU 25 HD12 LEU 25 -17.856 -10.818 -14.762 229 HD13 LEU 25 HD13 LEU 25 -16.528 -11.978 -14.756 230 HD21 LEU 25 HD21 LEU 25 -15.886 -7.796 -14.130 231 HD22 LEU 25 HD22 LEU 25 -17.491 -8.449 -14.488 232 HD23 LEU 25 HD23 LEU 25 -16.755 -8.734 -12.894 233 H SER 26 H SER 26 -12.614 -12.984 -15.924 234 HA SER 26 HA SER 26 -11.558 -12.934 -17.947 235 HB2 SER 26 HB2 SER 26 -13.892 -11.089 -18.545 236 HB3 SER 26 HB3 SER 26 -12.914 -11.932 -19.776 237 HG SER 26 HG SER 26 -14.836 -13.085 -19.242 238 H VAL 27 H VAL 27 -10.321 -11.221 -16.196 239 HA VAL 27 HA VAL 27 -8.850 -9.403 -17.967 240 HB VAL 27 HB VAL 27 -10.877 -8.165 -17.160 241 HG11 VAL 27 HG11 VAL 27 -9.560 -8.156 -14.420 242 HG12 VAL 27 HG12 VAL 27 -11.061 -7.342 -14.904 243 HG13 VAL 27 HG13 VAL 27 -11.001 -9.108 -14.839 244 HG21 VAL 27 HG21 VAL 27 -8.854 -6.945 -17.852 245 HG22 VAL 27 HG22 VAL 27 -9.730 -6.100 -16.571 246 HG23 VAL 27 HG23 VAL 27 -8.247 -6.987 -16.175 247 HA PRO 28 HA PRO 28 -5.838 -11.000 -15.065 248 HB2 PRO 28 HB2 PRO 28 -3.550 -9.739 -15.807 249 HB3 PRO 28 HB3 PRO 28 -4.412 -10.879 -16.874 250 HG2 PRO 28 HG2 PRO 28 -4.641 -7.848 -16.864 251 HG3 PRO 28 HG3 PRO 28 -4.294 -8.923 -18.259 252 HD2 PRO 28 HD2 PRO 28 -6.808 -8.050 -17.722 253 HD3 PRO 28 HD3 PRO 28 -6.517 -9.703 -18.333 254 H LYS 29 H LYS 29 -7.319 -9.856 -13.543 255 HA LYS 29 HA LYS 29 -7.824 -8.777 -11.665 256 HB2 LYS 29 HB2 LYS 29 -5.564 -9.705 -11.002 257 HB3 LYS 29 HB3 LYS 29 -4.921 -8.089 -11.261 258 HG2 LYS 29 HG2 LYS 29 -5.360 -8.149 -8.926 259 HG3 LYS 29 HG3 LYS 29 -6.719 -7.280 -9.600 260 HD2 LYS 29 HD2 LYS 29 -8.167 -9.213 -9.411 261 HD3 LYS 29 HD3 LYS 29 -6.792 -10.289 -9.087 262 HE2 LYS 29 HE2 LYS 29 -6.362 -9.141 -6.952 263 HE3 LYS 29 HE3 LYS 29 -7.686 -8.016 -7.266 264 HZ1 LYS 29 HZ1 LYS 29 -8.030 -10.954 -6.954 265 HZ2 LYS 29 HZ2 LYS 29 -8.371 -9.847 -5.806 266 HZ3 LYS 29 HZ3 LYS 29 -9.237 -9.873 -7.184 267 HA PRO 30 HA PRO 30 -8.299 -4.689 -13.496 268 HB2 PRO 30 HB2 PRO 30 -10.646 -3.934 -12.391 269 HB3 PRO 30 HB3 PRO 30 -10.554 -5.285 -13.563 270 HG2 PRO 30 HG2 PRO 30 -10.612 -5.450 -10.530 271 HG3 PRO 30 HG3 PRO 30 -11.612 -6.364 -11.705 272 HD2 PRO 30 HD2 PRO 30 -9.308 -7.362 -10.584 273 HD3 PRO 30 HD3 PRO 30 -9.844 -7.800 -12.232 274 H LYS 31 H LYS 31 -8.312 -2.437 -12.857 275 HA LYS 31 HA LYS 31 -6.711 -1.944 -10.463 276 HB2 LYS 31 HB2 LYS 31 -7.867 0.070 -12.432 277 HB3 LYS 31 HB3 LYS 31 -6.693 0.392 -11.161 278 HG2 LYS 31 HG2 LYS 31 -5.139 0.071 -12.738 279 HG3 LYS 31 HG3 LYS 31 -5.390 -1.640 -12.454 280 HD2 LYS 31 HD2 LYS 31 -7.062 -1.663 -14.345 281 HD3 LYS 31 HD3 LYS 31 -6.702 0.054 -14.627 282 HE2 LYS 31 HE2 LYS 31 -4.299 -0.540 -14.988 283 HE3 LYS 31 HE3 LYS 31 -4.695 -2.246 -14.749 284 HZ1 LYS 31 HZ1 LYS 31 -5.785 -0.531 -16.924 285 HZ2 LYS 31 HZ2 LYS 31 -4.639 -1.676 -17.110 286 HZ3 LYS 31 HZ3 LYS 31 -6.157 -2.106 -16.704 287 H LEU 32 H LEU 32 -7.205 -0.902 -8.580 288 HA LEU 32 HA LEU 32 -9.962 -0.056 -7.984 289 HB2 LEU 32 HB2 LEU 32 -9.909 -2.492 -7.570 290 HB3 LEU 32 HB3 LEU 32 -8.414 -2.319 -6.650 291 HG LEU 32 HG LEU 32 -9.615 -0.959 -4.963 292 HD11 LEU 32 HD11 LEU 32 -12.108 -1.828 -6.501 293 HD12 LEU 32 HD12 LEU 32 -12.106 -1.064 -4.899 294 HD13 LEU 32 HD13 LEU 32 -11.544 -0.155 -6.304 295 HD21 LEU 32 HD21 LEU 32 -9.248 -3.317 -4.570 296 HD22 LEU 32 HD22 LEU 32 -10.829 -2.856 -3.933 297 HD23 LEU 32 HD23 LEU 32 -10.723 -3.742 -5.474 298 H GLU 33 H GLU 33 -10.043 1.495 -6.424 299 HA GLU 33 HA GLU 33 -7.843 1.834 -4.478 300 HB2 GLU 33 HB2 GLU 33 -9.015 4.112 -6.133 301 HB3 GLU 33 HB3 GLU 33 -8.126 4.328 -4.622 302 HG2 GLU 33 HG2 GLU 33 -6.127 3.270 -5.623 303 HG3 GLU 33 HG3 GLU 33 -6.998 3.049 -7.146 304 H GLU 34 H GLU 34 -8.832 1.523 -2.550 305 HA GLU 34 HA GLU 34 -11.481 2.714 -1.992 306 HB2 GLU 34 HB2 GLU 34 -11.788 0.413 -2.927 307 HB3 GLU 34 HB3 GLU 34 -10.838 -0.242 -1.586 308 HG2 GLU 34 HG2 GLU 34 -12.470 0.693 0.020 309 HG3 GLU 34 HG3 GLU 34 -13.356 1.453 -1.300 310 H LEU 35 H LEU 35 -10.031 4.155 -0.913 311 HA LEU 35 HA LEU 35 -9.050 3.280 1.772 312 HB2 LEU 35 HB2 LEU 35 -7.709 4.988 -0.361 313 HB3 LEU 35 HB3 LEU 35 -7.108 4.852 1.278 314 HG LEU 35 HG LEU 35 -7.489 2.255 -0.195 315 HD11 LEU 35 HD11 LEU 35 -5.162 4.067 -0.857 316 HD12 LEU 35 HD12 LEU 35 -5.474 2.415 -1.442 317 HD13 LEU 35 HD13 LEU 35 -6.536 3.734 -1.936 318 HD21 LEU 35 HD21 LEU 35 -6.575 2.326 2.103 319 HD22 LEU 35 HD22 LEU 35 -5.415 1.672 0.940 320 HD23 LEU 35 HD23 LEU 35 -5.222 3.335 1.522 321 H SER 36 H SER 36 -8.968 4.977 3.342 322 HA SER 36 HA SER 36 -10.916 7.183 3.063 323 HB2 SER 36 HB2 SER 36 -10.570 5.950 5.211 324 HB3 SER 36 HB3 SER 36 -8.932 6.629 5.298 325 HG SER 36 HG SER 36 -10.551 7.849 6.462 326 H GLU 37 H GLU 37 -10.035 9.505 3.668 327 HA GLU 37 HA GLU 37 -8.375 10.304 1.521 328 HB2 GLU 37 HB2 GLU 37 -10.095 11.671 2.765 329 HB3 GLU 37 HB3 GLU 37 -8.949 11.816 4.097 330 HG2 GLU 37 HG2 GLU 37 -8.764 13.817 2.892 331 HG3 GLU 37 HG3 GLU 37 -7.332 12.905 2.442 332 H GLN 38 H GLN 38 -7.478 9.935 4.989 333 HA GLN 38 HA GLN 38 -4.701 10.695 4.561 334 HB2 GLN 38 HB2 GLN 38 -5.980 10.859 6.750 335 HB3 GLN 38 HB3 GLN 38 -5.902 9.097 6.854 336 HG2 GLN 38 HG2 GLN 38 -3.306 9.409 6.636 337 HG3 GLN 38 HG3 GLN 38 -3.620 11.114 6.952 338 HE21 GLN 38 HE21 GLN 38 -4.047 8.313 9.952 339 HE22 GLN 38 HE22 GLN 38 -3.963 7.798 8.272 340 H GLN 39 H GLN 39 -6.429 7.581 4.789 341 HA GLN 39 HA GLN 39 -4.210 5.800 4.624 342 HB2 GLN 39 HB2 GLN 39 -7.072 5.581 3.697 343 HB3 GLN 39 HB3 GLN 39 -5.949 4.239 3.614 344 HG2 GLN 39 HG2 GLN 39 -6.393 5.618 6.275 345 HG3 GLN 39 HG3 GLN 39 -7.617 4.525 5.649 346 HE21 GLN 39 HE21 GLN 39 -4.552 2.824 7.508 347 HE22 GLN 39 HE22 GLN 39 -4.902 4.547 7.634 348 H LYS 40 H LYS 40 -6.174 7.327 2.038 349 HA LYS 40 HA LYS 40 -4.870 6.142 -0.203 350 HB2 LYS 40 HB2 LYS 40 -7.060 7.281 -0.248 351 HB3 LYS 40 HB3 LYS 40 -6.289 8.832 0.091 352 HG2 LYS 40 HG2 LYS 40 -5.048 8.713 -2.034 353 HG3 LYS 40 HG3 LYS 40 -5.753 7.128 -2.386 354 HD2 LYS 40 HD2 LYS 40 -7.373 9.685 -1.979 355 HD3 LYS 40 HD3 LYS 40 -6.823 9.098 -3.559 356 HE2 LYS 40 HE2 LYS 40 -8.067 6.967 -3.196 357 HE3 LYS 40 HE3 LYS 40 -8.671 7.591 -1.653 358 HZ1 LYS 40 HZ1 LYS 40 -9.204 8.809 -4.312 359 HZ2 LYS 40 HZ2 LYS 40 -10.279 7.950 -3.437 360 HZ3 LYS 40 HZ3 LYS 40 -9.755 9.396 -2.891 361 H ILE 41 H ILE 41 -4.117 9.203 1.572 362 HA ILE 41 HA ILE 41 -1.926 9.919 -0.147 363 HB ILE 41 HB ILE 41 -2.430 10.654 2.722 364 HG12 ILE 41 HG12 ILE 41 -2.881 12.426 0.270 365 HG13 ILE 41 HG13 ILE 41 -4.145 11.346 0.816 366 HG21 ILE 41 HG21 ILE 41 -0.507 11.905 0.723 367 HG22 ILE 41 HG22 ILE 41 -0.930 12.622 2.291 368 HG23 ILE 41 HG23 ILE 41 -0.085 11.086 2.243 369 HD11 ILE 41 HD11 ILE 41 -2.945 13.613 2.452 370 HD12 ILE 41 HD12 ILE 41 -4.563 13.529 1.734 371 HD13 ILE 41 HD13 ILE 41 -4.130 12.430 3.057 372 H ILE 42 H ILE 42 -1.955 7.953 2.934 373 HA ILE 42 HA ILE 42 0.918 7.690 3.003 374 HB ILE 42 HB ILE 42 -1.203 5.783 4.044 375 HG12 ILE 42 HG12 ILE 42 0.392 7.715 5.763 376 HG13 ILE 42 HG13 ILE 42 -1.074 8.269 4.968 377 HG21 ILE 42 HG21 ILE 42 1.796 5.989 4.618 378 HG22 ILE 42 HG22 ILE 42 0.674 5.011 5.574 379 HG23 ILE 42 HG23 ILE 42 0.950 4.616 3.883 380 HD11 ILE 42 HD11 ILE 42 -0.934 5.911 6.887 381 HD12 ILE 42 HD12 ILE 42 -1.616 7.516 7.210 382 HD13 ILE 42 HD13 ILE 42 -2.381 6.451 6.007 383 H LEU 43 H LEU 43 -1.631 5.697 1.538 384 HA LEU 43 HA LEU 43 -0.012 3.637 0.453 385 HB2 LEU 43 HB2 LEU 43 -2.465 3.617 0.760 386 HB3 LEU 43 HB3 LEU 43 -2.673 4.836 -0.470 387 HG LEU 43 HG LEU 43 -3.254 2.463 -1.006 388 HD11 LEU 43 HD11 LEU 43 -1.285 3.764 -2.905 389 HD12 LEU 43 HD12 LEU 43 -2.483 2.524 -3.308 390 HD13 LEU 43 HD13 LEU 43 -3.013 4.126 -2.765 391 HD21 LEU 43 HD21 LEU 43 -1.337 1.370 0.026 392 HD22 LEU 43 HD22 LEU 43 -1.492 0.905 -1.677 393 HD23 LEU 43 HD23 LEU 43 -0.232 2.059 -1.182 394 H ALA 44 H ALA 44 -1.178 6.656 -1.067 395 HA ALA 44 HA ALA 44 0.179 6.405 -3.540 396 HB1 ALA 44 HB1 ALA 44 -0.748 8.849 -1.985 397 HB2 ALA 44 HB2 ALA 44 -0.321 8.832 -3.712 398 HB3 ALA 44 HB3 ALA 44 -1.727 7.904 -3.134 399 H GLU 45 H GLU 45 1.162 8.362 -0.609 400 HA GLU 45 HA GLU 45 3.613 9.267 -1.726 401 HB2 GLU 45 HB2 GLU 45 2.707 8.820 1.138 402 HB3 GLU 45 HB3 GLU 45 4.271 9.523 0.748 403 HG2 GLU 45 HG2 GLU 45 1.648 10.715 -0.243 404 HG3 GLU 45 HG3 GLU 45 2.430 11.178 1.264 405 H TYR 46 H TYR 46 2.902 6.115 -0.256 406 HA TYR 46 HA TYR 46 5.656 5.324 0.068 407 HB2 TYR 46 HB2 TYR 46 3.720 4.347 1.255 408 HB3 TYR 46 HB3 TYR 46 3.117 3.677 -0.250 409 HD1 TYR 46 HD1 TYR 46 3.020 1.660 1.328 410 HD2 TYR 46 HD2 TYR 46 6.724 3.357 -0.117 411 HE1 TYR 46 HE1 TYR 46 4.212 -0.459 1.874 412 HE2 TYR 46 HE2 TYR 46 7.899 1.261 0.444 413 HH TYR 46 HH TYR 46 6.225 -1.562 1.860 414 H ILE 47 H ILE 47 3.236 4.406 -2.446 415 HA ILE 47 HA ILE 47 4.960 3.097 -4.221 416 HB ILE 47 HB ILE 47 2.282 4.494 -4.413 417 HG12 ILE 47 HG12 ILE 47 3.043 1.540 -4.312 418 HG13 ILE 47 HG13 ILE 47 2.518 2.470 -2.919 419 HG21 ILE 47 HG21 ILE 47 3.608 2.794 -6.542 420 HG22 ILE 47 HG22 ILE 47 1.880 3.217 -6.556 421 HG23 ILE 47 HG23 ILE 47 3.084 4.479 -6.704 422 HD11 ILE 47 HD11 ILE 47 0.822 1.698 -5.305 423 HD12 ILE 47 HD12 ILE 47 0.613 1.269 -3.600 424 HD13 ILE 47 HD13 ILE 47 0.350 2.947 -4.127 425 H ALA 48 H ALA 48 4.030 6.559 -3.962 426 HA ALA 48 HA ALA 48 5.258 7.402 -6.425 427 HB1 ALA 48 HB1 ALA 48 4.563 8.915 -3.876 428 HB2 ALA 48 HB2 ALA 48 4.932 9.654 -5.454 429 HB3 ALA 48 HB3 ALA 48 3.483 8.643 -5.261 430 H GLU 49 H GLU 49 6.574 6.782 -3.206 431 HA GLU 49 HA GLU 49 9.163 8.057 -3.858 432 HB2 GLU 49 HB2 GLU 49 8.155 8.336 -1.636 433 HB3 GLU 49 HB3 GLU 49 8.239 6.587 -1.362 434 HG2 GLU 49 HG2 GLU 49 10.679 6.648 -1.455 435 HG3 GLU 49 HG3 GLU 49 10.660 8.340 -1.960 436 H VAL 50 H VAL 50 7.822 4.739 -3.450 437 HA VAL 50 HA VAL 50 10.510 3.675 -4.227 438 HB VAL 50 HB VAL 50 10.212 1.789 -3.046 439 HG11 VAL 50 HG11 VAL 50 8.857 3.846 -1.282 440 HG12 VAL 50 HG12 VAL 50 9.799 2.431 -0.772 441 HG13 VAL 50 HG13 VAL 50 10.600 3.763 -1.621 442 HG21 VAL 50 HG21 VAL 50 7.933 1.105 -3.691 443 HG22 VAL 50 HG22 VAL 50 8.168 1.007 -1.950 444 HG23 VAL 50 HG23 VAL 50 7.249 2.360 -2.639 445 H GLY 51 H GLY 51 7.535 4.158 -5.626 446 HA2 GLY 51 HA2 GLY 51 7.334 4.161 -7.913 447 HA3 GLY 51 HA3 GLY 51 8.706 3.058 -8.074 448 H LEU 52 H LEU 52 6.255 2.009 -5.977 449 HA LEU 52 HA LEU 52 5.035 0.196 -5.843 450 HB2 LEU 52 HB2 LEU 52 4.044 1.381 -8.138 451 HB3 LEU 52 HB3 LEU 52 4.391 -0.218 -8.728 452 HG LEU 52 HG LEU 52 2.675 0.371 -6.274 453 HD11 LEU 52 HD11 LEU 52 1.862 -0.173 -9.149 454 HD12 LEU 52 HD12 LEU 52 0.748 -0.114 -7.760 455 HD13 LEU 52 HD13 LEU 52 1.643 1.335 -8.236 456 HD21 LEU 52 HD21 LEU 52 3.490 -1.901 -6.201 457 HD22 LEU 52 HD22 LEU 52 1.788 -1.933 -6.672 458 HD23 LEU 52 HD23 LEU 52 3.059 -2.167 -7.897 459 H GLN 53 H GLN 53 7.932 0.126 -7.117 460 HA GLN 53 HA GLN 53 8.099 -2.689 -8.050 461 HB2 GLN 53 HB2 GLN 53 9.998 -0.350 -7.932 462 HB3 GLN 53 HB3 GLN 53 10.687 -1.964 -7.867 463 HG2 GLN 53 HG2 GLN 53 10.679 -1.293 -10.146 464 HG3 GLN 53 HG3 GLN 53 9.515 -2.606 -9.939 465 HE21 GLN 53 HE21 GLN 53 8.043 1.191 -10.515 466 HE22 GLN 53 HE22 GLN 53 9.729 0.990 -10.056 467 H ASN 54 H ASN 54 8.569 -0.959 -5.095 468 HA ASN 54 HA ASN 54 10.093 -3.252 -3.895 469 HB2 ASN 54 HB2 ASN 54 10.358 -0.296 -3.297 470 HB3 ASN 54 HB3 ASN 54 11.324 -1.579 -2.597 471 HD21 ASN 54 HD21 ASN 54 12.382 -0.089 -6.205 472 HD22 ASN 54 HD22 ASN 54 10.935 0.512 -5.409 473 H ILE 55 H ILE 55 7.078 -2.084 -3.711 474 HA ILE 55 HA ILE 55 6.779 -2.031 -0.793 475 HB ILE 55 HB ILE 55 4.442 -1.805 -1.106 476 HG12 ILE 55 HG12 ILE 55 4.861 -2.277 -4.091 477 HG13 ILE 55 HG13 ILE 55 4.036 -3.357 -2.962 478 HG21 ILE 55 HG21 ILE 55 5.669 -0.012 -3.225 479 HG22 ILE 55 HG22 ILE 55 4.374 0.351 -2.056 480 HG23 ILE 55 HG23 ILE 55 6.025 0.149 -1.496 481 HD11 ILE 55 HD11 ILE 55 3.152 -0.598 -3.826 482 HD12 ILE 55 HD12 ILE 55 2.347 -2.148 -4.123 483 HD13 ILE 55 HD13 ILE 55 2.400 -1.494 -2.470 484 H THR 56 H THR 56 5.575 -3.561 0.447 485 HA THR 56 HA THR 56 5.157 -6.252 -0.730 486 HB THR 56 HB THR 56 6.035 -6.968 1.712 487 HG1 THR 56 HG1 THR 56 7.873 -5.762 2.245 488 HG21 THR 56 HG21 THR 56 7.972 -6.289 -0.548 489 HG22 THR 56 HG22 THR 56 8.252 -7.456 0.765 490 HG23 THR 56 HG23 THR 56 6.998 -7.772 -0.444 491 H ALA 57 H ALA 57 3.373 -7.346 0.146 492 HA ALA 57 HA ALA 57 1.326 -5.777 1.285 493 HB1 ALA 57 HB1 ALA 57 1.654 -8.809 1.254 494 HB2 ALA 57 HB2 ALA 57 0.143 -7.903 1.497 495 HB3 ALA 57 HB3 ALA 57 0.980 -7.825 -0.066 496 H ILE 58 H ILE 58 3.877 -7.601 2.825 497 HA ILE 58 HA ILE 58 2.860 -7.729 5.526 498 HB ILE 58 HB ILE 58 5.648 -7.720 4.291 499 HG12 ILE 58 HG12 ILE 58 5.707 -10.102 5.083 500 HG13 ILE 58 HG13 ILE 58 4.042 -9.967 5.638 501 HG21 ILE 58 HG21 ILE 58 4.859 -8.102 7.225 502 HG22 ILE 58 HG22 ILE 58 6.459 -8.507 6.561 503 HG23 ILE 58 HG23 ILE 58 5.913 -6.836 6.565 504 HD11 ILE 58 HD11 ILE 58 4.899 -9.670 2.725 505 HD12 ILE 58 HD12 ILE 58 4.374 -11.191 3.470 506 HD13 ILE 58 HD13 ILE 58 3.234 -9.851 3.352 507 H THR 59 H THR 59 5.037 -5.439 3.830 508 HA THR 59 HA THR 59 5.237 -3.637 6.100 509 HB THR 59 HB THR 59 6.064 -3.401 3.193 510 HG1 THR 59 HG1 THR 59 7.983 -4.099 3.924 511 HG21 THR 59 HG21 THR 59 6.864 -1.713 5.607 512 HG22 THR 59 HG22 THR 59 7.650 -1.671 4.008 513 HG23 THR 59 HG23 THR 59 5.969 -1.139 4.178 514 H LEU 60 H LEU 60 3.453 -3.561 2.999 515 HA LEU 60 HA LEU 60 2.176 -1.077 3.363 516 HB2 LEU 60 HB2 LEU 60 2.440 -2.592 1.296 517 HB3 LEU 60 HB3 LEU 60 1.121 -3.555 1.931 518 HG LEU 60 HG LEU 60 -0.357 -1.498 1.753 519 HD11 LEU 60 HD11 LEU 60 2.161 -0.397 0.434 520 HD12 LEU 60 HD12 LEU 60 0.569 0.331 0.282 521 HD13 LEU 60 HD13 LEU 60 1.320 0.264 1.872 522 HD21 LEU 60 HD21 LEU 60 -0.241 -3.207 -0.030 523 HD22 LEU 60 HD22 LEU 60 -0.527 -1.588 -0.689 524 HD23 LEU 60 HD23 LEU 60 1.089 -2.324 -0.792 525 H SER 61 H SER 61 1.197 -4.359 4.451 526 HA SER 61 HA SER 61 -1.231 -3.760 5.685 527 HB2 SER 61 HB2 SER 61 -0.541 -6.010 5.380 528 HB3 SER 61 HB3 SER 61 0.884 -5.778 6.413 529 HG SER 61 HG SER 61 -0.694 -6.790 7.604 530 H LYS 62 H LYS 62 1.967 -2.988 6.649 531 HA LYS 62 HA LYS 62 1.125 -2.227 9.382 532 HB2 LYS 62 HB2 LYS 62 3.865 -2.809 8.225 533 HB3 LYS 62 HB3 LYS 62 3.626 -2.094 9.829 534 HG2 LYS 62 HG2 LYS 62 2.223 -4.006 10.511 535 HG3 LYS 62 HG3 LYS 62 2.456 -4.768 8.928 536 HD2 LYS 62 HD2 LYS 62 4.899 -4.824 9.309 537 HD3 LYS 62 HD3 LYS 62 4.682 -4.085 10.901 538 HE2 LYS 62 HE2 LYS 62 3.484 -6.761 10.033 539 HE3 LYS 62 HE3 LYS 62 5.008 -6.592 10.909 540 HZ1 LYS 62 HZ1 LYS 62 2.356 -5.741 11.945 541 HZ2 LYS 62 HZ2 LYS 62 3.203 -7.041 12.441 542 HZ3 LYS 62 HZ3 LYS 62 3.775 -5.543 12.736 543 H LYS 63 H LYS 63 2.404 -0.710 6.440 544 HA LYS 63 HA LYS 63 3.004 1.883 7.494 545 HB2 LYS 63 HB2 LYS 63 2.079 0.813 4.801 546 HB3 LYS 63 HB3 LYS 63 2.499 2.508 5.036 547 HG2 LYS 63 HG2 LYS 63 4.597 0.663 6.035 548 HG3 LYS 63 HG3 LYS 63 4.201 0.395 4.333 549 HD2 LYS 63 HD2 LYS 63 4.568 2.741 3.816 550 HD3 LYS 63 HD3 LYS 63 4.959 3.099 5.511 551 HE2 LYS 63 HE2 LYS 63 6.454 1.095 3.782 552 HE3 LYS 63 HE3 LYS 63 6.889 2.807 3.872 553 HZ1 LYS 63 HZ1 LYS 63 6.869 0.957 6.205 554 HZ2 LYS 63 HZ2 LYS 63 8.205 1.491 5.434 555 HZ3 LYS 63 HZ3 LYS 63 7.271 2.540 6.257 556 H LEU 64 H LEU 64 -0.014 0.388 6.497 557 HA LEU 64 HA LEU 64 -1.553 2.852 7.196 558 HB2 LEU 64 HB2 LEU 64 -2.111 0.576 5.273 559 HB3 LEU 64 HB3 LEU 64 -3.265 1.839 5.669 560 HG LEU 64 HG LEU 64 -0.970 3.265 4.934 561 HD11 LEU 64 HD11 LEU 64 -1.333 0.933 2.992 562 HD12 LEU 64 HD12 LEU 64 -0.228 2.319 2.805 563 HD13 LEU 64 HD13 LEU 64 0.037 1.116 4.080 564 HD21 LEU 64 HD21 LEU 64 -3.292 3.750 4.298 565 HD22 LEU 64 HD22 LEU 64 -2.182 3.778 2.921 566 HD23 LEU 64 HD23 LEU 64 -3.273 2.387 3.153 567 H ASN 65 H ASN 65 -0.759 0.124 8.780 568 HA ASN 65 HA ASN 65 -1.641 -1.203 10.385 569 HB2 ASN 65 HB2 ASN 65 -3.334 1.252 10.975 570 HB3 ASN 65 HB3 ASN 65 -3.010 -0.077 12.080 571 HD21 ASN 65 HD21 ASN 65 -0.235 2.842 11.640 572 HD22 ASN 65 HD22 ASN 65 -1.739 2.871 10.727 573 H ILE 66 H ILE 66 -2.491 -2.323 8.325 574 HA ILE 66 HA ILE 66 -5.441 -2.807 8.492 575 HB ILE 66 HB ILE 66 -5.011 -3.193 5.872 576 HG12 ILE 66 HG12 ILE 66 -3.173 -0.861 6.351 577 HG13 ILE 66 HG13 ILE 66 -2.511 -2.441 6.199 578 HG21 ILE 66 HG21 ILE 66 -5.525 -0.570 7.305 579 HG22 ILE 66 HG22 ILE 66 -5.816 -0.820 5.583 580 HG23 ILE 66 HG23 ILE 66 -6.710 -1.788 6.764 581 HD11 ILE 66 HD11 ILE 66 -4.044 -0.914 4.062 582 HD12 ILE 66 HD12 ILE 66 -2.363 -1.468 4.027 583 HD13 ILE 66 HD13 ILE 66 -3.682 -2.648 3.922 584 H THR 67 H THR 67 -5.594 -4.864 6.639 585 HA THR 67 HA THR 67 -4.070 -7.079 7.918 586 HB THR 67 HB THR 67 -5.614 -8.578 6.825 587 HG1 THR 67 HG1 THR 67 -7.438 -7.614 5.736 588 HG21 THR 67 HG21 THR 67 -7.229 -6.347 8.129 589 HG22 THR 67 HG22 THR 67 -7.672 -8.062 7.987 590 HG23 THR 67 HG23 THR 67 -6.309 -7.587 9.013 591 H VAL 68 H VAL 68 -2.986 -8.630 6.600 592 HA VAL 68 HA VAL 68 -1.563 -7.630 4.290 593 HB VAL 68 HB VAL 68 -1.915 -10.480 5.299 594 HG11 VAL 68 HG11 VAL 68 0.179 -9.317 3.410 595 HG12 VAL 68 HG12 VAL 68 0.198 -10.955 4.092 596 HG13 VAL 68 HG13 VAL 68 -1.080 -10.497 2.970 597 HG21 VAL 68 HG21 VAL 68 -0.840 -9.037 6.994 598 HG22 VAL 68 HG22 VAL 68 0.337 -10.145 6.295 599 HG23 VAL 68 HG23 VAL 68 0.317 -8.450 5.773 600 H GLU 69 H GLU 69 -4.744 -9.038 4.632 601 HA GLU 69 HA GLU 69 -4.879 -10.202 1.953 602 HB2 GLU 69 HB2 GLU 69 -6.883 -9.840 4.224 603 HB3 GLU 69 HB3 GLU 69 -7.296 -10.522 2.656 604 HG2 GLU 69 HG2 GLU 69 -6.936 -12.335 4.165 605 HG3 GLU 69 HG3 GLU 69 -5.671 -12.335 2.944 606 H LYS 70 H LYS 70 -5.817 -7.154 3.577 607 HA LYS 70 HA LYS 70 -7.112 -6.314 1.098 608 HB2 LYS 70 HB2 LYS 70 -8.199 -4.644 2.208 609 HB3 LYS 70 HB3 LYS 70 -8.123 -5.920 3.401 610 HG2 LYS 70 HG2 LYS 70 -7.415 -4.295 4.804 611 HG3 LYS 70 HG3 LYS 70 -5.848 -4.540 4.059 612 HD2 LYS 70 HD2 LYS 70 -6.139 -2.221 3.902 613 HD3 LYS 70 HD3 LYS 70 -6.646 -2.742 2.302 614 HE2 LYS 70 HE2 LYS 70 -9.001 -2.612 2.947 615 HE3 LYS 70 HE3 LYS 70 -8.572 -2.314 4.637 616 HZ1 LYS 70 HZ1 LYS 70 -7.919 -0.480 2.401 617 HZ2 LYS 70 HZ2 LYS 70 -9.175 -0.272 3.424 618 HZ3 LYS 70 HZ3 LYS 70 -7.643 -0.181 3.990 619 H ALA 71 H ALA 71 -4.170 -5.720 2.922 620 HA ALA 71 HA ALA 71 -3.096 -3.606 1.365 621 HB1 ALA 71 HB1 ALA 71 -1.664 -5.888 2.798 622 HB2 ALA 71 HB2 ALA 71 -0.949 -4.350 2.287 623 HB3 ALA 71 HB3 ALA 71 -2.189 -4.367 3.547 624 H LYS 72 H LYS 72 -2.851 -7.205 0.888 625 HA LYS 72 HA LYS 72 -1.083 -6.910 -1.355 626 HB2 LYS 72 HB2 LYS 72 -1.219 -9.272 -1.618 627 HB3 LYS 72 HB3 LYS 72 -1.287 -8.994 0.117 628 HG2 LYS 72 HG2 LYS 72 -3.832 -9.172 -0.061 629 HG3 LYS 72 HG3 LYS 72 -3.610 -9.704 -1.725 630 HD2 LYS 72 HD2 LYS 72 -2.518 -11.101 0.753 631 HD3 LYS 72 HD3 LYS 72 -3.933 -11.588 -0.194 632 HE2 LYS 72 HE2 LYS 72 -2.423 -11.812 -2.215 633 HE3 LYS 72 HE3 LYS 72 -1.038 -11.510 -1.156 634 HZ1 LYS 72 HZ1 LYS 72 -2.942 -13.780 -0.909 635 HZ2 LYS 72 HZ2 LYS 72 -1.407 -13.884 -1.437 636 HZ3 LYS 72 HZ3 LYS 72 -1.701 -13.502 0.123 637 H ASN 73 H ASN 73 -4.567 -6.788 -1.081 638 HA ASN 73 HA ASN 73 -5.054 -7.466 -3.769 639 HB2 ASN 73 HB2 ASN 73 -7.236 -7.013 -3.437 640 HB3 ASN 73 HB3 ASN 73 -6.724 -7.180 -1.778 641 HD21 ASN 73 HD21 ASN 73 -8.558 -4.210 -1.237 642 HD22 ASN 73 HD22 ASN 73 -8.362 -5.915 -0.852 643 H TYR 74 H TYR 74 -4.164 -4.321 -2.360 644 HA TYR 74 HA TYR 74 -4.446 -2.703 -4.645 645 HB2 TYR 74 HB2 TYR 74 -2.405 -2.543 -2.394 646 HB3 TYR 74 HB3 TYR 74 -2.853 -1.220 -3.467 647 HD1 TYR 74 HD1 TYR 74 -5.798 -1.316 -3.562 648 HD2 TYR 74 HD2 TYR 74 -3.116 -2.033 -0.244 649 HE1 TYR 74 HE1 TYR 74 -7.564 -0.592 -1.985 650 HE2 TYR 74 HE2 TYR 74 -4.893 -1.243 1.333 651 HH TYR 74 HH TYR 74 -8.124 -0.189 0.167 652 H ILE 75 H ILE 75 -1.715 -4.730 -3.630 653 HA ILE 75 HA ILE 75 0.116 -3.857 -5.669 654 HB ILE 75 HB ILE 75 0.267 -6.460 -4.121 655 HG12 ILE 75 HG12 ILE 75 0.966 -3.668 -3.105 656 HG13 ILE 75 HG13 ILE 75 -0.270 -4.740 -2.464 657 HG21 ILE 75 HG21 ILE 75 2.422 -4.539 -5.128 658 HG22 ILE 75 HG22 ILE 75 2.709 -6.082 -4.292 659 HG23 ILE 75 HG23 ILE 75 1.992 -6.087 -5.881 660 HD11 ILE 75 HD11 ILE 75 2.709 -5.150 -2.250 661 HD12 ILE 75 HD12 ILE 75 1.529 -4.849 -0.968 662 HD13 ILE 75 HD13 ILE 75 1.491 -6.389 -1.854 663 H LYS 76 H LYS 76 -2.564 -6.073 -5.776 664 HA LYS 76 HA LYS 76 -1.539 -7.501 -8.164 665 HB2 LYS 76 HB2 LYS 76 -2.313 -8.602 -5.974 666 HB3 LYS 76 HB3 LYS 76 -3.955 -8.148 -6.422 667 HG2 LYS 76 HG2 LYS 76 -3.919 -9.607 -8.322 668 HG3 LYS 76 HG3 LYS 76 -2.148 -9.727 -8.298 669 HD2 LYS 76 HD2 LYS 76 -2.271 -10.928 -6.121 670 HD3 LYS 76 HD3 LYS 76 -4.045 -10.870 -6.196 671 HE2 LYS 76 HE2 LYS 76 -4.021 -12.205 -8.266 672 HE3 LYS 76 HE3 LYS 76 -2.253 -12.159 -8.308 673 HZ1 LYS 76 HZ1 LYS 76 -3.848 -13.457 -6.155 674 HZ2 LYS 76 HZ2 LYS 76 -3.065 -14.247 -7.348 675 HZ3 LYS 76 HZ3 LYS 76 -2.218 -13.419 -6.229 676 H ASN 77 H ASN 77 -4.017 -5.306 -7.012 677 HA ASN 77 HA ASN 77 -5.636 -5.250 -9.447 678 HB2 ASN 77 HB2 ASN 77 -5.549 -3.596 -6.872 679 HB3 ASN 77 HB3 ASN 77 -6.643 -3.259 -8.199 680 HD21 ASN 77 HD21 ASN 77 -8.126 -5.668 -5.580 681 HD22 ASN 77 HD22 ASN 77 -6.987 -4.376 -5.248 682 H SER 78 H SER 78 -3.151 -3.178 -7.825 683 HA SER 78 HA SER 78 -2.654 -2.015 -10.517 684 HB2 SER 78 HB2 SER 78 -3.639 -0.345 -8.959 685 HB3 SER 78 HB3 SER 78 -2.216 -0.544 -7.909 686 HG SER 78 HG SER 78 -2.002 1.201 -9.426 687 H ASN 79 H ASN 79 -0.680 -2.254 -11.342 688 HA ASN 79 HA ASN 79 1.670 -2.534 -9.610 689 HB2 ASN 79 HB2 ASN 79 2.355 -4.709 -10.727 690 HB3 ASN 79 HB3 ASN 79 1.106 -4.747 -9.491 691 HD21 ASN 79 HD21 ASN 79 -0.838 -6.750 -11.587 692 HD22 ASN 79 HD22 ASN 79 -0.025 -6.550 -10.039 693 H ARG 80 H ARG 80 0.867 -3.061 -13.106 694 HA ARG 80 HA ARG 80 3.341 -1.622 -13.848 695 HB2 ARG 80 HB2 ARG 80 1.228 -3.129 -15.412 696 HB3 ARG 80 HB3 ARG 80 2.333 -2.034 -16.225 697 HG2 ARG 80 HG2 ARG 80 3.341 -4.137 -16.414 698 HG3 ARG 80 HG3 ARG 80 4.285 -3.237 -15.239 699 HD2 ARG 80 HD2 ARG 80 4.077 -5.513 -14.469 700 HD3 ARG 80 HD3 ARG 80 3.148 -4.487 -13.393 701 HE ARG 80 HE ARG 80 1.167 -5.481 -14.103 702 HH11 ARG 80 HH11 ARG 80 -0.095 -6.984 -15.126 703 HH12 ARG 80 HH12 ARG 80 0.585 -8.009 -16.358 704 HH21 ARG 80 HH21 ARG 80 3.722 -6.633 -16.218 705 HH22 ARG 80 HH22 ARG 80 2.687 -7.818 -16.968 706 H LEU 81 H LEU 81 0.083 -0.657 -13.361 707 HA LEU 81 HA LEU 81 0.158 1.687 -15.069 708 HB2 LEU 81 HB2 LEU 81 -1.935 0.540 -14.452 709 HB3 LEU 81 HB3 LEU 81 -1.649 0.901 -12.749 710 HG LEU 81 HG LEU 81 -1.846 3.346 -13.239 711 HD11 LEU 81 HD11 LEU 81 -2.631 2.399 -16.034 712 HD12 LEU 81 HD12 LEU 81 -2.848 4.047 -15.403 713 HD13 LEU 81 HD13 LEU 81 -1.220 3.401 -15.621 714 HD21 LEU 81 HD21 LEU 81 -3.780 1.999 -12.496 715 HD22 LEU 81 HD22 LEU 81 -4.258 3.351 -13.538 716 HD23 LEU 81 HD23 LEU 81 -4.213 1.703 -14.199 717 H GLY 82 H GLY 82 0.708 1.187 -11.545 718 HA2 GLY 82 HA2 GLY 82 1.284 4.055 -11.145 719 HA3 GLY 82 HA3 GLY 82 1.345 2.785 -9.926 720 H ARG 83 H ARG 83 3.223 4.849 -11.772 721 HA ARG 83 HA ARG 83 5.735 3.282 -11.385 722 HB2 ARG 83 HB2 ARG 83 5.011 4.668 -14.002 723 HB3 ARG 83 HB3 ARG 83 6.469 3.730 -13.673 724 HG2 ARG 83 HG2 ARG 83 3.647 2.585 -13.782 725 HG3 ARG 83 HG3 ARG 83 4.778 2.573 -15.107 726 HD2 ARG 83 HD2 ARG 83 5.642 1.344 -12.477 727 HD3 ARG 83 HD3 ARG 83 4.493 0.475 -13.467 728 HE ARG 83 HE ARG 83 7.320 0.787 -13.964 729 HH11 ARG 83 HH11 ARG 83 8.251 -0.207 -15.720 730 HH12 ARG 83 HH12 ARG 83 7.257 -0.770 -17.029 731 HH21 ARG 83 HH21 ARG 83 4.279 0.270 -15.672 732 HH22 ARG 83 HH22 ARG 83 5.085 -0.504 -17.012 733 H THR 84 H THR 84 7.627 4.624 -12.123 734 HA THR 84 HA THR 84 7.524 7.311 -10.802 735 HB THR 84 HB THR 84 8.420 5.415 -9.489 736 HG1 THR 84 HG1 THR 84 10.256 6.465 -8.809 737 HG21 THR 84 HG21 THR 84 10.705 5.366 -11.506 738 HG22 THR 84 HG22 THR 84 10.574 4.413 -10.014 739 HG23 THR 84 HG23 THR 84 9.455 4.115 -11.354 740 H ASN 85 H ASN 85 8.063 6.031 -13.833 741 HA ASN 85 HA ASN 85 10.584 7.405 -14.348 742 HB2 ASN 85 HB2 ASN 85 8.854 5.610 -16.096 743 HB3 ASN 85 HB3 ASN 85 10.429 6.237 -16.567 744 HD21 ASN 85 HD21 ASN 85 10.436 2.856 -14.544 745 HD22 ASN 85 HD22 ASN 85 9.070 3.469 -15.466 746 H ASN 86 H ASN 86 11.008 8.647 -16.244 747 HA ASN 86 HA ASN 86 8.831 10.407 -17.251 748 HB2 ASN 86 HB2 ASN 86 10.105 11.390 -15.255 749 HB3 ASN 86 HB3 ASN 86 11.548 11.390 -16.266 750 HD21 ASN 86 HD21 ASN 86 10.375 14.783 -16.651 751 HD22 ASN 86 HD22 ASN 86 11.345 13.772 -15.589 752 H LEU 87 H LEU 87 10.010 11.895 -19.055 753 HA LEU 87 HA LEU 87 10.686 11.955 -21.209 754 HB2 LEU 87 HB2 LEU 87 12.955 10.185 -20.252 755 HB3 LEU 87 HB3 LEU 87 12.935 11.093 -21.753 756 HG LEU 87 HG LEU 87 12.811 12.378 -18.991 757 HD11 LEU 87 HD11 LEU 87 15.140 12.074 -20.930 758 HD12 LEU 87 HD12 LEU 87 15.152 13.000 -19.410 759 HD13 LEU 87 HD13 LEU 87 14.956 11.241 -19.369 760 HD21 LEU 87 HD21 LEU 87 11.829 13.820 -20.735 761 HD22 LEU 87 HD22 LEU 87 13.403 14.446 -20.236 762 HD23 LEU 87 HD23 LEU 87 13.253 13.562 -21.771 763 H LYS 88 H LYS 88 8.703 10.059 -20.611 764 HA LYS 88 HA LYS 88 9.009 8.099 -22.850 765 HB2 LYS 88 HB2 LYS 88 7.619 6.545 -21.621 766 HB3 LYS 88 HB3 LYS 88 9.076 6.929 -20.722 767 HG2 LYS 88 HG2 LYS 88 7.940 8.238 -19.120 768 HG3 LYS 88 HG3 LYS 88 6.508 8.452 -20.129 769 HD2 LYS 88 HD2 LYS 88 7.358 5.756 -18.994 770 HD3 LYS 88 HD3 LYS 88 6.237 6.866 -18.184 771 HE2 LYS 88 HE2 LYS 88 4.736 6.826 -20.161 772 HE3 LYS 88 HE3 LYS 88 5.825 5.702 -20.979 773 HZ1 LYS 88 HZ1 LYS 88 4.390 5.132 -18.441 774 HZ2 LYS 88 HZ2 LYS 88 3.991 4.537 -19.906 775 HZ3 LYS 88 HZ3 LYS 88 5.395 4.089 -19.206 776 H THR 89 H THR 89 7.607 10.927 -22.355 777 HA THR 89 HA THR 89 5.630 10.370 -24.373 778 HB THR 89 HB THR 89 4.274 10.068 -22.337 779 HG1 THR 89 HG1 THR 89 2.642 11.402 -23.113 780 HG21 THR 89 HG21 THR 89 4.560 13.065 -21.883 781 HG22 THR 89 HG22 THR 89 3.603 11.903 -20.941 782 HG23 THR 89 HG23 THR 89 5.374 11.837 -20.884 783 H ILE 90 H ILE 90 6.102 11.714 -25.866 784 HA ILE 90 HA ILE 90 6.658 14.572 -25.332 785 HB ILE 90 HB ILE 90 8.411 14.316 -27.202 786 HG12 ILE 90 HG12 ILE 90 7.786 11.902 -27.750 787 HG13 ILE 90 HG13 ILE 90 9.458 12.420 -27.781 788 HG21 ILE 90 HG21 ILE 90 9.077 13.228 -24.455 789 HG22 ILE 90 HG22 ILE 90 10.220 13.903 -25.635 790 HG23 ILE 90 HG23 ILE 90 8.969 14.935 -24.925 791 HD11 ILE 90 HD11 ILE 90 8.229 10.784 -25.522 792 HD12 ILE 90 HD12 ILE 90 9.243 10.182 -26.837 793 HD13 ILE 90 HD13 ILE 90 9.923 11.300 -25.650 794 H GLY 91 H GLY 91 4.474 12.700 -26.750 795 HA2 GLY 91 HA2 GLY 91 3.041 12.878 -28.543 796 HA3 GLY 91 HA3 GLY 91 3.701 14.483 -28.878 797 H ILE 92 H ILE 92 6.192 12.233 -28.858 798 HA ILE 92 HA ILE 92 7.607 11.428 -30.404 799 HB ILE 92 HB ILE 92 5.114 10.321 -31.742 800 HG12 ILE 92 HG12 ILE 92 5.894 8.266 -30.203 801 HG13 ILE 92 HG13 ILE 92 6.568 9.525 -29.192 802 HG21 ILE 92 HG21 ILE 92 8.002 9.327 -31.655 803 HG22 ILE 92 HG22 ILE 92 6.623 8.368 -32.242 804 HG23 ILE 92 HG23 ILE 92 7.073 9.807 -33.098 805 HD11 ILE 92 HD11 ILE 92 3.641 9.346 -30.064 806 HD12 ILE 92 HD12 ILE 92 4.287 8.676 -28.556 807 HD13 ILE 92 HD13 ILE 92 4.300 10.418 -28.804 808 H LEU 93 H LEU 93 6.909 14.134 -30.777 809 HA LEU 93 HA LEU 93 6.993 15.884 -32.158 810 HB2 LEU 93 HB2 LEU 93 9.290 14.675 -32.386 811 HB3 LEU 93 HB3 LEU 93 8.746 14.249 -34.002 812 HG LEU 93 HG LEU 93 8.527 16.741 -34.498 813 HD11 LEU 93 HD11 LEU 93 9.933 16.995 -31.801 814 HD12 LEU 93 HD12 LEU 93 9.745 18.296 -32.997 815 HD13 LEU 93 HD13 LEU 93 8.320 17.626 -32.203 816 HD21 LEU 93 HD21 LEU 93 10.511 15.434 -35.153 817 HD22 LEU 93 HD22 LEU 93 10.948 17.090 -34.708 818 HD23 LEU 93 HD23 LEU 93 11.256 15.756 -33.572 819 H GLN 94 H GLN 94 4.811 13.994 -32.682 820 HA GLN 94 HA GLN 94 4.145 14.555 -35.539 821 HB2 GLN 94 HB2 GLN 94 3.387 12.313 -33.649 822 HB3 GLN 94 HB3 GLN 94 2.440 12.665 -35.104 823 HG2 GLN 94 HG2 GLN 94 4.412 12.371 -36.526 824 HG3 GLN 94 HG3 GLN 94 5.417 12.051 -35.115 825 HE21 GLN 94 HE21 GLN 94 2.817 9.130 -36.430 826 HE22 GLN 94 HE22 GLN 94 2.577 10.790 -36.956 827 H GLU 95 H GLU 95 3.896 16.763 -34.235 828 HA GLU 95 HA GLU 95 1.161 17.199 -33.227 829 HB2 GLU 95 HB2 GLU 95 3.122 18.391 -32.298 830 HB3 GLU 95 HB3 GLU 95 3.396 19.164 -33.863 831 HG2 GLU 95 HG2 GLU 95 1.236 20.328 -33.700 832 HG3 GLU 95 HG3 GLU 95 0.837 19.442 -32.225 833 H GLU 96 H GLU 96 -0.466 18.421 -34.294 834 HA GLU 96 HA GLU 96 -0.079 19.384 -37.009 835 HB2 GLU 96 HB2 GLU 96 -1.941 18.172 -37.979 836 HB3 GLU 96 HB3 GLU 96 -0.671 17.063 -37.473 837 HG2 GLU 96 HG2 GLU 96 -2.001 16.519 -35.413 838 HG3 GLU 96 HG3 GLU 96 -3.288 17.581 -35.992 839 H VAL 97 H VAL 97 -1.287 20.994 -37.533 840 HA VAL 97 HA VAL 97 -3.546 21.872 -35.844 841 HB VAL 97 HB VAL 97 -1.154 23.608 -36.588 842 HG11 VAL 97 HG11 VAL 97 -3.760 24.414 -35.233 843 HG12 VAL 97 HG12 VAL 97 -2.312 25.433 -35.357 844 HG13 VAL 97 HG13 VAL 97 -3.178 24.966 -36.818 845 HG21 VAL 97 HG21 VAL 97 -0.722 22.261 -34.582 846 HG22 VAL 97 HG22 VAL 97 -0.941 23.953 -34.139 847 HG23 VAL 97 HG23 VAL 97 -2.259 22.793 -33.866 848 H SER 98 H SER 98 -5.264 22.692 -37.011 849 HA SER 98 HA SER 98 -4.784 23.880 -39.655 850 HB2 SER 98 HB2 SER 98 -4.913 21.404 -40.047 851 HB3 SER 98 HB3 SER 98 -6.546 21.413 -39.356 852 HG SER 98 HG SER 98 -6.517 21.561 -41.674 853 H SER 99 H SER 99 -7.284 22.826 -37.264 854 HA SER 99 HA SER 99 -8.687 25.392 -37.696 855 HB2 SER 99 HB2 SER 99 -10.874 24.248 -38.086 856 HB3 SER 99 HB3 SER 99 -9.724 24.195 -39.424 857 HG SER 99 HG SER 99 -10.735 22.169 -39.081 858 H MET 100 H MET 100 -8.959 26.190 -35.839 859 HA MET 100 HA MET 100 -9.560 26.581 -33.680 860 HB2 MET 100 HB2 MET 100 -11.602 24.391 -34.175 861 HB3 MET 100 HB3 MET 100 -11.656 25.608 -32.892 862 HG2 MET 100 HG2 MET 100 -11.748 27.403 -34.599 863 HG3 MET 100 HG3 MET 100 -11.756 26.181 -35.877 864 HE1 MET 100 HE1 MET 100 -13.894 27.246 -36.960 865 HE2 MET 100 HE2 MET 100 -15.384 27.608 -36.064 866 HE3 MET 100 HE3 MET 100 -13.892 28.502 -35.699 867 H GLU 101 H GLU 101 -7.324 25.110 -33.847 868 HA GLU 101 HA GLU 101 -7.506 22.619 -32.429 869 HB2 GLU 101 HB2 GLU 101 -5.839 23.718 -34.391 870 HB3 GLU 101 HB3 GLU 101 -4.793 23.657 -32.986 871 HG2 GLU 101 HG2 GLU 101 -4.464 21.567 -33.953 872 HG3 GLU 101 HG3 GLU 101 -5.631 21.198 -32.701 873 H ALA 102 H ALA 102 -7.550 25.487 -30.962 874 HA ALA 102 HA ALA 102 -5.948 24.619 -28.599 875 HB1 ALA 102 HB1 ALA 102 -5.956 27.397 -29.849 876 HB2 ALA 102 HB2 ALA 102 -5.095 26.915 -28.370 877 HB3 ALA 102 HB3 ALA 102 -4.625 26.220 -29.932 878 H LYS 103 H LYS 103 -6.536 25.486 -26.606 879 HA LYS 103 HA LYS 103 -9.313 26.576 -26.312 880 HB2 LYS 103 HB2 LYS 103 -7.992 24.277 -24.811 881 HB3 LYS 103 HB3 LYS 103 -9.504 25.018 -24.310 882 HG2 LYS 103 HG2 LYS 103 -9.099 23.581 -26.961 883 HG3 LYS 103 HG3 LYS 103 -9.828 22.910 -25.502 884 HD2 LYS 103 HD2 LYS 103 -11.573 24.772 -25.605 885 HD3 LYS 103 HD3 LYS 103 -10.889 25.233 -27.167 886 HE2 LYS 103 HE2 LYS 103 -12.771 23.891 -27.654 887 HE3 LYS 103 HE3 LYS 103 -11.350 22.907 -28.011 888 HZ1 LYS 103 HZ1 LYS 103 -12.980 22.723 -25.525 889 HZ2 LYS 103 HZ2 LYS 103 -13.045 21.668 -26.765 890 HZ3 LYS 103 HZ3 LYS 103 -11.689 21.778 -25.867 891 H SER 104 H SER 104 -6.676 27.958 -26.169 892 HA SER 104 HA SER 104 -6.905 29.068 -23.395 893 HB2 SER 104 HB2 SER 104 -4.900 27.629 -23.660 894 HB3 SER 104 HB3 SER 104 -4.329 28.703 -24.953 895 HG SER 104 HG SER 104 -3.466 29.239 -22.868 896 H MET 105 H MET 105 -6.985 31.188 -23.176 897 HA MET 105 HA MET 105 -6.227 33.099 -25.280 898 HB2 MET 105 HB2 MET 105 -9.080 32.859 -24.213 899 HB3 MET 105 HB3 MET 105 -8.446 34.300 -25.006 900 HG2 MET 105 HG2 MET 105 -7.882 32.895 -27.016 901 HG3 MET 105 HG3 MET 105 -8.715 31.546 -26.241 902 HE1 MET 105 HE1 MET 105 -8.984 34.879 -28.181 903 HE2 MET 105 HE2 MET 105 -10.692 35.338 -28.020 904 HE3 MET 105 HE3 MET 105 -9.606 35.470 -26.623 905 H THR 106 H THR 106 -6.535 35.381 -24.444 906 HA THR 106 HA THR 106 -6.299 35.649 -21.497 907 HB THR 106 HB THR 106 -4.024 35.432 -22.436 908 HG1 THR 106 HG1 THR 106 -3.241 37.207 -21.337 909 HG21 THR 106 HG21 THR 106 -4.583 38.103 -23.801 910 HG22 THR 106 HG22 THR 106 -3.024 37.257 -23.717 911 HG23 THR 106 HG23 THR 106 -4.361 36.548 -24.634 912 H TRP 107 H TRP 107 -6.341 37.855 -20.786 913 HA TRP 107 HA TRP 107 -8.509 39.366 -22.169 914 HB2 TRP 107 HB2 TRP 107 -7.910 38.923 -19.238 915 HB3 TRP 107 HB3 TRP 107 -8.888 40.270 -19.787 916 HD1 TRP 107 HD1 TRP 107 -11.337 39.897 -20.240 917 HE1 TRP 107 HE1 TRP 107 -12.958 37.905 -20.215 918 HE3 TRP 107 HE3 TRP 107 -7.939 36.081 -19.759 919 HZ2 TRP 107 HZ2 TRP 107 -12.801 35.034 -20.065 920 HZ3 TRP 107 HZ3 TRP 107 -8.710 33.722 -19.714 921 HH2 TRP 107 HH2 TRP 107 -11.132 33.185 -19.861 Start of MODEL 13 1 H1 GLY -5 H1 GLY -5 -24.170 -61.164 7.658 2 H2 GLY -5 H2 GLY -5 -24.966 -62.226 8.618 3 H3 GLY -5 H3 GLY -5 -25.793 -61.334 7.521 4 HA2 GLY -5 HA2 GLY -5 -25.577 -63.583 6.720 5 HA3 GLY -5 HA3 GLY -5 -24.691 -62.445 5.690 6 H SER -4 H SER -4 -22.923 -63.532 4.997 7 HA SER -4 HA SER -4 -20.984 -64.577 6.987 8 HB2 SER -4 HB2 SER -4 -20.594 -66.591 5.637 9 HB3 SER -4 HB3 SER -4 -22.239 -66.537 6.287 10 HG SER -4 HG SER -4 -22.201 -67.153 4.072 11 H HIS -3 H HIS -3 -18.827 -64.842 6.156 12 HA HIS -3 HA HIS -3 -18.084 -63.538 3.628 13 HB2 HIS -3 HB2 HIS -3 -18.384 -61.759 5.511 14 HB3 HIS -3 HB3 HIS -3 -16.933 -62.453 6.222 15 HD2 HIS -3 HD2 HIS -3 -18.168 -60.194 3.419 16 HE1 HIS -3 HE1 HIS -3 -13.930 -60.368 2.951 17 HE2 HIS -3 HE2 HIS -3 -16.062 -59.199 2.182 18 H MET -2 H MET -2 -15.767 -63.819 3.146 19 HA MET -2 HA MET -2 -14.262 -65.785 4.746 20 HB2 MET -2 HB2 MET -2 -15.706 -67.149 3.240 21 HB3 MET -2 HB3 MET -2 -15.013 -66.320 1.840 22 HG2 MET -2 HG2 MET -2 -12.779 -67.219 2.407 23 HG3 MET -2 HG3 MET -2 -13.435 -67.941 3.878 24 HE1 MET -2 HE1 MET -2 -13.134 -68.114 -0.009 25 HE2 MET -2 HE2 MET -2 -14.228 -69.445 -0.442 26 HE3 MET -2 HE3 MET -2 -14.897 -67.900 0.117 27 H ALA -1 H ALA -1 -12.154 -65.435 4.688 28 HA ALA -1 HA ALA -1 -10.201 -64.336 4.443 29 HB1 ALA -1 HB1 ALA -1 -10.795 -64.567 1.468 30 HB2 ALA -1 HB2 ALA -1 -9.198 -64.455 2.241 31 HB3 ALA -1 HB3 ALA -1 -10.200 -65.887 2.497 32 H SER 0 H SER 0 -9.329 -62.453 2.390 33 HA SER 0 HA SER 0 -11.167 -60.189 2.441 34 HB2 SER 0 HB2 SER 0 -9.842 -60.128 4.666 35 HB3 SER 0 HB3 SER 0 -8.429 -59.725 3.660 36 HG SER 0 HG SER 0 -9.570 -57.855 4.409 37 H MET 1 H MET 1 -10.585 -58.547 0.973 38 HA MET 1 HA MET 1 -8.072 -58.649 -0.500 39 HB2 MET 1 HB2 MET 1 -9.479 -60.335 -1.692 40 HB3 MET 1 HB3 MET 1 -10.683 -59.084 -2.020 41 HG2 MET 1 HG2 MET 1 -9.010 -57.796 -3.296 42 HG3 MET 1 HG3 MET 1 -7.771 -58.994 -2.922 43 HE1 MET 1 HE1 MET 1 -9.151 -61.838 -3.388 44 HE2 MET 1 HE2 MET 1 -8.743 -62.063 -5.098 45 HE3 MET 1 HE3 MET 1 -7.556 -61.336 -3.996 46 H ASP 2 H ASP 2 -7.460 -56.623 -0.833 47 HA ASP 2 HA ASP 2 -9.486 -54.444 -1.236 48 HB2 ASP 2 HB2 ASP 2 -6.959 -54.393 0.429 49 HB3 ASP 2 HB3 ASP 2 -7.833 -52.952 -0.097 50 HA PRO 3 HA PRO 3 -6.680 -54.197 -4.849 51 HB2 PRO 3 HB2 PRO 3 -8.495 -53.773 -6.815 52 HB3 PRO 3 HB3 PRO 3 -8.318 -55.372 -6.032 53 HG2 PRO 3 HG2 PRO 3 -10.347 -53.206 -5.395 54 HG3 PRO 3 HG3 PRO 3 -10.646 -54.946 -5.690 55 HD2 PRO 3 HD2 PRO 3 -10.381 -53.863 -3.172 56 HD3 PRO 3 HD3 PRO 3 -9.883 -55.537 -3.559 57 H LEU 4 H LEU 4 -8.025 -51.921 -3.009 58 HA LEU 4 HA LEU 4 -7.428 -49.660 -4.846 59 HB2 LEU 4 HB2 LEU 4 -9.411 -49.806 -2.543 60 HB3 LEU 4 HB3 LEU 4 -9.097 -48.374 -3.517 61 HG LEU 4 HG LEU 4 -10.286 -50.966 -4.570 62 HD11 LEU 4 HD11 LEU 4 -11.546 -48.245 -4.049 63 HD12 LEU 4 HD12 LEU 4 -12.351 -49.660 -4.768 64 HD13 LEU 4 HD13 LEU 4 -11.800 -49.718 -3.086 65 HD21 LEU 4 HD21 LEU 4 -9.041 -49.812 -6.352 66 HD22 LEU 4 HD22 LEU 4 -10.777 -49.635 -6.609 67 HD23 LEU 4 HD23 LEU 4 -9.843 -48.277 -5.942 68 H ASP 5 H ASP 5 -5.450 -51.005 -3.108 69 HA ASP 5 HA ASP 5 -4.612 -48.639 -1.484 70 HB2 ASP 5 HB2 ASP 5 -3.762 -51.544 -1.537 71 HB3 ASP 5 HB3 ASP 5 -2.721 -50.323 -0.816 72 H LYS 6 H LYS 6 -4.334 -49.545 -4.540 73 HA LYS 6 HA LYS 6 -1.486 -48.798 -4.947 74 HB2 LYS 6 HB2 LYS 6 -1.647 -50.004 -7.015 75 HB3 LYS 6 HB3 LYS 6 -2.378 -50.970 -5.733 76 HG2 LYS 6 HG2 LYS 6 -4.631 -49.770 -6.582 77 HG3 LYS 6 HG3 LYS 6 -3.684 -49.553 -8.058 78 HD2 LYS 6 HD2 LYS 6 -4.373 -52.157 -6.663 79 HD3 LYS 6 HD3 LYS 6 -5.124 -51.503 -8.126 80 HE2 LYS 6 HE2 LYS 6 -2.952 -51.668 -9.328 81 HE3 LYS 6 HE3 LYS 6 -2.174 -52.278 -7.861 82 HZ1 LYS 6 HZ1 LYS 6 -4.363 -53.662 -9.318 83 HZ2 LYS 6 HZ2 LYS 6 -2.790 -54.091 -9.352 84 HZ3 LYS 6 HZ3 LYS 6 -3.636 -54.222 -7.964 85 H ILE 7 H ILE 7 -4.666 -47.666 -5.892 86 HA ILE 7 HA ILE 7 -3.550 -45.194 -7.083 87 HB ILE 7 HB ILE 7 -5.048 -45.384 -9.074 88 HG12 ILE 7 HG12 ILE 7 -5.238 -48.019 -9.741 89 HG13 ILE 7 HG13 ILE 7 -5.599 -48.152 -8.033 90 HG21 ILE 7 HG21 ILE 7 -2.847 -47.469 -8.978 91 HG22 ILE 7 HG22 ILE 7 -3.465 -46.604 -10.395 92 HG23 ILE 7 HG23 ILE 7 -2.601 -45.716 -9.136 93 HD11 ILE 7 HD11 ILE 7 -7.081 -46.360 -9.998 94 HD12 ILE 7 HD12 ILE 7 -7.597 -47.970 -9.459 95 HD13 ILE 7 HD13 ILE 7 -7.528 -46.653 -8.298 96 H ILE 8 H ILE 8 -6.506 -46.913 -6.070 97 HA ILE 8 HA ILE 8 -8.606 -46.148 -5.705 98 HB ILE 8 HB ILE 8 -7.312 -46.221 -3.626 99 HG12 ILE 8 HG12 ILE 8 -9.732 -44.397 -3.458 100 HG13 ILE 8 HG13 ILE 8 -9.805 -46.126 -3.784 101 HG21 ILE 8 HG21 ILE 8 -7.425 -43.193 -3.568 102 HG22 ILE 8 HG22 ILE 8 -6.788 -44.276 -2.319 103 HG23 ILE 8 HG23 ILE 8 -5.965 -44.158 -3.869 104 HD11 ILE 8 HD11 ILE 8 -8.749 -44.819 -1.246 105 HD12 ILE 8 HD12 ILE 8 -10.260 -45.719 -1.450 106 HD13 ILE 8 HD13 ILE 8 -8.710 -46.567 -1.585 107 H ASN 9 H ASN 9 -7.838 -44.777 -7.986 108 HA ASN 9 HA ASN 9 -8.336 -43.048 -9.348 109 HB2 ASN 9 HB2 ASN 9 -10.589 -44.032 -8.640 110 HB3 ASN 9 HB3 ASN 9 -10.781 -42.632 -7.595 111 HD21 ASN 9 HD21 ASN 9 -11.645 -40.468 -10.283 112 HD22 ASN 9 HD22 ASN 9 -10.932 -40.504 -8.667 113 H ASP 10 H ASP 10 -6.521 -42.350 -7.177 114 HA ASP 10 HA ASP 10 -7.399 -39.836 -6.190 115 HB2 ASP 10 HB2 ASP 10 -5.631 -39.917 -4.693 116 HB3 ASP 10 HB3 ASP 10 -6.064 -41.598 -4.944 117 H ILE 11 H ILE 11 -6.524 -40.103 -9.088 118 HA ILE 11 HA ILE 11 -5.333 -37.414 -9.320 119 HB ILE 11 HB ILE 11 -3.515 -39.170 -9.218 120 HG12 ILE 11 HG12 ILE 11 -2.079 -38.379 -10.949 121 HG13 ILE 11 HG13 ILE 11 -3.407 -37.692 -11.866 122 HG21 ILE 11 HG21 ILE 11 -4.523 -40.019 -11.962 123 HG22 ILE 11 HG22 ILE 11 -3.074 -40.610 -11.130 124 HG23 ILE 11 HG23 ILE 11 -4.671 -40.962 -10.461 125 HD11 ILE 11 HD11 ILE 11 -2.577 -36.795 -9.068 126 HD12 ILE 11 HD12 ILE 11 -2.094 -36.005 -10.582 127 HD13 ILE 11 HD13 ILE 11 -3.798 -36.015 -10.106 128 H LYS 12 H LYS 12 -7.934 -38.684 -9.906 129 HA LYS 12 HA LYS 12 -8.183 -37.654 -12.701 130 HB2 LYS 12 HB2 LYS 12 -8.065 -40.117 -12.612 131 HB3 LYS 12 HB3 LYS 12 -9.506 -40.179 -11.608 132 HG2 LYS 12 HG2 LYS 12 -9.651 -38.726 -14.256 133 HG3 LYS 12 HG3 LYS 12 -9.517 -40.481 -14.283 134 HD2 LYS 12 HD2 LYS 12 -11.544 -40.780 -13.016 135 HD3 LYS 12 HD3 LYS 12 -11.707 -39.033 -12.730 136 HE2 LYS 12 HE2 LYS 12 -11.922 -38.605 -15.118 137 HE3 LYS 12 HE3 LYS 12 -11.641 -40.313 -15.490 138 HZ1 LYS 12 HZ1 LYS 12 -13.983 -39.257 -13.996 139 HZ2 LYS 12 HZ2 LYS 12 -14.005 -39.799 -15.533 140 HZ3 LYS 12 HZ3 LYS 12 -13.714 -40.841 -14.314 141 H LYS 13 H LYS 13 -9.808 -37.917 -9.600 142 HA LYS 13 HA LYS 13 -11.624 -35.733 -10.415 143 HB2 LYS 13 HB2 LYS 13 -12.852 -37.900 -10.489 144 HB3 LYS 13 HB3 LYS 13 -12.470 -38.158 -8.783 145 HG2 LYS 13 HG2 LYS 13 -13.676 -35.963 -8.285 146 HG3 LYS 13 HG3 LYS 13 -14.180 -35.922 -9.973 147 HD2 LYS 13 HD2 LYS 13 -14.801 -38.125 -7.953 148 HD3 LYS 13 HD3 LYS 13 -15.910 -36.839 -8.398 149 HE2 LYS 13 HE2 LYS 13 -14.825 -38.916 -10.358 150 HE3 LYS 13 HE3 LYS 13 -16.340 -39.079 -9.476 151 HZ1 LYS 13 HZ1 LYS 13 -15.753 -36.891 -11.398 152 HZ2 LYS 13 HZ2 LYS 13 -16.744 -38.161 -11.667 153 HZ3 LYS 13 HZ3 LYS 13 -17.139 -37.050 -10.547 154 H GLU 14 H GLU 14 -10.656 -34.108 -9.363 155 HA GLU 14 HA GLU 14 -10.775 -34.103 -6.412 156 HB2 GLU 14 HB2 GLU 14 -8.481 -34.938 -7.213 157 HB3 GLU 14 HB3 GLU 14 -8.187 -33.296 -7.792 158 HG2 GLU 14 HG2 GLU 14 -8.405 -32.432 -5.498 159 HG3 GLU 14 HG3 GLU 14 -8.991 -33.991 -4.931 160 H ALA 15 H ALA 15 -12.286 -32.737 -8.569 161 HA ALA 15 HA ALA 15 -11.429 -29.912 -8.437 162 HB1 ALA 15 HB1 ALA 15 -13.719 -31.300 -9.841 163 HB2 ALA 15 HB2 ALA 15 -13.275 -29.582 -9.996 164 HB3 ALA 15 HB3 ALA 15 -12.140 -30.848 -10.557 165 H ASN 16 H ASN 16 -11.763 -29.309 -6.294 166 HA ASN 16 HA ASN 16 -14.544 -28.616 -5.661 167 HB2 ASN 16 HB2 ASN 16 -14.216 -30.932 -4.793 168 HB3 ASN 16 HB3 ASN 16 -12.870 -30.361 -3.805 169 HD21 ASN 16 HD21 ASN 16 -15.476 -30.258 -1.336 170 HD22 ASN 16 HD22 ASN 16 -14.190 -31.262 -1.992 171 H ASP 17 H ASP 17 -14.620 -26.656 -4.796 172 HA ASP 17 HA ASP 17 -12.357 -25.565 -3.195 173 HB2 ASP 17 HB2 ASP 17 -12.225 -24.875 -5.649 174 HB3 ASP 17 HB3 ASP 17 -13.713 -23.967 -5.395 175 H SER 18 H SER 18 -12.998 -24.559 -1.402 176 HA SER 18 HA SER 18 -15.846 -23.716 -1.056 177 HB2 SER 18 HB2 SER 18 -14.067 -25.009 1.038 178 HB3 SER 18 HB3 SER 18 -15.736 -24.453 1.268 179 HG SER 18 HG SER 18 -15.641 -26.701 0.863 180 H GLY 19 H GLY 19 -13.535 -22.094 -1.903 181 HA2 GLY 19 HA2 GLY 19 -13.232 -19.822 -1.665 182 HA3 GLY 19 HA3 GLY 19 -14.033 -19.830 -0.081 183 H VAL 20 H VAL 20 -11.194 -21.291 -1.625 184 HA VAL 20 HA VAL 20 -9.455 -20.565 0.687 185 HB VAL 20 HB VAL 20 -10.052 -22.933 0.526 186 HG11 VAL 20 HG11 VAL 20 -8.598 -22.934 -2.142 187 HG12 VAL 20 HG12 VAL 20 -9.199 -24.364 -1.272 188 HG13 VAL 20 HG13 VAL 20 -10.341 -23.158 -1.879 189 HG21 VAL 20 HG21 VAL 20 -7.843 -22.287 1.494 190 HG22 VAL 20 HG22 VAL 20 -7.949 -23.940 0.865 191 HG23 VAL 20 HG23 VAL 20 -7.094 -22.706 -0.067 192 H THR 21 H THR 21 -10.047 -19.367 -2.119 193 HA THR 21 HA THR 21 -7.397 -19.265 -3.329 194 HB THR 21 HB THR 21 -9.309 -17.381 -4.479 195 HG1 THR 21 HG1 THR 21 -10.714 -18.954 -5.278 196 HG21 THR 21 HG21 THR 21 -8.012 -19.917 -5.572 197 HG22 THR 21 HG22 THR 21 -8.743 -18.603 -6.522 198 HG23 THR 21 HG23 THR 21 -7.256 -18.312 -5.603 199 H LEU 22 H LEU 22 -6.589 -17.210 -4.207 200 HA LEU 22 HA LEU 22 -5.901 -15.434 -1.992 201 HB2 LEU 22 HB2 LEU 22 -4.896 -15.689 -4.858 202 HB3 LEU 22 HB3 LEU 22 -4.095 -14.757 -3.600 203 HG LEU 22 HG LEU 22 -4.553 -17.734 -3.197 204 HD11 LEU 22 HD11 LEU 22 -2.300 -16.481 -4.790 205 HD12 LEU 22 HD12 LEU 22 -2.370 -18.170 -4.227 206 HD13 LEU 22 HD13 LEU 22 -3.574 -17.583 -5.385 207 HD21 LEU 22 HD21 LEU 22 -3.733 -16.369 -1.296 208 HD22 LEU 22 HD22 LEU 22 -2.526 -17.546 -1.842 209 HD23 LEU 22 HD23 LEU 22 -2.355 -15.832 -2.285 210 H ALA 23 H ALA 23 -8.515 -14.945 -2.690 211 HA ALA 23 HA ALA 23 -8.567 -12.388 -4.204 212 HB1 ALA 23 HB1 ALA 23 -9.967 -14.978 -5.027 213 HB2 ALA 23 HB2 ALA 23 -10.169 -13.408 -5.827 214 HB3 ALA 23 HB3 ALA 23 -8.594 -14.229 -5.863 215 HA PRO 24 HA PRO 24 -11.938 -11.508 -1.483 216 HB2 PRO 24 HB2 PRO 24 -13.383 -9.609 -2.814 217 HB3 PRO 24 HB3 PRO 24 -11.724 -9.325 -2.207 218 HG2 PRO 24 HG2 PRO 24 -12.564 -10.120 -5.017 219 HG3 PRO 24 HG3 PRO 24 -11.463 -8.791 -4.526 220 HD2 PRO 24 HD2 PRO 24 -10.514 -11.211 -5.313 221 HD3 PRO 24 HD3 PRO 24 -9.729 -10.298 -3.991 222 H LEU 25 H LEU 25 -12.804 -12.627 -4.724 223 HA LEU 25 HA LEU 25 -14.964 -14.261 -3.639 224 HB2 LEU 25 HB2 LEU 25 -15.817 -11.835 -4.493 225 HB3 LEU 25 HB3 LEU 25 -15.676 -12.601 -6.062 226 HG LEU 25 HG LEU 25 -17.197 -14.478 -5.099 227 HD11 LEU 25 HD11 LEU 25 -17.704 -12.337 -2.994 228 HD12 LEU 25 HD12 LEU 25 -18.642 -13.829 -3.227 229 HD13 LEU 25 HD13 LEU 25 -16.958 -13.921 -2.699 230 HD21 LEU 25 HD21 LEU 25 -17.986 -12.799 -6.697 231 HD22 LEU 25 HD22 LEU 25 -19.231 -13.163 -5.495 232 HD23 LEU 25 HD23 LEU 25 -18.295 -11.654 -5.369 233 H SER 26 H SER 26 -15.979 -15.093 -6.122 234 HA SER 26 HA SER 26 -13.955 -16.898 -7.119 235 HB2 SER 26 HB2 SER 26 -15.911 -17.744 -8.466 236 HB3 SER 26 HB3 SER 26 -16.160 -17.704 -6.711 237 HG SER 26 HG SER 26 -17.950 -16.848 -7.911 238 H VAL 27 H VAL 27 -12.978 -14.459 -7.651 239 HA VAL 27 HA VAL 27 -13.022 -14.146 -10.589 240 HB VAL 27 HB VAL 27 -14.913 -12.842 -9.651 241 HG11 VAL 27 HG11 VAL 27 -12.843 -11.057 -8.311 242 HG12 VAL 27 HG12 VAL 27 -14.601 -10.828 -8.356 243 HG13 VAL 27 HG13 VAL 27 -13.904 -12.188 -7.464 244 HG21 VAL 27 HG21 VAL 27 -13.877 -12.116 -11.751 245 HG22 VAL 27 HG22 VAL 27 -14.464 -10.736 -10.816 246 HG23 VAL 27 HG23 VAL 27 -12.727 -11.092 -10.854 247 HA PRO 28 HA PRO 28 -8.805 -13.003 -9.454 248 HB2 PRO 28 HB2 PRO 28 -7.731 -12.319 -11.830 249 HB3 PRO 28 HB3 PRO 28 -8.179 -14.001 -11.420 250 HG2 PRO 28 HG2 PRO 28 -9.815 -11.995 -13.016 251 HG3 PRO 28 HG3 PRO 28 -9.433 -13.693 -13.444 252 HD2 PRO 28 HD2 PRO 28 -11.783 -12.970 -12.246 253 HD3 PRO 28 HD3 PRO 28 -10.989 -14.531 -11.892 254 H LYS 29 H LYS 29 -10.018 -11.349 -8.272 255 HA LYS 29 HA LYS 29 -10.426 -9.204 -7.568 256 HB2 LYS 29 HB2 LYS 29 -8.379 -8.079 -7.006 257 HB3 LYS 29 HB3 LYS 29 -8.419 -9.773 -6.595 258 HG2 LYS 29 HG2 LYS 29 -6.943 -8.851 -9.090 259 HG3 LYS 29 HG3 LYS 29 -6.234 -8.646 -7.504 260 HD2 LYS 29 HD2 LYS 29 -7.047 -11.318 -8.705 261 HD3 LYS 29 HD3 LYS 29 -5.424 -10.653 -8.617 262 HE2 LYS 29 HE2 LYS 29 -5.637 -10.589 -6.099 263 HE3 LYS 29 HE3 LYS 29 -7.213 -11.360 -6.244 264 HZ1 LYS 29 HZ1 LYS 29 -4.637 -12.569 -7.108 265 HZ2 LYS 29 HZ2 LYS 29 -5.547 -13.001 -5.808 266 HZ3 LYS 29 HZ3 LYS 29 -6.103 -13.264 -7.325 267 HA PRO 30 HA PRO 30 -11.020 -6.608 -11.290 268 HB2 PRO 30 HB2 PRO 30 -13.323 -5.372 -10.436 269 HB3 PRO 30 HB3 PRO 30 -13.303 -6.974 -11.237 270 HG2 PRO 30 HG2 PRO 30 -13.350 -6.387 -8.256 271 HG3 PRO 30 HG3 PRO 30 -14.418 -7.495 -9.180 272 HD2 PRO 30 HD2 PRO 30 -12.273 -8.423 -7.856 273 HD3 PRO 30 HD3 PRO 30 -12.672 -9.072 -9.476 274 H LYS 31 H LYS 31 -10.868 -4.276 -11.473 275 HA LYS 31 HA LYS 31 -8.925 -3.274 -9.671 276 HB2 LYS 31 HB2 LYS 31 -10.478 -1.847 -11.849 277 HB3 LYS 31 HB3 LYS 31 -9.191 -1.090 -10.895 278 HG2 LYS 31 HG2 LYS 31 -7.622 -2.914 -11.591 279 HG3 LYS 31 HG3 LYS 31 -8.886 -3.561 -12.654 280 HD2 LYS 31 HD2 LYS 31 -8.910 -1.414 -13.921 281 HD3 LYS 31 HD3 LYS 31 -7.710 -0.749 -12.808 282 HE2 LYS 31 HE2 LYS 31 -6.511 -1.388 -14.749 283 HE3 LYS 31 HE3 LYS 31 -6.104 -2.554 -13.486 284 HZ1 LYS 31 HZ1 LYS 31 -8.087 -3.016 -15.662 285 HZ2 LYS 31 HZ2 LYS 31 -6.578 -3.631 -15.629 286 HZ3 LYS 31 HZ3 LYS 31 -7.672 -4.114 -14.521 287 H LEU 32 H LEU 32 -9.026 -2.411 -7.759 288 HA LEU 32 HA LEU 32 -11.320 -0.794 -6.848 289 HB2 LEU 32 HB2 LEU 32 -11.800 -2.191 -4.972 290 HB3 LEU 32 HB3 LEU 32 -11.838 -3.160 -6.436 291 HG LEU 32 HG LEU 32 -9.334 -3.759 -5.730 292 HD11 LEU 32 HD11 LEU 32 -10.668 -3.283 -3.025 293 HD12 LEU 32 HD12 LEU 32 -9.059 -3.974 -3.330 294 HD13 LEU 32 HD13 LEU 32 -9.364 -2.275 -3.668 295 HD21 LEU 32 HD21 LEU 32 -11.153 -5.398 -5.987 296 HD22 LEU 32 HD22 LEU 32 -10.159 -5.753 -4.574 297 HD23 LEU 32 HD23 LEU 32 -11.759 -4.994 -4.370 298 H GLU 33 H GLU 33 -10.853 0.716 -5.358 299 HA GLU 33 HA GLU 33 -8.238 0.858 -3.988 300 HB2 GLU 33 HB2 GLU 33 -9.252 2.879 -6.042 301 HB3 GLU 33 HB3 GLU 33 -8.021 3.287 -4.859 302 HG2 GLU 33 HG2 GLU 33 -7.710 1.120 -6.973 303 HG3 GLU 33 HG3 GLU 33 -7.143 2.772 -7.104 304 H GLU 34 H GLU 34 -9.995 0.288 -2.436 305 HA GLU 34 HA GLU 34 -11.603 2.608 -1.516 306 HB2 GLU 34 HB2 GLU 34 -12.692 0.428 -1.954 307 HB3 GLU 34 HB3 GLU 34 -11.752 -0.297 -0.643 308 HG2 GLU 34 HG2 GLU 34 -12.766 1.299 0.963 309 HG3 GLU 34 HG3 GLU 34 -13.626 2.095 -0.355 310 H LEU 35 H LEU 35 -10.159 3.936 -0.545 311 HA LEU 35 HA LEU 35 -8.988 3.090 2.073 312 HB2 LEU 35 HB2 LEU 35 -7.817 4.779 -0.170 313 HB3 LEU 35 HB3 LEU 35 -7.126 4.719 1.445 314 HG LEU 35 HG LEU 35 -7.510 2.166 -0.174 315 HD11 LEU 35 HD11 LEU 35 -5.017 3.880 -0.165 316 HD12 LEU 35 HD12 LEU 35 -5.302 2.336 -1.005 317 HD13 LEU 35 HD13 LEU 35 -6.180 3.779 -1.517 318 HD21 LEU 35 HD21 LEU 35 -6.989 1.948 2.257 319 HD22 LEU 35 HD22 LEU 35 -5.648 1.387 1.246 320 HD23 LEU 35 HD23 LEU 35 -5.546 2.967 2.013 321 H SER 36 H SER 36 -8.734 4.802 3.612 322 HA SER 36 HA SER 36 -10.800 6.890 3.595 323 HB2 SER 36 HB2 SER 36 -10.072 5.762 5.673 324 HB3 SER 36 HB3 SER 36 -8.449 6.447 5.475 325 HG SER 36 HG SER 36 -9.898 7.659 6.882 326 H GLU 37 H GLU 37 -10.147 9.242 3.900 327 HA GLU 37 HA GLU 37 -8.739 10.237 1.654 328 HB2 GLU 37 HB2 GLU 37 -10.388 11.525 2.684 329 HB3 GLU 37 HB3 GLU 37 -9.667 11.430 4.279 330 HG2 GLU 37 HG2 GLU 37 -8.254 12.832 1.987 331 HG3 GLU 37 HG3 GLU 37 -9.549 13.630 2.875 332 H GLN 38 H GLN 38 -7.518 9.804 4.996 333 HA GLN 38 HA GLN 38 -4.850 10.775 4.250 334 HB2 GLN 38 HB2 GLN 38 -4.202 10.147 6.512 335 HB3 GLN 38 HB3 GLN 38 -5.602 11.216 6.478 336 HG2 GLN 38 HG2 GLN 38 -7.100 9.500 7.162 337 HG3 GLN 38 HG3 GLN 38 -5.975 8.208 6.750 338 HE21 GLN 38 HE21 GLN 38 -4.130 8.379 9.783 339 HE22 GLN 38 HE22 GLN 38 -4.078 7.831 8.114 340 H GLN 39 H GLN 39 -6.415 7.608 4.517 341 HA GLN 39 HA GLN 39 -3.965 6.074 4.378 342 HB2 GLN 39 HB2 GLN 39 -6.867 5.375 3.963 343 HB3 GLN 39 HB3 GLN 39 -5.561 4.206 3.777 344 HG2 GLN 39 HG2 GLN 39 -4.796 4.608 6.082 345 HG3 GLN 39 HG3 GLN 39 -6.122 5.745 6.339 346 HE21 GLN 39 HE21 GLN 39 -6.956 2.087 7.346 347 HE22 GLN 39 HE22 GLN 39 -5.401 2.880 7.494 348 H LYS 40 H LYS 40 -6.223 7.300 1.917 349 HA LYS 40 HA LYS 40 -4.995 6.076 -0.379 350 HB2 LYS 40 HB2 LYS 40 -7.197 7.159 -0.377 351 HB3 LYS 40 HB3 LYS 40 -6.474 8.726 0.002 352 HG2 LYS 40 HG2 LYS 40 -5.291 8.748 -2.152 353 HG3 LYS 40 HG3 LYS 40 -5.936 7.151 -2.557 354 HD2 LYS 40 HD2 LYS 40 -7.653 9.624 -2.015 355 HD3 LYS 40 HD3 LYS 40 -7.114 9.118 -3.625 356 HE2 LYS 40 HE2 LYS 40 -8.259 6.918 -3.304 357 HE3 LYS 40 HE3 LYS 40 -8.866 7.477 -1.739 358 HZ1 LYS 40 HZ1 LYS 40 -9.482 8.746 -4.357 359 HZ2 LYS 40 HZ2 LYS 40 -10.506 7.810 -3.500 360 HZ3 LYS 40 HZ3 LYS 40 -10.047 9.262 -2.913 361 H ILE 41 H ILE 41 -4.193 9.102 1.379 362 HA ILE 41 HA ILE 41 -2.024 9.817 -0.398 363 HB ILE 41 HB ILE 41 -2.556 10.683 2.434 364 HG12 ILE 41 HG12 ILE 41 -3.161 12.272 -0.110 365 HG13 ILE 41 HG13 ILE 41 -4.359 11.185 0.565 366 HG21 ILE 41 HG21 ILE 41 -0.739 11.906 0.322 367 HG22 ILE 41 HG22 ILE 41 -1.152 12.679 1.865 368 HG23 ILE 41 HG23 ILE 41 -0.243 11.179 1.865 369 HD11 ILE 41 HD11 ILE 41 -3.207 13.612 1.978 370 HD12 ILE 41 HD12 ILE 41 -4.850 13.383 1.348 371 HD13 ILE 41 HD13 ILE 41 -4.294 12.412 2.720 372 H ILE 42 H ILE 42 -2.100 7.996 2.754 373 HA ILE 42 HA ILE 42 0.768 7.749 2.934 374 HB ILE 42 HB ILE 42 -1.433 5.956 4.000 375 HG12 ILE 42 HG12 ILE 42 0.262 7.862 5.660 376 HG13 ILE 42 HG13 ILE 42 -1.138 8.481 4.802 377 HG21 ILE 42 HG21 ILE 42 1.553 6.012 4.658 378 HG22 ILE 42 HG22 ILE 42 0.337 5.135 5.601 379 HG23 ILE 42 HG23 ILE 42 0.653 4.663 3.937 380 HD11 ILE 42 HD11 ILE 42 -1.199 6.228 6.845 381 HD12 ILE 42 HD12 ILE 42 -1.812 7.883 7.046 382 HD13 ILE 42 HD13 ILE 42 -2.581 6.782 5.882 383 H LEU 43 H LEU 43 -1.706 5.707 1.432 384 HA LEU 43 HA LEU 43 -0.056 3.625 0.429 385 HB2 LEU 43 HB2 LEU 43 -2.485 3.542 0.503 386 HB3 LEU 43 HB3 LEU 43 -2.628 4.857 -0.638 387 HG LEU 43 HG LEU 43 -3.161 2.602 -1.491 388 HD11 LEU 43 HD11 LEU 43 -0.847 3.759 -3.070 389 HD12 LEU 43 HD12 LEU 43 -2.231 2.829 -3.652 390 HD13 LEU 43 HD13 LEU 43 -2.478 4.465 -3.018 391 HD21 LEU 43 HD21 LEU 43 -1.558 1.244 -0.389 392 HD22 LEU 43 HD22 LEU 43 -1.331 1.058 -2.130 393 HD23 LEU 43 HD23 LEU 43 -0.178 2.041 -1.193 394 H ALA 44 H ALA 44 -1.091 6.671 -1.166 395 HA ALA 44 HA ALA 44 0.458 6.329 -3.515 396 HB1 ALA 44 HB1 ALA 44 -0.611 8.820 -2.124 397 HB2 ALA 44 HB2 ALA 44 -0.070 8.749 -3.820 398 HB3 ALA 44 HB3 ALA 44 -1.496 7.818 -3.294 399 H GLU 45 H GLU 45 1.228 8.361 -0.602 400 HA GLU 45 HA GLU 45 3.722 9.299 -1.582 401 HB2 GLU 45 HB2 GLU 45 2.618 8.938 1.223 402 HB3 GLU 45 HB3 GLU 45 4.181 9.686 0.918 403 HG2 GLU 45 HG2 GLU 45 1.585 10.724 -0.296 404 HG3 GLU 45 HG3 GLU 45 2.262 11.292 1.225 405 H TYR 46 H TYR 46 3.006 6.127 -0.229 406 HA TYR 46 HA TYR 46 5.767 5.453 0.375 407 HB2 TYR 46 HB2 TYR 46 3.850 4.374 1.437 408 HB3 TYR 46 HB3 TYR 46 3.279 3.783 -0.112 409 HD1 TYR 46 HD1 TYR 46 6.917 3.478 0.332 410 HD2 TYR 46 HD2 TYR 46 3.087 1.652 1.104 411 HE1 TYR 46 HE1 TYR 46 8.044 1.313 0.799 412 HE2 TYR 46 HE2 TYR 46 4.228 -0.536 1.531 413 HH TYR 46 HH TYR 46 7.784 -0.875 1.382 414 H ILE 47 H ILE 47 3.587 4.407 -2.317 415 HA ILE 47 HA ILE 47 5.556 3.205 -3.959 416 HB ILE 47 HB ILE 47 2.807 4.346 -4.338 417 HG12 ILE 47 HG12 ILE 47 3.606 1.441 -4.552 418 HG13 ILE 47 HG13 ILE 47 3.542 2.133 -2.945 419 HG21 ILE 47 HG21 ILE 47 4.547 2.921 -6.380 420 HG22 ILE 47 HG22 ILE 47 2.781 2.902 -6.473 421 HG23 ILE 47 HG23 ILE 47 3.647 4.440 -6.572 422 HD11 ILE 47 HD11 ILE 47 1.169 2.214 -4.851 423 HD12 ILE 47 HD12 ILE 47 1.418 1.005 -3.572 424 HD13 ILE 47 HD13 ILE 47 1.211 2.708 -3.159 425 H ALA 48 H ALA 48 4.370 6.599 -3.768 426 HA ALA 48 HA ALA 48 5.722 7.530 -6.133 427 HB1 ALA 48 HB1 ALA 48 4.751 8.993 -3.647 428 HB2 ALA 48 HB2 ALA 48 5.175 9.751 -5.200 429 HB3 ALA 48 HB3 ALA 48 3.786 8.647 -5.099 430 H GLU 49 H GLU 49 6.896 6.850 -2.894 431 HA GLU 49 HA GLU 49 9.384 8.407 -3.310 432 HB2 GLU 49 HB2 GLU 49 8.117 8.463 -1.148 433 HB3 GLU 49 HB3 GLU 49 8.490 6.751 -0.929 434 HG2 GLU 49 HG2 GLU 49 10.024 8.001 0.387 435 HG3 GLU 49 HG3 GLU 49 10.944 7.353 -0.955 436 H VAL 50 H VAL 50 8.309 4.952 -3.207 437 HA VAL 50 HA VAL 50 11.166 4.191 -3.733 438 HB VAL 50 HB VAL 50 10.858 2.138 -2.652 439 HG11 VAL 50 HG11 VAL 50 9.657 4.267 -0.842 440 HG12 VAL 50 HG12 VAL 50 10.560 2.819 -0.356 441 HG13 VAL 50 HG13 VAL 50 11.384 4.115 -1.240 442 HG21 VAL 50 HG21 VAL 50 8.513 1.590 -3.188 443 HG22 VAL 50 HG22 VAL 50 8.850 1.439 -1.470 444 HG23 VAL 50 HG23 VAL 50 7.951 2.840 -2.075 445 H GLY 51 H GLY 51 8.011 4.079 -5.140 446 HA2 GLY 51 HA2 GLY 51 7.416 3.307 -7.259 447 HA3 GLY 51 HA3 GLY 51 8.971 2.498 -7.445 448 H LEU 52 H LEU 52 6.052 1.569 -7.733 449 HA LEU 52 HA LEU 52 5.379 0.052 -5.502 450 HB2 LEU 52 HB2 LEU 52 3.861 0.840 -7.353 451 HB3 LEU 52 HB3 LEU 52 4.425 -0.450 -8.386 452 HG LEU 52 HG LEU 52 3.529 -1.360 -5.665 453 HD11 LEU 52 HD11 LEU 52 1.566 -0.132 -7.604 454 HD12 LEU 52 HD12 LEU 52 1.134 -1.092 -6.154 455 HD13 LEU 52 HD13 LEU 52 1.972 0.456 -5.997 456 HD21 LEU 52 HD21 LEU 52 4.016 -2.986 -7.428 457 HD22 LEU 52 HD22 LEU 52 2.287 -3.016 -7.066 458 HD23 LEU 52 HD23 LEU 52 2.897 -2.170 -8.518 459 H GLN 53 H GLN 53 7.599 -0.695 -7.804 460 HA GLN 53 HA GLN 53 7.733 -3.603 -7.728 461 HB2 GLN 53 HB2 GLN 53 9.779 -1.467 -8.449 462 HB3 GLN 53 HB3 GLN 53 10.044 -3.198 -8.678 463 HG2 GLN 53 HG2 GLN 53 8.266 -3.378 -10.290 464 HG3 GLN 53 HG3 GLN 53 7.690 -1.743 -9.961 465 HE21 GLN 53 HE21 GLN 53 10.298 -0.117 -11.822 466 HE22 GLN 53 HE22 GLN 53 9.232 0.090 -10.437 467 H ASN 54 H ASN 54 8.667 -1.179 -5.425 468 HA ASN 54 HA ASN 54 10.540 -3.071 -4.059 469 HB2 ASN 54 HB2 ASN 54 10.422 -0.037 -3.951 470 HB3 ASN 54 HB3 ASN 54 11.590 -1.048 -3.104 471 HD21 ASN 54 HD21 ASN 54 12.365 0.013 -6.872 472 HD22 ASN 54 HD22 ASN 54 11.139 0.771 -5.851 473 H ILE 55 H ILE 55 7.446 -1.945 -3.712 474 HA ILE 55 HA ILE 55 7.438 -1.979 -0.769 475 HB ILE 55 HB ILE 55 5.178 -1.527 -0.762 476 HG12 ILE 55 HG12 ILE 55 4.981 -2.388 -3.649 477 HG13 ILE 55 HG13 ILE 55 4.230 -3.134 -2.244 478 HG21 ILE 55 HG21 ILE 55 6.114 0.028 -3.191 479 HG22 ILE 55 HG22 ILE 55 5.064 0.555 -1.847 480 HG23 ILE 55 HG23 ILE 55 6.774 0.271 -1.564 481 HD11 ILE 55 HD11 ILE 55 3.590 -0.422 -3.420 482 HD12 ILE 55 HD12 ILE 55 2.558 -1.860 -3.417 483 HD13 ILE 55 HD13 ILE 55 2.906 -1.026 -1.884 484 H THR 56 H THR 56 6.068 -3.393 0.481 485 HA THR 56 HA THR 56 5.548 -6.082 -0.698 486 HB THR 56 HB THR 56 6.076 -6.786 1.844 487 HG1 THR 56 HG1 THR 56 8.167 -5.720 2.265 488 HG21 THR 56 HG21 THR 56 8.249 -6.385 -0.260 489 HG22 THR 56 HG22 THR 56 8.308 -7.527 1.105 490 HG23 THR 56 HG23 THR 56 7.127 -7.762 -0.192 491 H ALA 57 H ALA 57 3.657 -7.107 0.071 492 HA ALA 57 HA ALA 57 1.560 -5.460 1.086 493 HB1 ALA 57 HB1 ALA 57 1.826 -8.500 1.001 494 HB2 ALA 57 HB2 ALA 57 0.326 -7.572 1.224 495 HB3 ALA 57 HB3 ALA 57 1.205 -7.475 -0.314 496 H ILE 58 H ILE 58 4.037 -7.342 2.671 497 HA ILE 58 HA ILE 58 2.916 -7.502 5.338 498 HB ILE 58 HB ILE 58 5.728 -7.620 4.168 499 HG12 ILE 58 HG12 ILE 58 5.669 -9.976 5.003 500 HG13 ILE 58 HG13 ILE 58 4.013 -9.751 5.560 501 HG21 ILE 58 HG21 ILE 58 4.905 -7.857 7.100 502 HG22 ILE 58 HG22 ILE 58 6.484 -8.375 6.460 503 HG23 ILE 58 HG23 ILE 58 6.027 -6.676 6.392 504 HD11 ILE 58 HD11 ILE 58 4.878 -9.557 2.641 505 HD12 ILE 58 HD12 ILE 58 4.262 -11.029 3.417 506 HD13 ILE 58 HD13 ILE 58 3.206 -9.623 3.269 507 H THR 59 H THR 59 5.122 -5.203 3.679 508 HA THR 59 HA THR 59 5.308 -3.422 5.959 509 HB THR 59 HB THR 59 6.034 -3.029 3.036 510 HG1 THR 59 HG1 THR 59 7.500 -4.351 3.565 511 HG21 THR 59 HG21 THR 59 6.807 -1.501 5.568 512 HG22 THR 59 HG22 THR 59 7.628 -1.342 3.997 513 HG23 THR 59 HG23 THR 59 5.929 -0.861 4.153 514 H LEU 60 H LEU 60 3.476 -3.353 2.857 515 HA LEU 60 HA LEU 60 2.132 -0.929 3.356 516 HB2 LEU 60 HB2 LEU 60 2.367 -2.232 1.170 517 HB3 LEU 60 HB3 LEU 60 1.119 -3.315 1.755 518 HG LEU 60 HG LEU 60 -0.435 -1.306 1.897 519 HD11 LEU 60 HD11 LEU 60 1.792 0.017 0.292 520 HD12 LEU 60 HD12 LEU 60 0.218 0.714 0.703 521 HD13 LEU 60 HD13 LEU 60 1.376 0.441 1.977 522 HD21 LEU 60 HD21 LEU 60 -0.463 -2.846 -0.038 523 HD22 LEU 60 HD22 LEU 60 -0.798 -1.181 -0.533 524 HD23 LEU 60 HD23 LEU 60 0.802 -1.890 -0.828 525 H SER 61 H SER 61 1.246 -4.254 4.342 526 HA SER 61 HA SER 61 -1.156 -3.769 5.677 527 HB2 SER 61 HB2 SER 61 -0.256 -5.989 5.382 528 HB3 SER 61 HB3 SER 61 1.084 -5.616 6.480 529 HG SER 61 HG SER 61 -0.476 -6.709 7.623 530 H LYS 62 H LYS 62 2.004 -2.845 6.587 531 HA LYS 62 HA LYS 62 1.115 -2.012 9.280 532 HB2 LYS 62 HB2 LYS 62 3.899 -2.545 8.196 533 HB3 LYS 62 HB3 LYS 62 3.582 -1.848 9.793 534 HG2 LYS 62 HG2 LYS 62 2.193 -3.829 10.389 535 HG3 LYS 62 HG3 LYS 62 2.587 -4.570 8.827 536 HD2 LYS 62 HD2 LYS 62 4.994 -4.524 9.409 537 HD3 LYS 62 HD3 LYS 62 4.599 -3.759 10.966 538 HE2 LYS 62 HE2 LYS 62 3.184 -5.741 11.548 539 HE3 LYS 62 HE3 LYS 62 3.659 -6.510 10.028 540 HZ1 LYS 62 HZ1 LYS 62 5.525 -5.753 12.220 541 HZ2 LYS 62 HZ2 LYS 62 5.038 -7.272 11.881 542 HZ3 LYS 62 HZ3 LYS 62 5.974 -6.463 10.816 543 H LYS 63 H LYS 63 2.198 -0.570 6.266 544 HA LYS 63 HA LYS 63 2.832 2.069 7.241 545 HB2 LYS 63 HB2 LYS 63 1.794 0.916 4.628 546 HB3 LYS 63 HB3 LYS 63 2.127 2.636 4.796 547 HG2 LYS 63 HG2 LYS 63 4.244 0.497 5.294 548 HG3 LYS 63 HG3 LYS 63 3.900 1.176 3.711 549 HD2 LYS 63 HD2 LYS 63 4.374 3.477 4.704 550 HD3 LYS 63 HD3 LYS 63 4.957 2.622 6.160 551 HE2 LYS 63 HE2 LYS 63 6.580 1.369 4.751 552 HE3 LYS 63 HE3 LYS 63 5.990 2.222 3.316 553 HZ1 LYS 63 HZ1 LYS 63 7.304 3.520 5.648 554 HZ2 LYS 63 HZ2 LYS 63 8.002 3.261 4.196 555 HZ3 LYS 63 HZ3 LYS 63 6.757 4.308 4.325 556 H LEU 64 H LEU 64 -0.192 0.509 6.315 557 HA LEU 64 HA LEU 64 -1.746 2.971 6.977 558 HB2 LEU 64 HB2 LEU 64 -2.385 0.565 5.237 559 HB3 LEU 64 HB3 LEU 64 -3.463 1.927 5.516 560 HG LEU 64 HG LEU 64 -0.997 3.104 4.715 561 HD11 LEU 64 HD11 LEU 64 -1.767 0.855 2.814 562 HD12 LEU 64 HD12 LEU 64 -0.547 2.124 2.543 563 HD13 LEU 64 HD13 LEU 64 -0.298 0.908 3.801 564 HD21 LEU 64 HD21 LEU 64 -3.216 3.939 4.224 565 HD22 LEU 64 HD22 LEU 64 -2.224 3.792 2.770 566 HD23 LEU 64 HD23 LEU 64 -3.498 2.589 3.090 567 H ASN 65 H ASN 65 -0.956 0.230 8.587 568 HA ASN 65 HA ASN 65 -1.823 -1.102 10.172 569 HB2 ASN 65 HB2 ASN 65 -3.817 1.107 10.782 570 HB3 ASN 65 HB3 ASN 65 -3.226 -0.136 11.872 571 HD21 ASN 65 HD21 ASN 65 -1.103 3.284 11.371 572 HD22 ASN 65 HD22 ASN 65 -2.590 2.987 10.478 573 H ILE 66 H ILE 66 -2.567 -1.969 7.820 574 HA ILE 66 HA ILE 66 -5.482 -2.660 7.923 575 HB ILE 66 HB ILE 66 -5.257 -3.133 5.512 576 HG12 ILE 66 HG12 ILE 66 -2.455 -1.952 5.780 577 HG13 ILE 66 HG13 ILE 66 -3.010 -3.497 5.134 578 HG21 ILE 66 HG21 ILE 66 -4.697 -0.257 6.261 579 HG22 ILE 66 HG22 ILE 66 -5.575 -0.863 4.835 580 HG23 ILE 66 HG23 ILE 66 -6.256 -1.096 6.444 581 HD11 ILE 66 HD11 ILE 66 -3.531 -0.818 3.807 582 HD12 ILE 66 HD12 ILE 66 -2.299 -1.991 3.356 583 HD13 ILE 66 HD13 ILE 66 -4.022 -2.419 3.201 584 H THR 67 H THR 67 -5.459 -4.868 6.261 585 HA THR 67 HA THR 67 -3.841 -6.881 7.734 586 HB THR 67 HB THR 67 -5.256 -8.572 6.752 587 HG1 THR 67 HG1 THR 67 -7.117 -7.814 5.544 588 HG21 THR 67 HG21 THR 67 -7.078 -6.364 7.795 589 HG22 THR 67 HG22 THR 67 -7.383 -8.114 7.802 590 HG23 THR 67 HG23 THR 67 -6.100 -7.439 8.821 591 H VAL 68 H VAL 68 -2.716 -8.537 6.433 592 HA VAL 68 HA VAL 68 -1.274 -7.521 4.151 593 HB VAL 68 HB VAL 68 -1.683 -10.393 5.070 594 HG11 VAL 68 HG11 VAL 68 0.374 -9.221 3.143 595 HG12 VAL 68 HG12 VAL 68 0.418 -10.867 3.809 596 HG13 VAL 68 HG13 VAL 68 -0.897 -10.399 2.734 597 HG21 VAL 68 HG21 VAL 68 -0.554 -9.004 6.779 598 HG22 VAL 68 HG22 VAL 68 0.588 -10.128 6.044 599 HG23 VAL 68 HG23 VAL 68 0.598 -8.421 5.555 600 H GLU 69 H GLU 69 -4.480 -8.971 4.384 601 HA GLU 69 HA GLU 69 -4.500 -9.948 1.616 602 HB2 GLU 69 HB2 GLU 69 -6.665 -9.734 3.753 603 HB3 GLU 69 HB3 GLU 69 -6.892 -10.431 2.143 604 HG2 GLU 69 HG2 GLU 69 -5.142 -12.127 2.621 605 HG3 GLU 69 HG3 GLU 69 -4.927 -11.460 4.241 606 H LYS 70 H LYS 70 -5.778 -7.126 3.496 607 HA LYS 70 HA LYS 70 -6.707 -6.050 0.961 608 HB2 LYS 70 HB2 LYS 70 -8.275 -4.809 1.909 609 HB3 LYS 70 HB3 LYS 70 -8.211 -6.172 2.992 610 HG2 LYS 70 HG2 LYS 70 -8.343 -4.545 4.531 611 HG3 LYS 70 HG3 LYS 70 -6.590 -4.589 4.399 612 HD2 LYS 70 HD2 LYS 70 -6.491 -2.497 3.463 613 HD3 LYS 70 HD3 LYS 70 -7.905 -2.720 2.457 614 HE2 LYS 70 HE2 LYS 70 -8.082 -2.236 5.456 615 HE3 LYS 70 HE3 LYS 70 -8.052 -0.936 4.258 616 HZ1 LYS 70 HZ1 LYS 70 -10.112 -3.074 4.345 617 HZ2 LYS 70 HZ2 LYS 70 -10.328 -1.532 4.831 618 HZ3 LYS 70 HZ3 LYS 70 -10.055 -1.854 3.257 619 H ALA 71 H ALA 71 -3.882 -6.135 2.288 620 HA ALA 71 HA ALA 71 -2.993 -3.558 1.085 621 HB1 ALA 71 HB1 ALA 71 -1.444 -5.822 2.444 622 HB2 ALA 71 HB2 ALA 71 -0.777 -4.288 1.882 623 HB3 ALA 71 HB3 ALA 71 -1.933 -4.310 3.220 624 H LYS 72 H LYS 72 -2.764 -7.122 0.638 625 HA LYS 72 HA LYS 72 -1.085 -6.943 -1.686 626 HB2 LYS 72 HB2 LYS 72 -1.083 -8.821 -0.041 627 HB3 LYS 72 HB3 LYS 72 -2.755 -9.200 -0.450 628 HG2 LYS 72 HG2 LYS 72 -2.082 -9.861 -2.707 629 HG3 LYS 72 HG3 LYS 72 -0.398 -9.432 -2.366 630 HD2 LYS 72 HD2 LYS 72 -2.019 -11.481 -0.777 631 HD3 LYS 72 HD3 LYS 72 -1.030 -11.927 -2.163 632 HE2 LYS 72 HE2 LYS 72 0.061 -10.562 0.345 633 HE3 LYS 72 HE3 LYS 72 -0.010 -12.308 0.127 634 HZ1 LYS 72 HZ1 LYS 72 1.525 -10.469 -1.636 635 HZ2 LYS 72 HZ2 LYS 72 2.161 -11.463 -0.506 636 HZ3 LYS 72 HZ3 LYS 72 1.430 -12.093 -1.814 637 H ASN 73 H ASN 73 -4.588 -7.085 -1.182 638 HA ASN 73 HA ASN 73 -5.282 -7.855 -3.783 639 HB2 ASN 73 HB2 ASN 73 -7.458 -6.807 -3.383 640 HB3 ASN 73 HB3 ASN 73 -6.925 -7.750 -1.999 641 HD21 ASN 73 HD21 ASN 73 -8.329 -4.593 -0.695 642 HD22 ASN 73 HD22 ASN 73 -8.944 -6.003 -1.550 643 H TYR 74 H TYR 74 -4.522 -4.523 -2.640 644 HA TYR 74 HA TYR 74 -4.890 -3.094 -5.025 645 HB2 TYR 74 HB2 TYR 74 -2.671 -2.711 -2.982 646 HB3 TYR 74 HB3 TYR 74 -3.297 -1.491 -4.081 647 HD1 TYR 74 HD1 TYR 74 -6.242 -1.710 -3.754 648 HD2 TYR 74 HD2 TYR 74 -3.055 -1.981 -0.832 649 HE1 TYR 74 HE1 TYR 74 -7.811 -0.975 -1.978 650 HE2 TYR 74 HE2 TYR 74 -4.612 -1.073 0.903 651 HH TYR 74 HH TYR 74 -8.085 -0.475 0.243 652 H ILE 75 H ILE 75 -2.019 -4.849 -3.900 653 HA ILE 75 HA ILE 75 -0.313 -4.156 -6.113 654 HB ILE 75 HB ILE 75 -0.108 -6.417 -4.082 655 HG12 ILE 75 HG12 ILE 75 1.122 -3.618 -4.025 656 HG13 ILE 75 HG13 ILE 75 -0.262 -4.106 -3.062 657 HG21 ILE 75 HG21 ILE 75 2.060 -5.138 -5.815 658 HG22 ILE 75 HG22 ILE 75 2.312 -6.399 -4.595 659 HG23 ILE 75 HG23 ILE 75 1.388 -6.770 -6.039 660 HD11 ILE 75 HD11 ILE 75 2.563 -5.145 -2.741 661 HD12 ILE 75 HD12 ILE 75 1.615 -4.160 -1.618 662 HD13 ILE 75 HD13 ILE 75 1.136 -5.834 -1.927 663 H LYS 76 H LYS 76 -2.751 -6.651 -5.629 664 HA LYS 76 HA LYS 76 -1.953 -8.100 -8.072 665 HB2 LYS 76 HB2 LYS 76 -4.086 -8.568 -5.957 666 HB3 LYS 76 HB3 LYS 76 -3.844 -9.613 -7.356 667 HG2 LYS 76 HG2 LYS 76 -1.699 -9.089 -5.264 668 HG3 LYS 76 HG3 LYS 76 -2.808 -10.461 -5.264 669 HD2 LYS 76 HD2 LYS 76 -1.922 -11.120 -7.532 670 HD3 LYS 76 HD3 LYS 76 -0.720 -9.820 -7.396 671 HE2 LYS 76 HE2 LYS 76 0.170 -10.840 -5.328 672 HE3 LYS 76 HE3 LYS 76 -1.046 -12.123 -5.424 673 HZ1 LYS 76 HZ1 LYS 76 1.079 -11.641 -7.448 674 HZ2 LYS 76 HZ2 LYS 76 1.069 -12.857 -6.361 675 HZ3 LYS 76 HZ3 LYS 76 -0.050 -12.817 -7.545 676 H ASN 77 H ASN 77 -4.478 -5.703 -7.354 677 HA ASN 77 HA ASN 77 -5.626 -6.291 -10.053 678 HB2 ASN 77 HB2 ASN 77 -7.543 -5.149 -9.472 679 HB3 ASN 77 HB3 ASN 77 -7.205 -6.203 -8.101 680 HD21 ASN 77 HD21 ASN 77 -7.003 -3.430 -5.875 681 HD22 ASN 77 HD22 ASN 77 -6.550 -5.134 -6.069 682 H SER 78 H SER 78 -4.091 -3.704 -8.144 683 HA SER 78 HA SER 78 -4.493 -1.860 -10.427 684 HB2 SER 78 HB2 SER 78 -5.315 -1.261 -8.125 685 HB3 SER 78 HB3 SER 78 -3.631 -1.258 -7.561 686 HG SER 78 HG SER 78 -4.481 0.777 -8.147 687 H ASN 79 H ASN 79 -1.901 -2.520 -8.044 688 HA ASN 79 HA ASN 79 0.284 -1.977 -8.077 689 HB2 ASN 79 HB2 ASN 79 1.573 -3.337 -9.771 690 HB3 ASN 79 HB3 ASN 79 0.479 -4.141 -8.683 691 HD21 ASN 79 HD21 ASN 79 -1.275 -5.690 -11.277 692 HD22 ASN 79 HD22 ASN 79 -0.869 -5.600 -9.560 693 H ARG 80 H ARG 80 -1.091 0.251 -9.207 694 HA ARG 80 HA ARG 80 -0.836 2.167 -10.459 695 HB2 ARG 80 HB2 ARG 80 2.015 1.479 -9.742 696 HB3 ARG 80 HB3 ARG 80 1.745 2.771 -10.884 697 HG2 ARG 80 HG2 ARG 80 2.039 3.499 -8.547 698 HG3 ARG 80 HG3 ARG 80 0.619 4.132 -9.346 699 HD2 ARG 80 HD2 ARG 80 0.257 1.635 -7.694 700 HD3 ARG 80 HD3 ARG 80 0.571 3.156 -6.841 701 HE ARG 80 HE ARG 80 -1.358 3.967 -8.526 702 HH11 ARG 80 HH11 ARG 80 -3.566 3.958 -8.243 703 HH12 ARG 80 HH12 ARG 80 -4.248 2.729 -7.179 704 HH21 ARG 80 HH21 ARG 80 -1.411 1.268 -6.225 705 HH22 ARG 80 HH22 ARG 80 -3.177 1.354 -6.182 706 H LEU 81 H LEU 81 -0.927 -0.499 -11.735 707 HA LEU 81 HA LEU 81 -0.554 -1.715 -13.505 708 HB2 LEU 81 HB2 LEU 81 -2.444 -0.219 -13.979 709 HB3 LEU 81 HB3 LEU 81 -1.386 0.810 -14.951 710 HG LEU 81 HG LEU 81 -1.123 -1.995 -15.791 711 HD11 LEU 81 HD11 LEU 81 -3.947 -0.870 -15.851 712 HD12 LEU 81 HD12 LEU 81 -3.390 -2.371 -16.627 713 HD13 LEU 81 HD13 LEU 81 -3.391 -2.231 -14.852 714 HD21 LEU 81 HD21 LEU 81 -0.575 -0.021 -17.195 715 HD22 LEU 81 HD22 LEU 81 -1.740 -1.098 -17.982 716 HD23 LEU 81 HD23 LEU 81 -2.295 0.420 -17.236 717 H GLY 82 H GLY 82 1.967 -0.727 -12.496 718 HA2 GLY 82 HA2 GLY 82 3.581 0.004 -14.809 719 HA3 GLY 82 HA3 GLY 82 4.180 -0.496 -13.217 720 H ARG 83 H ARG 83 4.032 -1.343 -16.419 721 HA ARG 83 HA ARG 83 4.576 -4.249 -15.953 722 HB2 ARG 83 HB2 ARG 83 2.735 -3.102 -18.093 723 HB3 ARG 83 HB3 ARG 83 3.254 -4.789 -17.967 724 HG2 ARG 83 HG2 ARG 83 2.195 -4.890 -15.672 725 HG3 ARG 83 HG3 ARG 83 1.534 -3.271 -15.960 726 HD2 ARG 83 HD2 ARG 83 0.423 -4.123 -18.026 727 HD3 ARG 83 HD3 ARG 83 0.997 -5.748 -17.650 728 HE ARG 83 HE ARG 83 -1.218 -4.289 -16.416 729 HH11 ARG 83 HH11 ARG 83 -2.546 -5.307 -14.965 730 HH12 ARG 83 HH12 ARG 83 -2.068 -6.824 -14.266 731 HH21 ARG 83 HH21 ARG 83 0.959 -6.984 -15.861 732 HH22 ARG 83 HH22 ARG 83 -0.128 -7.737 -14.728 733 H THR 84 H THR 84 5.599 -5.319 -17.729 734 HA THR 84 HA THR 84 7.942 -3.829 -18.594 735 HB THR 84 HB THR 84 7.950 -6.096 -17.574 736 HG1 THR 84 HG1 THR 84 9.594 -6.846 -18.862 737 HG21 THR 84 HG21 THR 84 7.054 -7.081 -20.320 738 HG22 THR 84 HG22 THR 84 7.530 -8.071 -18.924 739 HG23 THR 84 HG23 THR 84 6.050 -7.103 -18.853 740 H ASN 85 H ASN 85 4.998 -4.515 -20.238 741 HA ASN 85 HA ASN 85 6.176 -4.933 -22.813 742 HB2 ASN 85 HB2 ASN 85 3.320 -4.323 -21.951 743 HB3 ASN 85 HB3 ASN 85 3.773 -4.590 -23.629 744 HD21 ASN 85 HD21 ASN 85 3.260 -7.817 -21.298 745 HD22 ASN 85 HD22 ASN 85 2.848 -6.202 -20.747 746 H ASN 86 H ASN 86 6.845 -3.640 -24.336 747 HA ASN 86 HA ASN 86 5.762 -0.946 -24.779 748 HB2 ASN 86 HB2 ASN 86 7.582 -0.510 -23.175 749 HB3 ASN 86 HB3 ASN 86 8.711 -1.455 -24.145 750 HD21 ASN 86 HD21 ASN 86 9.328 1.183 -26.448 751 HD22 ASN 86 HD22 ASN 86 9.547 -0.529 -26.110 752 H LEU 87 H LEU 87 5.373 -0.852 -26.933 753 HA LEU 87 HA LEU 87 7.209 -1.836 -28.937 754 HB2 LEU 87 HB2 LEU 87 5.585 -3.804 -27.992 755 HB3 LEU 87 HB3 LEU 87 4.451 -3.057 -29.100 756 HG LEU 87 HG LEU 87 6.156 -3.414 -30.954 757 HD11 LEU 87 HD11 LEU 87 7.606 -5.019 -28.800 758 HD12 LEU 87 HD12 LEU 87 7.971 -5.066 -30.537 759 HD13 LEU 87 HD13 LEU 87 8.238 -3.583 -29.623 760 HD21 LEU 87 HD21 LEU 87 4.312 -5.009 -30.559 761 HD22 LEU 87 HD22 LEU 87 5.769 -5.831 -31.134 762 HD23 LEU 87 HD23 LEU 87 5.328 -5.907 -29.412 763 H LYS 88 H LYS 88 6.091 -1.555 -31.176 764 HA LYS 88 HA LYS 88 4.630 1.054 -31.228 765 HB2 LYS 88 HB2 LYS 88 6.089 1.664 -33.148 766 HB3 LYS 88 HB3 LYS 88 6.939 1.496 -31.613 767 HG2 LYS 88 HG2 LYS 88 7.848 -0.660 -32.242 768 HG3 LYS 88 HG3 LYS 88 6.825 -0.736 -33.682 769 HD2 LYS 88 HD2 LYS 88 9.084 -0.182 -34.338 770 HD3 LYS 88 HD3 LYS 88 8.029 1.202 -34.654 771 HE2 LYS 88 HE2 LYS 88 8.815 2.283 -32.555 772 HE3 LYS 88 HE3 LYS 88 9.842 0.883 -32.215 773 HZ1 LYS 88 HZ1 LYS 88 10.123 2.669 -34.576 774 HZ2 LYS 88 HZ2 LYS 88 11.101 2.671 -33.271 775 HZ3 LYS 88 HZ3 LYS 88 11.073 1.377 -34.263 776 H THR 89 H THR 89 3.786 -1.871 -31.649 777 HA THR 89 HA THR 89 1.887 -1.257 -33.670 778 HB THR 89 HB THR 89 3.633 -2.078 -35.149 779 HG1 THR 89 HG1 THR 89 2.316 -3.580 -36.172 780 HG21 THR 89 HG21 THR 89 3.343 -4.792 -33.776 781 HG22 THR 89 HG22 THR 89 4.376 -4.393 -35.167 782 HG23 THR 89 HG23 THR 89 4.747 -3.719 -33.570 783 H ILE 90 H ILE 90 0.084 -2.047 -33.054 784 HA ILE 90 HA ILE 90 -0.180 -4.447 -31.348 785 HB ILE 90 HB ILE 90 -1.825 -2.724 -29.995 786 HG12 ILE 90 HG12 ILE 90 -0.727 -0.669 -29.427 787 HG13 ILE 90 HG13 ILE 90 0.545 -0.934 -30.618 788 HG21 ILE 90 HG21 ILE 90 1.128 -3.094 -29.401 789 HG22 ILE 90 HG22 ILE 90 -0.155 -2.703 -28.242 790 HG23 ILE 90 HG23 ILE 90 -0.152 -4.276 -29.049 791 HD11 ILE 90 HD11 ILE 90 -2.406 -0.549 -31.195 792 HD12 ILE 90 HD12 ILE 90 -1.158 0.705 -31.340 793 HD13 ILE 90 HD13 ILE 90 -1.120 -0.681 -32.435 794 H GLY 91 H GLY 91 -1.156 -3.504 -34.155 795 HA2 GLY 91 HA2 GLY 91 -3.058 -4.000 -35.440 796 HA3 GLY 91 HA3 GLY 91 -3.933 -4.475 -33.976 797 H ILE 92 H ILE 92 -2.820 -1.605 -33.106 798 HA ILE 92 HA ILE 92 -3.807 0.330 -32.544 799 HB ILE 92 HB ILE 92 -5.026 0.422 -35.322 800 HG12 ILE 92 HG12 ILE 92 -2.988 2.169 -35.458 801 HG13 ILE 92 HG13 ILE 92 -2.264 1.104 -34.258 802 HG21 ILE 92 HG21 ILE 92 -4.463 2.585 -33.236 803 HG22 ILE 92 HG22 ILE 92 -5.101 2.851 -34.873 804 HG23 ILE 92 HG23 ILE 92 -6.071 1.976 -33.695 805 HD11 ILE 92 HD11 ILE 92 -3.275 0.243 -37.012 806 HD12 ILE 92 HD12 ILE 92 -1.591 0.622 -36.611 807 HD13 ILE 92 HD13 ILE 92 -2.370 -0.775 -35.868 808 H LEU 93 H LEU 93 -4.873 -0.561 -30.908 809 HA LEU 93 HA LEU 93 -7.120 -2.255 -31.047 810 HB2 LEU 93 HB2 LEU 93 -5.918 -0.632 -28.776 811 HB3 LEU 93 HB3 LEU 93 -7.198 -1.814 -28.538 812 HG LEU 93 HG LEU 93 -4.490 -2.518 -29.749 813 HD11 LEU 93 HD11 LEU 93 -5.481 -2.837 -26.888 814 HD12 LEU 93 HD12 LEU 93 -3.951 -3.468 -27.544 815 HD13 LEU 93 HD13 LEU 93 -4.213 -1.720 -27.442 816 HD21 LEU 93 HD21 LEU 93 -6.265 -4.144 -30.310 817 HD22 LEU 93 HD22 LEU 93 -5.145 -4.834 -29.137 818 HD23 LEU 93 HD23 LEU 93 -6.731 -4.245 -28.597 819 H GLN 94 H GLN 94 -8.679 -1.399 -32.264 820 HA GLN 94 HA GLN 94 -10.166 1.003 -31.337 821 HB2 GLN 94 HB2 GLN 94 -10.997 1.136 -33.597 822 HB3 GLN 94 HB3 GLN 94 -9.244 0.981 -33.597 823 HG2 GLN 94 HG2 GLN 94 -9.501 -1.478 -34.120 824 HG3 GLN 94 HG3 GLN 94 -11.250 -1.246 -34.202 825 HE21 GLN 94 HE21 GLN 94 -8.855 0.147 -37.255 826 HE22 GLN 94 HE22 GLN 94 -8.135 -0.270 -35.701 827 H GLU 95 H GLU 95 -10.533 -2.136 -30.604 828 HA GLU 95 HA GLU 95 -13.336 -2.522 -31.344 829 HB2 GLU 95 HB2 GLU 95 -11.462 -4.246 -31.439 830 HB3 GLU 95 HB3 GLU 95 -11.589 -4.358 -29.680 831 HG2 GLU 95 HG2 GLU 95 -13.943 -5.076 -29.899 832 HG3 GLU 95 HG3 GLU 95 -13.888 -4.804 -31.638 833 H GLU 96 H GLU 96 -15.108 -2.787 -29.968 834 HA GLU 96 HA GLU 96 -14.892 -1.420 -27.314 835 HB2 GLU 96 HB2 GLU 96 -17.206 -1.679 -29.267 836 HB3 GLU 96 HB3 GLU 96 -17.296 -0.922 -27.670 837 HG2 GLU 96 HG2 GLU 96 -15.589 0.741 -28.349 838 HG3 GLU 96 HG3 GLU 96 -15.499 0.010 -29.953 839 H VAL 97 H VAL 97 -14.427 -3.031 -25.928 840 HA VAL 97 HA VAL 97 -16.426 -5.148 -25.521 841 HB VAL 97 HB VAL 97 -14.389 -6.542 -24.935 842 HG11 VAL 97 HG11 VAL 97 -14.575 -5.637 -27.812 843 HG12 VAL 97 HG12 VAL 97 -13.873 -7.157 -27.228 844 HG13 VAL 97 HG13 VAL 97 -15.609 -6.851 -27.036 845 HG21 VAL 97 HG21 VAL 97 -12.746 -4.674 -24.694 846 HG22 VAL 97 HG22 VAL 97 -12.212 -5.969 -25.777 847 HG23 VAL 97 HG23 VAL 97 -12.805 -4.446 -26.458 848 H SER 98 H SER 98 -16.436 -2.716 -24.122 849 HA SER 98 HA SER 98 -15.374 -3.410 -21.391 850 HB2 SER 98 HB2 SER 98 -15.138 -0.815 -22.926 851 HB3 SER 98 HB3 SER 98 -14.704 -1.024 -21.210 852 HG SER 98 HG SER 98 -12.891 -1.263 -22.598 853 H SER 99 H SER 99 -17.438 -0.801 -22.855 854 HA SER 99 HA SER 99 -19.102 -0.670 -20.452 855 HB2 SER 99 HB2 SER 99 -20.363 1.010 -21.783 856 HB3 SER 99 HB3 SER 99 -18.630 1.358 -21.651 857 HG SER 99 HG SER 99 -19.404 1.611 -23.805 858 H MET 100 H MET 100 -19.215 -2.337 -23.492 859 HA MET 100 HA MET 100 -21.597 -3.863 -22.601 860 HB2 MET 100 HB2 MET 100 -21.128 -2.851 -25.439 861 HB3 MET 100 HB3 MET 100 -22.352 -4.037 -24.968 862 HG2 MET 100 HG2 MET 100 -23.389 -2.356 -23.462 863 HG3 MET 100 HG3 MET 100 -22.225 -1.151 -24.008 864 HE1 MET 100 HE1 MET 100 -21.996 -1.552 -27.164 865 HE2 MET 100 HE2 MET 100 -23.262 -0.421 -27.680 866 HE3 MET 100 HE3 MET 100 -22.199 0.003 -26.321 867 H GLU 101 H GLU 101 -21.345 -6.046 -22.874 868 HA GLU 101 HA GLU 101 -19.129 -7.091 -24.538 869 HB2 GLU 101 HB2 GLU 101 -18.464 -6.589 -22.013 870 HB3 GLU 101 HB3 GLU 101 -19.323 -8.096 -21.700 871 HG2 GLU 101 HG2 GLU 101 -17.802 -9.019 -23.680 872 HG3 GLU 101 HG3 GLU 101 -16.841 -7.586 -23.380 873 H ALA 102 H ALA 102 -22.139 -7.228 -24.652 874 HA ALA 102 HA ALA 102 -23.048 -9.747 -23.681 875 HB1 ALA 102 HB1 ALA 102 -24.182 -7.984 -25.887 876 HB2 ALA 102 HB2 ALA 102 -25.026 -9.323 -25.084 877 HB3 ALA 102 HB3 ALA 102 -24.563 -7.885 -24.148 878 H LYS 103 H LYS 103 -22.891 -11.727 -24.393 879 HA LYS 103 HA LYS 103 -22.218 -12.416 -27.217 880 HB2 LYS 103 HB2 LYS 103 -20.704 -13.222 -24.702 881 HB3 LYS 103 HB3 LYS 103 -20.602 -14.150 -26.199 882 HG2 LYS 103 HG2 LYS 103 -19.671 -12.313 -27.426 883 HG3 LYS 103 HG3 LYS 103 -19.937 -11.177 -26.106 884 HD2 LYS 103 HD2 LYS 103 -18.077 -13.573 -25.852 885 HD3 LYS 103 HD3 LYS 103 -17.566 -11.966 -26.401 886 HE2 LYS 103 HE2 LYS 103 -18.509 -10.979 -24.304 887 HE3 LYS 103 HE3 LYS 103 -18.849 -12.601 -23.703 888 HZ1 LYS 103 HZ1 LYS 103 -16.128 -11.676 -24.471 889 HZ2 LYS 103 HZ2 LYS 103 -16.710 -11.597 -22.959 890 HZ3 LYS 103 HZ3 LYS 103 -16.501 -13.063 -23.661 891 H SER 104 H SER 104 -22.988 -14.342 -27.913 892 HA SER 104 HA SER 104 -24.640 -16.054 -26.113 893 HB2 SER 104 HB2 SER 104 -26.438 -16.066 -27.798 894 HB3 SER 104 HB3 SER 104 -26.159 -14.454 -27.122 895 HG SER 104 HG SER 104 -26.379 -14.402 -29.407 896 H MET 105 H MET 105 -25.288 -18.106 -27.075 897 HA MET 105 HA MET 105 -23.154 -19.295 -28.798 898 HB2 MET 105 HB2 MET 105 -24.994 -20.520 -26.715 899 HB3 MET 105 HB3 MET 105 -23.988 -21.464 -27.821 900 HG2 MET 105 HG2 MET 105 -21.958 -20.398 -26.971 901 HG3 MET 105 HG3 MET 105 -22.910 -19.354 -25.918 902 HE1 MET 105 HE1 MET 105 -21.507 -22.948 -26.557 903 HE2 MET 105 HE2 MET 105 -22.272 -23.908 -25.272 904 HE3 MET 105 HE3 MET 105 -23.248 -23.309 -26.625 905 H THR 106 H THR 106 -23.754 -21.012 -30.246 906 HA THR 106 HA THR 106 -26.514 -21.154 -31.234 907 HB THR 106 HB THR 106 -25.619 -19.198 -32.400 908 HG1 THR 106 HG1 THR 106 -26.175 -19.887 -34.438 909 HG21 THR 106 HG21 THR 106 -23.585 -21.095 -33.655 910 HG22 THR 106 HG22 THR 106 -23.865 -19.395 -34.095 911 HG23 THR 106 HG23 THR 106 -23.210 -19.796 -32.500 912 H TRP 107 H TRP 107 -26.873 -22.719 -32.780 913 HA TRP 107 HA TRP 107 -25.006 -25.021 -32.753 914 HB2 TRP 107 HB2 TRP 107 -27.908 -25.039 -31.890 915 HB3 TRP 107 HB3 TRP 107 -27.077 -26.485 -32.430 916 HD1 TRP 107 HD1 TRP 107 -25.552 -27.726 -30.807 917 HE1 TRP 107 HE1 TRP 107 -24.907 -27.477 -28.333 918 HE3 TRP 107 HE3 TRP 107 -27.468 -23.056 -29.937 919 HZ2 TRP 107 HZ2 TRP 107 -25.153 -25.490 -26.257 920 HZ3 TRP 107 HZ3 TRP 107 -27.229 -21.997 -27.699 921 HH2 TRP 107 HH2 TRP 107 -26.075 -23.202 -25.856 Start of MODEL 14 1 H1 GLY -5 H1 GLY -5 -35.183 -4.965 -44.505 2 H2 GLY -5 H2 GLY -5 -36.756 -4.915 -44.967 3 H3 GLY -5 H3 GLY -5 -36.269 -5.986 -43.826 4 HA2 GLY -5 HA2 GLY -5 -36.276 -3.050 -43.535 5 HA3 GLY -5 HA3 GLY -5 -37.440 -4.160 -42.790 6 H SER -4 H SER -4 -36.916 -3.558 -40.688 7 HA SER -4 HA SER -4 -34.197 -4.294 -39.654 8 HB2 SER -4 HB2 SER -4 -36.119 -2.179 -38.624 9 HB3 SER -4 HB3 SER -4 -34.562 -2.617 -37.898 10 HG SER -4 HG SER -4 -34.403 -0.777 -39.273 11 H HIS -3 H HIS -3 -34.088 -5.118 -37.490 12 HA HIS -3 HA HIS -3 -36.555 -6.257 -36.302 13 HB2 HIS -3 HB2 HIS -3 -35.525 -7.915 -37.941 14 HB3 HIS -3 HB3 HIS -3 -34.108 -7.968 -36.894 15 HD2 HIS -3 HD2 HIS -3 -37.884 -8.851 -36.940 16 HE1 HIS -3 HE1 HIS -3 -36.140 -11.098 -33.762 17 HE2 HIS -3 HE2 HIS -3 -38.266 -10.705 -35.104 18 H MET -2 H MET -2 -36.311 -6.913 -34.095 19 HA MET -2 HA MET -2 -33.885 -6.028 -32.631 20 HB2 MET -2 HB2 MET -2 -35.328 -4.032 -32.848 21 HB3 MET -2 HB3 MET -2 -36.675 -4.910 -32.114 22 HG2 MET -2 HG2 MET -2 -35.355 -5.171 -30.029 23 HG3 MET -2 HG3 MET -2 -33.997 -4.323 -30.782 24 HE1 MET -2 HE1 MET -2 -33.942 -2.761 -28.608 25 HE2 MET -2 HE2 MET -2 -35.343 -1.831 -28.029 26 HE3 MET -2 HE3 MET -2 -35.360 -3.606 -27.941 27 H ALA -1 H ALA -1 -33.412 -8.019 -31.901 28 HA ALA -1 HA ALA -1 -34.885 -8.938 -29.584 29 HB1 ALA -1 HB1 ALA -1 -34.518 -10.826 -31.971 30 HB2 ALA -1 HB2 ALA -1 -35.147 -11.287 -30.375 31 HB3 ALA -1 HB3 ALA -1 -36.079 -10.187 -31.401 32 H SER 0 H SER 0 -33.758 -10.631 -28.404 33 HA SER 0 HA SER 0 -30.856 -10.894 -28.946 34 HB2 SER 0 HB2 SER 0 -30.292 -10.035 -26.726 35 HB3 SER 0 HB3 SER 0 -31.104 -8.822 -27.743 36 HG SER 0 HG SER 0 -31.902 -8.817 -25.597 37 H MET 1 H MET 1 -30.307 -12.930 -28.729 38 HA MET 1 HA MET 1 -31.416 -14.655 -26.597 39 HB2 MET 1 HB2 MET 1 -32.936 -14.563 -28.697 40 HB3 MET 1 HB3 MET 1 -31.667 -15.467 -29.519 41 HG2 MET 1 HG2 MET 1 -31.988 -17.350 -28.001 42 HG3 MET 1 HG3 MET 1 -32.988 -16.369 -26.931 43 HE1 MET 1 HE1 MET 1 -32.750 -18.239 -30.378 44 HE2 MET 1 HE2 MET 1 -34.353 -17.943 -31.087 45 HE3 MET 1 HE3 MET 1 -33.191 -16.611 -30.945 46 H ASP 2 H ASP 2 -28.673 -13.613 -27.670 47 HA ASP 2 HA ASP 2 -27.243 -16.247 -27.836 48 HB2 ASP 2 HB2 ASP 2 -26.917 -13.846 -29.662 49 HB3 ASP 2 HB3 ASP 2 -25.826 -15.231 -29.601 50 HA PRO 3 HA PRO 3 -25.083 -13.534 -24.792 51 HB2 PRO 3 HB2 PRO 3 -25.136 -15.106 -22.574 52 HB3 PRO 3 HB3 PRO 3 -26.587 -14.215 -23.129 53 HG2 PRO 3 HG2 PRO 3 -25.869 -17.116 -23.676 54 HG3 PRO 3 HG3 PRO 3 -27.417 -16.462 -23.057 55 HD2 PRO 3 HD2 PRO 3 -27.000 -17.019 -25.710 56 HD3 PRO 3 HD3 PRO 3 -28.037 -15.665 -25.169 57 H LEU 4 H LEU 4 -24.255 -16.283 -26.381 58 HA LEU 4 HA LEU 4 -21.526 -16.446 -25.178 59 HB2 LEU 4 HB2 LEU 4 -23.154 -18.581 -26.602 60 HB3 LEU 4 HB3 LEU 4 -21.500 -18.778 -26.037 61 HG LEU 4 HG LEU 4 -23.888 -18.271 -24.233 62 HD11 LEU 4 HD11 LEU 4 -22.229 -20.778 -24.717 63 HD12 LEU 4 HD12 LEU 4 -23.554 -20.602 -23.543 64 HD13 LEU 4 HD13 LEU 4 -23.893 -20.503 -25.277 65 HD21 LEU 4 HD21 LEU 4 -21.852 -17.373 -23.197 66 HD22 LEU 4 HD22 LEU 4 -22.314 -18.876 -22.402 67 HD23 LEU 4 HD23 LEU 4 -20.972 -18.877 -23.567 68 H ASP 5 H ASP 5 -22.019 -14.418 -26.955 69 HA ASP 5 HA ASP 5 -20.367 -15.207 -29.323 70 HB2 ASP 5 HB2 ASP 5 -22.790 -13.544 -29.008 71 HB3 ASP 5 HB3 ASP 5 -21.527 -12.723 -29.890 72 H LYS 6 H LYS 6 -19.830 -13.927 -26.459 73 HA LYS 6 HA LYS 6 -18.055 -11.683 -27.395 74 HB2 LYS 6 HB2 LYS 6 -19.236 -11.825 -24.606 75 HB3 LYS 6 HB3 LYS 6 -18.529 -10.466 -25.458 76 HG2 LYS 6 HG2 LYS 6 -20.667 -9.853 -25.827 77 HG3 LYS 6 HG3 LYS 6 -20.589 -11.014 -27.144 78 HD2 LYS 6 HD2 LYS 6 -22.621 -11.474 -25.970 79 HD3 LYS 6 HD3 LYS 6 -21.505 -12.772 -25.564 80 HE2 LYS 6 HE2 LYS 6 -22.641 -12.179 -23.561 81 HE3 LYS 6 HE3 LYS 6 -20.980 -11.620 -23.395 82 HZ1 LYS 6 HZ1 LYS 6 -23.292 -9.897 -24.135 83 HZ2 LYS 6 HZ2 LYS 6 -22.587 -9.941 -22.666 84 HZ3 LYS 6 HZ3 LYS 6 -21.757 -9.367 -23.945 85 H ILE 7 H ILE 7 -18.356 -13.914 -24.689 86 HA ILE 7 HA ILE 7 -15.394 -14.236 -24.522 87 HB ILE 7 HB ILE 7 -15.636 -14.226 -22.024 88 HG12 ILE 7 HG12 ILE 7 -17.514 -12.959 -21.031 89 HG13 ILE 7 HG13 ILE 7 -18.374 -12.985 -22.567 90 HG21 ILE 7 HG21 ILE 7 -16.380 -11.620 -23.402 91 HG22 ILE 7 HG22 ILE 7 -15.551 -11.821 -21.848 92 HG23 ILE 7 HG23 ILE 7 -14.750 -12.328 -23.340 93 HD11 ILE 7 HD11 ILE 7 -17.627 -15.469 -20.964 94 HD12 ILE 7 HD12 ILE 7 -19.197 -14.647 -20.899 95 HD13 ILE 7 HD13 ILE 7 -18.676 -15.406 -22.407 96 H ILE 8 H ILE 8 -17.813 -15.904 -25.496 97 HA ILE 8 HA ILE 8 -18.237 -18.203 -24.082 98 HB ILE 8 HB ILE 8 -19.259 -17.768 -26.196 99 HG12 ILE 8 HG12 ILE 8 -17.854 -20.465 -26.019 100 HG13 ILE 8 HG13 ILE 8 -19.403 -20.002 -25.315 101 HG21 ILE 8 HG21 ILE 8 -16.744 -18.661 -27.651 102 HG22 ILE 8 HG22 ILE 8 -18.256 -18.052 -28.351 103 HG23 ILE 8 HG23 ILE 8 -17.207 -16.960 -27.448 104 HD11 ILE 8 HD11 ILE 8 -18.751 -20.406 -28.263 105 HD12 ILE 8 HD12 ILE 8 -19.797 -21.394 -27.233 106 HD13 ILE 8 HD13 ILE 8 -20.297 -19.753 -27.680 107 H ASN 9 H ASN 9 -17.030 -19.690 -23.127 108 HA ASN 9 HA ASN 9 -14.588 -20.795 -24.398 109 HB2 ASN 9 HB2 ASN 9 -14.210 -18.745 -22.751 110 HB3 ASN 9 HB3 ASN 9 -14.471 -19.945 -21.491 111 HD21 ASN 9 HD21 ASN 9 -11.312 -21.592 -22.219 112 HD22 ASN 9 HD22 ASN 9 -12.973 -21.996 -21.781 113 H ASP 10 H ASP 10 -17.464 -21.662 -23.437 114 HA ASP 10 HA ASP 10 -16.812 -23.536 -21.374 115 HB2 ASP 10 HB2 ASP 10 -18.907 -22.161 -21.481 116 HB3 ASP 10 HB3 ASP 10 -19.418 -23.086 -22.889 117 H ILE 11 H ILE 11 -16.045 -23.892 -24.320 118 HA ILE 11 HA ILE 11 -16.214 -26.824 -24.401 119 HB ILE 11 HB ILE 11 -18.296 -25.871 -25.454 120 HG12 ILE 11 HG12 ILE 11 -18.470 -27.210 -27.413 121 HG13 ILE 11 HG13 ILE 11 -16.732 -27.402 -27.552 122 HG21 ILE 11 HG21 ILE 11 -16.454 -24.825 -27.637 123 HG22 ILE 11 HG22 ILE 11 -18.226 -24.783 -27.632 124 HG23 ILE 11 HG23 ILE 11 -17.327 -23.836 -26.445 125 HD11 ILE 11 HD11 ILE 11 -18.421 -28.422 -25.219 126 HD12 ILE 11 HD12 ILE 11 -17.876 -29.398 -26.599 127 HD13 ILE 11 HD13 ILE 11 -16.684 -28.732 -25.473 128 H LYS 12 H LYS 12 -14.097 -24.844 -24.092 129 HA LYS 12 HA LYS 12 -12.302 -25.931 -26.225 130 HB2 LYS 12 HB2 LYS 12 -12.855 -23.540 -26.579 131 HB3 LYS 12 HB3 LYS 12 -12.167 -23.145 -24.998 132 HG2 LYS 12 HG2 LYS 12 -9.951 -23.975 -25.745 133 HG3 LYS 12 HG3 LYS 12 -10.630 -24.420 -27.316 134 HD2 LYS 12 HD2 LYS 12 -10.545 -21.587 -26.182 135 HD3 LYS 12 HD3 LYS 12 -9.348 -22.270 -27.294 136 HE2 LYS 12 HE2 LYS 12 -11.148 -22.664 -28.979 137 HE3 LYS 12 HE3 LYS 12 -12.320 -21.910 -27.891 138 HZ1 LYS 12 HZ1 LYS 12 -9.938 -20.550 -29.034 139 HZ2 LYS 12 HZ2 LYS 12 -11.478 -20.318 -29.516 140 HZ3 LYS 12 HZ3 LYS 12 -11.016 -19.852 -28.022 141 H LYS 13 H LYS 13 -12.402 -24.807 -22.846 142 HA LYS 13 HA LYS 13 -10.389 -26.724 -22.043 143 HB2 LYS 13 HB2 LYS 13 -9.112 -24.723 -23.083 144 HB3 LYS 13 HB3 LYS 13 -9.649 -23.782 -21.692 145 HG2 LYS 13 HG2 LYS 13 -8.459 -25.360 -20.179 146 HG3 LYS 13 HG3 LYS 13 -8.023 -26.369 -21.575 147 HD2 LYS 13 HD2 LYS 13 -6.781 -24.417 -22.551 148 HD3 LYS 13 HD3 LYS 13 -7.141 -23.489 -21.080 149 HE2 LYS 13 HE2 LYS 13 -5.947 -25.202 -19.723 150 HE3 LYS 13 HE3 LYS 13 -5.607 -26.129 -21.191 151 HZ1 LYS 13 HZ1 LYS 13 -4.616 -23.379 -20.646 152 HZ2 LYS 13 HZ2 LYS 13 -3.717 -24.738 -20.585 153 HZ3 LYS 13 HZ3 LYS 13 -4.316 -24.226 -22.012 154 H GLU 14 H GLU 14 -10.483 -27.187 -19.888 155 HA GLU 14 HA GLU 14 -11.808 -25.434 -17.940 156 HB2 GLU 14 HB2 GLU 14 -13.684 -26.592 -19.124 157 HB3 GLU 14 HB3 GLU 14 -12.993 -28.152 -18.673 158 HG2 GLU 14 HG2 GLU 14 -13.367 -27.663 -16.293 159 HG3 GLU 14 HG3 GLU 14 -13.877 -26.016 -16.683 160 H ALA 15 H ALA 15 -11.422 -26.065 -15.769 161 HA ALA 15 HA ALA 15 -9.998 -28.576 -15.199 162 HB1 ALA 15 HB1 ALA 15 -8.888 -25.858 -14.376 163 HB2 ALA 15 HB2 ALA 15 -8.258 -27.446 -13.885 164 HB3 ALA 15 HB3 ALA 15 -8.176 -26.954 -15.588 165 H ASN 16 H ASN 16 -9.985 -29.119 -12.936 166 HA ASN 16 HA ASN 16 -12.471 -28.197 -11.588 167 HB2 ASN 16 HB2 ASN 16 -12.202 -30.541 -12.517 168 HB3 ASN 16 HB3 ASN 16 -11.001 -30.835 -11.263 169 HD21 ASN 16 HD21 ASN 16 -13.506 -30.859 -8.628 170 HD22 ASN 16 HD22 ASN 16 -11.840 -30.358 -8.947 171 H ASP 17 H ASP 17 -10.912 -26.340 -10.937 172 HA ASP 17 HA ASP 17 -9.582 -26.974 -8.317 173 HB2 ASP 17 HB2 ASP 17 -9.065 -24.746 -10.309 174 HB3 ASP 17 HB3 ASP 17 -8.423 -24.781 -8.667 175 H SER 18 H SER 18 -10.968 -26.723 -6.754 176 HA SER 18 HA SER 18 -12.460 -24.153 -6.447 177 HB2 SER 18 HB2 SER 18 -13.612 -26.941 -6.042 178 HB3 SER 18 HB3 SER 18 -14.389 -25.425 -5.551 179 HG SER 18 HG SER 18 -15.139 -26.162 -7.591 180 H GLY 19 H GLY 19 -11.321 -23.310 -4.832 181 HA2 GLY 19 HA2 GLY 19 -11.742 -23.382 -2.280 182 HA3 GLY 19 HA3 GLY 19 -10.785 -24.865 -2.326 183 H VAL 20 H VAL 20 -8.970 -23.720 -4.431 184 HA VAL 20 HA VAL 20 -7.725 -21.375 -3.146 185 HB VAL 20 HB VAL 20 -6.585 -23.232 -2.128 186 HG11 VAL 20 HG11 VAL 20 -5.642 -24.158 -4.868 187 HG12 VAL 20 HG12 VAL 20 -5.187 -24.820 -3.289 188 HG13 VAL 20 HG13 VAL 20 -6.850 -24.990 -3.865 189 HG21 VAL 20 HG21 VAL 20 -5.335 -21.160 -2.650 190 HG22 VAL 20 HG22 VAL 20 -4.290 -22.591 -2.643 191 HG23 VAL 20 HG23 VAL 20 -4.795 -21.877 -4.188 192 H THR 21 H THR 21 -7.481 -19.870 -4.629 193 HA THR 21 HA THR 21 -6.348 -20.432 -7.245 194 HB THR 21 HB THR 21 -8.692 -18.912 -7.926 195 HG1 THR 21 HG1 THR 21 -10.295 -20.442 -7.613 196 HG21 THR 21 HG21 THR 21 -7.832 -21.748 -8.616 197 HG22 THR 21 HG22 THR 21 -8.990 -20.750 -9.536 198 HG23 THR 21 HG23 THR 21 -7.288 -20.260 -9.425 199 H LEU 22 H LEU 22 -6.039 -18.547 -8.583 200 HA LEU 22 HA LEU 22 -5.141 -16.316 -6.952 201 HB2 LEU 22 HB2 LEU 22 -3.736 -15.755 -8.785 202 HB3 LEU 22 HB3 LEU 22 -3.627 -17.484 -8.508 203 HG LEU 22 HG LEU 22 -5.610 -16.611 -10.601 204 HD11 LEU 22 HD11 LEU 22 -2.601 -16.507 -11.054 205 HD12 LEU 22 HD12 LEU 22 -3.854 -16.389 -12.312 206 HD13 LEU 22 HD13 LEU 22 -3.719 -15.123 -11.083 207 HD21 LEU 22 HD21 LEU 22 -5.196 -19.026 -10.138 208 HD22 LEU 22 HD22 LEU 22 -4.736 -18.576 -11.782 209 HD23 LEU 22 HD23 LEU 22 -3.483 -18.796 -10.543 210 H ALA 23 H ALA 23 -7.921 -16.385 -7.253 211 HA ALA 23 HA ALA 23 -8.461 -13.714 -8.416 212 HB1 ALA 23 HB1 ALA 23 -9.949 -16.252 -9.206 213 HB2 ALA 23 HB2 ALA 23 -10.438 -14.596 -9.633 214 HB3 ALA 23 HB3 ALA 23 -8.911 -15.257 -10.249 215 HA PRO 24 HA PRO 24 -10.591 -13.946 -4.474 216 HB2 PRO 24 HB2 PRO 24 -11.302 -11.348 -4.103 217 HB3 PRO 24 HB3 PRO 24 -9.603 -11.908 -4.059 218 HG2 PRO 24 HG2 PRO 24 -11.082 -10.631 -6.382 219 HG3 PRO 24 HG3 PRO 24 -9.468 -10.216 -5.724 220 HD2 PRO 24 HD2 PRO 24 -9.802 -11.859 -7.902 221 HD3 PRO 24 HD3 PRO 24 -8.467 -12.083 -6.739 222 H LEU 25 H LEU 25 -12.289 -12.481 -7.247 223 HA LEU 25 HA LEU 25 -14.789 -13.824 -6.518 224 HB2 LEU 25 HB2 LEU 25 -14.795 -11.649 -5.238 225 HB3 LEU 25 HB3 LEU 25 -14.677 -10.787 -6.768 226 HG LEU 25 HG LEU 25 -16.914 -11.645 -7.434 227 HD11 LEU 25 HD11 LEU 25 -16.909 -12.999 -4.704 228 HD12 LEU 25 HD12 LEU 25 -18.336 -12.795 -5.747 229 HD13 LEU 25 HD13 LEU 25 -16.997 -13.804 -6.291 230 HD21 LEU 25 HD21 LEU 25 -16.723 -9.537 -6.163 231 HD22 LEU 25 HD22 LEU 25 -18.233 -10.388 -5.807 232 HD23 LEU 25 HD23 LEU 25 -16.892 -10.439 -4.640 233 H SER 26 H SER 26 -13.592 -14.772 -8.461 234 HA SER 26 HA SER 26 -13.210 -15.114 -10.677 235 HB2 SER 26 HB2 SER 26 -15.740 -14.849 -10.745 236 HB3 SER 26 HB3 SER 26 -15.459 -13.207 -11.352 237 HG SER 26 HG SER 26 -15.710 -14.828 -13.019 238 H VAL 27 H VAL 27 -13.019 -13.745 -12.879 239 HA VAL 27 HA VAL 27 -11.644 -12.479 -14.130 240 HB VAL 27 HB VAL 27 -12.316 -10.505 -11.958 241 HG11 VAL 27 HG11 VAL 27 -11.062 -9.698 -14.604 242 HG12 VAL 27 HG12 VAL 27 -11.648 -8.646 -13.323 243 HG13 VAL 27 HG13 VAL 27 -10.228 -9.643 -13.026 244 HG21 VAL 27 HG21 VAL 27 -14.181 -11.292 -13.346 245 HG22 VAL 27 HG22 VAL 27 -13.835 -9.589 -13.654 246 HG23 VAL 27 HG23 VAL 27 -13.298 -10.823 -14.816 247 HA PRO 28 HA PRO 28 -7.398 -12.904 -12.638 248 HB2 PRO 28 HB2 PRO 28 -5.977 -11.656 -14.615 249 HB3 PRO 28 HB3 PRO 28 -6.796 -13.225 -14.833 250 HG2 PRO 28 HG2 PRO 28 -7.889 -10.477 -15.547 251 HG3 PRO 28 HG3 PRO 28 -7.757 -11.921 -16.607 252 HD2 PRO 28 HD2 PRO 28 -10.065 -11.388 -15.350 253 HD3 PRO 28 HD3 PRO 28 -9.468 -13.060 -15.421 254 H LYS 29 H LYS 29 -8.376 -11.532 -10.946 255 HA LYS 29 HA LYS 29 -8.596 -9.901 -9.487 256 HB2 LYS 29 HB2 LYS 29 -6.261 -10.349 -9.076 257 HB3 LYS 29 HB3 LYS 29 -5.780 -9.152 -10.288 258 HG2 LYS 29 HG2 LYS 29 -5.529 -8.079 -8.147 259 HG3 LYS 29 HG3 LYS 29 -6.959 -7.386 -8.895 260 HD2 LYS 29 HD2 LYS 29 -8.341 -9.025 -7.497 261 HD3 LYS 29 HD3 LYS 29 -6.816 -9.507 -6.736 262 HE2 LYS 29 HE2 LYS 29 -7.558 -7.936 -5.222 263 HE3 LYS 29 HE3 LYS 29 -6.516 -6.958 -6.259 264 HZ1 LYS 29 HZ1 LYS 29 -9.497 -7.134 -6.389 265 HZ2 LYS 29 HZ2 LYS 29 -8.641 -5.839 -5.907 266 HZ3 LYS 29 HZ3 LYS 29 -8.624 -6.292 -7.482 267 HA PRO 30 HA PRO 30 -10.101 -6.463 -12.045 268 HB2 PRO 30 HB2 PRO 30 -12.247 -5.748 -10.505 269 HB3 PRO 30 HB3 PRO 30 -12.273 -7.145 -11.621 270 HG2 PRO 30 HG2 PRO 30 -11.754 -7.154 -8.635 271 HG3 PRO 30 HG3 PRO 30 -12.851 -8.218 -9.574 272 HD2 PRO 30 HD2 PRO 30 -10.342 -8.971 -8.837 273 HD3 PRO 30 HD3 PRO 30 -11.052 -9.504 -10.385 274 H LYS 31 H LYS 31 -10.133 -4.173 -11.718 275 HA LYS 31 HA LYS 31 -8.218 -3.181 -9.798 276 HB2 LYS 31 HB2 LYS 31 -8.506 -1.032 -10.813 277 HB3 LYS 31 HB3 LYS 31 -8.407 -2.275 -12.043 278 HG2 LYS 31 HG2 LYS 31 -10.110 -1.077 -12.936 279 HG3 LYS 31 HG3 LYS 31 -11.085 -2.159 -11.945 280 HD2 LYS 31 HD2 LYS 31 -11.163 -0.355 -10.167 281 HD3 LYS 31 HD3 LYS 31 -10.219 0.689 -11.247 282 HE2 LYS 31 HE2 LYS 31 -12.010 0.477 -12.975 283 HE3 LYS 31 HE3 LYS 31 -12.950 -0.531 -11.867 284 HZ1 LYS 31 HZ1 LYS 31 -12.181 2.298 -11.361 285 HZ2 LYS 31 HZ2 LYS 31 -13.670 1.787 -11.787 286 HZ3 LYS 31 HZ3 LYS 31 -13.054 1.368 -10.337 287 H LEU 32 H LEU 32 -8.422 -1.842 -8.033 288 HA LEU 32 HA LEU 32 -11.076 -1.319 -6.861 289 HB2 LEU 32 HB2 LEU 32 -10.560 -3.629 -6.209 290 HB3 LEU 32 HB3 LEU 32 -8.926 -3.155 -5.731 291 HG LEU 32 HG LEU 32 -9.895 -1.713 -3.949 292 HD11 LEU 32 HD11 LEU 32 -12.505 -3.124 -4.684 293 HD12 LEU 32 HD12 LEU 32 -12.243 -2.146 -3.226 294 HD13 LEU 32 HD13 LEU 32 -12.196 -1.380 -4.817 295 HD21 LEU 32 HD21 LEU 32 -9.057 -3.973 -3.523 296 HD22 LEU 32 HD22 LEU 32 -10.417 -3.579 -2.446 297 HD23 LEU 32 HD23 LEU 32 -10.674 -4.654 -3.840 298 H GLU 33 H GLU 33 -11.049 0.562 -5.801 299 HA GLU 33 HA GLU 33 -8.549 1.687 -4.626 300 HB2 GLU 33 HB2 GLU 33 -10.427 3.132 -6.546 301 HB3 GLU 33 HB3 GLU 33 -9.191 3.915 -5.552 302 HG2 GLU 33 HG2 GLU 33 -7.429 2.593 -6.694 303 HG3 GLU 33 HG3 GLU 33 -8.657 1.844 -7.722 304 H GLU 34 H GLU 34 -9.483 0.971 -2.627 305 HA GLU 34 HA GLU 34 -11.613 2.770 -1.567 306 HB2 GLU 34 HB2 GLU 34 -12.541 0.556 -2.178 307 HB3 GLU 34 HB3 GLU 34 -11.389 -0.230 -1.089 308 HG2 GLU 34 HG2 GLU 34 -12.346 1.020 0.821 309 HG3 GLU 34 HG3 GLU 34 -13.432 1.881 -0.270 310 H LEU 35 H LEU 35 -10.121 4.097 -0.601 311 HA LEU 35 HA LEU 35 -8.765 3.103 1.866 312 HB2 LEU 35 HB2 LEU 35 -7.760 5.013 -0.284 313 HB3 LEU 35 HB3 LEU 35 -7.007 4.860 1.291 314 HG LEU 35 HG LEU 35 -7.322 2.284 -0.207 315 HD11 LEU 35 HD11 LEU 35 -5.245 4.282 -1.124 316 HD12 LEU 35 HD12 LEU 35 -5.498 2.618 -1.692 317 HD13 LEU 35 HD13 LEU 35 -6.715 3.852 -2.030 318 HD21 LEU 35 HD21 LEU 35 -6.145 2.422 1.960 319 HD22 LEU 35 HD22 LEU 35 -5.068 1.895 0.659 320 HD23 LEU 35 HD23 LEU 35 -4.976 3.566 1.249 321 H SER 36 H SER 36 -8.635 4.706 3.546 322 HA SER 36 HA SER 36 -10.732 6.768 3.622 323 HB2 SER 36 HB2 SER 36 -10.010 5.546 5.648 324 HB3 SER 36 HB3 SER 36 -8.393 6.262 5.500 325 HG SER 36 HG SER 36 -9.866 7.387 6.951 326 H GLU 37 H GLU 37 -10.085 9.137 4.056 327 HA GLU 37 HA GLU 37 -8.661 10.137 1.798 328 HB2 GLU 37 HB2 GLU 37 -10.430 11.341 3.025 329 HB3 GLU 37 HB3 GLU 37 -9.340 11.557 4.403 330 HG2 GLU 37 HG2 GLU 37 -7.816 12.911 3.006 331 HG3 GLU 37 HG3 GLU 37 -8.818 12.606 1.585 332 H GLN 38 H GLN 38 -7.492 9.748 5.167 333 HA GLN 38 HA GLN 38 -4.816 10.744 4.476 334 HB2 GLN 38 HB2 GLN 38 -4.170 9.984 6.712 335 HB3 GLN 38 HB3 GLN 38 -5.542 11.083 6.737 336 HG2 GLN 38 HG2 GLN 38 -7.079 9.372 7.337 337 HG3 GLN 38 HG3 GLN 38 -5.987 8.075 6.857 338 HE21 GLN 38 HE21 GLN 38 -4.087 8.095 9.870 339 HE22 GLN 38 HE22 GLN 38 -4.028 7.665 8.167 340 H GLN 39 H GLN 39 -6.360 7.551 4.641 341 HA GLN 39 HA GLN 39 -3.907 6.050 4.425 342 HB2 GLN 39 HB2 GLN 39 -6.799 5.360 3.930 343 HB3 GLN 39 HB3 GLN 39 -5.498 4.206 3.644 344 HG2 GLN 39 HG2 GLN 39 -4.741 4.404 5.982 345 HG3 GLN 39 HG3 GLN 39 -6.027 5.560 6.326 346 HE21 GLN 39 HE21 GLN 39 -7.031 1.965 7.225 347 HE22 GLN 39 HE22 GLN 39 -5.489 2.750 7.476 348 H LYS 40 H LYS 40 -6.165 7.377 2.011 349 HA LYS 40 HA LYS 40 -4.968 6.269 -0.332 350 HB2 LYS 40 HB2 LYS 40 -7.160 7.401 -0.237 351 HB3 LYS 40 HB3 LYS 40 -6.383 8.937 0.155 352 HG2 LYS 40 HG2 LYS 40 -5.228 8.931 -2.034 353 HG3 LYS 40 HG3 LYS 40 -5.998 7.392 -2.449 354 HD2 LYS 40 HD2 LYS 40 -7.494 9.979 -1.804 355 HD3 LYS 40 HD3 LYS 40 -7.080 9.442 -3.441 356 HE2 LYS 40 HE2 LYS 40 -8.397 7.352 -3.077 357 HE3 LYS 40 HE3 LYS 40 -8.864 7.936 -1.474 358 HZ1 LYS 40 HZ1 LYS 40 -9.518 9.291 -4.039 359 HZ2 LYS 40 HZ2 LYS 40 -10.569 8.440 -3.129 360 HZ3 LYS 40 HZ3 LYS 40 -9.947 9.838 -2.560 361 H ILE 41 H ILE 41 -4.157 9.233 1.512 362 HA ILE 41 HA ILE 41 -2.034 10.050 -0.268 363 HB ILE 41 HB ILE 41 -2.483 10.772 2.613 364 HG12 ILE 41 HG12 ILE 41 -3.218 12.481 0.181 365 HG13 ILE 41 HG13 ILE 41 -4.367 11.328 0.825 366 HG21 ILE 41 HG21 ILE 41 -0.781 12.133 0.489 367 HG22 ILE 41 HG22 ILE 41 -1.147 12.827 2.082 368 HG23 ILE 41 HG23 ILE 41 -0.207 11.347 1.976 369 HD11 ILE 41 HD11 ILE 41 -3.235 13.702 2.341 370 HD12 ILE 41 HD12 ILE 41 -4.890 13.468 1.741 371 HD13 ILE 41 HD13 ILE 41 -4.278 12.440 3.044 372 H ILE 42 H ILE 42 -2.011 8.137 2.834 373 HA ILE 42 HA ILE 42 0.862 7.904 2.925 374 HB ILE 42 HB ILE 42 -1.285 6.041 3.992 375 HG12 ILE 42 HG12 ILE 42 0.379 7.950 5.674 376 HG13 ILE 42 HG13 ILE 42 -1.060 8.544 4.864 377 HG21 ILE 42 HG21 ILE 42 1.713 6.161 4.582 378 HG22 ILE 42 HG22 ILE 42 0.550 5.233 5.540 379 HG23 ILE 42 HG23 ILE 42 0.827 4.805 3.857 380 HD11 ILE 42 HD11 ILE 42 -1.001 6.238 6.848 381 HD12 ILE 42 HD12 ILE 42 -1.665 7.865 7.104 382 HD13 ILE 42 HD13 ILE 42 -2.425 6.769 5.929 383 H LEU 43 H LEU 43 -1.650 5.869 1.459 384 HA LEU 43 HA LEU 43 -0.038 3.808 0.389 385 HB2 LEU 43 HB2 LEU 43 -2.478 3.767 0.597 386 HB3 LEU 43 HB3 LEU 43 -2.657 5.036 -0.584 387 HG LEU 43 HG LEU 43 -3.243 2.695 -1.242 388 HD11 LEU 43 HD11 LEU 43 -1.201 4.045 -3.029 389 HD12 LEU 43 HD12 LEU 43 -2.422 2.860 -3.514 390 HD13 LEU 43 HD13 LEU 43 -2.920 4.448 -2.908 391 HD21 LEU 43 HD21 LEU 43 -1.477 1.453 -0.257 392 HD22 LEU 43 HD22 LEU 43 -1.434 1.187 -2.002 393 HD23 LEU 43 HD23 LEU 43 -0.226 2.249 -1.244 394 H ALA 44 H ALA 44 -1.139 6.849 -1.154 395 HA ALA 44 HA ALA 44 0.304 6.562 -3.573 396 HB1 ALA 44 HB1 ALA 44 -0.701 9.006 -2.064 397 HB2 ALA 44 HB2 ALA 44 -0.219 9.007 -3.774 398 HB3 ALA 44 HB3 ALA 44 -1.628 8.051 -3.245 399 H GLU 45 H GLU 45 1.201 8.453 -0.605 400 HA GLU 45 HA GLU 45 3.685 9.405 -1.658 401 HB2 GLU 45 HB2 GLU 45 2.640 9.048 1.170 402 HB3 GLU 45 HB3 GLU 45 4.204 9.770 0.825 403 HG2 GLU 45 HG2 GLU 45 1.603 10.866 -0.323 404 HG3 GLU 45 HG3 GLU 45 2.313 11.402 1.193 405 H TYR 46 H TYR 46 2.901 6.279 -0.184 406 HA TYR 46 HA TYR 46 5.660 5.548 0.340 407 HB2 TYR 46 HB2 TYR 46 3.784 4.585 1.542 408 HB3 TYR 46 HB3 TYR 46 3.108 3.942 0.054 409 HD1 TYR 46 HD1 TYR 46 6.778 3.546 0.433 410 HD2 TYR 46 HD2 TYR 46 2.897 1.862 1.296 411 HE1 TYR 46 HE1 TYR 46 7.824 1.344 0.812 412 HE2 TYR 46 HE2 TYR 46 3.970 -0.379 1.646 413 HH TYR 46 HH TYR 46 7.490 -0.869 1.294 414 H ILE 47 H ILE 47 3.365 4.621 -2.337 415 HA ILE 47 HA ILE 47 5.250 3.361 -4.007 416 HB ILE 47 HB ILE 47 2.663 4.852 -4.427 417 HG12 ILE 47 HG12 ILE 47 3.208 1.868 -4.692 418 HG13 ILE 47 HG13 ILE 47 2.935 2.571 -3.114 419 HG21 ILE 47 HG21 ILE 47 4.156 3.229 -6.529 420 HG22 ILE 47 HG22 ILE 47 2.469 3.751 -6.677 421 HG23 ILE 47 HG23 ILE 47 3.750 4.951 -6.619 422 HD11 ILE 47 HD11 ILE 47 0.927 2.716 -5.400 423 HD12 ILE 47 HD12 ILE 47 0.831 1.682 -3.957 424 HD13 ILE 47 HD13 ILE 47 0.745 3.446 -3.810 425 H ALA 48 H ALA 48 4.449 6.852 -3.587 426 HA ALA 48 HA ALA 48 5.988 7.836 -5.805 427 HB1 ALA 48 HB1 ALA 48 5.289 9.136 -3.147 428 HB2 ALA 48 HB2 ALA 48 5.772 9.984 -4.630 429 HB3 ALA 48 HB3 ALA 48 4.230 9.106 -4.568 430 H GLU 49 H GLU 49 6.981 6.678 -2.633 431 HA GLU 49 HA GLU 49 9.671 7.880 -2.855 432 HB2 GLU 49 HB2 GLU 49 8.305 7.833 -0.724 433 HB3 GLU 49 HB3 GLU 49 8.521 6.085 -0.694 434 HG2 GLU 49 HG2 GLU 49 10.113 7.056 0.791 435 HG3 GLU 49 HG3 GLU 49 11.010 6.440 -0.583 436 H VAL 50 H VAL 50 8.140 4.652 -3.264 437 HA VAL 50 HA VAL 50 10.859 3.534 -3.838 438 HB VAL 50 HB VAL 50 10.329 1.522 -2.757 439 HG11 VAL 50 HG11 VAL 50 9.382 3.691 -0.861 440 HG12 VAL 50 HG12 VAL 50 10.147 2.146 -0.452 441 HG13 VAL 50 HG13 VAL 50 11.083 3.392 -1.295 442 HG21 VAL 50 HG21 VAL 50 7.963 1.223 -3.281 443 HG22 VAL 50 HG22 VAL 50 8.264 1.047 -1.562 444 HG23 VAL 50 HG23 VAL 50 7.520 2.533 -2.184 445 H GLY 51 H GLY 51 7.616 3.831 -5.081 446 HA2 GLY 51 HA2 GLY 51 6.881 3.223 -7.195 447 HA3 GLY 51 HA3 GLY 51 8.256 2.151 -7.420 448 H LEU 52 H LEU 52 5.376 1.727 -7.849 449 HA LEU 52 HA LEU 52 4.106 0.197 -5.938 450 HB2 LEU 52 HB2 LEU 52 3.371 1.185 -8.277 451 HB3 LEU 52 HB3 LEU 52 3.931 -0.322 -8.951 452 HG LEU 52 HG LEU 52 1.583 -0.355 -8.858 453 HD11 LEU 52 HD11 LEU 52 2.219 -2.040 -6.429 454 HD12 LEU 52 HD12 LEU 52 0.965 -2.280 -7.648 455 HD13 LEU 52 HD13 LEU 52 2.670 -2.518 -8.083 456 HD21 LEU 52 HD21 LEU 52 1.229 1.392 -7.214 457 HD22 LEU 52 HD22 LEU 52 0.250 -0.030 -6.833 458 HD23 LEU 52 HD23 LEU 52 1.725 0.290 -5.902 459 H GLN 53 H GLN 53 6.594 -0.665 -7.966 460 HA GLN 53 HA GLN 53 6.436 -3.590 -7.808 461 HB2 GLN 53 HB2 GLN 53 8.303 -3.617 -9.290 462 HB3 GLN 53 HB3 GLN 53 7.192 -2.359 -9.825 463 HG2 GLN 53 HG2 GLN 53 8.730 -0.709 -8.487 464 HG3 GLN 53 HG3 GLN 53 9.882 -2.044 -8.441 465 HE21 GLN 53 HE21 GLN 53 9.271 0.014 -11.938 466 HE22 GLN 53 HE22 GLN 53 8.215 0.293 -10.563 467 H ASN 54 H ASN 54 7.765 -1.230 -5.689 468 HA ASN 54 HA ASN 54 9.544 -3.278 -4.426 469 HB2 ASN 54 HB2 ASN 54 9.863 -0.267 -4.424 470 HB3 ASN 54 HB3 ASN 54 10.938 -1.405 -3.627 471 HD21 ASN 54 HD21 ASN 54 11.835 -0.391 -7.314 472 HD22 ASN 54 HD22 ASN 54 10.796 0.522 -6.208 473 H ILE 55 H ILE 55 6.780 -1.439 -3.906 474 HA ILE 55 HA ILE 55 6.797 -1.590 -0.992 475 HB ILE 55 HB ILE 55 4.398 -1.328 -1.057 476 HG12 ILE 55 HG12 ILE 55 4.568 -1.278 -4.083 477 HG13 ILE 55 HG13 ILE 55 3.948 -2.661 -3.169 478 HG21 ILE 55 HG21 ILE 55 5.519 0.646 -3.081 479 HG22 ILE 55 HG22 ILE 55 4.331 0.920 -1.781 480 HG23 ILE 55 HG23 ILE 55 6.010 0.629 -1.383 481 HD11 ILE 55 HD11 ILE 55 2.765 0.136 -3.184 482 HD12 ILE 55 HD12 ILE 55 2.105 -1.303 -3.974 483 HD13 ILE 55 HD13 ILE 55 2.195 -1.238 -2.197 484 H THR 56 H THR 56 5.763 -3.166 0.349 485 HA THR 56 HA THR 56 5.193 -5.799 -0.927 486 HB THR 56 HB THR 56 6.150 -6.607 1.441 487 HG1 THR 56 HG1 THR 56 8.147 -5.279 1.686 488 HG21 THR 56 HG21 THR 56 8.013 -5.751 -0.823 489 HG22 THR 56 HG22 THR 56 8.354 -6.989 0.412 490 HG23 THR 56 HG23 THR 56 7.079 -7.263 -0.784 491 H ALA 57 H ALA 57 3.475 -6.973 -0.026 492 HA ALA 57 HA ALA 57 1.411 -5.493 1.201 493 HB1 ALA 57 HB1 ALA 57 1.813 -8.514 1.046 494 HB2 ALA 57 HB2 ALA 57 0.282 -7.662 1.347 495 HB3 ALA 57 HB3 ALA 57 1.091 -7.498 -0.222 496 H ILE 58 H ILE 58 4.061 -7.261 2.620 497 HA ILE 58 HA ILE 58 3.083 -7.513 5.341 498 HB ILE 58 HB ILE 58 5.843 -7.490 4.037 499 HG12 ILE 58 HG12 ILE 58 5.890 -9.908 4.731 500 HG13 ILE 58 HG13 ILE 58 4.233 -9.778 5.312 501 HG21 ILE 58 HG21 ILE 58 5.065 -7.927 6.962 502 HG22 ILE 58 HG22 ILE 58 6.650 -8.406 6.293 503 HG23 ILE 58 HG23 ILE 58 6.178 -6.707 6.318 504 HD11 ILE 58 HD11 ILE 58 5.059 -9.361 2.404 505 HD12 ILE 58 HD12 ILE 58 4.529 -10.911 3.086 506 HD13 ILE 58 HD13 ILE 58 3.400 -9.558 3.043 507 H THR 59 H THR 59 5.019 -5.107 3.557 508 HA THR 59 HA THR 59 5.449 -3.416 5.915 509 HB THR 59 HB THR 59 5.955 -2.922 2.961 510 HG1 THR 59 HG1 THR 59 7.447 -4.268 3.283 511 HG21 THR 59 HG21 THR 59 6.964 -1.536 5.485 512 HG22 THR 59 HG22 THR 59 7.626 -1.287 3.848 513 HG23 THR 59 HG23 THR 59 5.951 -0.822 4.201 514 H LEU 60 H LEU 60 3.473 -3.323 2.956 515 HA LEU 60 HA LEU 60 2.115 -0.918 3.496 516 HB2 LEU 60 HB2 LEU 60 2.387 -2.189 1.307 517 HB3 LEU 60 HB3 LEU 60 1.186 -3.321 1.887 518 HG LEU 60 HG LEU 60 -0.435 -1.314 2.054 519 HD11 LEU 60 HD11 LEU 60 1.763 -0.008 0.387 520 HD12 LEU 60 HD12 LEU 60 0.186 0.682 0.794 521 HD13 LEU 60 HD13 LEU 60 1.359 0.439 2.067 522 HD21 LEU 60 HD21 LEU 60 -0.528 -2.878 0.178 523 HD22 LEU 60 HD22 LEU 60 -0.798 -1.224 -0.403 524 HD23 LEU 60 HD23 LEU 60 0.772 -2.018 -0.653 525 H SER 61 H SER 61 1.288 -4.298 4.483 526 HA SER 61 HA SER 61 -1.183 -3.732 5.672 527 HB2 SER 61 HB2 SER 61 -1.020 -5.672 6.967 528 HB3 SER 61 HB3 SER 61 -0.360 -6.008 5.374 529 HG SER 61 HG SER 61 0.919 -6.815 7.154 530 H LYS 62 H LYS 62 1.982 -2.928 6.684 531 HA LYS 62 HA LYS 62 1.088 -2.101 9.378 532 HB2 LYS 62 HB2 LYS 62 3.886 -2.483 8.262 533 HB3 LYS 62 HB3 LYS 62 3.535 -1.855 9.879 534 HG2 LYS 62 HG2 LYS 62 2.255 -3.928 10.410 535 HG3 LYS 62 HG3 LYS 62 2.686 -4.590 8.824 536 HD2 LYS 62 HD2 LYS 62 5.096 -4.410 9.414 537 HD3 LYS 62 HD3 LYS 62 4.637 -3.779 11.015 538 HE2 LYS 62 HE2 LYS 62 3.357 -5.881 11.447 539 HE3 LYS 62 HE3 LYS 62 3.865 -6.505 9.873 540 HZ1 LYS 62 HZ1 LYS 62 5.701 -5.815 12.111 541 HZ2 LYS 62 HZ2 LYS 62 5.295 -7.328 11.658 542 HZ3 LYS 62 HZ3 LYS 62 6.178 -6.389 10.656 543 H LYS 63 H LYS 63 2.317 -0.602 6.394 544 HA LYS 63 HA LYS 63 2.845 2.018 7.389 545 HB2 LYS 63 HB2 LYS 63 1.965 0.852 4.733 546 HB3 LYS 63 HB3 LYS 63 2.306 2.572 4.900 547 HG2 LYS 63 HG2 LYS 63 4.445 0.738 5.921 548 HG3 LYS 63 HG3 LYS 63 4.116 0.634 4.188 549 HD2 LYS 63 HD2 LYS 63 4.469 3.015 3.908 550 HD3 LYS 63 HD3 LYS 63 4.754 3.231 5.646 551 HE2 LYS 63 HE2 LYS 63 6.391 1.371 3.881 552 HE3 LYS 63 HE3 LYS 63 6.787 3.084 4.067 553 HZ1 LYS 63 HZ1 LYS 63 6.678 1.141 6.318 554 HZ2 LYS 63 HZ2 LYS 63 8.042 1.729 5.640 555 HZ3 LYS 63 HZ3 LYS 63 7.046 2.727 6.453 556 H LEU 64 H LEU 64 -0.182 0.489 6.394 557 HA LEU 64 HA LEU 64 -1.698 2.945 7.199 558 HB2 LEU 64 HB2 LEU 64 -2.530 0.859 5.145 559 HB3 LEU 64 HB3 LEU 64 -3.368 2.334 5.578 560 HG LEU 64 HG LEU 64 -0.935 3.357 4.837 561 HD11 LEU 64 HD11 LEU 64 -1.447 1.015 2.942 562 HD12 LEU 64 HD12 LEU 64 -0.173 2.252 2.811 563 HD13 LEU 64 HD13 LEU 64 -0.138 1.052 4.115 564 HD21 LEU 64 HD21 LEU 64 -3.123 4.052 4.040 565 HD22 LEU 64 HD22 LEU 64 -1.967 3.882 2.722 566 HD23 LEU 64 HD23 LEU 64 -3.219 2.635 2.967 567 H ASN 65 H ASN 65 -0.917 0.249 8.662 568 HA ASN 65 HA ASN 65 -1.823 -1.093 10.258 569 HB2 ASN 65 HB2 ASN 65 -1.827 0.949 11.441 570 HB3 ASN 65 HB3 ASN 65 -3.231 1.566 10.593 571 HD21 ASN 65 HD21 ASN 65 -5.468 0.483 13.003 572 HD22 ASN 65 HD22 ASN 65 -5.109 1.483 11.595 573 H ILE 66 H ILE 66 -2.504 -2.348 8.290 574 HA ILE 66 HA ILE 66 -5.425 -2.959 8.300 575 HB ILE 66 HB ILE 66 -4.993 -3.243 5.718 576 HG12 ILE 66 HG12 ILE 66 -3.193 -0.857 6.122 577 HG13 ILE 66 HG13 ILE 66 -2.476 -2.409 6.091 578 HG21 ILE 66 HG21 ILE 66 -5.430 -0.544 7.064 579 HG22 ILE 66 HG22 ILE 66 -5.854 -0.921 5.391 580 HG23 ILE 66 HG23 ILE 66 -6.661 -1.776 6.723 581 HD11 ILE 66 HD11 ILE 66 -4.118 -1.179 3.829 582 HD12 ILE 66 HD12 ILE 66 -2.371 -1.495 3.846 583 HD13 ILE 66 HD13 ILE 66 -3.523 -2.846 3.823 584 H THR 67 H THR 67 -5.755 -5.013 6.790 585 HA THR 67 HA THR 67 -4.035 -7.131 7.871 586 HB THR 67 HB THR 67 -5.468 -8.689 6.745 587 HG1 THR 67 HG1 THR 67 -7.249 -7.796 5.506 588 HG21 THR 67 HG21 THR 67 -7.270 -6.478 7.819 589 HG22 THR 67 HG22 THR 67 -7.626 -8.216 7.721 590 HG23 THR 67 HG23 THR 67 -6.376 -7.633 8.834 591 H VAL 68 H VAL 68 -2.914 -8.698 6.473 592 HA VAL 68 HA VAL 68 -1.432 -7.531 4.256 593 HB VAL 68 HB VAL 68 -1.721 -10.419 5.159 594 HG11 VAL 68 HG11 VAL 68 0.300 -9.167 3.246 595 HG12 VAL 68 HG12 VAL 68 0.397 -10.810 3.910 596 HG13 VAL 68 HG13 VAL 68 -0.926 -10.385 2.828 597 HG21 VAL 68 HG21 VAL 68 -0.637 -8.921 6.849 598 HG22 VAL 68 HG22 VAL 68 0.504 -10.079 6.164 599 HG23 VAL 68 HG23 VAL 68 0.525 -8.397 5.606 600 H GLU 69 H GLU 69 -4.571 -9.061 4.474 601 HA GLU 69 HA GLU 69 -4.660 -10.003 1.703 602 HB2 GLU 69 HB2 GLU 69 -6.766 -9.827 3.893 603 HB3 GLU 69 HB3 GLU 69 -7.020 -10.529 2.289 604 HG2 GLU 69 HG2 GLU 69 -5.207 -12.181 2.728 605 HG3 GLU 69 HG3 GLU 69 -5.002 -11.522 4.352 606 H LYS 70 H LYS 70 -5.670 -7.174 3.571 607 HA LYS 70 HA LYS 70 -6.575 -5.949 1.089 608 HB2 LYS 70 HB2 LYS 70 -8.176 -4.756 2.045 609 HB3 LYS 70 HB3 LYS 70 -8.160 -6.147 3.095 610 HG2 LYS 70 HG2 LYS 70 -8.266 -4.614 4.714 611 HG3 LYS 70 HG3 LYS 70 -6.520 -4.589 4.552 612 HD2 LYS 70 HD2 LYS 70 -6.543 -2.429 3.874 613 HD3 LYS 70 HD3 LYS 70 -7.729 -2.706 2.627 614 HE2 LYS 70 HE2 LYS 70 -8.449 -2.346 5.565 615 HE3 LYS 70 HE3 LYS 70 -8.362 -1.020 4.399 616 HZ1 LYS 70 HZ1 LYS 70 -10.189 -3.351 4.157 617 HZ2 LYS 70 HZ2 LYS 70 -10.627 -1.847 4.608 618 HZ3 LYS 70 HZ3 LYS 70 -10.089 -2.112 3.092 619 H ALA 71 H ALA 71 -3.818 -6.321 2.250 620 HA ALA 71 HA ALA 71 -2.863 -3.659 1.280 621 HB1 ALA 71 HB1 ALA 71 -1.344 -5.957 2.588 622 HB2 ALA 71 HB2 ALA 71 -0.662 -4.416 2.060 623 HB3 ALA 71 HB3 ALA 71 -1.837 -4.446 3.383 624 H LYS 72 H LYS 72 -2.679 -7.219 0.656 625 HA LYS 72 HA LYS 72 -1.037 -6.888 -1.696 626 HB2 LYS 72 HB2 LYS 72 -1.148 -9.261 -1.907 627 HB3 LYS 72 HB3 LYS 72 -1.028 -8.903 -0.187 628 HG2 LYS 72 HG2 LYS 72 -3.614 -9.115 -0.140 629 HG3 LYS 72 HG3 LYS 72 -3.477 -9.846 -1.734 630 HD2 LYS 72 HD2 LYS 72 -2.094 -10.821 0.803 631 HD3 LYS 72 HD3 LYS 72 -3.566 -11.520 0.143 632 HE2 LYS 72 HE2 LYS 72 -0.990 -11.354 -1.473 633 HE3 LYS 72 HE3 LYS 72 -1.294 -12.678 -0.343 634 HZ1 LYS 72 HZ1 LYS 72 -3.047 -12.020 -2.648 635 HZ2 LYS 72 HZ2 LYS 72 -2.011 -13.286 -2.563 636 HZ3 LYS 72 HZ3 LYS 72 -3.306 -13.229 -1.580 637 H ASN 73 H ASN 73 -4.454 -6.874 -1.140 638 HA ASN 73 HA ASN 73 -5.416 -7.460 -3.706 639 HB2 ASN 73 HB2 ASN 73 -7.387 -6.130 -3.064 640 HB3 ASN 73 HB3 ASN 73 -6.860 -7.132 -1.718 641 HD21 ASN 73 HD21 ASN 73 -7.461 -3.471 -0.725 642 HD22 ASN 73 HD22 ASN 73 -8.439 -4.544 -1.725 643 H TYR 74 H TYR 74 -4.056 -4.400 -2.502 644 HA TYR 74 HA TYR 74 -4.596 -2.739 -4.764 645 HB2 TYR 74 HB2 TYR 74 -2.462 -2.536 -2.611 646 HB3 TYR 74 HB3 TYR 74 -2.979 -1.240 -3.678 647 HD1 TYR 74 HD1 TYR 74 -5.918 -1.245 -3.549 648 HD2 TYR 74 HD2 TYR 74 -3.025 -2.036 -0.432 649 HE1 TYR 74 HE1 TYR 74 -7.532 -0.443 -1.838 650 HE2 TYR 74 HE2 TYR 74 -4.612 -1.119 1.247 651 HH TYR 74 HH TYR 74 -7.910 -0.022 0.413 652 H ILE 75 H ILE 75 -1.720 -4.545 -3.661 653 HA ILE 75 HA ILE 75 -0.026 -3.793 -5.841 654 HB ILE 75 HB ILE 75 0.136 -6.233 -4.024 655 HG12 ILE 75 HG12 ILE 75 1.418 -3.478 -3.718 656 HG13 ILE 75 HG13 ILE 75 0.032 -4.029 -2.789 657 HG21 ILE 75 HG21 ILE 75 2.293 -4.823 -5.676 658 HG22 ILE 75 HG22 ILE 75 2.550 -6.208 -4.594 659 HG23 ILE 75 HG23 ILE 75 1.587 -6.411 -6.048 660 HD11 ILE 75 HD11 ILE 75 2.843 -5.134 -2.608 661 HD12 ILE 75 HD12 ILE 75 1.920 -4.248 -1.382 662 HD13 ILE 75 HD13 ILE 75 1.414 -5.880 -1.848 663 H LYS 76 H LYS 76 -2.194 -6.631 -5.387 664 HA LYS 76 HA LYS 76 -1.364 -7.955 -7.776 665 HB2 LYS 76 HB2 LYS 76 -2.357 -9.033 -5.740 666 HB3 LYS 76 HB3 LYS 76 -3.907 -8.306 -6.145 667 HG2 LYS 76 HG2 LYS 76 -3.952 -10.588 -6.874 668 HG3 LYS 76 HG3 LYS 76 -3.911 -9.573 -8.298 669 HD2 LYS 76 HD2 LYS 76 -2.466 -11.380 -8.780 670 HD3 LYS 76 HD3 LYS 76 -1.429 -10.002 -8.494 671 HE2 LYS 76 HE2 LYS 76 -0.336 -11.695 -7.342 672 HE3 LYS 76 HE3 LYS 76 -1.214 -10.880 -6.049 673 HZ1 LYS 76 HZ1 LYS 76 -2.080 -13.368 -7.441 674 HZ2 LYS 76 HZ2 LYS 76 -1.456 -13.306 -5.941 675 HZ3 LYS 76 HZ3 LYS 76 -2.926 -12.648 -6.241 676 H ASN 77 H ASN 77 -3.868 -5.471 -7.241 677 HA ASN 77 HA ASN 77 -4.839 -5.917 -9.993 678 HB2 ASN 77 HB2 ASN 77 -6.604 -4.615 -9.610 679 HB3 ASN 77 HB3 ASN 77 -6.408 -5.419 -8.061 680 HD21 ASN 77 HD21 ASN 77 -6.240 -2.384 -6.304 681 HD22 ASN 77 HD22 ASN 77 -5.972 -4.129 -6.194 682 H SER 78 H SER 78 -2.993 -3.488 -8.084 683 HA SER 78 HA SER 78 -3.140 -1.669 -10.289 684 HB2 SER 78 HB2 SER 78 -3.278 -1.079 -7.867 685 HB3 SER 78 HB3 SER 78 -1.519 -1.303 -7.764 686 HG SER 78 HG SER 78 -2.197 0.896 -8.173 687 H ASN 79 H ASN 79 -0.707 -4.022 -9.560 688 HA ASN 79 HA ASN 79 1.605 -2.579 -10.143 689 HB2 ASN 79 HB2 ASN 79 2.779 -4.652 -10.124 690 HB3 ASN 79 HB3 ASN 79 1.495 -4.762 -8.938 691 HD21 ASN 79 HD21 ASN 79 -0.138 -7.442 -10.617 692 HD22 ASN 79 HD22 ASN 79 -0.166 -6.292 -9.274 693 H ARG 80 H ARG 80 -0.570 -3.656 -12.595 694 HA ARG 80 HA ARG 80 1.486 -3.131 -14.708 695 HB2 ARG 80 HB2 ARG 80 -0.917 -4.856 -14.592 696 HB3 ARG 80 HB3 ARG 80 -0.834 -3.876 -16.045 697 HG2 ARG 80 HG2 ARG 80 0.269 -5.976 -16.476 698 HG3 ARG 80 HG3 ARG 80 1.461 -4.672 -16.500 699 HD2 ARG 80 HD2 ARG 80 2.060 -5.275 -14.115 700 HD3 ARG 80 HD3 ARG 80 0.959 -6.659 -14.246 701 HE ARG 80 HE ARG 80 2.765 -6.794 -16.423 702 HH11 ARG 80 HH11 ARG 80 4.642 -7.997 -16.420 703 HH12 ARG 80 HH12 ARG 80 5.337 -8.523 -14.915 704 HH21 ARG 80 HH21 ARG 80 2.936 -7.059 -12.930 705 HH22 ARG 80 HH22 ARG 80 4.407 -8.004 -12.985 706 H LEU 81 H LEU 81 -0.477 -1.246 -12.964 707 HA LEU 81 HA LEU 81 -0.789 0.731 -15.194 708 HB2 LEU 81 HB2 LEU 81 -2.950 0.010 -14.243 709 HB3 LEU 81 HB3 LEU 81 -2.384 0.412 -12.624 710 HG LEU 81 HG LEU 81 -2.179 2.828 -13.334 711 HD11 LEU 81 HD11 LEU 81 -3.607 1.833 -15.841 712 HD12 LEU 81 HD12 LEU 81 -3.398 3.537 -15.376 713 HD13 LEU 81 HD13 LEU 81 -1.984 2.561 -15.771 714 HD21 LEU 81 HD21 LEU 81 -4.131 2.018 -12.119 715 HD22 LEU 81 HD22 LEU 81 -4.589 3.268 -13.286 716 HD23 LEU 81 HD23 LEU 81 -4.920 1.556 -13.645 717 H GLY 82 H GLY 82 -0.155 0.539 -11.650 718 HA2 GLY 82 HA2 GLY 82 1.194 1.869 -10.317 719 HA3 GLY 82 HA3 GLY 82 1.902 2.600 -11.768 720 H ARG 83 H ARG 83 0.545 4.212 -12.921 721 HA ARG 83 HA ARG 83 -1.534 5.625 -11.358 722 HB2 ARG 83 HB2 ARG 83 0.951 7.092 -12.337 723 HB3 ARG 83 HB3 ARG 83 -0.485 7.815 -11.595 724 HG2 ARG 83 HG2 ARG 83 -0.008 6.416 -9.517 725 HG3 ARG 83 HG3 ARG 83 1.547 5.988 -10.261 726 HD2 ARG 83 HD2 ARG 83 2.011 8.468 -10.480 727 HD3 ARG 83 HD3 ARG 83 0.562 8.776 -9.525 728 HE ARG 83 HE ARG 83 3.165 7.750 -8.619 729 HH11 ARG 83 HH11 ARG 83 3.593 7.553 -6.486 730 HH12 ARG 83 HH12 ARG 83 2.331 7.605 -5.295 731 HH21 ARG 83 HH21 ARG 83 -0.184 8.043 -7.632 732 HH22 ARG 83 HH22 ARG 83 0.205 7.855 -5.947 733 H THR 84 H THR 84 -2.422 7.482 -12.607 734 HA THR 84 HA THR 84 -3.216 6.367 -15.238 735 HB THR 84 HB THR 84 -4.791 6.189 -13.471 736 HG1 THR 84 HG1 THR 84 -6.533 7.105 -14.529 737 HG21 THR 84 HG21 THR 84 -4.936 9.223 -13.279 738 HG22 THR 84 HG22 THR 84 -5.932 8.038 -12.415 739 HG23 THR 84 HG23 THR 84 -4.200 8.152 -12.070 740 H ASN 85 H ASN 85 -1.175 7.610 -15.944 741 HA ASN 85 HA ASN 85 -2.006 10.286 -16.992 742 HB2 ASN 85 HB2 ASN 85 0.623 9.546 -15.658 743 HB3 ASN 85 HB3 ASN 85 0.412 10.996 -16.635 744 HD21 ASN 85 HD21 ASN 85 -0.878 11.121 -12.854 745 HD22 ASN 85 HD22 ASN 85 0.068 9.777 -13.476 746 H ASN 86 H ASN 86 -2.152 7.703 -18.342 747 HA ASN 86 HA ASN 86 -0.690 8.505 -20.793 748 HB2 ASN 86 HB2 ASN 86 0.621 6.720 -19.536 749 HB3 ASN 86 HB3 ASN 86 -0.750 5.635 -19.769 750 HD21 ASN 86 HD21 ASN 86 1.308 4.660 -22.548 751 HD22 ASN 86 HD22 ASN 86 0.957 4.298 -20.864 752 H LEU 87 H LEU 87 -1.626 7.661 -22.745 753 HA LEU 87 HA LEU 87 -3.415 7.568 -24.158 754 HB2 LEU 87 HB2 LEU 87 -3.917 5.188 -22.345 755 HB3 LEU 87 HB3 LEU 87 -4.735 5.413 -23.885 756 HG LEU 87 HG LEU 87 -1.702 5.265 -23.662 757 HD11 LEU 87 HD11 LEU 87 -3.694 3.058 -24.311 758 HD12 LEU 87 HD12 LEU 87 -1.922 2.941 -24.433 759 HD13 LEU 87 HD13 LEU 87 -2.683 3.170 -22.852 760 HD21 LEU 87 HD21 LEU 87 -2.532 6.316 -25.750 761 HD22 LEU 87 HD22 LEU 87 -1.854 4.719 -26.074 762 HD23 LEU 87 HD23 LEU 87 -3.617 4.935 -26.017 763 H LYS 88 H LYS 88 -3.899 9.572 -22.427 764 HA LYS 88 HA LYS 88 -6.819 9.455 -21.805 765 HB2 LYS 88 HB2 LYS 88 -6.453 11.170 -20.160 766 HB3 LYS 88 HB3 LYS 88 -5.419 9.778 -19.848 767 HG2 LYS 88 HG2 LYS 88 -3.463 10.975 -20.758 768 HG3 LYS 88 HG3 LYS 88 -4.486 12.358 -21.195 769 HD2 LYS 88 HD2 LYS 88 -5.056 12.702 -18.811 770 HD3 LYS 88 HD3 LYS 88 -4.040 11.317 -18.359 771 HE2 LYS 88 HE2 LYS 88 -2.046 12.459 -19.274 772 HE3 LYS 88 HE3 LYS 88 -3.048 13.813 -19.810 773 HZ1 LYS 88 HZ1 LYS 88 -2.656 13.021 -16.964 774 HZ2 LYS 88 HZ2 LYS 88 -1.975 14.310 -17.695 775 HZ3 LYS 88 HZ3 LYS 88 -3.588 14.263 -17.478 776 H THR 89 H THR 89 -4.822 10.629 -24.177 777 HA THR 89 HA THR 89 -7.037 12.001 -25.306 778 HB THR 89 HB THR 89 -6.076 13.914 -24.102 779 HG1 THR 89 HG1 THR 89 -6.068 15.237 -25.913 780 HG21 THR 89 HG21 THR 89 -3.667 13.724 -25.955 781 HG22 THR 89 HG22 THR 89 -3.983 14.929 -24.689 782 HG23 THR 89 HG23 THR 89 -3.632 13.250 -24.242 783 H ILE 90 H ILE 90 -7.148 11.276 -27.258 784 HA ILE 90 HA ILE 90 -4.756 10.884 -28.963 785 HB ILE 90 HB ILE 90 -6.020 8.774 -29.772 786 HG12 ILE 90 HG12 ILE 90 -8.084 9.228 -28.335 787 HG13 ILE 90 HG13 ILE 90 -7.492 7.597 -28.569 788 HG21 ILE 90 HG21 ILE 90 -4.545 8.696 -27.128 789 HG22 ILE 90 HG22 ILE 90 -4.795 7.333 -28.241 790 HG23 ILE 90 HG23 ILE 90 -3.824 8.723 -28.747 791 HD11 ILE 90 HD11 ILE 90 -7.039 9.214 -26.024 792 HD12 ILE 90 HD12 ILE 90 -8.248 7.950 -26.273 793 HD13 ILE 90 HD13 ILE 90 -6.532 7.536 -26.318 794 H GLY 91 H GLY 91 -7.409 12.689 -28.802 795 HA2 GLY 91 HA2 GLY 91 -8.843 13.683 -30.307 796 HA3 GLY 91 HA3 GLY 91 -7.850 13.041 -31.621 797 H ILE 92 H ILE 92 -8.980 10.573 -29.589 798 HA ILE 92 HA ILE 92 -10.365 8.826 -29.857 799 HB ILE 92 HB ILE 92 -12.454 10.947 -30.456 800 HG12 ILE 92 HG12 ILE 92 -12.738 10.418 -27.790 801 HG13 ILE 92 HG13 ILE 92 -11.017 10.127 -27.920 802 HG21 ILE 92 HG21 ILE 92 -12.709 8.134 -29.299 803 HG22 ILE 92 HG22 ILE 92 -13.989 9.367 -29.228 804 HG23 ILE 92 HG23 ILE 92 -13.477 8.771 -30.777 805 HD11 ILE 92 HD11 ILE 92 -12.467 12.692 -28.744 806 HD12 ILE 92 HD12 ILE 92 -11.627 12.430 -27.204 807 HD13 ILE 92 HD13 ILE 92 -10.703 12.466 -28.705 808 H LEU 93 H LEU 93 -8.763 9.400 -32.104 809 HA LEU 93 HA LEU 93 -8.407 8.988 -34.271 810 HB2 LEU 93 HB2 LEU 93 -9.359 6.696 -33.067 811 HB3 LEU 93 HB3 LEU 93 -10.359 6.761 -34.502 812 HG LEU 93 HG LEU 93 -7.304 6.833 -34.421 813 HD11 LEU 93 HD11 LEU 93 -9.216 4.597 -35.212 814 HD12 LEU 93 HD12 LEU 93 -7.440 4.536 -35.296 815 HD13 LEU 93 HD13 LEU 93 -8.245 4.669 -33.724 816 HD21 LEU 93 HD21 LEU 93 -8.105 7.952 -36.456 817 HD22 LEU 93 HD22 LEU 93 -7.403 6.381 -36.855 818 HD23 LEU 93 HD23 LEU 93 -9.170 6.575 -36.815 819 H GLN 94 H GLN 94 -10.487 10.962 -33.753 820 HA GLN 94 HA GLN 94 -12.018 10.890 -36.329 821 HB2 GLN 94 HB2 GLN 94 -12.642 12.093 -33.618 822 HB3 GLN 94 HB3 GLN 94 -13.440 12.636 -35.108 823 HG2 GLN 94 HG2 GLN 94 -14.214 10.342 -35.569 824 HG3 GLN 94 HG3 GLN 94 -13.427 9.758 -34.107 825 HE21 GLN 94 HE21 GLN 94 -16.962 10.189 -33.175 826 HE22 GLN 94 HE22 GLN 94 -15.992 9.111 -34.171 827 H GLU 95 H GLU 95 -10.520 11.677 -37.665 828 HA GLU 95 HA GLU 95 -9.697 14.541 -37.351 829 HB2 GLU 95 HB2 GLU 95 -8.157 12.265 -38.662 830 HB3 GLU 95 HB3 GLU 95 -7.723 13.976 -38.749 831 HG2 GLU 95 HG2 GLU 95 -7.517 14.043 -36.263 832 HG3 GLU 95 HG3 GLU 95 -7.854 12.311 -36.198 833 H GLU 96 H GLU 96 -9.365 15.665 -39.451 834 HA GLU 96 HA GLU 96 -11.060 14.681 -41.685 835 HB2 GLU 96 HB2 GLU 96 -12.459 16.103 -40.195 836 HB3 GLU 96 HB3 GLU 96 -11.312 17.432 -40.405 837 HG2 GLU 96 HG2 GLU 96 -11.775 17.438 -42.850 838 HG3 GLU 96 HG3 GLU 96 -12.869 16.068 -42.650 839 H VAL 97 H VAL 97 -10.028 14.727 -43.456 840 HA VAL 97 HA VAL 97 -8.120 16.911 -44.091 841 HB VAL 97 HB VAL 97 -7.632 13.950 -44.635 842 HG11 VAL 97 HG11 VAL 97 -5.973 16.398 -45.378 843 HG12 VAL 97 HG12 VAL 97 -5.454 14.708 -45.558 844 HG13 VAL 97 HG13 VAL 97 -6.809 15.313 -46.512 845 HG21 VAL 97 HG21 VAL 97 -7.090 14.522 -42.308 846 HG22 VAL 97 HG22 VAL 97 -5.609 14.261 -43.230 847 HG23 VAL 97 HG23 VAL 97 -6.134 15.918 -42.852 848 H SER 98 H SER 98 -8.560 17.848 -45.985 849 HA SER 98 HA SER 98 -9.473 16.379 -48.314 850 HB2 SER 98 HB2 SER 98 -11.624 16.593 -47.164 851 HB3 SER 98 HB3 SER 98 -11.411 18.344 -47.032 852 HG SER 98 HG SER 98 -12.729 17.717 -48.832 853 H SER 99 H SER 99 -9.592 19.757 -47.031 854 HA SER 99 HA SER 99 -8.904 20.879 -49.608 855 HB2 SER 99 HB2 SER 99 -10.431 21.899 -47.908 856 HB3 SER 99 HB3 SER 99 -9.015 22.245 -46.896 857 HG SER 99 HG SER 99 -9.638 24.024 -48.238 858 H MET 100 H MET 100 -7.011 20.107 -46.740 859 HA MET 100 HA MET 100 -4.510 21.002 -48.097 860 HB2 MET 100 HB2 MET 100 -5.399 22.659 -46.374 861 HB3 MET 100 HB3 MET 100 -5.090 21.432 -45.142 862 HG2 MET 100 HG2 MET 100 -2.679 21.430 -45.808 863 HG3 MET 100 HG3 MET 100 -3.047 22.639 -47.048 864 HE1 MET 100 HE1 MET 100 -1.614 24.653 -46.450 865 HE2 MET 100 HE2 MET 100 -1.178 25.077 -44.781 866 HE3 MET 100 HE3 MET 100 -0.736 23.483 -45.436 867 H GLU 101 H GLU 101 -3.358 19.239 -48.423 868 HA GLU 101 HA GLU 101 -3.587 16.912 -46.565 869 HB2 GLU 101 HB2 GLU 101 -4.594 16.887 -48.912 870 HB3 GLU 101 HB3 GLU 101 -2.944 16.889 -49.533 871 HG2 GLU 101 HG2 GLU 101 -2.525 14.718 -48.399 872 HG3 GLU 101 HG3 GLU 101 -4.135 14.778 -47.676 873 H ALA 102 H ALA 102 -1.357 19.188 -47.495 874 HA ALA 102 HA ALA 102 1.025 17.444 -47.455 875 HB1 ALA 102 HB1 ALA 102 0.749 20.453 -47.818 876 HB2 ALA 102 HB2 ALA 102 2.241 19.506 -48.001 877 HB3 ALA 102 HB3 ALA 102 0.885 19.239 -49.113 878 H LYS 103 H LYS 103 2.121 16.964 -45.699 879 HA LYS 103 HA LYS 103 2.441 18.876 -43.449 880 HB2 LYS 103 HB2 LYS 103 1.585 15.966 -43.114 881 HB3 LYS 103 HB3 LYS 103 2.163 17.010 -41.809 882 HG2 LYS 103 HG2 LYS 103 0.268 18.586 -42.266 883 HG3 LYS 103 HG3 LYS 103 -0.373 17.439 -43.450 884 HD2 LYS 103 HD2 LYS 103 0.047 16.862 -40.487 885 HD3 LYS 103 HD3 LYS 103 -1.492 17.295 -41.245 886 HE2 LYS 103 HE2 LYS 103 -1.347 15.269 -42.692 887 HE3 LYS 103 HE3 LYS 103 0.162 14.813 -41.892 888 HZ1 LYS 103 HZ1 LYS 103 -2.467 15.078 -40.532 889 HZ2 LYS 103 HZ2 LYS 103 -1.735 13.669 -40.906 890 HZ3 LYS 103 HZ3 LYS 103 -1.071 14.660 -39.793 891 H SER 104 H SER 104 4.454 18.932 -42.695 892 HA SER 104 HA SER 104 6.413 16.753 -43.278 893 HB2 SER 104 HB2 SER 104 6.907 19.663 -44.010 894 HB3 SER 104 HB3 SER 104 8.052 18.319 -44.163 895 HG SER 104 HG SER 104 7.011 18.801 -46.149 896 H MET 105 H MET 105 5.983 19.951 -41.710 897 HA MET 105 HA MET 105 7.620 19.036 -39.384 898 HB2 MET 105 HB2 MET 105 7.842 21.581 -41.027 899 HB3 MET 105 HB3 MET 105 8.288 21.559 -39.321 900 HG2 MET 105 HG2 MET 105 10.302 21.184 -40.401 901 HG3 MET 105 HG3 MET 105 9.810 19.603 -39.814 902 HE1 MET 105 HE1 MET 105 10.753 17.773 -41.165 903 HE2 MET 105 HE2 MET 105 11.395 18.008 -42.805 904 HE3 MET 105 HE3 MET 105 11.989 19.018 -41.465 905 H THR 106 H THR 106 7.223 20.114 -37.422 906 HA THR 106 HA THR 106 4.492 21.286 -37.103 907 HB THR 106 HB THR 106 4.900 19.176 -35.899 908 HG1 THR 106 HG1 THR 106 3.999 19.932 -34.015 909 HG21 THR 106 HG21 THR 106 6.821 20.802 -34.172 910 HG22 THR 106 HG22 THR 106 6.254 19.146 -33.865 911 HG23 THR 106 HG23 THR 106 7.289 19.475 -35.261 912 H TRP 107 H TRP 107 4.348 22.821 -35.252 913 HA TRP 107 HA TRP 107 6.330 24.985 -35.793 914 HB2 TRP 107 HB2 TRP 107 3.921 25.100 -36.670 915 HB3 TRP 107 HB3 TRP 107 3.446 25.414 -35.009 916 HD1 TRP 107 HD1 TRP 107 4.342 27.757 -33.946 917 HE1 TRP 107 HE1 TRP 107 4.972 29.998 -35.040 918 HE3 TRP 107 HE3 TRP 107 4.995 26.145 -38.765 919 HZ2 TRP 107 HZ2 TRP 107 5.668 30.962 -37.675 920 HZ3 TRP 107 HZ3 TRP 107 5.643 27.749 -40.550 921 HH2 TRP 107 HH2 TRP 107 5.981 30.154 -40.018 Start of MODEL 15 1 H1 GLY -5 H1 GLY -5 -33.067 -7.856 29.270 2 H2 GLY -5 H2 GLY -5 -31.892 -6.746 29.004 3 H3 GLY -5 H3 GLY -5 -33.068 -6.448 30.113 4 HA2 GLY -5 HA2 GLY -5 -31.036 -7.031 31.243 5 HA3 GLY -5 HA3 GLY -5 -32.293 -8.252 31.509 6 H SER -4 H SER -4 -30.449 -9.657 32.017 7 HA SER -4 HA SER -4 -28.501 -10.357 30.000 8 HB2 SER -4 HB2 SER -4 -29.182 -11.688 32.643 9 HB3 SER -4 HB3 SER -4 -27.742 -12.002 31.651 10 HG SER -4 HG SER -4 -27.337 -10.474 33.327 11 H HIS -3 H HIS -3 -29.720 -11.029 28.190 12 HA HIS -3 HA HIS -3 -30.315 -13.932 28.214 13 HB2 HIS -3 HB2 HIS -3 -32.476 -12.596 28.523 14 HB3 HIS -3 HB3 HIS -3 -32.214 -11.944 26.908 15 HD2 HIS -3 HD2 HIS -3 -33.348 -15.058 28.786 16 HE1 HIS -3 HE1 HIS -3 -33.758 -16.004 24.648 17 HE2 HIS -3 HE2 HIS -3 -34.278 -16.778 27.017 18 H MET -2 H MET -2 -29.679 -14.964 26.334 19 HA MET -2 HA MET -2 -28.714 -13.402 24.014 20 HB2 MET -2 HB2 MET -2 -26.932 -13.357 25.833 21 HB3 MET -2 HB3 MET -2 -26.809 -15.105 25.683 22 HG2 MET -2 HG2 MET -2 -25.056 -14.073 24.415 23 HG3 MET -2 HG3 MET -2 -26.178 -14.796 23.266 24 HE1 MET -2 HE1 MET -2 -24.750 -13.327 21.449 25 HE2 MET -2 HE2 MET -2 -24.607 -11.557 21.536 26 HE3 MET -2 HE3 MET -2 -23.816 -12.571 22.761 27 H ALA -1 H ALA -1 -30.473 -14.594 23.071 28 HA ALA -1 HA ALA -1 -29.498 -17.068 21.834 29 HB1 ALA -1 HB1 ALA -1 -32.187 -16.964 23.272 30 HB2 ALA -1 HB2 ALA -1 -31.560 -18.330 22.328 31 HB3 ALA -1 HB3 ALA -1 -30.757 -17.857 23.836 32 H SER 0 H SER 0 -30.888 -17.761 19.998 33 HA SER 0 HA SER 0 -32.783 -15.817 18.875 34 HB2 SER 0 HB2 SER 0 -30.372 -15.203 18.106 35 HB3 SER 0 HB3 SER 0 -30.468 -16.688 17.126 36 HG SER 0 HG SER 0 -31.192 -14.826 15.982 37 H MET 1 H MET 1 -33.828 -16.652 16.912 38 HA MET 1 HA MET 1 -33.616 -19.543 16.343 39 HB2 MET 1 HB2 MET 1 -36.245 -18.209 17.130 40 HB3 MET 1 HB3 MET 1 -36.091 -19.808 16.391 41 HG2 MET 1 HG2 MET 1 -34.737 -20.564 18.336 42 HG3 MET 1 HG3 MET 1 -34.980 -18.987 19.097 43 HE1 MET 1 HE1 MET 1 -35.851 -20.122 21.289 44 HE2 MET 1 HE2 MET 1 -37.154 -21.331 21.332 45 HE3 MET 1 HE3 MET 1 -35.606 -21.724 20.552 46 H ASP 2 H ASP 2 -33.844 -19.962 14.225 47 HA ASP 2 HA ASP 2 -35.191 -18.013 12.423 48 HB2 ASP 2 HB2 ASP 2 -32.410 -19.177 12.109 49 HB3 ASP 2 HB3 ASP 2 -33.325 -18.547 10.746 50 HA PRO 3 HA PRO 3 -36.981 -21.738 10.859 51 HB2 PRO 3 HB2 PRO 3 -38.310 -20.874 8.654 52 HB3 PRO 3 HB3 PRO 3 -38.711 -20.273 10.293 53 HG2 PRO 3 HG2 PRO 3 -36.888 -18.976 8.238 54 HG3 PRO 3 HG3 PRO 3 -38.260 -18.225 9.115 55 HD2 PRO 3 HD2 PRO 3 -35.681 -17.971 9.980 56 HD3 PRO 3 HD3 PRO 3 -37.045 -18.126 11.125 57 H LEU 4 H LEU 4 -34.388 -20.418 9.259 58 HA LEU 4 HA LEU 4 -34.130 -22.737 7.437 59 HB2 LEU 4 HB2 LEU 4 -33.448 -21.494 5.604 60 HB3 LEU 4 HB3 LEU 4 -34.985 -20.861 6.146 61 HG LEU 4 HG LEU 4 -32.307 -19.510 6.763 62 HD11 LEU 4 HD11 LEU 4 -34.304 -18.965 4.532 63 HD12 LEU 4 HD12 LEU 4 -32.857 -17.995 4.907 64 HD13 LEU 4 HD13 LEU 4 -32.681 -19.661 4.335 65 HD21 LEU 4 HD21 LEU 4 -34.103 -18.779 8.253 66 HD22 LEU 4 HD22 LEU 4 -33.711 -17.505 7.100 67 HD23 LEU 4 HD23 LEU 4 -35.167 -18.495 6.851 68 H ASP 5 H ASP 5 -32.886 -22.356 10.040 69 HA ASP 5 HA ASP 5 -30.019 -22.172 9.275 70 HB2 ASP 5 HB2 ASP 5 -31.268 -21.000 11.324 71 HB3 ASP 5 HB3 ASP 5 -30.956 -22.556 12.100 72 H LYS 6 H LYS 6 -32.153 -24.583 9.356 73 HA LYS 6 HA LYS 6 -30.332 -26.623 10.608 74 HB2 LYS 6 HB2 LYS 6 -33.341 -26.782 10.930 75 HB3 LYS 6 HB3 LYS 6 -32.065 -27.606 11.807 76 HG2 LYS 6 HG2 LYS 6 -32.540 -26.036 13.386 77 HG3 LYS 6 HG3 LYS 6 -31.377 -25.101 12.459 78 HD2 LYS 6 HD2 LYS 6 -33.102 -23.559 12.603 79 HD3 LYS 6 HD3 LYS 6 -33.567 -24.350 11.083 80 HE2 LYS 6 HE2 LYS 6 -35.068 -25.886 12.438 81 HE3 LYS 6 HE3 LYS 6 -34.617 -24.974 13.883 82 HZ1 LYS 6 HZ1 LYS 6 -36.115 -23.953 11.543 83 HZ2 LYS 6 HZ2 LYS 6 -36.645 -24.061 13.083 84 HZ3 LYS 6 HZ3 LYS 6 -35.497 -22.954 12.688 85 H ILE 7 H ILE 7 -33.297 -26.500 8.678 86 HA ILE 7 HA ILE 7 -32.465 -28.932 7.180 87 HB ILE 7 HB ILE 7 -34.882 -29.196 6.679 88 HG12 ILE 7 HG12 ILE 7 -36.560 -28.105 8.095 89 HG13 ILE 7 HG13 ILE 7 -35.355 -27.026 8.782 90 HG21 ILE 7 HG21 ILE 7 -34.139 -29.089 9.635 91 HG22 ILE 7 HG22 ILE 7 -35.419 -30.076 8.897 92 HG23 ILE 7 HG23 ILE 7 -33.724 -30.389 8.499 93 HD11 ILE 7 HD11 ILE 7 -36.146 -27.079 5.836 94 HD12 ILE 7 HD12 ILE 7 -36.816 -25.975 7.052 95 HD13 ILE 7 HD13 ILE 7 -35.102 -25.874 6.638 96 H ILE 8 H ILE 8 -31.961 -25.880 6.712 97 HA ILE 8 HA ILE 8 -33.168 -24.959 4.440 98 HB ILE 8 HB ILE 8 -31.760 -23.611 5.717 99 HG12 ILE 8 HG12 ILE 8 -30.682 -23.744 2.871 100 HG13 ILE 8 HG13 ILE 8 -32.205 -23.000 3.367 101 HG21 ILE 8 HG21 ILE 8 -29.255 -24.963 4.646 102 HG22 ILE 8 HG22 ILE 8 -29.359 -23.651 5.832 103 HG23 ILE 8 HG23 ILE 8 -29.926 -25.258 6.262 104 HD11 ILE 8 HD11 ILE 8 -29.405 -22.078 4.136 105 HD12 ILE 8 HD12 ILE 8 -30.541 -21.282 3.039 106 HD13 ILE 8 HD13 ILE 8 -30.913 -21.374 4.769 107 H ASN 9 H ASN 9 -33.556 -25.793 2.576 108 HA ASN 9 HA ASN 9 -31.477 -26.372 0.645 109 HB2 ASN 9 HB2 ASN 9 -31.682 -28.618 1.663 110 HB3 ASN 9 HB3 ASN 9 -33.435 -28.568 1.493 111 HD21 ASN 9 HD21 ASN 9 -33.378 -29.571 -1.908 112 HD22 ASN 9 HD22 ASN 9 -34.366 -28.908 -0.612 113 H ASP 10 H ASP 10 -32.219 -25.530 -1.289 114 HA ASP 10 HA ASP 10 -35.050 -25.648 -1.989 115 HB2 ASP 10 HB2 ASP 10 -34.872 -23.594 -0.531 116 HB3 ASP 10 HB3 ASP 10 -33.718 -22.930 -1.683 117 H ILE 11 H ILE 11 -33.301 -27.026 -3.082 118 HA ILE 11 HA ILE 11 -31.913 -27.645 -4.654 119 HB ILE 11 HB ILE 11 -33.688 -25.965 -6.392 120 HG12 ILE 11 HG12 ILE 11 -33.956 -28.908 -5.640 121 HG13 ILE 11 HG13 ILE 11 -34.959 -27.603 -5.005 122 HG21 ILE 11 HG21 ILE 11 -31.869 -28.364 -6.982 123 HG22 ILE 11 HG22 ILE 11 -32.893 -27.547 -8.195 124 HG23 ILE 11 HG23 ILE 11 -31.524 -26.706 -7.473 125 HD11 ILE 11 HD11 ILE 11 -34.891 -28.541 -7.892 126 HD12 ILE 11 HD12 ILE 11 -36.206 -28.700 -6.720 127 HD13 ILE 11 HD13 ILE 11 -35.753 -27.091 -7.317 128 H LYS 12 H LYS 12 -30.027 -26.928 -4.055 129 HA LYS 12 HA LYS 12 -28.011 -25.925 -4.234 130 HB2 LYS 12 HB2 LYS 12 -28.927 -25.402 -7.065 131 HB3 LYS 12 HB3 LYS 12 -27.267 -25.242 -6.519 132 HG2 LYS 12 HG2 LYS 12 -28.836 -27.864 -6.428 133 HG3 LYS 12 HG3 LYS 12 -27.780 -27.345 -7.728 134 HD2 LYS 12 HD2 LYS 12 -26.340 -28.686 -6.589 135 HD3 LYS 12 HD3 LYS 12 -25.931 -27.124 -5.883 136 HE2 LYS 12 HE2 LYS 12 -27.454 -27.701 -3.931 137 HE3 LYS 12 HE3 LYS 12 -27.746 -29.272 -4.679 138 HZ1 LYS 12 HZ1 LYS 12 -25.091 -28.261 -3.804 139 HZ2 LYS 12 HZ2 LYS 12 -25.984 -29.368 -3.009 140 HZ3 LYS 12 HZ3 LYS 12 -25.360 -29.729 -4.475 141 H LYS 13 H LYS 13 -29.760 -24.418 -2.894 142 HA LYS 13 HA LYS 13 -29.119 -21.603 -3.507 143 HB2 LYS 13 HB2 LYS 13 -31.427 -23.017 -2.227 144 HB3 LYS 13 HB3 LYS 13 -31.009 -21.483 -1.496 145 HG2 LYS 13 HG2 LYS 13 -31.482 -21.782 -4.485 146 HG3 LYS 13 HG3 LYS 13 -32.760 -21.402 -3.322 147 HD2 LYS 13 HD2 LYS 13 -31.506 -19.400 -2.564 148 HD3 LYS 13 HD3 LYS 13 -30.267 -19.693 -3.784 149 HE2 LYS 13 HE2 LYS 13 -33.229 -19.236 -4.371 150 HE3 LYS 13 HE3 LYS 13 -32.003 -17.965 -4.388 151 HZ1 LYS 13 HZ1 LYS 13 -32.005 -20.339 -6.174 152 HZ2 LYS 13 HZ2 LYS 13 -32.379 -18.814 -6.615 153 HZ3 LYS 13 HZ3 LYS 13 -30.854 -19.174 -6.165 154 H GLU 14 H GLU 14 -27.538 -23.810 -2.113 155 HA GLU 14 HA GLU 14 -27.183 -22.746 0.609 156 HB2 GLU 14 HB2 GLU 14 -25.907 -25.177 -0.697 157 HB3 GLU 14 HB3 GLU 14 -25.863 -24.730 1.004 158 HG2 GLU 14 HG2 GLU 14 -27.511 -26.383 0.918 159 HG3 GLU 14 HG3 GLU 14 -28.410 -24.874 1.028 160 H ALA 15 H ALA 15 -25.157 -22.197 1.518 161 HA ALA 15 HA ALA 15 -23.723 -20.381 -0.211 162 HB1 ALA 15 HB1 ALA 15 -23.496 -20.941 2.765 163 HB2 ALA 15 HB2 ALA 15 -22.849 -19.523 1.903 164 HB3 ALA 15 HB3 ALA 15 -24.606 -19.774 2.003 165 H ASN 16 H ASN 16 -22.981 -22.748 -1.224 166 HA ASN 16 HA ASN 16 -20.100 -23.039 -0.476 167 HB2 ASN 16 HB2 ASN 16 -21.443 -24.780 0.674 168 HB3 ASN 16 HB3 ASN 16 -22.083 -25.317 -0.880 169 HD21 ASN 16 HD21 ASN 16 -19.412 -27.689 -0.260 170 HD22 ASN 16 HD22 ASN 16 -21.083 -27.369 0.188 171 H ASP 17 H ASP 17 -19.116 -22.263 -2.205 172 HA ASP 17 HA ASP 17 -19.856 -23.229 -4.941 173 HB2 ASP 17 HB2 ASP 17 -20.024 -20.768 -4.577 174 HB3 ASP 17 HB3 ASP 17 -18.302 -20.731 -4.189 175 H SER 18 H SER 18 -18.285 -24.074 -6.285 176 HA SER 18 HA SER 18 -15.535 -24.471 -5.247 177 HB2 SER 18 HB2 SER 18 -17.124 -26.421 -4.679 178 HB3 SER 18 HB3 SER 18 -17.098 -26.793 -6.409 179 HG SER 18 HG SER 18 -15.483 -27.935 -5.218 180 H GLY 19 H GLY 19 -16.253 -22.583 -7.117 181 HA2 GLY 19 HA2 GLY 19 -14.648 -23.540 -9.421 182 HA3 GLY 19 HA3 GLY 19 -16.226 -22.767 -9.723 183 H VAL 20 H VAL 20 -13.700 -21.995 -7.376 184 HA VAL 20 HA VAL 20 -13.409 -19.244 -8.482 185 HB VAL 20 HB VAL 20 -12.652 -20.475 -5.827 186 HG11 VAL 20 HG11 VAL 20 -12.351 -17.590 -6.813 187 HG12 VAL 20 HG12 VAL 20 -12.193 -18.096 -5.115 188 HG13 VAL 20 HG13 VAL 20 -11.038 -18.678 -6.311 189 HG21 VAL 20 HG21 VAL 20 -15.070 -20.115 -6.090 190 HG22 VAL 20 HG22 VAL 20 -14.407 -18.954 -4.936 191 HG23 VAL 20 HG23 VAL 20 -14.788 -18.437 -6.595 192 H THR 21 H THR 21 -11.505 -18.411 -9.108 193 HA THR 21 HA THR 21 -9.023 -20.058 -9.130 194 HB THR 21 HB THR 21 -10.314 -20.299 -11.282 195 HG1 THR 21 HG1 THR 21 -8.451 -20.192 -12.448 196 HG21 THR 21 HG21 THR 21 -9.280 -17.517 -11.927 197 HG22 THR 21 HG22 THR 21 -10.315 -18.566 -12.909 198 HG23 THR 21 HG23 THR 21 -10.970 -17.817 -11.438 199 H LEU 22 H LEU 22 -7.392 -18.278 -10.475 200 HA LEU 22 HA LEU 22 -6.761 -16.520 -8.269 201 HB2 LEU 22 HB2 LEU 22 -5.229 -16.585 -10.886 202 HB3 LEU 22 HB3 LEU 22 -4.650 -16.212 -9.272 203 HG LEU 22 HG LEU 22 -5.570 -18.811 -8.969 204 HD11 LEU 22 HD11 LEU 22 -4.168 -18.671 -11.671 205 HD12 LEU 22 HD12 LEU 22 -4.733 -20.132 -10.829 206 HD13 LEU 22 HD13 LEU 22 -5.902 -18.958 -11.460 207 HD21 LEU 22 HD21 LEU 22 -3.428 -17.952 -8.116 208 HD22 LEU 22 HD22 LEU 22 -3.191 -19.477 -8.985 209 HD23 LEU 22 HD23 LEU 22 -2.760 -17.937 -9.765 210 H ALA 23 H ALA 23 -9.111 -15.693 -9.512 211 HA ALA 23 HA ALA 23 -8.592 -12.981 -10.576 212 HB1 ALA 23 HB1 ALA 23 -9.848 -15.264 -12.167 213 HB2 ALA 23 HB2 ALA 23 -9.707 -13.578 -12.717 214 HB3 ALA 23 HB3 ALA 23 -8.248 -14.570 -12.450 215 HA PRO 24 HA PRO 24 -12.294 -12.819 -8.141 216 HB2 PRO 24 HB2 PRO 24 -12.980 -10.178 -8.281 217 HB3 PRO 24 HB3 PRO 24 -11.519 -10.776 -7.438 218 HG2 PRO 24 HG2 PRO 24 -11.715 -9.646 -10.246 219 HG3 PRO 24 HG3 PRO 24 -10.552 -9.218 -8.954 220 HD2 PRO 24 HD2 PRO 24 -9.933 -11.001 -10.930 221 HD3 PRO 24 HD3 PRO 24 -9.328 -11.213 -9.263 222 H LEU 25 H LEU 25 -12.637 -11.365 -11.400 223 HA LEU 25 HA LEU 25 -15.257 -12.638 -11.749 224 HB2 LEU 25 HB2 LEU 25 -15.605 -10.436 -10.473 225 HB3 LEU 25 HB3 LEU 25 -15.036 -9.604 -11.913 226 HG LEU 25 HG LEU 25 -16.968 -10.623 -13.196 227 HD11 LEU 25 HD11 LEU 25 -17.802 -11.625 -10.437 228 HD12 LEU 25 HD12 LEU 25 -18.848 -11.586 -11.873 229 HD13 LEU 25 HD13 LEU 25 -17.428 -12.630 -11.856 230 HD21 LEU 25 HD21 LEU 25 -17.130 -8.375 -12.189 231 HD22 LEU 25 HD22 LEU 25 -18.691 -9.207 -12.169 232 HD23 LEU 25 HD23 LEU 25 -17.731 -9.089 -10.676 233 H SER 26 H SER 26 -13.481 -13.596 -13.199 234 HA SER 26 HA SER 26 -12.590 -13.968 -15.250 235 HB2 SER 26 HB2 SER 26 -15.136 -13.998 -15.567 236 HB3 SER 26 HB3 SER 26 -14.934 -12.463 -16.422 237 HG SER 26 HG SER 26 -14.854 -14.292 -17.834 238 H VAL 27 H VAL 27 -11.253 -12.002 -14.102 239 HA VAL 27 HA VAL 27 -10.238 -10.325 -16.290 240 HB VAL 27 HB VAL 27 -12.174 -9.106 -15.351 241 HG11 VAL 27 HG11 VAL 27 -10.605 -8.957 -12.755 242 HG12 VAL 27 HG12 VAL 27 -12.113 -8.094 -13.124 243 HG13 VAL 27 HG13 VAL 27 -12.112 -9.856 -13.009 244 HG21 VAL 27 HG21 VAL 27 -10.336 -7.798 -16.314 245 HG22 VAL 27 HG22 VAL 27 -11.114 -6.938 -14.985 246 HG23 VAL 27 HG23 VAL 27 -9.541 -7.710 -14.717 247 HA PRO 28 HA PRO 28 -6.627 -11.191 -13.740 248 HB2 PRO 28 HB2 PRO 28 -4.662 -9.800 -14.996 249 HB3 PRO 28 HB3 PRO 28 -5.504 -11.175 -15.759 250 HG2 PRO 28 HG2 PRO 28 -6.143 -8.222 -16.093 251 HG3 PRO 28 HG3 PRO 28 -5.849 -9.438 -17.379 252 HD2 PRO 28 HD2 PRO 28 -8.357 -8.798 -16.566 253 HD3 PRO 28 HD3 PRO 28 -7.932 -10.474 -17.008 254 H LYS 29 H LYS 29 -8.147 -9.907 -12.248 255 HA LYS 29 HA LYS 29 -8.547 -8.580 -10.500 256 HB2 LYS 29 HB2 LYS 29 -6.233 -9.495 -9.957 257 HB3 LYS 29 HB3 LYS 29 -5.607 -7.917 -10.406 258 HG2 LYS 29 HG2 LYS 29 -5.858 -7.598 -8.130 259 HG3 LYS 29 HG3 LYS 29 -7.463 -7.058 -8.653 260 HD2 LYS 29 HD2 LYS 29 -8.307 -9.360 -8.199 261 HD3 LYS 29 HD3 LYS 29 -6.680 -9.804 -7.634 262 HE2 LYS 29 HE2 LYS 29 -6.808 -8.075 -5.867 263 HE3 LYS 29 HE3 LYS 29 -8.403 -7.580 -6.442 264 HZ1 LYS 29 HZ1 LYS 29 -7.770 -10.270 -5.331 265 HZ2 LYS 29 HZ2 LYS 29 -8.595 -9.094 -4.552 266 HZ3 LYS 29 HZ3 LYS 29 -9.239 -9.800 -5.868 267 HA PRO 30 HA PRO 30 -8.967 -4.658 -12.674 268 HB2 PRO 30 HB2 PRO 30 -11.310 -3.773 -11.675 269 HB3 PRO 30 HB3 PRO 30 -11.227 -5.227 -12.721 270 HG2 PRO 30 HG2 PRO 30 -11.348 -5.114 -9.689 271 HG3 PRO 30 HG3 PRO 30 -12.318 -6.132 -10.801 272 HD2 PRO 30 HD2 PRO 30 -10.015 -6.989 -9.523 273 HD3 PRO 30 HD3 PRO 30 -10.565 -7.633 -11.094 274 H LYS 31 H LYS 31 -8.618 -2.465 -12.273 275 HA LYS 31 HA LYS 31 -7.028 -1.808 -10.025 276 HB2 LYS 31 HB2 LYS 31 -6.945 0.448 -10.938 277 HB3 LYS 31 HB3 LYS 31 -6.691 -0.792 -12.162 278 HG2 LYS 31 HG2 LYS 31 -9.199 -0.507 -12.759 279 HG3 LYS 31 HG3 LYS 31 -9.156 0.948 -11.749 280 HD2 LYS 31 HD2 LYS 31 -7.354 1.880 -13.184 281 HD3 LYS 31 HD3 LYS 31 -7.359 0.388 -14.152 282 HE2 LYS 31 HE2 LYS 31 -9.807 0.801 -14.648 283 HE3 LYS 31 HE3 LYS 31 -9.662 2.365 -13.835 284 HZ1 LYS 31 HZ1 LYS 31 -8.133 1.522 -16.245 285 HZ2 LYS 31 HZ2 LYS 31 -9.363 2.593 -16.230 286 HZ3 LYS 31 HZ3 LYS 31 -7.952 2.962 -15.495 287 H LEU 32 H LEU 32 -7.380 -1.011 -8.042 288 HA LEU 32 HA LEU 32 -10.016 0.072 -7.265 289 HB2 LEU 32 HB2 LEU 32 -9.939 -2.484 -7.123 290 HB3 LEU 32 HB3 LEU 32 -8.582 -2.313 -6.009 291 HG LEU 32 HG LEU 32 -10.148 -0.833 -4.609 292 HD11 LEU 32 HD11 LEU 32 -12.245 -2.301 -6.272 293 HD12 LEU 32 HD12 LEU 32 -12.570 -1.317 -4.829 294 HD13 LEU 32 HD13 LEU 32 -11.958 -0.549 -6.302 295 HD21 LEU 32 HD21 LEU 32 -9.459 -3.026 -3.884 296 HD22 LEU 32 HD22 LEU 32 -11.172 -2.800 -3.496 297 HD23 LEU 32 HD23 LEU 32 -10.702 -3.805 -4.890 298 H GLU 33 H GLU 33 -9.907 1.521 -5.577 299 HA GLU 33 HA GLU 33 -7.504 1.803 -3.907 300 HB2 GLU 33 HB2 GLU 33 -7.215 4.213 -4.587 301 HB3 GLU 33 HB3 GLU 33 -6.745 3.028 -5.796 302 HG2 GLU 33 HG2 GLU 33 -8.831 3.394 -7.057 303 HG3 GLU 33 HG3 GLU 33 -9.396 4.542 -5.838 304 H GLU 34 H GLU 34 -9.423 0.985 -2.680 305 HA GLU 34 HA GLU 34 -11.279 3.095 -1.750 306 HB2 GLU 34 HB2 GLU 34 -12.103 0.891 -2.561 307 HB3 GLU 34 HB3 GLU 34 -11.306 0.108 -1.190 308 HG2 GLU 34 HG2 GLU 34 -12.698 1.462 0.371 309 HG3 GLU 34 HG3 GLU 34 -13.434 2.289 -1.003 310 H LEU 35 H LEU 35 -9.970 4.383 -0.537 311 HA LEU 35 HA LEU 35 -9.271 3.448 2.208 312 HB2 LEU 35 HB2 LEU 35 -7.506 4.904 0.199 313 HB3 LEU 35 HB3 LEU 35 -7.169 4.891 1.921 314 HG LEU 35 HG LEU 35 -7.297 2.415 0.150 315 HD11 LEU 35 HD11 LEU 35 -4.939 3.802 1.463 316 HD12 LEU 35 HD12 LEU 35 -4.903 2.309 0.495 317 HD13 LEU 35 HD13 LEU 35 -5.354 3.846 -0.268 318 HD21 LEU 35 HD21 LEU 35 -7.921 1.692 2.328 319 HD22 LEU 35 HD22 LEU 35 -6.174 1.387 2.250 320 HD23 LEU 35 HD23 LEU 35 -6.796 2.786 3.133 321 H SER 36 H SER 36 -8.807 5.194 3.707 322 HA SER 36 HA SER 36 -10.769 7.413 3.517 323 HB2 SER 36 HB2 SER 36 -8.755 6.651 5.672 324 HB3 SER 36 HB3 SER 36 -9.916 7.989 5.780 325 HG SER 36 HG SER 36 -10.708 6.078 6.779 326 H GLU 37 H GLU 37 -9.946 9.720 3.958 327 HA GLU 37 HA GLU 37 -8.251 10.498 1.888 328 HB2 GLU 37 HB2 GLU 37 -9.877 11.940 3.060 329 HB3 GLU 37 HB3 GLU 37 -8.814 12.007 4.473 330 HG2 GLU 37 HG2 GLU 37 -7.067 13.129 3.117 331 HG3 GLU 37 HG3 GLU 37 -8.077 12.986 1.675 332 H GLN 38 H GLN 38 -7.260 10.103 5.317 333 HA GLN 38 HA GLN 38 -4.490 10.848 4.880 334 HB2 GLN 38 HB2 GLN 38 -5.704 10.880 7.105 335 HB3 GLN 38 HB3 GLN 38 -5.734 9.116 7.065 336 HG2 GLN 38 HG2 GLN 38 -3.116 9.297 6.867 337 HG3 GLN 38 HG3 GLN 38 -3.343 10.972 7.362 338 HE21 GLN 38 HE21 GLN 38 -3.933 7.899 10.056 339 HE22 GLN 38 HE22 GLN 38 -3.854 7.545 8.337 340 H GLN 39 H GLN 39 -6.223 7.710 4.957 341 HA GLN 39 HA GLN 39 -3.891 6.080 4.659 342 HB2 GLN 39 HB2 GLN 39 -6.802 5.552 4.121 343 HB3 GLN 39 HB3 GLN 39 -5.513 4.360 3.861 344 HG2 GLN 39 HG2 GLN 39 -4.817 4.557 6.224 345 HG3 GLN 39 HG3 GLN 39 -6.144 5.682 6.529 346 HE21 GLN 39 HE21 GLN 39 -7.023 1.942 7.163 347 HE22 GLN 39 HE22 GLN 39 -5.471 2.709 7.431 348 H LYS 40 H LYS 40 -6.083 7.522 2.250 349 HA LYS 40 HA LYS 40 -4.854 6.398 -0.100 350 HB2 LYS 40 HB2 LYS 40 -7.047 7.393 -0.179 351 HB3 LYS 40 HB3 LYS 40 -6.457 8.939 0.436 352 HG2 LYS 40 HG2 LYS 40 -5.177 9.350 -1.599 353 HG3 LYS 40 HG3 LYS 40 -5.618 7.770 -2.254 354 HD2 LYS 40 HD2 LYS 40 -7.620 9.960 -1.527 355 HD3 LYS 40 HD3 LYS 40 -6.911 9.807 -3.130 356 HE2 LYS 40 HE2 LYS 40 -8.545 7.615 -1.767 357 HE3 LYS 40 HE3 LYS 40 -9.214 8.812 -2.879 358 HZ1 LYS 40 HZ1 LYS 40 -7.080 6.879 -3.616 359 HZ2 LYS 40 HZ2 LYS 40 -8.650 6.744 -4.032 360 HZ3 LYS 40 HZ3 LYS 40 -7.757 7.959 -4.625 361 H ILE 41 H ILE 41 -4.081 9.410 1.752 362 HA ILE 41 HA ILE 41 -1.929 10.173 0.001 363 HB ILE 41 HB ILE 41 -2.346 10.812 2.904 364 HG12 ILE 41 HG12 ILE 41 -2.837 12.675 0.528 365 HG13 ILE 41 HG13 ILE 41 -4.100 11.589 1.060 366 HG21 ILE 41 HG21 ILE 41 -0.454 12.100 0.903 367 HG22 ILE 41 HG22 ILE 41 -0.838 12.781 2.496 368 HG23 ILE 41 HG23 ILE 41 -0.015 11.235 2.392 369 HD11 ILE 41 HD11 ILE 41 -2.839 13.776 2.758 370 HD12 ILE 41 HD12 ILE 41 -4.470 13.744 2.066 371 HD13 ILE 41 HD13 ILE 41 -4.031 12.588 3.337 372 H ILE 42 H ILE 42 -1.902 8.097 3.002 373 HA ILE 42 HA ILE 42 0.965 7.793 2.997 374 HB ILE 42 HB ILE 42 -1.190 5.931 4.046 375 HG12 ILE 42 HG12 ILE 42 0.568 7.732 5.751 376 HG13 ILE 42 HG13 ILE 42 -0.901 8.375 5.035 377 HG21 ILE 42 HG21 ILE 42 1.830 5.970 4.518 378 HG22 ILE 42 HG22 ILE 42 0.693 5.024 5.486 379 HG23 ILE 42 HG23 ILE 42 0.884 4.660 3.778 380 HD11 ILE 42 HD11 ILE 42 -0.787 5.955 6.880 381 HD12 ILE 42 HD12 ILE 42 -1.383 7.576 7.279 382 HD13 ILE 42 HD13 ILE 42 -2.241 6.582 6.077 383 H LEU 43 H LEU 43 -1.634 5.853 1.544 384 HA LEU 43 HA LEU 43 -0.063 3.817 0.353 385 HB2 LEU 43 HB2 LEU 43 -2.505 3.789 0.679 386 HB3 LEU 43 HB3 LEU 43 -2.726 5.073 -0.481 387 HG LEU 43 HG LEU 43 -3.356 2.745 -1.159 388 HD11 LEU 43 HD11 LEU 43 -1.365 4.117 -2.977 389 HD12 LEU 43 HD12 LEU 43 -2.580 2.919 -3.446 390 HD13 LEU 43 HD13 LEU 43 -3.084 4.496 -2.810 391 HD21 LEU 43 HD21 LEU 43 -1.520 1.527 -0.183 392 HD22 LEU 43 HD22 LEU 43 -1.610 1.198 -1.920 393 HD23 LEU 43 HD23 LEU 43 -0.342 2.274 -1.285 394 H ALA 44 H ALA 44 -1.184 6.925 -1.026 395 HA ALA 44 HA ALA 44 0.163 6.754 -3.517 396 HB1 ALA 44 HB1 ALA 44 -0.680 9.140 -1.831 397 HB2 ALA 44 HB2 ALA 44 -0.256 9.204 -3.558 398 HB3 ALA 44 HB3 ALA 44 -1.692 8.293 -3.026 399 H GLU 45 H GLU 45 1.203 8.553 -0.512 400 HA GLU 45 HA GLU 45 3.691 9.417 -1.572 401 HB2 GLU 45 HB2 GLU 45 2.756 8.865 1.266 402 HB3 GLU 45 HB3 GLU 45 4.348 9.521 0.918 403 HG2 GLU 45 HG2 GLU 45 1.788 10.870 -0.035 404 HG3 GLU 45 HG3 GLU 45 2.556 11.213 1.511 405 H TYR 46 H TYR 46 2.876 6.238 -0.175 406 HA TYR 46 HA TYR 46 5.599 5.355 0.110 407 HB2 TYR 46 HB2 TYR 46 3.645 4.388 1.269 408 HB3 TYR 46 HB3 TYR 46 3.012 3.796 -0.259 409 HD1 TYR 46 HD1 TYR 46 2.849 1.705 1.199 410 HD2 TYR 46 HD2 TYR 46 6.619 3.369 -0.106 411 HE1 TYR 46 HE1 TYR 46 3.973 -0.473 1.640 412 HE2 TYR 46 HE2 TYR 46 7.734 1.216 0.390 413 HH TYR 46 HH TYR 46 5.950 -1.616 1.641 414 H ILE 47 H ILE 47 3.167 4.656 -2.451 415 HA ILE 47 HA ILE 47 4.864 3.247 -4.220 416 HB ILE 47 HB ILE 47 2.250 4.732 -4.414 417 HG12 ILE 47 HG12 ILE 47 2.894 1.744 -4.486 418 HG13 ILE 47 HG13 ILE 47 2.462 2.604 -3.015 419 HG21 ILE 47 HG21 ILE 47 3.518 3.045 -6.594 420 HG22 ILE 47 HG22 ILE 47 1.821 3.569 -6.607 421 HG23 ILE 47 HG23 ILE 47 3.096 4.764 -6.706 422 HD11 ILE 47 HD11 ILE 47 0.642 2.103 -5.391 423 HD12 ILE 47 HD12 ILE 47 0.484 1.520 -3.729 424 HD13 ILE 47 HD13 ILE 47 0.277 3.248 -4.090 425 H ALA 48 H ALA 48 4.054 6.740 -3.917 426 HA ALA 48 HA ALA 48 5.372 7.554 -6.352 427 HB1 ALA 48 HB1 ALA 48 4.631 9.103 -3.835 428 HB2 ALA 48 HB2 ALA 48 5.068 9.814 -5.405 429 HB3 ALA 48 HB3 ALA 48 3.587 8.848 -5.252 430 H GLU 49 H GLU 49 6.536 6.979 -3.048 431 HA GLU 49 HA GLU 49 9.165 8.189 -3.591 432 HB2 GLU 49 HB2 GLU 49 8.109 8.376 -1.385 433 HB3 GLU 49 HB3 GLU 49 8.163 6.613 -1.192 434 HG2 GLU 49 HG2 GLU 49 10.615 6.655 -1.243 435 HG3 GLU 49 HG3 GLU 49 10.611 8.379 -1.627 436 H VAL 50 H VAL 50 7.807 4.842 -3.349 437 HA VAL 50 HA VAL 50 10.531 3.821 -4.034 438 HB VAL 50 HB VAL 50 10.117 1.830 -3.054 439 HG11 VAL 50 HG11 VAL 50 8.728 3.791 -1.209 440 HG12 VAL 50 HG12 VAL 50 9.598 2.310 -0.762 441 HG13 VAL 50 HG13 VAL 50 10.483 3.674 -1.461 442 HG21 VAL 50 HG21 VAL 50 7.860 1.279 -3.882 443 HG22 VAL 50 HG22 VAL 50 8.006 1.021 -2.145 444 HG23 VAL 50 HG23 VAL 50 7.151 2.450 -2.756 445 H GLY 51 H GLY 51 7.563 4.366 -5.568 446 HA2 GLY 51 HA2 GLY 51 7.412 4.428 -7.890 447 HA3 GLY 51 HA3 GLY 51 8.917 3.519 -8.031 448 H LEU 52 H LEU 52 6.054 2.543 -6.267 449 HA LEU 52 HA LEU 52 4.799 0.763 -6.142 450 HB2 LEU 52 HB2 LEU 52 3.972 1.794 -8.339 451 HB3 LEU 52 HB3 LEU 52 4.939 0.600 -9.178 452 HG LEU 52 HG LEU 52 3.567 -1.231 -8.200 453 HD11 LEU 52 HD11 LEU 52 1.961 1.060 -6.992 454 HD12 LEU 52 HD12 LEU 52 1.420 -0.623 -7.064 455 HD13 LEU 52 HD13 LEU 52 2.829 -0.209 -6.094 456 HD21 LEU 52 HD21 LEU 52 2.961 -0.189 -10.362 457 HD22 LEU 52 HD22 LEU 52 1.530 -0.759 -9.471 458 HD23 LEU 52 HD23 LEU 52 1.929 0.964 -9.486 459 H GLN 53 H GLN 53 7.595 0.181 -7.824 460 HA GLN 53 HA GLN 53 7.458 -2.670 -8.211 461 HB2 GLN 53 HB2 GLN 53 9.726 -0.650 -8.317 462 HB3 GLN 53 HB3 GLN 53 9.942 -2.338 -8.777 463 HG2 GLN 53 HG2 GLN 53 8.575 -2.175 -10.674 464 HG3 GLN 53 HG3 GLN 53 7.735 -0.738 -10.098 465 HE21 GLN 53 HE21 GLN 53 10.256 1.571 -11.147 466 HE22 GLN 53 HE22 GLN 53 8.903 1.317 -10.034 467 H ASN 54 H ASN 54 8.187 -0.936 -5.378 468 HA ASN 54 HA ASN 54 9.806 -3.191 -4.235 469 HB2 ASN 54 HB2 ASN 54 10.064 -0.218 -3.709 470 HB3 ASN 54 HB3 ASN 54 11.040 -1.472 -2.959 471 HD21 ASN 54 HD21 ASN 54 12.102 -0.064 -6.579 472 HD22 ASN 54 HD22 ASN 54 10.740 0.618 -5.699 473 H ILE 55 H ILE 55 6.800 -1.972 -3.952 474 HA ILE 55 HA ILE 55 6.622 -1.981 -1.018 475 HB ILE 55 HB ILE 55 4.290 -1.667 -1.198 476 HG12 ILE 55 HG12 ILE 55 4.516 -2.102 -4.202 477 HG13 ILE 55 HG13 ILE 55 3.726 -3.180 -3.048 478 HG21 ILE 55 HG21 ILE 55 5.450 0.119 -3.359 479 HG22 ILE 55 HG22 ILE 55 4.254 0.507 -2.095 480 HG23 ILE 55 HG23 ILE 55 5.929 0.228 -1.657 481 HD11 ILE 55 HD11 ILE 55 2.874 -0.344 -3.703 482 HD12 ILE 55 HD12 ILE 55 2.060 -1.840 -4.182 483 HD13 ILE 55 HD13 ILE 55 2.124 -1.389 -2.459 484 H THR 56 H THR 56 5.436 -3.499 0.257 485 HA THR 56 HA THR 56 4.937 -6.160 -0.951 486 HB THR 56 HB THR 56 5.876 -6.897 1.473 487 HG1 THR 56 HG1 THR 56 7.731 -5.696 1.954 488 HG21 THR 56 HG21 THR 56 7.743 -6.214 -0.845 489 HG22 THR 56 HG22 THR 56 8.065 -7.385 0.456 490 HG23 THR 56 HG23 THR 56 6.772 -7.698 -0.714 491 H ALA 57 H ALA 57 3.228 -7.311 -0.018 492 HA ALA 57 HA ALA 57 1.146 -5.818 1.166 493 HB1 ALA 57 HB1 ALA 57 1.627 -8.834 1.123 494 HB2 ALA 57 HB2 ALA 57 0.087 -8.013 1.451 495 HB3 ALA 57 HB3 ALA 57 0.830 -7.888 -0.157 496 H ILE 58 H ILE 58 3.806 -7.553 2.630 497 HA ILE 58 HA ILE 58 2.827 -7.713 5.352 498 HB ILE 58 HB ILE 58 5.603 -7.707 4.090 499 HG12 ILE 58 HG12 ILE 58 5.660 -10.100 4.847 500 HG13 ILE 58 HG13 ILE 58 4.000 -9.971 5.419 501 HG21 ILE 58 HG21 ILE 58 4.779 -8.084 7.023 502 HG22 ILE 58 HG22 ILE 58 6.379 -8.541 6.385 503 HG23 ILE 58 HG23 ILE 58 5.878 -6.855 6.369 504 HD11 ILE 58 HD11 ILE 58 4.827 -9.639 2.501 505 HD12 ILE 58 HD12 ILE 58 4.310 -11.170 3.234 506 HD13 ILE 58 HD13 ILE 58 3.168 -9.830 3.144 507 H THR 59 H THR 59 5.003 -5.410 3.619 508 HA THR 59 HA THR 59 5.241 -3.668 5.925 509 HB THR 59 HB THR 59 5.960 -3.336 2.998 510 HG1 THR 59 HG1 THR 59 7.919 -4.023 3.645 511 HG21 THR 59 HG21 THR 59 6.825 -1.712 5.435 512 HG22 THR 59 HG22 THR 59 7.553 -1.615 3.810 513 HG23 THR 59 HG23 THR 59 5.871 -1.117 4.055 514 H LEU 60 H LEU 60 3.381 -3.508 2.869 515 HA LEU 60 HA LEU 60 2.038 -1.089 3.378 516 HB2 LEU 60 HB2 LEU 60 2.306 -2.453 1.229 517 HB3 LEU 60 HB3 LEU 60 1.058 -3.525 1.834 518 HG LEU 60 HG LEU 60 -0.521 -1.506 1.829 519 HD11 LEU 60 HD11 LEU 60 1.813 -0.250 0.325 520 HD12 LEU 60 HD12 LEU 60 0.196 0.438 0.504 521 HD13 LEU 60 HD13 LEU 60 1.211 0.269 1.928 522 HD21 LEU 60 HD21 LEU 60 -0.478 -3.133 -0.011 523 HD22 LEU 60 HD22 LEU 60 -0.768 -1.494 -0.624 524 HD23 LEU 60 HD23 LEU 60 0.835 -2.242 -0.792 525 H SER 61 H SER 61 1.217 -4.419 4.425 526 HA SER 61 HA SER 61 -1.228 -3.968 5.685 527 HB2 SER 61 HB2 SER 61 -0.576 -6.150 5.475 528 HB3 SER 61 HB3 SER 61 0.997 -5.888 6.219 529 HG SER 61 HG SER 61 -0.798 -6.962 7.450 530 H LYS 62 H LYS 62 1.926 -2.966 6.627 531 HA LYS 62 HA LYS 62 0.943 -2.082 9.286 532 HB2 LYS 62 HB2 LYS 62 3.737 -2.875 8.391 533 HB3 LYS 62 HB3 LYS 62 3.464 -1.893 9.826 534 HG2 LYS 62 HG2 LYS 62 3.542 -3.999 10.743 535 HG3 LYS 62 HG3 LYS 62 1.813 -3.697 10.616 536 HD2 LYS 62 HD2 LYS 62 1.972 -5.033 8.363 537 HD3 LYS 62 HD3 LYS 62 3.588 -5.475 8.904 538 HE2 LYS 62 HE2 LYS 62 2.166 -7.262 9.485 539 HE3 LYS 62 HE3 LYS 62 2.510 -6.423 11.003 540 HZ1 LYS 62 HZ1 LYS 62 0.048 -6.020 9.364 541 HZ2 LYS 62 HZ2 LYS 62 0.119 -6.964 10.702 542 HZ3 LYS 62 HZ3 LYS 62 0.331 -5.351 10.831 543 H LYS 63 H LYS 63 2.221 -0.730 6.301 544 HA LYS 63 HA LYS 63 2.873 1.889 7.269 545 HB2 LYS 63 HB2 LYS 63 1.858 0.777 4.633 546 HB3 LYS 63 HB3 LYS 63 2.237 2.486 4.822 547 HG2 LYS 63 HG2 LYS 63 4.260 0.254 5.313 548 HG3 LYS 63 HG3 LYS 63 4.005 1.041 3.765 549 HD2 LYS 63 HD2 LYS 63 4.550 3.249 4.892 550 HD3 LYS 63 HD3 LYS 63 5.023 2.301 6.327 551 HE2 LYS 63 HE2 LYS 63 6.649 1.034 4.935 552 HE3 LYS 63 HE3 LYS 63 6.177 1.985 3.518 553 HZ1 LYS 63 HZ1 LYS 63 7.427 3.098 5.977 554 HZ2 LYS 63 HZ2 LYS 63 8.188 2.874 4.552 555 HZ3 LYS 63 HZ3 LYS 63 6.990 3.977 4.670 556 H LEU 64 H LEU 64 -0.236 0.414 6.439 557 HA LEU 64 HA LEU 64 -1.636 2.912 7.304 558 HB2 LEU 64 HB2 LEU 64 -2.740 0.930 5.299 559 HB3 LEU 64 HB3 LEU 64 -3.348 2.502 5.747 560 HG LEU 64 HG LEU 64 -0.876 3.228 4.857 561 HD11 LEU 64 HD11 LEU 64 -1.696 0.883 3.073 562 HD12 LEU 64 HD12 LEU 64 -0.330 1.997 2.822 563 HD13 LEU 64 HD13 LEU 64 -0.324 0.852 4.175 564 HD21 LEU 64 HD21 LEU 64 -3.029 4.114 4.145 565 HD22 LEU 64 HD22 LEU 64 -1.941 3.826 2.789 566 HD23 LEU 64 HD23 LEU 64 -3.292 2.700 3.096 567 H ASN 65 H ASN 65 -0.893 0.306 8.813 568 HA ASN 65 HA ASN 65 -1.760 -1.239 10.202 569 HB2 ASN 65 HB2 ASN 65 -3.099 -0.315 12.023 570 HB3 ASN 65 HB3 ASN 65 -1.725 0.684 11.584 571 HD21 ASN 65 HD21 ASN 65 -5.515 2.167 10.979 572 HD22 ASN 65 HD22 ASN 65 -5.250 0.421 10.943 573 H ILE 66 H ILE 66 -2.558 -2.210 8.078 574 HA ILE 66 HA ILE 66 -5.491 -2.802 8.203 575 HB ILE 66 HB ILE 66 -5.049 -3.213 5.632 576 HG12 ILE 66 HG12 ILE 66 -3.025 -0.993 6.096 577 HG13 ILE 66 HG13 ILE 66 -2.570 -2.625 5.820 578 HG21 ILE 66 HG21 ILE 66 -5.474 -0.495 6.907 579 HG22 ILE 66 HG22 ILE 66 -5.863 -0.900 5.226 580 HG23 ILE 66 HG23 ILE 66 -6.705 -1.730 6.534 581 HD11 ILE 66 HD11 ILE 66 -4.048 -0.828 3.865 582 HD12 ILE 66 HD12 ILE 66 -2.432 -1.528 3.702 583 HD13 ILE 66 HD13 ILE 66 -3.864 -2.577 3.615 584 H THR 67 H THR 67 -5.758 -4.893 6.574 585 HA THR 67 HA THR 67 -4.178 -7.048 7.852 586 HB THR 67 HB THR 67 -5.654 -8.605 6.795 587 HG1 THR 67 HG1 THR 67 -7.441 -7.715 5.564 588 HG21 THR 67 HG21 THR 67 -7.382 -6.321 7.837 589 HG22 THR 67 HG22 THR 67 -7.783 -8.052 7.794 590 HG23 THR 67 HG23 THR 67 -6.496 -7.472 8.865 591 H VAL 68 H VAL 68 -3.052 -8.648 6.591 592 HA VAL 68 HA VAL 68 -1.514 -7.680 4.337 593 HB VAL 68 HB VAL 68 -1.993 -10.529 5.295 594 HG11 VAL 68 HG11 VAL 68 0.160 -9.418 3.438 595 HG12 VAL 68 HG12 VAL 68 0.135 -11.058 4.116 596 HG13 VAL 68 HG13 VAL 68 -1.122 -10.567 2.982 597 HG21 VAL 68 HG21 VAL 68 -0.904 -9.145 7.028 598 HG22 VAL 68 HG22 VAL 68 0.250 -10.285 6.341 599 HG23 VAL 68 HG23 VAL 68 0.299 -8.583 5.838 600 H GLU 69 H GLU 69 -4.742 -9.107 4.521 601 HA GLU 69 HA GLU 69 -4.699 -10.142 1.779 602 HB2 GLU 69 HB2 GLU 69 -6.940 -9.777 3.819 603 HB3 GLU 69 HB3 GLU 69 -7.125 -10.522 2.225 604 HG2 GLU 69 HG2 GLU 69 -5.456 -12.262 2.845 605 HG3 GLU 69 HG3 GLU 69 -5.310 -11.550 4.453 606 H LYS 70 H LYS 70 -6.028 -7.267 3.556 607 HA LYS 70 HA LYS 70 -7.147 -6.323 1.088 608 HB2 LYS 70 HB2 LYS 70 -8.425 -4.967 2.256 609 HB3 LYS 70 HB3 LYS 70 -7.966 -5.994 3.581 610 HG2 LYS 70 HG2 LYS 70 -7.526 -4.063 4.650 611 HG3 LYS 70 HG3 LYS 70 -5.996 -4.119 3.792 612 HD2 LYS 70 HD2 LYS 70 -6.891 -1.916 3.496 613 HD3 LYS 70 HD3 LYS 70 -7.104 -2.737 1.943 614 HE2 LYS 70 HE2 LYS 70 -9.477 -3.204 2.507 615 HE3 LYS 70 HE3 LYS 70 -9.261 -2.473 4.098 616 HZ1 LYS 70 HZ1 LYS 70 -8.966 -0.981 1.532 617 HZ2 LYS 70 HZ2 LYS 70 -10.302 -0.960 2.466 618 HZ3 LYS 70 HZ3 LYS 70 -8.913 -0.338 3.037 619 H ALA 71 H ALA 71 -4.183 -5.729 2.829 620 HA ALA 71 HA ALA 71 -3.140 -3.610 1.208 621 HB1 ALA 71 HB1 ALA 71 -1.731 -5.860 2.716 622 HB2 ALA 71 HB2 ALA 71 -0.979 -4.374 2.119 623 HB3 ALA 71 HB3 ALA 71 -2.204 -4.289 3.393 624 H LYS 72 H LYS 72 -2.907 -7.214 0.854 625 HA LYS 72 HA LYS 72 -1.209 -7.112 -1.457 626 HB2 LYS 72 HB2 LYS 72 -1.388 -9.020 0.158 627 HB3 LYS 72 HB3 LYS 72 -3.052 -9.300 -0.336 628 HG2 LYS 72 HG2 LYS 72 -2.351 -9.990 -2.531 629 HG3 LYS 72 HG3 LYS 72 -0.671 -9.514 -2.221 630 HD2 LYS 72 HD2 LYS 72 -2.141 -11.621 -0.563 631 HD3 LYS 72 HD3 LYS 72 -1.223 -12.015 -2.033 632 HE2 LYS 72 HE2 LYS 72 0.814 -10.986 -1.001 633 HE3 LYS 72 HE3 LYS 72 -0.102 -10.718 0.490 634 HZ1 LYS 72 HZ1 LYS 72 0.428 -13.375 -0.738 635 HZ2 LYS 72 HZ2 LYS 72 1.165 -12.790 0.592 636 HZ3 LYS 72 HZ3 LYS 72 -0.429 -13.140 0.633 637 H ASN 73 H ASN 73 -4.681 -7.084 -0.996 638 HA ASN 73 HA ASN 73 -5.509 -7.648 -3.575 639 HB2 ASN 73 HB2 ASN 73 -7.416 -7.431 -2.419 640 HB3 ASN 73 HB3 ASN 73 -6.639 -6.503 -1.159 641 HD21 ASN 73 HD21 ASN 73 -7.824 -3.377 -2.276 642 HD22 ASN 73 HD22 ASN 73 -6.711 -4.205 -1.196 643 H TYR 74 H TYR 74 -4.090 -4.597 -2.420 644 HA TYR 74 HA TYR 74 -4.653 -2.999 -4.732 645 HB2 TYR 74 HB2 TYR 74 -2.486 -2.715 -2.629 646 HB3 TYR 74 HB3 TYR 74 -2.977 -1.485 -3.784 647 HD1 TYR 74 HD1 TYR 74 -3.110 -2.167 -0.489 648 HD2 TYR 74 HD2 TYR 74 -5.813 -1.248 -3.728 649 HE1 TYR 74 HE1 TYR 74 -4.757 -1.245 1.137 650 HE2 TYR 74 HE2 TYR 74 -7.491 -0.410 -2.084 651 HH TYR 74 HH TYR 74 -6.803 -0.351 1.409 652 H ILE 75 H ILE 75 -1.898 -4.965 -3.610 653 HA ILE 75 HA ILE 75 -0.128 -4.266 -5.763 654 HB ILE 75 HB ILE 75 -0.090 -6.647 -3.866 655 HG12 ILE 75 HG12 ILE 75 1.324 -3.945 -3.699 656 HG13 ILE 75 HG13 ILE 75 -0.086 -4.383 -2.744 657 HG21 ILE 75 HG21 ILE 75 2.143 -5.452 -5.577 658 HG22 ILE 75 HG22 ILE 75 2.324 -6.783 -4.415 659 HG23 ILE 75 HG23 ILE 75 1.356 -7.020 -5.855 660 HD11 ILE 75 HD11 ILE 75 2.667 -5.619 -2.514 661 HD12 ILE 75 HD12 ILE 75 1.802 -4.615 -1.341 662 HD13 ILE 75 HD13 ILE 75 1.200 -6.241 -1.712 663 H LYS 76 H LYS 76 -2.470 -6.937 -5.324 664 HA LYS 76 HA LYS 76 -1.749 -8.348 -7.713 665 HB2 LYS 76 HB2 LYS 76 -4.335 -8.304 -6.096 666 HB3 LYS 76 HB3 LYS 76 -4.085 -9.323 -7.525 667 HG2 LYS 76 HG2 LYS 76 -2.004 -10.243 -6.417 668 HG3 LYS 76 HG3 LYS 76 -2.510 -9.414 -4.934 669 HD2 LYS 76 HD2 LYS 76 -4.600 -10.718 -4.887 670 HD3 LYS 76 HD3 LYS 76 -4.202 -11.450 -6.460 671 HE2 LYS 76 HE2 LYS 76 -2.123 -12.418 -5.446 672 HE3 LYS 76 HE3 LYS 76 -2.626 -11.790 -3.873 673 HZ1 LYS 76 HZ1 LYS 76 -4.150 -13.764 -5.495 674 HZ2 LYS 76 HZ2 LYS 76 -3.285 -14.115 -4.161 675 HZ3 LYS 76 HZ3 LYS 76 -4.626 -13.193 -4.037 676 H ASN 77 H ASN 77 -3.908 -5.528 -7.348 677 HA ASN 77 HA ASN 77 -4.626 -5.822 -10.209 678 HB2 ASN 77 HB2 ASN 77 -5.990 -3.927 -10.015 679 HB3 ASN 77 HB3 ASN 77 -6.451 -5.112 -8.793 680 HD21 ASN 77 HD21 ASN 77 -5.945 -2.811 -6.152 681 HD22 ASN 77 HD22 ASN 77 -6.009 -4.537 -6.481 682 H SER 78 H SER 78 -2.774 -3.724 -7.972 683 HA SER 78 HA SER 78 -1.691 -2.306 -10.322 684 HB2 SER 78 HB2 SER 78 -3.042 -0.988 -8.709 685 HB3 SER 78 HB3 SER 78 -1.788 -1.274 -7.487 686 HG SER 78 HG SER 78 -1.486 0.697 -8.650 687 H ASN 79 H ASN 79 0.004 -3.711 -10.803 688 HA ASN 79 HA ASN 79 2.406 -3.072 -9.265 689 HB2 ASN 79 HB2 ASN 79 3.293 -5.284 -9.136 690 HB3 ASN 79 HB3 ASN 79 1.722 -5.282 -8.346 691 HD21 ASN 79 HD21 ASN 79 0.282 -7.612 -10.610 692 HD22 ASN 79 HD22 ASN 79 0.017 -6.486 -9.272 693 H ARG 80 H ARG 80 4.150 -2.760 -10.558 694 HA ARG 80 HA ARG 80 5.292 -2.018 -12.370 695 HB2 ARG 80 HB2 ARG 80 4.160 -4.589 -13.514 696 HB3 ARG 80 HB3 ARG 80 5.135 -3.506 -14.486 697 HG2 ARG 80 HG2 ARG 80 6.575 -5.175 -13.658 698 HG3 ARG 80 HG3 ARG 80 6.998 -3.659 -12.868 699 HD2 ARG 80 HD2 ARG 80 5.839 -4.389 -10.813 700 HD3 ARG 80 HD3 ARG 80 5.325 -5.882 -11.602 701 HE ARG 80 HE ARG 80 8.003 -5.179 -10.578 702 HH11 ARG 80 HH11 ARG 80 9.582 -6.722 -10.469 703 HH12 ARG 80 HH12 ARG 80 9.371 -8.245 -11.279 704 HH21 ARG 80 HH21 ARG 80 6.271 -7.511 -12.544 705 HH22 ARG 80 HH22 ARG 80 7.553 -8.686 -12.427 706 H LEU 81 H LEU 81 1.900 -2.281 -12.949 707 HA LEU 81 HA LEU 81 1.931 -0.591 -15.338 708 HB2 LEU 81 HB2 LEU 81 0.574 -2.661 -15.091 709 HB3 LEU 81 HB3 LEU 81 -0.280 -1.933 -13.731 710 HG LEU 81 HG LEU 81 -1.237 -0.206 -15.252 711 HD11 LEU 81 HD11 LEU 81 0.160 -1.821 -17.439 712 HD12 LEU 81 HD12 LEU 81 -1.084 -0.581 -17.714 713 HD13 LEU 81 HD13 LEU 81 0.471 -0.120 -17.018 714 HD21 LEU 81 HD21 LEU 81 -2.434 -2.303 -14.763 715 HD22 LEU 81 HD22 LEU 81 -2.782 -1.731 -16.399 716 HD23 LEU 81 HD23 LEU 81 -1.654 -3.087 -16.152 717 H GLY 82 H GLY 82 1.023 -0.188 -11.915 718 HA2 GLY 82 HA2 GLY 82 -0.340 2.339 -12.362 719 HA3 GLY 82 HA3 GLY 82 0.107 1.652 -10.802 720 H ARG 83 H ARG 83 0.352 4.397 -11.855 721 HA ARG 83 HA ARG 83 3.241 4.914 -11.270 722 HB2 ARG 83 HB2 ARG 83 1.802 6.156 -13.642 723 HB3 ARG 83 HB3 ARG 83 3.434 6.536 -13.062 724 HG2 ARG 83 HG2 ARG 83 4.036 4.094 -13.448 725 HG3 ARG 83 HG3 ARG 83 2.453 3.895 -14.220 726 HD2 ARG 83 HD2 ARG 83 3.086 5.755 -15.809 727 HD3 ARG 83 HD3 ARG 83 4.719 5.704 -15.142 728 HE ARG 83 HE ARG 83 3.473 3.825 -16.990 729 HH11 ARG 83 HH11 ARG 83 4.525 2.029 -17.729 730 HH12 ARG 83 HH12 ARG 83 5.981 1.486 -16.949 731 HH21 ARG 83 HH21 ARG 83 6.042 3.982 -14.602 732 HH22 ARG 83 HH22 ARG 83 6.822 2.557 -15.231 733 H THR 84 H THR 84 0.746 7.188 -12.259 734 HA THR 84 HA THR 84 0.131 8.063 -9.551 735 HB THR 84 HB THR 84 2.194 9.189 -9.667 736 HG1 THR 84 HG1 THR 84 1.495 11.318 -9.544 737 HG21 THR 84 HG21 THR 84 1.427 10.402 -12.347 738 HG22 THR 84 HG22 THR 84 2.872 10.779 -11.388 739 HG23 THR 84 HG23 THR 84 2.674 9.161 -12.075 740 H ASN 85 H ASN 85 -1.959 8.555 -9.607 741 HA ASN 85 HA ASN 85 -3.188 9.661 -12.083 742 HB2 ASN 85 HB2 ASN 85 -4.359 7.275 -10.625 743 HB3 ASN 85 HB3 ASN 85 -4.828 7.943 -12.189 744 HD21 ASN 85 HD21 ASN 85 -1.845 6.330 -13.738 745 HD22 ASN 85 HD22 ASN 85 -2.336 8.001 -13.560 746 H ASN 86 H ASN 86 -4.807 11.081 -11.720 747 HA ASN 86 HA ASN 86 -6.142 11.323 -9.112 748 HB2 ASN 86 HB2 ASN 86 -5.324 13.531 -8.638 749 HB3 ASN 86 HB3 ASN 86 -3.926 12.502 -8.861 750 HD21 ASN 86 HD21 ASN 86 -4.158 15.816 -11.041 751 HD22 ASN 86 HD22 ASN 86 -5.097 15.525 -9.585 752 H LEU 87 H LEU 87 -7.700 13.164 -9.102 753 HA LEU 87 HA LEU 87 -9.594 14.068 -9.863 754 HB2 LEU 87 HB2 LEU 87 -7.435 15.322 -11.064 755 HB3 LEU 87 HB3 LEU 87 -8.457 15.021 -12.437 756 HG LEU 87 HG LEU 87 -8.834 17.228 -11.596 757 HD11 LEU 87 HD11 LEU 87 -11.239 15.576 -10.728 758 HD12 LEU 87 HD12 LEU 87 -11.218 17.302 -11.139 759 HD13 LEU 87 HD13 LEU 87 -10.876 16.098 -12.390 760 HD21 LEU 87 HD21 LEU 87 -8.047 16.873 -9.279 761 HD22 LEU 87 HD22 LEU 87 -9.571 17.768 -9.355 762 HD23 LEU 87 HD23 LEU 87 -9.577 16.058 -8.885 763 H LYS 88 H LYS 88 -9.331 11.293 -10.544 764 HA LYS 88 HA LYS 88 -11.344 11.106 -12.749 765 HB2 LYS 88 HB2 LYS 88 -10.296 9.104 -13.588 766 HB3 LYS 88 HB3 LYS 88 -9.171 10.458 -13.631 767 HG2 LYS 88 HG2 LYS 88 -7.875 9.596 -11.813 768 HG3 LYS 88 HG3 LYS 88 -9.147 8.474 -11.320 769 HD2 LYS 88 HD2 LYS 88 -7.335 7.269 -12.416 770 HD3 LYS 88 HD3 LYS 88 -8.841 7.134 -13.331 771 HE2 LYS 88 HE2 LYS 88 -8.038 8.962 -14.861 772 HE3 LYS 88 HE3 LYS 88 -6.508 9.000 -13.975 773 HZ1 LYS 88 HZ1 LYS 88 -7.587 6.660 -15.463 774 HZ2 LYS 88 HZ2 LYS 88 -6.352 7.600 -15.954 775 HZ3 LYS 88 HZ3 LYS 88 -6.177 6.654 -14.635 776 H THR 89 H THR 89 -11.240 10.804 -9.567 777 HA THR 89 HA THR 89 -13.481 8.996 -9.584 778 HB THR 89 HB THR 89 -11.655 7.384 -9.248 779 HG1 THR 89 HG1 THR 89 -12.696 6.426 -7.510 780 HG21 THR 89 HG21 THR 89 -11.237 8.648 -6.508 781 HG22 THR 89 HG22 THR 89 -10.415 7.233 -7.197 782 HG23 THR 89 HG23 THR 89 -10.105 8.845 -7.867 783 H ILE 90 H ILE 90 -14.943 10.006 -8.569 784 HA ILE 90 HA ILE 90 -14.460 11.441 -6.023 785 HB ILE 90 HB ILE 90 -16.168 13.129 -6.954 786 HG12 ILE 90 HG12 ILE 90 -16.672 11.776 -9.061 787 HG13 ILE 90 HG13 ILE 90 -16.585 13.523 -9.121 788 HG21 ILE 90 HG21 ILE 90 -13.333 13.200 -8.016 789 HG22 ILE 90 HG22 ILE 90 -14.432 14.585 -7.841 790 HG23 ILE 90 HG23 ILE 90 -13.879 13.706 -6.407 791 HD11 ILE 90 HD11 ILE 90 -14.369 11.679 -10.114 792 HD12 ILE 90 HD12 ILE 90 -15.574 12.515 -11.100 793 HD13 ILE 90 HD13 ILE 90 -14.384 13.455 -10.193 794 H GLY 91 H GLY 91 -15.979 8.855 -7.150 795 HA2 GLY 91 HA2 GLY 91 -17.885 7.679 -6.622 796 HA3 GLY 91 HA3 GLY 91 -18.220 8.852 -5.343 797 H ILE 92 H ILE 92 -17.941 10.459 -8.282 798 HA ILE 92 HA ILE 92 -19.357 11.589 -9.614 799 HB ILE 92 HB ILE 92 -20.806 8.918 -9.791 800 HG12 ILE 92 HG12 ILE 92 -19.223 8.965 -12.000 801 HG13 ILE 92 HG13 ILE 92 -18.208 9.943 -10.966 802 HG21 ILE 92 HG21 ILE 92 -20.737 11.271 -11.724 803 HG22 ILE 92 HG22 ILE 92 -21.273 9.634 -12.169 804 HG23 ILE 92 HG23 ILE 92 -22.166 10.514 -10.970 805 HD11 ILE 92 HD11 ILE 92 -19.231 7.133 -10.313 806 HD12 ILE 92 HD12 ILE 92 -17.652 7.504 -11.028 807 HD13 ILE 92 HD13 ILE 92 -18.010 8.037 -9.388 808 H LEU 93 H LEU 93 -19.850 11.798 -6.808 809 HA LEU 93 HA LEU 93 -21.275 12.496 -5.227 810 HB2 LEU 93 HB2 LEU 93 -21.218 14.379 -7.044 811 HB3 LEU 93 HB3 LEU 93 -22.873 13.897 -7.378 812 HG LEU 93 HG LEU 93 -23.429 14.421 -4.943 813 HD11 LEU 93 HD11 LEU 93 -20.609 15.590 -4.976 814 HD12 LEU 93 HD12 LEU 93 -21.836 15.885 -3.724 815 HD13 LEU 93 HD13 LEU 93 -21.179 14.262 -3.941 816 HD21 LEU 93 HD21 LEU 93 -23.865 16.016 -6.771 817 HD22 LEU 93 HD22 LEU 93 -23.402 16.855 -5.283 818 HD23 LEU 93 HD23 LEU 93 -22.222 16.673 -6.602 819 H GLN 94 H GLN 94 -21.959 9.937 -6.490 820 HA GLN 94 HA GLN 94 -24.899 9.715 -6.088 821 HB2 GLN 94 HB2 GLN 94 -22.791 7.921 -7.332 822 HB3 GLN 94 HB3 GLN 94 -24.412 7.342 -6.953 823 HG2 GLN 94 HG2 GLN 94 -23.872 9.747 -8.746 824 HG3 GLN 94 HG3 GLN 94 -24.047 8.099 -9.335 825 HE21 GLN 94 HE21 GLN 94 -27.605 7.996 -8.823 826 HE22 GLN 94 HE22 GLN 94 -26.172 6.989 -8.974 827 H GLU 95 H GLU 95 -25.121 9.901 -3.909 828 HA GLU 95 HA GLU 95 -23.994 7.709 -2.202 829 HB2 GLU 95 HB2 GLU 95 -24.639 10.572 -1.408 830 HB3 GLU 95 HB3 GLU 95 -24.147 9.277 -0.309 831 HG2 GLU 95 HG2 GLU 95 -21.993 9.055 -1.549 832 HG3 GLU 95 HG3 GLU 95 -22.456 10.409 -2.583 833 H GLU 96 H GLU 96 -25.336 6.685 -0.762 834 HA GLU 96 HA GLU 96 -28.291 7.155 -1.022 835 HB2 GLU 96 HB2 GLU 96 -26.766 4.523 -0.940 836 HB3 GLU 96 HB3 GLU 96 -28.527 4.693 -0.854 837 HG2 GLU 96 HG2 GLU 96 -28.526 5.799 -3.083 838 HG3 GLU 96 HG3 GLU 96 -26.781 5.564 -3.198 839 H VAL 97 H VAL 97 -27.838 8.592 0.788 840 HA VAL 97 HA VAL 97 -27.937 7.186 3.366 841 HB VAL 97 HB VAL 97 -26.572 9.113 4.189 842 HG11 VAL 97 HG11 VAL 97 -25.150 7.546 2.021 843 HG12 VAL 97 HG12 VAL 97 -24.422 8.318 3.442 844 HG13 VAL 97 HG13 VAL 97 -25.516 6.941 3.652 845 HG21 VAL 97 HG21 VAL 97 -27.036 10.751 2.388 846 HG22 VAL 97 HG22 VAL 97 -25.307 10.527 2.691 847 HG23 VAL 97 HG23 VAL 97 -26.054 9.775 1.271 848 H SER 98 H SER 98 -30.171 8.291 1.753 849 HA SER 98 HA SER 98 -31.415 9.942 3.886 850 HB2 SER 98 HB2 SER 98 -30.298 11.566 2.388 851 HB3 SER 98 HB3 SER 98 -31.245 10.951 1.022 852 HG SER 98 HG SER 98 -32.189 12.814 2.012 853 H SER 99 H SER 99 -32.082 8.827 0.518 854 HA SER 99 HA SER 99 -34.926 8.459 1.189 855 HB2 SER 99 HB2 SER 99 -33.461 7.922 -1.416 856 HB3 SER 99 HB3 SER 99 -35.218 7.944 -1.174 857 HG SER 99 HG SER 99 -34.448 9.950 -1.979 858 H MET 100 H MET 100 -32.197 6.391 0.319 859 HA MET 100 HA MET 100 -33.543 4.027 1.538 860 HB2 MET 100 HB2 MET 100 -31.858 4.092 -1.004 861 HB3 MET 100 HB3 MET 100 -32.113 2.643 -0.033 862 HG2 MET 100 HG2 MET 100 -33.683 2.475 -1.738 863 HG3 MET 100 HG3 MET 100 -34.597 2.950 -0.312 864 HE1 MET 100 HE1 MET 100 -36.709 3.532 -1.634 865 HE2 MET 100 HE2 MET 100 -36.749 4.531 -3.103 866 HE3 MET 100 HE3 MET 100 -35.915 2.961 -3.119 867 H GLU 101 H GLU 101 -32.309 2.907 2.940 868 HA GLU 101 HA GLU 101 -29.421 3.446 3.231 869 HB2 GLU 101 HB2 GLU 101 -30.561 5.199 4.584 870 HB3 GLU 101 HB3 GLU 101 -31.382 3.942 5.514 871 HG2 GLU 101 HG2 GLU 101 -29.140 3.064 6.234 872 HG3 GLU 101 HG3 GLU 101 -28.361 4.339 5.297 873 H ALA 102 H ALA 102 -29.049 1.338 2.667 874 HA ALA 102 HA ALA 102 -29.781 -0.771 4.637 875 HB1 ALA 102 HB1 ALA 102 -30.023 -1.014 1.606 876 HB2 ALA 102 HB2 ALA 102 -30.294 -2.316 2.783 877 HB3 ALA 102 HB3 ALA 102 -31.377 -0.912 2.756 878 H LYS 103 H LYS 103 -28.406 -2.612 4.636 879 HA LYS 103 HA LYS 103 -25.676 -2.273 3.456 880 HB2 LYS 103 HB2 LYS 103 -26.329 -3.204 6.284 881 HB3 LYS 103 HB3 LYS 103 -24.725 -3.130 5.585 882 HG2 LYS 103 HG2 LYS 103 -26.549 -0.762 6.170 883 HG3 LYS 103 HG3 LYS 103 -25.207 -1.277 7.164 884 HD2 LYS 103 HD2 LYS 103 -24.819 -0.311 4.289 885 HD3 LYS 103 HD3 LYS 103 -24.881 0.751 5.680 886 HE2 LYS 103 HE2 LYS 103 -22.618 0.481 5.389 887 HE3 LYS 103 HE3 LYS 103 -22.990 -0.606 6.724 888 HZ1 LYS 103 HZ1 LYS 103 -22.628 -1.431 3.883 889 HZ2 LYS 103 HZ2 LYS 103 -21.519 -1.615 5.059 890 HZ3 LYS 103 HZ3 LYS 103 -22.906 -2.460 5.134 891 H SER 104 H SER 104 -24.715 -4.067 2.700 892 HA SER 104 HA SER 104 -25.950 -6.757 3.038 893 HB2 SER 104 HB2 SER 104 -25.375 -5.439 0.351 894 HB3 SER 104 HB3 SER 104 -25.876 -7.121 0.596 895 HG SER 104 HG SER 104 -27.643 -5.749 0.063 896 H MET 105 H MET 105 -24.579 -8.504 2.455 897 HA MET 105 HA MET 105 -21.680 -8.013 2.639 898 HB2 MET 105 HB2 MET 105 -23.438 -10.476 2.581 899 HB3 MET 105 HB3 MET 105 -21.704 -10.614 2.303 900 HG2 MET 105 HG2 MET 105 -22.895 -9.308 4.779 901 HG3 MET 105 HG3 MET 105 -22.417 -10.998 4.658 902 HE1 MET 105 HE1 MET 105 -21.372 -7.906 6.227 903 HE2 MET 105 HE2 MET 105 -19.714 -7.527 5.707 904 HE3 MET 105 HE3 MET 105 -21.076 -7.248 4.601 905 H THR 106 H THR 106 -20.167 -8.878 1.194 906 HA THR 106 HA THR 106 -20.789 -8.549 -1.662 907 HB THR 106 HB THR 106 -18.729 -7.646 -0.604 908 HG1 THR 106 HG1 THR 106 -17.473 -8.188 -2.348 909 HG21 THR 106 HG21 THR 106 -17.769 -10.545 -0.586 910 HG22 THR 106 HG22 THR 106 -16.827 -9.095 -0.168 911 HG23 THR 106 HG23 THR 106 -18.167 -9.600 0.864 912 H TRP 107 H TRP 107 -19.653 -10.210 -3.115 913 HA TRP 107 HA TRP 107 -21.161 -12.714 -2.740 914 HB2 TRP 107 HB2 TRP 107 -19.881 -11.470 -5.184 915 HB3 TRP 107 HB3 TRP 107 -20.730 -13.008 -5.173 916 HD1 TRP 107 HD1 TRP 107 -23.293 -12.986 -5.345 917 HE1 TRP 107 HE1 TRP 107 -25.113 -11.185 -5.566 918 HE3 TRP 107 HE3 TRP 107 -20.448 -8.845 -4.372 919 HZ2 TRP 107 HZ2 TRP 107 -25.312 -8.315 -5.312 920 HZ3 TRP 107 HZ3 TRP 107 -21.483 -6.582 -4.348 921 HH2 TRP 107 HH2 TRP 107 -23.909 -6.307 -4.814 Start of MODEL 16 1 H1 GLY -5 H1 GLY -5 -4.871 -27.461 16.366 2 H2 GLY -5 H2 GLY -5 -4.776 -26.145 15.397 3 H3 GLY -5 H3 GLY -5 -3.414 -26.781 16.049 4 HA2 GLY -5 HA2 GLY -5 -5.141 -28.121 14.069 5 HA3 GLY -5 HA3 GLY -5 -3.580 -27.361 13.714 6 H SER -4 H SER -4 -4.864 -30.276 13.928 7 HA SER -4 HA SER -4 -2.331 -31.589 14.625 8 HB2 SER -4 HB2 SER -4 -3.632 -31.450 16.785 9 HB3 SER -4 HB3 SER -4 -4.904 -32.423 16.023 10 HG SER -4 HG SER -4 -3.369 -33.679 17.227 11 H HIS -3 H HIS -3 -2.290 -33.837 13.903 12 HA HIS -3 HA HIS -3 -4.424 -34.793 12.155 13 HB2 HIS -3 HB2 HIS -3 -2.574 -33.159 10.951 14 HB3 HIS -3 HB3 HIS -3 -1.758 -34.696 10.782 15 HD2 HIS -3 HD2 HIS -3 -5.307 -35.640 10.364 16 HE1 HIS -3 HE1 HIS -3 -4.282 -34.128 6.518 17 HE2 HIS -3 HE2 HIS -3 -6.000 -35.458 7.846 18 H MET -2 H MET -2 -3.858 -36.996 11.205 19 HA MET -2 HA MET -2 -2.517 -38.579 13.341 20 HB2 MET -2 HB2 MET -2 -5.004 -38.782 12.915 21 HB3 MET -2 HB3 MET -2 -4.612 -39.516 11.354 22 HG2 MET -2 HG2 MET -2 -3.400 -41.333 12.521 23 HG3 MET -2 HG3 MET -2 -3.698 -40.537 14.075 24 HE1 MET -2 HE1 MET -2 -4.752 -42.572 15.258 25 HE2 MET -2 HE2 MET -2 -5.962 -43.638 14.515 26 HE3 MET -2 HE3 MET -2 -4.326 -43.534 13.823 27 H ALA -1 H ALA -1 -1.026 -40.131 12.938 28 HA ALA -1 HA ALA -1 0.470 -39.885 10.462 29 HB1 ALA -1 HB1 ALA -1 0.952 -41.592 12.939 30 HB2 ALA -1 HB2 ALA -1 2.120 -41.282 11.639 31 HB3 ALA -1 HB3 ALA -1 1.572 -39.946 12.667 32 H SER 0 H SER 0 1.234 -41.651 9.177 33 HA SER 0 HA SER 0 -0.106 -44.252 9.265 34 HB2 SER 0 HB2 SER 0 -1.671 -42.826 7.944 35 HB3 SER 0 HB3 SER 0 -0.368 -42.504 6.785 36 HG SER 0 HG SER 0 -1.897 -44.318 6.352 37 H MET 1 H MET 1 0.872 -45.801 7.849 38 HA MET 1 HA MET 1 3.541 -45.129 6.728 39 HB2 MET 1 HB2 MET 1 3.584 -45.958 9.171 40 HB3 MET 1 HB3 MET 1 3.124 -47.537 8.535 41 HG2 MET 1 HG2 MET 1 5.183 -47.605 7.191 42 HG3 MET 1 HG3 MET 1 5.590 -45.959 7.673 43 HE1 MET 1 HE1 MET 1 5.174 -45.779 10.800 44 HE2 MET 1 HE2 MET 1 6.777 -46.310 11.344 45 HE3 MET 1 HE3 MET 1 6.630 -45.261 9.918 46 H ASP 2 H ASP 2 0.690 -46.102 5.823 47 HA ASP 2 HA ASP 2 1.338 -48.604 4.413 48 HB2 ASP 2 HB2 ASP 2 -1.169 -46.931 4.685 49 HB3 ASP 2 HB3 ASP 2 -1.057 -48.280 3.560 50 HA PRO 3 HA PRO 3 2.703 -46.693 0.754 51 HB2 PRO 3 HB2 PRO 3 2.281 -48.585 -1.195 52 HB3 PRO 3 HB3 PRO 3 3.464 -48.795 0.132 53 HG2 PRO 3 HG2 PRO 3 0.603 -49.806 0.016 54 HG3 PRO 3 HG3 PRO 3 2.083 -50.732 0.423 55 HD2 PRO 3 HD2 PRO 3 0.496 -49.715 2.366 56 HD3 PRO 3 HD3 PRO 3 2.277 -49.677 2.533 57 H LEU 4 H LEU 4 -0.562 -47.409 0.935 58 HA LEU 4 HA LEU 4 -1.235 -45.844 -1.477 59 HB2 LEU 4 HB2 LEU 4 -3.190 -47.109 -1.795 60 HB3 LEU 4 HB3 LEU 4 -1.820 -48.188 -1.687 61 HG LEU 4 HG LEU 4 -3.684 -47.695 0.689 62 HD11 LEU 4 HD11 LEU 4 -3.859 -49.837 -1.468 63 HD12 LEU 4 HD12 LEU 4 -4.841 -49.767 0.018 64 HD13 LEU 4 HD13 LEU 4 -5.010 -48.508 -1.212 65 HD21 LEU 4 HD21 LEU 4 -1.583 -48.790 1.296 66 HD22 LEU 4 HD22 LEU 4 -2.891 -49.961 1.360 67 HD23 LEU 4 HD23 LEU 4 -1.779 -49.960 -0.028 68 H ASP 5 H ASP 5 -0.809 -44.729 1.257 69 HA ASP 5 HA ASP 5 -3.501 -43.577 1.781 70 HB2 ASP 5 HB2 ASP 5 -1.032 -44.104 3.401 71 HB3 ASP 5 HB3 ASP 5 -1.958 -42.686 3.835 72 H LYS 6 H LYS 6 -1.132 -42.685 -0.167 73 HA LYS 6 HA LYS 6 -1.191 -39.766 0.578 74 HB2 LYS 6 HB2 LYS 6 1.161 -40.946 -0.889 75 HB3 LYS 6 HB3 LYS 6 1.042 -39.511 0.102 76 HG2 LYS 6 HG2 LYS 6 2.106 -40.766 1.647 77 HG3 LYS 6 HG3 LYS 6 0.493 -41.379 1.996 78 HD2 LYS 6 HD2 LYS 6 1.907 -43.286 1.818 79 HD3 LYS 6 HD3 LYS 6 0.968 -43.261 0.314 80 HE2 LYS 6 HE2 LYS 6 2.898 -42.144 -0.836 81 HE3 LYS 6 HE3 LYS 6 3.812 -42.194 0.675 82 HZ1 LYS 6 HZ1 LYS 6 2.820 -44.595 -0.780 83 HZ2 LYS 6 HZ2 LYS 6 4.367 -44.052 -0.801 84 HZ3 LYS 6 HZ3 LYS 6 3.729 -44.604 0.593 85 H ILE 7 H ILE 7 -0.564 -41.819 -2.234 86 HA ILE 7 HA ILE 7 -1.733 -39.751 -4.048 87 HB ILE 7 HB ILE 7 0.103 -40.286 -5.672 88 HG12 ILE 7 HG12 ILE 7 2.265 -41.084 -4.775 89 HG13 ILE 7 HG13 ILE 7 1.496 -41.539 -3.258 90 HG21 ILE 7 HG21 ILE 7 1.007 -39.045 -3.046 91 HG22 ILE 7 HG22 ILE 7 1.668 -38.747 -4.663 92 HG23 ILE 7 HG23 ILE 7 0.018 -38.238 -4.282 93 HD11 ILE 7 HD11 ILE 7 0.813 -42.747 -5.972 94 HD12 ILE 7 HD12 ILE 7 1.935 -43.451 -4.793 95 HD13 ILE 7 HD13 ILE 7 0.223 -43.300 -4.380 96 H ILE 8 H ILE 8 -2.559 -42.455 -2.909 97 HA ILE 8 HA ILE 8 -2.911 -44.480 -4.643 98 HB ILE 8 HB ILE 8 -3.800 -44.373 -2.394 99 HG12 ILE 8 HG12 ILE 8 -5.857 -45.246 -4.467 100 HG13 ILE 8 HG13 ILE 8 -4.472 -46.181 -3.895 101 HG21 ILE 8 HG21 ILE 8 -6.239 -42.887 -3.435 102 HG22 ILE 8 HG22 ILE 8 -5.872 -43.352 -1.762 103 HG23 ILE 8 HG23 ILE 8 -4.913 -42.105 -2.553 104 HD11 ILE 8 HD11 ILE 8 -6.940 -45.383 -2.298 105 HD12 ILE 8 HD12 ILE 8 -6.459 -47.003 -2.820 106 HD13 ILE 8 HD13 ILE 8 -5.505 -46.157 -1.587 107 H ASN 9 H ASN 9 -3.828 -45.028 -6.457 108 HA ASN 9 HA ASN 9 -6.208 -43.715 -7.559 109 HB2 ASN 9 HB2 ASN 9 -4.456 -42.389 -8.636 110 HB3 ASN 9 HB3 ASN 9 -3.564 -43.848 -9.072 111 HD21 ASN 9 HD21 ASN 9 -5.156 -43.692 -12.224 112 HD22 ASN 9 HD22 ASN 9 -3.638 -43.740 -11.337 113 H ASP 10 H ASP 10 -7.378 -45.045 -8.921 114 HA ASP 10 HA ASP 10 -6.317 -47.690 -9.690 115 HB2 ASP 10 HB2 ASP 10 -8.952 -47.251 -8.230 116 HB3 ASP 10 HB3 ASP 10 -8.574 -48.709 -9.146 117 H ILE 11 H ILE 11 -6.009 -46.281 -11.547 118 HA ILE 11 HA ILE 11 -6.410 -45.546 -13.584 119 HB ILE 11 HB ILE 11 -6.407 -48.049 -13.680 120 HG12 ILE 11 HG12 ILE 11 -6.902 -48.270 -16.046 121 HG13 ILE 11 HG13 ILE 11 -7.730 -46.724 -16.078 122 HG21 ILE 11 HG21 ILE 11 -9.368 -47.744 -14.300 123 HG22 ILE 11 HG22 ILE 11 -8.405 -49.217 -14.507 124 HG23 ILE 11 HG23 ILE 11 -8.654 -48.569 -12.890 125 HD11 ILE 11 HD11 ILE 11 -4.783 -47.109 -15.380 126 HD12 ILE 11 HD12 ILE 11 -5.407 -46.654 -16.978 127 HD13 ILE 11 HD13 ILE 11 -5.617 -45.550 -15.613 128 H LYS 12 H LYS 12 -8.186 -44.307 -11.728 129 HA LYS 12 HA LYS 12 -10.071 -43.195 -13.755 130 HB2 LYS 12 HB2 LYS 12 -10.712 -44.331 -11.071 131 HB3 LYS 12 HB3 LYS 12 -11.395 -42.750 -11.343 132 HG2 LYS 12 HG2 LYS 12 -13.056 -43.562 -12.525 133 HG3 LYS 12 HG3 LYS 12 -11.968 -44.217 -13.740 134 HD2 LYS 12 HD2 LYS 12 -12.640 -45.660 -11.143 135 HD3 LYS 12 HD3 LYS 12 -13.569 -45.867 -12.640 136 HE2 LYS 12 HE2 LYS 12 -11.654 -46.713 -13.835 137 HE3 LYS 12 HE3 LYS 12 -10.563 -46.285 -12.517 138 HZ1 LYS 12 HZ1 LYS 12 -12.713 -48.325 -12.290 139 HZ2 LYS 12 HZ2 LYS 12 -11.128 -48.663 -12.502 140 HZ3 LYS 12 HZ3 LYS 12 -11.620 -47.941 -11.130 141 H LYS 13 H LYS 13 -8.036 -42.510 -10.987 142 HA LYS 13 HA LYS 13 -7.434 -40.612 -9.897 143 HB2 LYS 13 HB2 LYS 13 -6.326 -40.514 -12.216 144 HB3 LYS 13 HB3 LYS 13 -7.480 -39.231 -12.593 145 HG2 LYS 13 HG2 LYS 13 -6.591 -37.965 -10.568 146 HG3 LYS 13 HG3 LYS 13 -5.400 -39.255 -10.351 147 HD2 LYS 13 HD2 LYS 13 -4.500 -38.805 -12.617 148 HD3 LYS 13 HD3 LYS 13 -5.686 -37.518 -12.854 149 HE2 LYS 13 HE2 LYS 13 -3.566 -37.564 -10.654 150 HE3 LYS 13 HE3 LYS 13 -3.381 -36.738 -12.204 151 HZ1 LYS 13 HZ1 LYS 13 -5.460 -36.090 -10.182 152 HZ2 LYS 13 HZ2 LYS 13 -4.134 -35.200 -10.505 153 HZ3 LYS 13 HZ3 LYS 13 -5.301 -35.350 -11.632 154 H GLU 14 H GLU 14 -10.142 -41.017 -9.634 155 HA GLU 14 HA GLU 14 -11.628 -38.562 -10.165 156 HB2 GLU 14 HB2 GLU 14 -12.668 -40.794 -10.247 157 HB3 GLU 14 HB3 GLU 14 -12.400 -40.991 -8.509 158 HG2 GLU 14 HG2 GLU 14 -13.847 -39.023 -8.063 159 HG3 GLU 14 HG3 GLU 14 -14.046 -38.762 -9.797 160 H ALA 15 H ALA 15 -11.653 -36.789 -8.974 161 HA ALA 15 HA ALA 15 -11.515 -36.804 -6.049 162 HB1 ALA 15 HB1 ALA 15 -9.417 -35.362 -7.744 163 HB2 ALA 15 HB2 ALA 15 -9.602 -35.231 -5.981 164 HB3 ALA 15 HB3 ALA 15 -9.119 -36.774 -6.705 165 H ASN 16 H ASN 16 -11.818 -34.545 -5.192 166 HA ASN 16 HA ASN 16 -13.629 -32.942 -6.956 167 HB2 ASN 16 HB2 ASN 16 -14.732 -34.112 -5.070 168 HB3 ASN 16 HB3 ASN 16 -13.658 -33.293 -3.934 169 HD21 ASN 16 HD21 ASN 16 -16.744 -31.212 -5.672 170 HD22 ASN 16 HD22 ASN 16 -16.260 -32.765 -6.336 171 H ASP 17 H ASP 17 -13.034 -30.956 -7.463 172 HA ASP 17 HA ASP 17 -11.462 -29.243 -5.640 173 HB2 ASP 17 HB2 ASP 17 -10.637 -29.909 -8.499 174 HB3 ASP 17 HB3 ASP 17 -10.080 -28.481 -7.636 175 H SER 18 H SER 18 -11.964 -27.077 -5.848 176 HA SER 18 HA SER 18 -13.932 -26.238 -7.924 177 HB2 SER 18 HB2 SER 18 -15.346 -25.257 -6.156 178 HB3 SER 18 HB3 SER 18 -15.175 -27.006 -5.960 179 HG SER 18 HG SER 18 -14.888 -25.860 -3.975 180 H GLY 19 H GLY 19 -10.991 -25.500 -7.036 181 HA2 GLY 19 HA2 GLY 19 -11.196 -22.917 -8.263 182 HA3 GLY 19 HA3 GLY 19 -10.833 -22.735 -6.544 183 H VAL 20 H VAL 20 -9.565 -23.256 -9.610 184 HA VAL 20 HA VAL 20 -6.836 -23.907 -8.577 185 HB VAL 20 HB VAL 20 -7.925 -25.095 -11.151 186 HG11 VAL 20 HG11 VAL 20 -5.511 -25.770 -9.396 187 HG12 VAL 20 HG12 VAL 20 -6.009 -26.662 -10.853 188 HG13 VAL 20 HG13 VAL 20 -5.448 -25.004 -10.994 189 HG21 VAL 20 HG21 VAL 20 -9.261 -26.096 -9.373 190 HG22 VAL 20 HG22 VAL 20 -8.072 -27.263 -9.940 191 HG23 VAL 20 HG23 VAL 20 -7.798 -26.407 -8.406 192 H THR 21 H THR 21 -7.739 -21.288 -9.019 193 HA THR 21 HA THR 21 -5.897 -20.495 -11.158 194 HB THR 21 HB THR 21 -8.087 -18.812 -11.729 195 HG1 THR 21 HG1 THR 21 -9.704 -20.241 -12.325 196 HG21 THR 21 HG21 THR 21 -7.078 -21.273 -13.206 197 HG22 THR 21 HG22 THR 21 -7.969 -19.896 -13.914 198 HG23 THR 21 HG23 THR 21 -6.341 -19.652 -13.246 199 H LEU 22 H LEU 22 -5.529 -18.272 -11.432 200 HA LEU 22 HA LEU 22 -5.111 -17.052 -8.820 201 HB2 LEU 22 HB2 LEU 22 -3.245 -15.989 -9.808 202 HB3 LEU 22 HB3 LEU 22 -3.238 -17.669 -10.326 203 HG LEU 22 HG LEU 22 -4.458 -15.618 -12.194 204 HD11 LEU 22 HD11 LEU 22 -1.469 -16.081 -11.845 205 HD12 LEU 22 HD12 LEU 22 -2.242 -15.156 -13.156 206 HD13 LEU 22 HD13 LEU 22 -2.352 -14.578 -11.488 207 HD21 LEU 22 HD21 LEU 22 -4.515 -17.998 -12.867 208 HD22 LEU 22 HD22 LEU 22 -3.440 -17.076 -13.909 209 HD23 LEU 22 HD23 LEU 22 -2.756 -18.111 -12.641 210 H ALA 23 H ALA 23 -7.699 -16.707 -9.830 211 HA ALA 23 HA ALA 23 -7.880 -13.757 -10.204 212 HB1 ALA 23 HB1 ALA 23 -9.285 -15.877 -11.879 213 HB2 ALA 23 HB2 ALA 23 -9.539 -14.122 -11.998 214 HB3 ALA 23 HB3 ALA 23 -7.962 -14.819 -12.411 215 HA PRO 24 HA PRO 24 -11.055 -14.273 -7.108 216 HB2 PRO 24 HB2 PRO 24 -12.145 -11.788 -7.020 217 HB3 PRO 24 HB3 PRO 24 -10.452 -12.104 -6.535 218 HG2 PRO 24 HG2 PRO 24 -11.461 -11.049 -9.197 219 HG3 PRO 24 HG3 PRO 24 -10.128 -10.412 -8.184 220 HD2 PRO 24 HD2 PRO 24 -9.714 -12.112 -10.313 221 HD3 PRO 24 HD3 PRO 24 -8.667 -12.120 -8.869 222 H LEU 25 H LEU 25 -11.947 -13.143 -10.312 223 HA LEU 25 HA LEU 25 -14.342 -14.790 -10.383 224 HB2 LEU 25 HB2 LEU 25 -14.853 -12.301 -9.484 225 HB3 LEU 25 HB3 LEU 25 -14.702 -11.883 -11.177 226 HG LEU 25 HG LEU 25 -16.520 -13.641 -11.644 227 HD11 LEU 25 HD11 LEU 25 -16.811 -13.515 -8.609 228 HD12 LEU 25 HD12 LEU 25 -17.969 -14.259 -9.733 229 HD13 LEU 25 HD13 LEU 25 -16.356 -14.951 -9.547 230 HD21 LEU 25 HD21 LEU 25 -16.993 -11.223 -11.556 231 HD22 LEU 25 HD22 LEU 25 -18.338 -12.162 -10.890 232 HD23 LEU 25 HD23 LEU 25 -17.216 -11.322 -9.796 233 H SER 26 H SER 26 -15.235 -13.622 -12.928 234 HA SER 26 HA SER 26 -13.171 -14.689 -14.707 235 HB2 SER 26 HB2 SER 26 -15.669 -15.110 -14.898 236 HB3 SER 26 HB3 SER 26 -15.812 -13.465 -15.539 237 HG SER 26 HG SER 26 -15.540 -15.066 -17.190 238 H VAL 27 H VAL 27 -11.835 -12.824 -13.650 239 HA VAL 27 HA VAL 27 -11.391 -10.709 -15.625 240 HB VAL 27 HB VAL 27 -13.248 -9.834 -14.294 241 HG11 VAL 27 HG11 VAL 27 -11.431 -9.951 -11.866 242 HG12 VAL 27 HG12 VAL 27 -13.045 -9.215 -11.950 243 HG13 VAL 27 HG13 VAL 27 -12.854 -10.962 -12.142 244 HG21 VAL 27 HG21 VAL 27 -11.629 -8.224 -15.198 245 HG22 VAL 27 HG22 VAL 27 -12.328 -7.662 -13.679 246 HG23 VAL 27 HG23 VAL 27 -10.678 -8.312 -13.691 247 HA PRO 28 HA PRO 28 -7.355 -11.446 -13.746 248 HB2 PRO 28 HB2 PRO 28 -5.751 -9.839 -15.221 249 HB3 PRO 28 HB3 PRO 28 -6.610 -11.235 -15.925 250 HG2 PRO 28 HG2 PRO 28 -7.501 -8.328 -15.950 251 HG3 PRO 28 HG3 PRO 28 -7.355 -9.451 -17.343 252 HD2 PRO 28 HD2 PRO 28 -9.720 -9.043 -16.052 253 HD3 PRO 28 HD3 PRO 28 -9.277 -10.644 -16.707 254 H LYS 29 H LYS 29 -8.626 -10.422 -11.908 255 HA LYS 29 HA LYS 29 -8.751 -9.250 -10.013 256 HB2 LYS 29 HB2 LYS 29 -6.233 -9.822 -10.129 257 HB3 LYS 29 HB3 LYS 29 -5.990 -8.116 -10.459 258 HG2 LYS 29 HG2 LYS 29 -5.850 -7.965 -8.176 259 HG3 LYS 29 HG3 LYS 29 -7.626 -7.936 -8.251 260 HD2 LYS 29 HD2 LYS 29 -7.579 -10.434 -8.022 261 HD3 LYS 29 HD3 LYS 29 -5.817 -10.319 -7.825 262 HE2 LYS 29 HE2 LYS 29 -6.164 -8.867 -5.819 263 HE3 LYS 29 HE3 LYS 29 -7.913 -9.006 -6.024 264 HZ1 LYS 29 HZ1 LYS 29 -6.089 -11.293 -5.463 265 HZ2 LYS 29 HZ2 LYS 29 -7.088 -10.597 -4.376 266 HZ3 LYS 29 HZ3 LYS 29 -7.708 -11.408 -5.644 267 HA PRO 30 HA PRO 30 -10.159 -5.387 -11.866 268 HB2 PRO 30 HB2 PRO 30 -12.326 -4.852 -10.326 269 HB3 PRO 30 HB3 PRO 30 -12.291 -6.207 -11.497 270 HG2 PRO 30 HG2 PRO 30 -11.807 -6.317 -8.505 271 HG3 PRO 30 HG3 PRO 30 -12.845 -7.384 -9.501 272 HD2 PRO 30 HD2 PRO 30 -10.266 -8.020 -8.766 273 HD3 PRO 30 HD3 PRO 30 -11.007 -8.589 -10.285 274 H LYS 31 H LYS 31 -9.646 -3.276 -11.553 275 HA LYS 31 HA LYS 31 -7.962 -2.575 -9.314 276 HB2 LYS 31 HB2 LYS 31 -7.541 -0.515 -10.486 277 HB3 LYS 31 HB3 LYS 31 -7.412 -1.909 -11.554 278 HG2 LYS 31 HG2 LYS 31 -9.827 -1.373 -12.315 279 HG3 LYS 31 HG3 LYS 31 -9.645 0.163 -11.470 280 HD2 LYS 31 HD2 LYS 31 -7.902 -0.890 -13.740 281 HD3 LYS 31 HD3 LYS 31 -9.166 0.317 -13.910 282 HE2 LYS 31 HE2 LYS 31 -6.646 0.671 -12.217 283 HE3 LYS 31 HE3 LYS 31 -6.823 1.218 -13.883 284 HZ1 LYS 31 HZ1 LYS 31 -8.477 2.179 -11.609 285 HZ2 LYS 31 HZ2 LYS 31 -7.300 3.021 -12.363 286 HZ3 LYS 31 HZ3 LYS 31 -8.667 2.640 -13.167 287 H LEU 32 H LEU 32 -8.292 -1.528 -7.500 288 HA LEU 32 HA LEU 32 -10.610 0.248 -7.150 289 HB2 LEU 32 HB2 LEU 32 -11.529 -0.919 -5.312 290 HB3 LEU 32 HB3 LEU 32 -11.339 -2.041 -6.651 291 HG LEU 32 HG LEU 32 -9.076 -2.681 -5.348 292 HD11 LEU 32 HD11 LEU 32 -10.977 -1.735 -3.140 293 HD12 LEU 32 HD12 LEU 32 -9.492 -2.671 -2.900 294 HD13 LEU 32 HD13 LEU 32 -9.395 -1.022 -3.515 295 HD21 LEU 32 HD21 LEU 32 -10.889 -4.233 -5.903 296 HD22 LEU 32 HD22 LEU 32 -10.386 -4.476 -4.226 297 HD23 LEU 32 HD23 LEU 32 -11.886 -3.590 -4.575 298 H GLU 33 H GLU 33 -10.518 1.655 -5.388 299 HA GLU 33 HA GLU 33 -7.955 1.908 -3.915 300 HB2 GLU 33 HB2 GLU 33 -9.233 4.117 -5.607 301 HB3 GLU 33 HB3 GLU 33 -7.847 4.333 -4.529 302 HG2 GLU 33 HG2 GLU 33 -6.501 2.796 -5.908 303 HG3 GLU 33 HG3 GLU 33 -7.870 2.548 -6.998 304 H GLU 34 H GLU 34 -9.888 0.912 -2.694 305 HA GLU 34 HA GLU 34 -11.687 2.858 -1.439 306 HB2 GLU 34 HB2 GLU 34 -12.390 0.571 -2.149 307 HB3 GLU 34 HB3 GLU 34 -11.432 -0.105 -0.825 308 HG2 GLU 34 HG2 GLU 34 -12.779 1.223 0.800 309 HG3 GLU 34 HG3 GLU 34 -13.666 1.961 -0.532 310 H LEU 35 H LEU 35 -10.077 4.191 -0.569 311 HA LEU 35 HA LEU 35 -8.918 3.383 2.072 312 HB2 LEU 35 HB2 LEU 35 -7.735 4.964 -0.247 313 HB3 LEU 35 HB3 LEU 35 -6.988 4.886 1.342 314 HG LEU 35 HG LEU 35 -7.569 2.294 -0.111 315 HD11 LEU 35 HD11 LEU 35 -5.119 3.984 -0.644 316 HD12 LEU 35 HD12 LEU 35 -5.493 2.361 -1.278 317 HD13 LEU 35 HD13 LEU 35 -6.468 3.744 -1.781 318 HD21 LEU 35 HD21 LEU 35 -6.699 2.303 2.240 319 HD22 LEU 35 HD22 LEU 35 -5.582 1.545 1.089 320 HD23 LEU 35 HD23 LEU 35 -5.264 3.188 1.667 321 H SER 36 H SER 36 -8.792 5.063 3.642 322 HA SER 36 HA SER 36 -10.709 7.282 3.424 323 HB2 SER 36 HB2 SER 36 -8.578 6.652 5.509 324 HB3 SER 36 HB3 SER 36 -9.805 7.927 5.640 325 HG SER 36 HG SER 36 -10.458 6.002 6.705 326 H GLU 37 H GLU 37 -9.901 9.627 3.847 327 HA GLU 37 HA GLU 37 -8.297 10.422 1.683 328 HB2 GLU 37 HB2 GLU 37 -9.912 11.839 2.879 329 HB3 GLU 37 HB3 GLU 37 -8.828 11.927 4.275 330 HG2 GLU 37 HG2 GLU 37 -7.123 13.076 2.888 331 HG3 GLU 37 HG3 GLU 37 -8.154 12.913 1.464 332 H GLN 38 H GLN 38 -7.230 10.050 5.089 333 HA GLN 38 HA GLN 38 -4.465 10.764 4.552 334 HB2 GLN 38 HB2 GLN 38 -5.620 10.915 6.798 335 HB3 GLN 38 HB3 GLN 38 -5.681 9.151 6.841 336 HG2 GLN 38 HG2 GLN 38 -3.067 9.279 6.574 337 HG3 GLN 38 HG3 GLN 38 -3.255 10.978 6.998 338 HE21 GLN 38 HE21 GLN 38 -3.877 8.040 9.837 339 HE22 GLN 38 HE22 GLN 38 -3.863 7.610 8.134 340 H GLN 39 H GLN 39 -6.200 7.625 4.840 341 HA GLN 39 HA GLN 39 -3.907 5.955 4.521 342 HB2 GLN 39 HB2 GLN 39 -6.844 5.511 4.019 343 HB3 GLN 39 HB3 GLN 39 -5.632 4.270 3.684 344 HG2 GLN 39 HG2 GLN 39 -4.814 4.413 6.027 345 HG3 GLN 39 HG3 GLN 39 -6.109 5.556 6.402 346 HE21 GLN 39 HE21 GLN 39 -7.096 1.944 7.198 347 HE22 GLN 39 HE22 GLN 39 -5.579 2.767 7.504 348 H LYS 40 H LYS 40 -6.069 7.404 2.086 349 HA LYS 40 HA LYS 40 -4.900 6.154 -0.218 350 HB2 LYS 40 HB2 LYS 40 -7.112 7.268 -0.077 351 HB3 LYS 40 HB3 LYS 40 -6.325 8.841 0.114 352 HG2 LYS 40 HG2 LYS 40 -5.287 8.590 -2.110 353 HG3 LYS 40 HG3 LYS 40 -6.055 7.009 -2.311 354 HD2 LYS 40 HD2 LYS 40 -7.558 9.650 -1.929 355 HD3 LYS 40 HD3 LYS 40 -7.191 8.910 -3.483 356 HE2 LYS 40 HE2 LYS 40 -9.305 8.133 -3.259 357 HE3 LYS 40 HE3 LYS 40 -8.440 6.796 -2.508 358 HZ1 LYS 40 HZ1 LYS 40 -9.773 9.039 -1.062 359 HZ2 LYS 40 HZ2 LYS 40 -10.346 7.518 -1.177 360 HZ3 LYS 40 HZ3 LYS 40 -9.000 7.793 -0.322 361 H ILE 41 H ILE 41 -4.087 9.229 1.483 362 HA ILE 41 HA ILE 41 -1.955 9.900 -0.338 363 HB ILE 41 HB ILE 41 -2.418 10.769 2.499 364 HG12 ILE 41 HG12 ILE 41 -2.928 12.403 -0.039 365 HG13 ILE 41 HG13 ILE 41 -4.173 11.348 0.596 366 HG21 ILE 41 HG21 ILE 41 -0.534 11.928 0.407 367 HG22 ILE 41 HG22 ILE 41 -0.941 12.726 1.939 368 HG23 ILE 41 HG23 ILE 41 -0.086 11.195 1.963 369 HD11 ILE 41 HD11 ILE 41 -2.960 13.717 2.064 370 HD12 ILE 41 HD12 ILE 41 -4.598 13.562 1.405 371 HD13 ILE 41 HD13 ILE 41 -4.102 12.550 2.776 372 H ILE 42 H ILE 42 -1.948 8.014 2.770 373 HA ILE 42 HA ILE 42 0.929 7.750 2.860 374 HB ILE 42 HB ILE 42 -1.242 5.900 3.907 375 HG12 ILE 42 HG12 ILE 42 0.515 7.725 5.590 376 HG13 ILE 42 HG13 ILE 42 -0.951 8.354 4.855 377 HG21 ILE 42 HG21 ILE 42 1.773 5.917 4.421 378 HG22 ILE 42 HG22 ILE 42 0.613 4.995 5.387 379 HG23 ILE 42 HG23 ILE 42 0.826 4.606 3.688 380 HD11 ILE 42 HD11 ILE 42 -0.857 5.963 6.740 381 HD12 ILE 42 HD12 ILE 42 -1.424 7.595 7.123 382 HD13 ILE 42 HD13 ILE 42 -2.303 6.604 5.935 383 H LEU 43 H LEU 43 -1.614 5.741 1.422 384 HA LEU 43 HA LEU 43 -0.010 3.685 0.339 385 HB2 LEU 43 HB2 LEU 43 -2.493 3.729 0.626 386 HB3 LEU 43 HB3 LEU 43 -2.643 4.883 -0.670 387 HG LEU 43 HG LEU 43 -3.249 2.493 -1.095 388 HD11 LEU 43 HD11 LEU 43 -1.175 3.629 -2.988 389 HD12 LEU 43 HD12 LEU 43 -2.409 2.417 -3.368 390 HD13 LEU 43 HD13 LEU 43 -2.892 4.068 -2.932 391 HD21 LEU 43 HD21 LEU 43 -1.354 1.446 0.066 392 HD22 LEU 43 HD22 LEU 43 -1.506 0.865 -1.604 393 HD23 LEU 43 HD23 LEU 43 -0.233 2.032 -1.183 394 H ALA 44 H ALA 44 -1.165 6.689 -1.215 395 HA ALA 44 HA ALA 44 0.215 6.425 -3.674 396 HB1 ALA 44 HB1 ALA 44 -0.713 8.869 -2.121 397 HB2 ALA 44 HB2 ALA 44 -0.286 8.855 -3.848 398 HB3 ALA 44 HB3 ALA 44 -1.694 7.929 -3.272 399 H GLU 45 H GLU 45 1.178 8.394 -0.751 400 HA GLU 45 HA GLU 45 3.648 9.290 -1.829 401 HB2 GLU 45 HB2 GLU 45 2.705 8.830 1.022 402 HB3 GLU 45 HB3 GLU 45 4.280 9.518 0.656 403 HG2 GLU 45 HG2 GLU 45 1.691 10.751 -0.371 404 HG3 GLU 45 HG3 GLU 45 2.437 11.182 1.164 405 H TYR 46 H TYR 46 2.902 6.162 -0.286 406 HA TYR 46 HA TYR 46 5.635 5.366 0.081 407 HB2 TYR 46 HB2 TYR 46 3.671 4.410 1.237 408 HB3 TYR 46 HB3 TYR 46 3.110 3.707 -0.272 409 HD1 TYR 46 HD1 TYR 46 2.984 1.743 1.398 410 HD2 TYR 46 HD2 TYR 46 6.705 3.389 -0.059 411 HE1 TYR 46 HE1 TYR 46 4.161 -0.381 1.971 412 HE2 TYR 46 HE2 TYR 46 7.865 1.295 0.536 413 HH TYR 46 HH TYR 46 6.170 -1.493 1.996 414 H ILE 47 H ILE 47 3.286 4.469 -2.515 415 HA ILE 47 HA ILE 47 5.065 3.114 -4.220 416 HB ILE 47 HB ILE 47 2.440 4.575 -4.535 417 HG12 ILE 47 HG12 ILE 47 3.110 1.592 -4.507 418 HG13 ILE 47 HG13 ILE 47 2.584 2.487 -3.089 419 HG21 ILE 47 HG21 ILE 47 3.872 2.915 -6.630 420 HG22 ILE 47 HG22 ILE 47 2.146 3.329 -6.729 421 HG23 ILE 47 HG23 ILE 47 3.349 4.602 -6.777 422 HD11 ILE 47 HD11 ILE 47 0.924 1.857 -5.545 423 HD12 ILE 47 HD12 ILE 47 0.638 1.411 -3.856 424 HD13 ILE 47 HD13 ILE 47 0.467 3.105 -4.366 425 H ALA 48 H ALA 48 4.168 6.605 -3.978 426 HA ALA 48 HA ALA 48 5.515 7.438 -6.376 427 HB1 ALA 48 HB1 ALA 48 4.725 8.960 -3.860 428 HB2 ALA 48 HB2 ALA 48 5.165 9.693 -5.420 429 HB3 ALA 48 HB3 ALA 48 3.699 8.695 -5.287 430 H GLU 49 H GLU 49 6.655 6.898 -3.064 431 HA GLU 49 HA GLU 49 9.284 8.118 -3.582 432 HB2 GLU 49 HB2 GLU 49 8.109 8.229 -1.367 433 HB3 GLU 49 HB3 GLU 49 8.303 6.482 -1.217 434 HG2 GLU 49 HG2 GLU 49 10.012 7.493 0.081 435 HG3 GLU 49 HG3 GLU 49 10.811 6.823 -1.329 436 H VAL 50 H VAL 50 7.928 4.783 -3.310 437 HA VAL 50 HA VAL 50 10.651 3.728 -3.939 438 HB VAL 50 HB VAL 50 10.269 1.842 -2.792 439 HG11 VAL 50 HG11 VAL 50 8.789 3.880 -1.118 440 HG12 VAL 50 HG12 VAL 50 9.699 2.466 -0.553 441 HG13 VAL 50 HG13 VAL 50 10.550 3.805 -1.336 442 HG21 VAL 50 HG21 VAL 50 8.054 1.143 -3.611 443 HG22 VAL 50 HG22 VAL 50 8.148 1.044 -1.856 444 HG23 VAL 50 HG23 VAL 50 7.276 2.387 -2.620 445 H GLY 51 H GLY 51 7.730 4.183 -5.524 446 HA2 GLY 51 HA2 GLY 51 7.647 4.150 -7.831 447 HA3 GLY 51 HA3 GLY 51 9.102 3.155 -7.895 448 H LEU 52 H LEU 52 6.267 2.206 -6.075 449 HA LEU 52 HA LEU 52 5.030 0.371 -6.010 450 HB2 LEU 52 HB2 LEU 52 4.455 1.617 -8.425 451 HB3 LEU 52 HB3 LEU 52 4.735 -0.020 -8.954 452 HG LEU 52 HG LEU 52 2.723 0.834 -6.826 453 HD11 LEU 52 HD11 LEU 52 2.330 0.007 -9.729 454 HD12 LEU 52 HD12 LEU 52 1.032 0.364 -8.561 455 HD13 LEU 52 HD13 LEU 52 2.141 1.646 -9.066 456 HD21 LEU 52 HD21 LEU 52 3.358 -1.482 -6.437 457 HD22 LEU 52 HD22 LEU 52 1.726 -1.404 -7.102 458 HD23 LEU 52 HD23 LEU 52 3.085 -1.875 -8.151 459 H GLN 53 H GLN 53 8.023 0.061 -6.852 460 HA GLN 53 HA GLN 53 8.076 -2.780 -7.784 461 HB2 GLN 53 HB2 GLN 53 10.065 -0.490 -7.776 462 HB3 GLN 53 HB3 GLN 53 10.561 -2.143 -8.137 463 HG2 GLN 53 HG2 GLN 53 9.312 -2.269 -10.121 464 HG3 GLN 53 HG3 GLN 53 8.259 -0.926 -9.681 465 HE21 GLN 53 HE21 GLN 53 10.528 1.634 -10.700 466 HE22 GLN 53 HE22 GLN 53 9.118 1.244 -9.700 467 H ASN 54 H ASN 54 8.619 -0.938 -4.941 468 HA ASN 54 HA ASN 54 10.167 -3.177 -3.671 469 HB2 ASN 54 HB2 ASN 54 10.460 -0.208 -3.158 470 HB3 ASN 54 HB3 ASN 54 11.392 -1.481 -2.393 471 HD21 ASN 54 HD21 ASN 54 12.560 -0.088 -6.004 472 HD22 ASN 54 HD22 ASN 54 11.121 0.564 -5.232 473 H ILE 55 H ILE 55 7.159 -1.988 -3.614 474 HA ILE 55 HA ILE 55 6.764 -1.883 -0.708 475 HB ILE 55 HB ILE 55 4.430 -1.717 -1.097 476 HG12 ILE 55 HG12 ILE 55 4.940 -2.146 -4.076 477 HG13 ILE 55 HG13 ILE 55 4.135 -3.281 -2.980 478 HG21 ILE 55 HG21 ILE 55 5.686 0.107 -3.174 479 HG22 ILE 55 HG22 ILE 55 4.347 0.437 -2.048 480 HG23 ILE 55 HG23 ILE 55 5.979 0.271 -1.432 481 HD11 ILE 55 HD11 ILE 55 3.151 -0.522 -3.757 482 HD12 ILE 55 HD12 ILE 55 2.449 -2.087 -4.197 483 HD13 ILE 55 HD13 ILE 55 2.398 -1.552 -2.497 484 H THR 56 H THR 56 5.593 -3.434 0.526 485 HA THR 56 HA THR 56 5.265 -6.144 -0.627 486 HB THR 56 HB THR 56 6.127 -6.801 1.836 487 HG1 THR 56 HG1 THR 56 7.895 -5.508 2.400 488 HG21 THR 56 HG21 THR 56 8.081 -6.050 -0.386 489 HG22 THR 56 HG22 THR 56 8.385 -7.196 0.941 490 HG23 THR 56 HG23 THR 56 7.174 -7.576 -0.293 491 H ALA 57 H ALA 57 3.519 -7.296 0.232 492 HA ALA 57 HA ALA 57 1.378 -5.822 1.323 493 HB1 ALA 57 HB1 ALA 57 1.886 -8.834 1.347 494 HB2 ALA 57 HB2 ALA 57 0.318 -8.018 1.555 495 HB3 ALA 57 HB3 ALA 57 1.167 -7.920 0.002 496 H ILE 58 H ILE 58 3.987 -7.532 2.914 497 HA ILE 58 HA ILE 58 2.944 -7.708 5.598 498 HB ILE 58 HB ILE 58 5.737 -7.576 4.382 499 HG12 ILE 58 HG12 ILE 58 5.906 -9.937 5.198 500 HG13 ILE 58 HG13 ILE 58 4.246 -9.868 5.779 501 HG21 ILE 58 HG21 ILE 58 4.967 -7.919 7.322 502 HG22 ILE 58 HG22 ILE 58 6.581 -8.287 6.667 503 HG23 ILE 58 HG23 ILE 58 5.975 -6.636 6.625 504 HD11 ILE 58 HD11 ILE 58 5.044 -9.583 2.850 505 HD12 ILE 58 HD12 ILE 58 4.584 -11.109 3.627 506 HD13 ILE 58 HD13 ILE 58 3.395 -9.813 3.505 507 H THR 59 H THR 59 4.988 -5.301 3.913 508 HA THR 59 HA THR 59 5.089 -3.515 6.210 509 HB THR 59 HB THR 59 5.998 -3.243 3.334 510 HG1 THR 59 HG1 THR 59 7.932 -3.849 4.144 511 HG21 THR 59 HG21 THR 59 6.647 -1.531 5.780 512 HG22 THR 59 HG22 THR 59 7.502 -1.466 4.218 513 HG23 THR 59 HG23 THR 59 5.798 -0.994 4.313 514 H LEU 60 H LEU 60 3.409 -3.461 3.033 515 HA LEU 60 HA LEU 60 2.027 -1.038 3.410 516 HB2 LEU 60 HB2 LEU 60 2.374 -2.546 1.318 517 HB3 LEU 60 HB3 LEU 60 1.021 -3.484 1.901 518 HG LEU 60 HG LEU 60 -0.393 -1.375 1.735 519 HD11 LEU 60 HD11 LEU 60 2.168 -0.374 0.423 520 HD12 LEU 60 HD12 LEU 60 0.604 0.419 0.286 521 HD13 LEU 60 HD13 LEU 60 1.359 0.305 1.869 522 HD21 LEU 60 HD21 LEU 60 -0.380 -3.089 -0.025 523 HD22 LEU 60 HD22 LEU 60 -0.552 -1.465 -0.709 524 HD23 LEU 60 HD23 LEU 60 1.014 -2.304 -0.791 525 H SER 61 H SER 61 1.174 -4.350 4.482 526 HA SER 61 HA SER 61 -1.321 -3.868 5.635 527 HB2 SER 61 HB2 SER 61 -0.501 -6.083 5.421 528 HB3 SER 61 HB3 SER 61 0.896 -5.739 6.456 529 HG SER 61 HG SER 61 -0.605 -6.809 7.677 530 H LYS 62 H LYS 62 1.820 -2.965 6.734 531 HA LYS 62 HA LYS 62 0.801 -2.149 9.386 532 HB2 LYS 62 HB2 LYS 62 3.631 -2.681 8.427 533 HB3 LYS 62 HB3 LYS 62 3.246 -1.988 10.010 534 HG2 LYS 62 HG2 LYS 62 1.825 -3.966 10.538 535 HG3 LYS 62 HG3 LYS 62 2.288 -4.703 8.994 536 HD2 LYS 62 HD2 LYS 62 4.668 -4.663 9.688 537 HD3 LYS 62 HD3 LYS 62 4.200 -3.903 11.228 538 HE2 LYS 62 HE2 LYS 62 2.760 -5.886 11.736 539 HE3 LYS 62 HE3 LYS 62 3.304 -6.650 10.238 540 HZ1 LYS 62 HZ1 LYS 62 5.068 -5.904 12.515 541 HZ2 LYS 62 HZ2 LYS 62 4.595 -7.420 12.147 542 HZ3 LYS 62 HZ3 LYS 62 5.580 -6.608 11.131 543 H LYS 63 H LYS 63 2.147 -0.676 6.473 544 HA LYS 63 HA LYS 63 2.721 1.938 7.514 545 HB2 LYS 63 HB2 LYS 63 1.925 0.796 4.815 546 HB3 LYS 63 HB3 LYS 63 2.248 2.516 5.008 547 HG2 LYS 63 HG2 LYS 63 4.298 0.393 5.768 548 HG3 LYS 63 HG3 LYS 63 4.097 0.976 4.116 549 HD2 LYS 63 HD2 LYS 63 4.494 3.319 4.980 550 HD3 LYS 63 HD3 LYS 63 4.921 2.580 6.550 551 HE2 LYS 63 HE2 LYS 63 6.667 1.223 5.401 552 HE3 LYS 63 HE3 LYS 63 6.241 1.990 3.863 553 HZ1 LYS 63 HZ1 LYS 63 7.314 3.419 6.241 554 HZ2 LYS 63 HZ2 LYS 63 8.159 3.071 4.890 555 HZ3 LYS 63 HZ3 LYS 63 6.919 4.129 4.822 556 H LEU 64 H LEU 64 -0.273 0.411 6.466 557 HA LEU 64 HA LEU 64 -1.810 2.902 7.076 558 HB2 LEU 64 HB2 LEU 64 -2.430 0.659 5.125 559 HB3 LEU 64 HB3 LEU 64 -3.440 2.060 5.442 560 HG LEU 64 HG LEU 64 -0.981 3.215 4.814 561 HD11 LEU 64 HD11 LEU 64 -1.415 0.864 2.908 562 HD12 LEU 64 HD12 LEU 64 -0.181 2.143 2.769 563 HD13 LEU 64 HD13 LEU 64 -0.115 0.958 4.087 564 HD21 LEU 64 HD21 LEU 64 -3.206 3.856 3.997 565 HD22 LEU 64 HD22 LEU 64 -1.979 3.791 2.731 566 HD23 LEU 64 HD23 LEU 64 -3.188 2.484 2.863 567 H ASN 65 H ASN 65 -1.153 0.155 8.649 568 HA ASN 65 HA ASN 65 -2.093 -1.148 10.212 569 HB2 ASN 65 HB2 ASN 65 -4.033 1.146 10.682 570 HB3 ASN 65 HB3 ASN 65 -3.556 -0.096 11.830 571 HD21 ASN 65 HD21 ASN 65 -1.244 3.199 11.357 572 HD22 ASN 65 HD22 ASN 65 -2.716 2.964 10.420 573 H ILE 66 H ILE 66 -2.725 -2.326 8.126 574 HA ILE 66 HA ILE 66 -5.636 -3.005 8.106 575 HB ILE 66 HB ILE 66 -5.010 -3.416 5.527 576 HG12 ILE 66 HG12 ILE 66 -3.394 -0.928 6.067 577 HG13 ILE 66 HG13 ILE 66 -2.592 -2.451 5.954 578 HG21 ILE 66 HG21 ILE 66 -5.778 -0.774 6.814 579 HG22 ILE 66 HG22 ILE 66 -6.017 -1.168 5.108 580 HG23 ILE 66 HG23 ILE 66 -6.864 -2.104 6.347 581 HD11 ILE 66 HD11 ILE 66 -4.191 -1.098 3.742 582 HD12 ILE 66 HD12 ILE 66 -2.456 -1.437 3.786 583 HD13 ILE 66 HD13 ILE 66 -3.609 -2.774 3.641 584 H THR 67 H THR 67 -5.422 -5.142 6.266 585 HA THR 67 HA THR 67 -3.744 -7.123 7.751 586 HB THR 67 HB THR 67 -5.114 -8.846 7.162 587 HG1 THR 67 HG1 THR 67 -6.787 -8.611 5.597 588 HG21 THR 67 HG21 THR 67 -7.179 -6.618 7.368 589 HG22 THR 67 HG22 THR 67 -7.378 -8.331 7.790 590 HG23 THR 67 HG23 THR 67 -6.302 -7.308 8.756 591 H VAL 68 H VAL 68 -2.683 -8.784 6.470 592 HA VAL 68 HA VAL 68 -1.153 -7.781 4.251 593 HB VAL 68 HB VAL 68 -1.630 -10.642 5.174 594 HG11 VAL 68 HG11 VAL 68 0.584 -9.530 3.396 595 HG12 VAL 68 HG12 VAL 68 0.496 -11.181 4.036 596 HG13 VAL 68 HG13 VAL 68 -0.704 -10.640 2.864 597 HG21 VAL 68 HG21 VAL 68 -0.587 -9.259 6.933 598 HG22 VAL 68 HG22 VAL 68 0.602 -10.370 6.259 599 HG23 VAL 68 HG23 VAL 68 0.618 -8.660 5.772 600 H GLU 69 H GLU 69 -4.369 -9.246 4.344 601 HA GLU 69 HA GLU 69 -4.251 -10.051 1.485 602 HB2 GLU 69 HB2 GLU 69 -6.493 -10.142 3.546 603 HB3 GLU 69 HB3 GLU 69 -6.623 -10.694 1.871 604 HG2 GLU 69 HG2 GLU 69 -4.794 -12.336 2.271 605 HG3 GLU 69 HG3 GLU 69 -4.701 -11.823 3.957 606 H LYS 70 H LYS 70 -5.654 -7.565 3.582 607 HA LYS 70 HA LYS 70 -7.160 -6.172 1.627 608 HB2 LYS 70 HB2 LYS 70 -7.155 -6.148 4.228 609 HB3 LYS 70 HB3 LYS 70 -5.871 -4.959 4.111 610 HG2 LYS 70 HG2 LYS 70 -8.647 -4.731 2.900 611 HG3 LYS 70 HG3 LYS 70 -8.183 -4.166 4.508 612 HD2 LYS 70 HD2 LYS 70 -6.539 -2.587 3.399 613 HD3 LYS 70 HD3 LYS 70 -7.295 -3.007 1.843 614 HE2 LYS 70 HE2 LYS 70 -9.491 -2.318 2.646 615 HE3 LYS 70 HE3 LYS 70 -8.884 -2.082 4.286 616 HZ1 LYS 70 HZ1 LYS 70 -7.989 -0.476 1.960 617 HZ2 LYS 70 HZ2 LYS 70 -9.144 0.008 2.995 618 HZ3 LYS 70 HZ3 LYS 70 -7.610 -0.193 3.529 619 H ALA 71 H ALA 71 -3.951 -5.672 2.936 620 HA ALA 71 HA ALA 71 -2.946 -3.625 1.248 621 HB1 ALA 71 HB1 ALA 71 -1.587 -5.968 2.660 622 HB2 ALA 71 HB2 ALA 71 -0.740 -4.610 1.928 623 HB3 ALA 71 HB3 ALA 71 -1.832 -4.328 3.297 624 H LYS 72 H LYS 72 -2.785 -7.226 0.762 625 HA LYS 72 HA LYS 72 -1.172 -6.993 -1.603 626 HB2 LYS 72 HB2 LYS 72 -1.081 -8.903 -0.054 627 HB3 LYS 72 HB3 LYS 72 -2.760 -9.319 -0.408 628 HG2 LYS 72 HG2 LYS 72 -2.208 -9.950 -2.652 629 HG3 LYS 72 HG3 LYS 72 -0.562 -9.308 -2.511 630 HD2 LYS 72 HD2 LYS 72 -1.621 -11.558 -0.736 631 HD3 LYS 72 HD3 LYS 72 -0.854 -11.854 -2.309 632 HE2 LYS 72 HE2 LYS 72 1.185 -10.638 -1.510 633 HE3 LYS 72 HE3 LYS 72 0.429 -10.455 0.080 634 HZ1 LYS 72 HZ1 LYS 72 1.055 -13.057 -1.220 635 HZ2 LYS 72 HZ2 LYS 72 1.894 -12.396 0.011 636 HZ3 LYS 72 HZ3 LYS 72 0.356 -12.892 0.248 637 H ASN 73 H ASN 73 -4.640 -6.990 -1.051 638 HA ASN 73 HA ASN 73 -5.500 -7.560 -3.621 639 HB2 ASN 73 HB2 ASN 73 -7.480 -7.026 -2.732 640 HB3 ASN 73 HB3 ASN 73 -6.672 -6.473 -1.283 641 HD21 ASN 73 HD21 ASN 73 -7.283 -3.039 -1.990 642 HD22 ASN 73 HD22 ASN 73 -6.534 -4.190 -0.897 643 H TYR 74 H TYR 74 -4.238 -4.428 -2.423 644 HA TYR 74 HA TYR 74 -4.499 -2.981 -4.866 645 HB2 TYR 74 HB2 TYR 74 -2.465 -2.621 -2.630 646 HB3 TYR 74 HB3 TYR 74 -2.928 -1.404 -3.817 647 HD1 TYR 74 HD1 TYR 74 -5.786 -1.258 -3.915 648 HD2 TYR 74 HD2 TYR 74 -3.243 -2.175 -0.507 649 HE1 TYR 74 HE1 TYR 74 -7.515 -0.388 -2.383 650 HE2 TYR 74 HE2 TYR 74 -5.041 -1.330 1.017 651 HH TYR 74 HH TYR 74 -8.161 -0.078 -0.255 652 H ILE 75 H ILE 75 -1.755 -4.828 -3.507 653 HA ILE 75 HA ILE 75 0.102 -4.249 -5.594 654 HB ILE 75 HB ILE 75 -0.011 -6.649 -3.724 655 HG12 ILE 75 HG12 ILE 75 1.319 -3.917 -3.403 656 HG13 ILE 75 HG13 ILE 75 -0.080 -4.481 -2.503 657 HG21 ILE 75 HG21 ILE 75 2.347 -5.439 -5.245 658 HG22 ILE 75 HG22 ILE 75 2.438 -6.787 -4.090 659 HG23 ILE 75 HG23 ILE 75 1.579 -7.003 -5.597 660 HD11 ILE 75 HD11 ILE 75 2.750 -5.512 -2.250 661 HD12 ILE 75 HD12 ILE 75 1.752 -4.684 -1.046 662 HD13 ILE 75 HD13 ILE 75 1.321 -6.327 -1.561 663 H LYS 76 H LYS 76 -2.564 -6.546 -5.482 664 HA LYS 76 HA LYS 76 -1.672 -7.972 -7.907 665 HB2 LYS 76 HB2 LYS 76 -4.035 -8.253 -6.025 666 HB3 LYS 76 HB3 LYS 76 -3.828 -9.240 -7.477 667 HG2 LYS 76 HG2 LYS 76 -1.770 -9.126 -5.242 668 HG3 LYS 76 HG3 LYS 76 -3.083 -10.305 -5.330 669 HD2 LYS 76 HD2 LYS 76 -2.226 -11.121 -7.512 670 HD3 LYS 76 HD3 LYS 76 -0.895 -9.949 -7.437 671 HE2 LYS 76 HE2 LYS 76 -0.078 -10.985 -5.347 672 HE3 LYS 76 HE3 LYS 76 -1.404 -12.155 -5.397 673 HZ1 LYS 76 HZ1 LYS 76 0.710 -11.904 -7.475 674 HZ2 LYS 76 HZ2 LYS 76 0.652 -13.070 -6.340 675 HZ3 LYS 76 HZ3 LYS 76 -0.500 -13.003 -7.492 676 H ASN 77 H ASN 77 -4.101 -5.434 -7.190 677 HA ASN 77 HA ASN 77 -5.006 -5.745 -10.011 678 HB2 ASN 77 HB2 ASN 77 -6.936 -4.476 -9.488 679 HB3 ASN 77 HB3 ASN 77 -6.819 -5.903 -8.516 680 HD21 ASN 77 HD21 ASN 77 -7.361 -4.164 -5.555 681 HD22 ASN 77 HD22 ASN 77 -7.457 -5.639 -6.473 682 H SER 78 H SER 78 -3.420 -3.386 -7.848 683 HA SER 78 HA SER 78 -3.886 -1.214 -9.733 684 HB2 SER 78 HB2 SER 78 -4.012 -1.099 -7.188 685 HB3 SER 78 HB3 SER 78 -2.238 -1.059 -7.204 686 HG SER 78 HG SER 78 -3.227 1.043 -7.224 687 H ASN 79 H ASN 79 -1.373 -3.483 -9.320 688 HA ASN 79 HA ASN 79 0.955 -2.047 -9.849 689 HB2 ASN 79 HB2 ASN 79 1.931 -4.229 -10.412 690 HB3 ASN 79 HB3 ASN 79 0.858 -4.358 -9.029 691 HD21 ASN 79 HD21 ASN 79 -1.098 -6.838 -10.560 692 HD22 ASN 79 HD22 ASN 79 -0.401 -6.139 -9.099 693 H ARG 80 H ARG 80 -1.517 -2.649 -12.175 694 HA ARG 80 HA ARG 80 0.120 -2.618 -14.580 695 HB2 ARG 80 HB2 ARG 80 -2.853 -1.992 -14.263 696 HB3 ARG 80 HB3 ARG 80 -1.998 -2.315 -15.758 697 HG2 ARG 80 HG2 ARG 80 -3.042 -4.311 -15.402 698 HG3 ARG 80 HG3 ARG 80 -1.438 -4.650 -14.752 699 HD2 ARG 80 HD2 ARG 80 -2.297 -4.432 -12.452 700 HD3 ARG 80 HD3 ARG 80 -3.802 -3.748 -13.061 701 HE ARG 80 HE ARG 80 -4.648 -5.836 -13.381 702 HH11 ARG 80 HH11 ARG 80 -4.769 -8.037 -13.381 703 HH12 ARG 80 HH12 ARG 80 -3.303 -8.979 -13.361 704 HH21 ARG 80 HH21 ARG 80 -1.166 -6.318 -13.087 705 HH22 ARG 80 HH22 ARG 80 -1.335 -8.045 -13.268 706 H LEU 81 H LEU 81 -1.041 -0.127 -12.481 707 HA LEU 81 HA LEU 81 -1.317 1.940 -14.466 708 HB2 LEU 81 HB2 LEU 81 -2.518 1.573 -12.184 709 HB3 LEU 81 HB3 LEU 81 -1.079 2.260 -11.451 710 HG LEU 81 HG LEU 81 -1.484 4.344 -12.911 711 HD11 LEU 81 HD11 LEU 81 -4.181 2.953 -13.294 712 HD12 LEU 81 HD12 LEU 81 -3.821 4.641 -13.717 713 HD13 LEU 81 HD13 LEU 81 -3.018 3.326 -14.581 714 HD21 LEU 81 HD21 LEU 81 -2.044 4.274 -10.526 715 HD22 LEU 81 HD22 LEU 81 -3.302 5.154 -11.411 716 HD23 LEU 81 HD23 LEU 81 -3.591 3.477 -10.880 717 H GLY 82 H GLY 82 1.141 1.357 -11.948 718 HA2 GLY 82 HA2 GLY 82 2.746 3.665 -12.762 719 HA3 GLY 82 HA3 GLY 82 3.068 2.560 -11.423 720 H ARG 83 H ARG 83 2.770 2.180 -14.991 721 HA ARG 83 HA ARG 83 5.456 0.832 -15.114 722 HB2 ARG 83 HB2 ARG 83 2.798 -0.324 -15.947 723 HB3 ARG 83 HB3 ARG 83 4.299 -0.770 -16.778 724 HG2 ARG 83 HG2 ARG 83 5.343 -1.431 -14.668 725 HG3 ARG 83 HG3 ARG 83 3.877 -1.008 -13.767 726 HD2 ARG 83 HD2 ARG 83 2.657 -2.821 -14.648 727 HD3 ARG 83 HD3 ARG 83 3.701 -2.945 -16.066 728 HE ARG 83 HE ARG 83 5.034 -4.418 -14.973 729 HH11 ARG 83 HH11 ARG 83 6.087 -5.463 -13.349 730 HH12 ARG 83 HH12 ARG 83 5.711 -5.110 -11.690 731 HH21 ARG 83 HH21 ARG 83 3.309 -2.762 -12.398 732 HH22 ARG 83 HH22 ARG 83 4.270 -3.546 -11.163 733 H THR 84 H THR 84 2.839 1.829 -17.291 734 HA THR 84 HA THR 84 4.594 3.662 -18.730 735 HB THR 84 HB THR 84 5.429 1.721 -19.769 736 HG1 THR 84 HG1 THR 84 4.772 2.036 -21.874 737 HG21 THR 84 HG21 THR 84 2.570 0.787 -20.206 738 HG22 THR 84 HG22 THR 84 4.026 0.017 -20.884 739 HG23 THR 84 HG23 THR 84 3.786 0.052 -19.128 740 H ASN 85 H ASN 85 3.452 5.206 -19.639 741 HA ASN 85 HA ASN 85 0.487 4.945 -19.915 742 HB2 ASN 85 HB2 ASN 85 1.920 7.291 -18.639 743 HB3 ASN 85 HB3 ASN 85 0.186 6.999 -18.702 744 HD21 ASN 85 HD21 ASN 85 0.774 4.309 -16.058 745 HD22 ASN 85 HD22 ASN 85 0.351 4.152 -17.754 746 H ASN 86 H ASN 86 -0.494 6.372 -21.413 747 HA ASN 86 HA ASN 86 1.363 7.683 -23.357 748 HB2 ASN 86 HB2 ASN 86 0.172 5.629 -24.185 749 HB3 ASN 86 HB3 ASN 86 -1.363 6.458 -23.914 750 HD21 ASN 86 HD21 ASN 86 -0.963 7.236 -27.382 751 HD22 ASN 86 HD22 ASN 86 -1.740 6.137 -26.251 752 H LEU 87 H LEU 87 0.865 9.674 -24.162 753 HA LEU 87 HA LEU 87 0.431 11.845 -23.937 754 HB2 LEU 87 HB2 LEU 87 -1.906 10.712 -24.646 755 HB3 LEU 87 HB3 LEU 87 -2.402 11.380 -23.104 756 HG LEU 87 HG LEU 87 -1.644 13.659 -23.939 757 HD11 LEU 87 HD11 LEU 87 -1.435 12.167 -26.594 758 HD12 LEU 87 HD12 LEU 87 -1.413 13.932 -26.396 759 HD13 LEU 87 HD13 LEU 87 -0.094 12.959 -25.741 760 HD21 LEU 87 HD21 LEU 87 -4.009 12.934 -23.999 761 HD22 LEU 87 HD22 LEU 87 -3.613 13.968 -25.380 762 HD23 LEU 87 HD23 LEU 87 -3.750 12.209 -25.598 763 H LYS 88 H LYS 88 -0.743 13.596 -22.360 764 HA LYS 88 HA LYS 88 0.148 12.960 -19.566 765 HB2 LYS 88 HB2 LYS 88 1.403 15.066 -19.546 766 HB3 LYS 88 HB3 LYS 88 1.993 13.938 -20.768 767 HG2 LYS 88 HG2 LYS 88 1.004 15.190 -22.565 768 HG3 LYS 88 HG3 LYS 88 0.041 16.167 -21.458 769 HD2 LYS 88 HD2 LYS 88 1.861 17.462 -22.354 770 HD3 LYS 88 HD3 LYS 88 2.057 17.300 -20.617 771 HE2 LYS 88 HE2 LYS 88 3.488 15.397 -22.513 772 HE3 LYS 88 HE3 LYS 88 4.088 17.041 -22.304 773 HZ1 LYS 88 HZ1 LYS 88 3.783 15.092 -20.085 774 HZ2 LYS 88 HZ2 LYS 88 5.186 15.561 -20.764 775 HZ3 LYS 88 HZ3 LYS 88 4.300 16.635 -19.922 776 H THR 89 H THR 89 -2.584 13.767 -21.019 777 HA THR 89 HA THR 89 -3.370 15.749 -18.951 778 HB THR 89 HB THR 89 -2.634 16.640 -21.273 779 HG1 THR 89 HG1 THR 89 -4.155 18.273 -21.221 780 HG21 THR 89 HG21 THR 89 -5.393 15.783 -22.155 781 HG22 THR 89 HG22 THR 89 -4.210 16.752 -23.055 782 HG23 THR 89 HG23 THR 89 -3.848 15.066 -22.679 783 H ILE 90 H ILE 90 -4.082 12.887 -19.501 784 HA ILE 90 HA ILE 90 -6.755 13.294 -20.622 785 HB ILE 90 HB ILE 90 -4.898 12.415 -21.745 786 HG12 ILE 90 HG12 ILE 90 -5.860 10.824 -23.212 787 HG13 ILE 90 HG13 ILE 90 -6.987 10.268 -21.958 788 HG21 ILE 90 HG21 ILE 90 -4.959 9.747 -20.666 789 HG22 ILE 90 HG22 ILE 90 -3.797 10.481 -21.723 790 HG23 ILE 90 HG23 ILE 90 -3.841 11.050 -20.052 791 HD11 ILE 90 HD11 ILE 90 -6.867 13.148 -22.909 792 HD12 ILE 90 HD12 ILE 90 -7.957 11.919 -23.646 793 HD13 ILE 90 HD13 ILE 90 -8.117 12.345 -21.918 794 H GLY 91 H GLY 91 -6.065 12.914 -17.698 795 HA2 GLY 91 HA2 GLY 91 -6.627 11.627 -15.918 796 HA3 GLY 91 HA3 GLY 91 -7.942 10.902 -16.916 797 H ILE 92 H ILE 92 -5.110 10.604 -18.626 798 HA ILE 92 HA ILE 92 -3.898 8.730 -19.249 799 HB ILE 92 HB ILE 92 -4.024 7.542 -16.489 800 HG12 ILE 92 HG12 ILE 92 -1.564 8.559 -16.540 801 HG13 ILE 92 HG13 ILE 92 -2.244 9.723 -17.667 802 HG21 ILE 92 HG21 ILE 92 -2.111 7.256 -18.859 803 HG22 ILE 92 HG22 ILE 92 -1.913 6.480 -17.267 804 HG23 ILE 92 HG23 ILE 92 -3.240 6.013 -18.304 805 HD11 ILE 92 HD11 ILE 92 -3.308 9.208 -14.847 806 HD12 ILE 92 HD12 ILE 92 -2.098 10.439 -15.254 807 HD13 ILE 92 HD13 ILE 92 -3.726 10.576 -15.910 808 H LEU 93 H LEU 93 -6.549 9.127 -19.747 809 HA LEU 93 HA LEU 93 -8.537 8.326 -20.274 810 HB2 LEU 93 HB2 LEU 93 -6.779 7.363 -21.918 811 HB3 LEU 93 HB3 LEU 93 -7.108 5.811 -21.155 812 HG LEU 93 HG LEU 93 -9.561 6.112 -21.843 813 HD11 LEU 93 HD11 LEU 93 -8.398 8.433 -23.448 814 HD12 LEU 93 HD12 LEU 93 -10.019 7.735 -23.656 815 HD13 LEU 93 HD13 LEU 93 -9.609 8.564 -22.154 816 HD21 LEU 93 HD21 LEU 93 -7.987 4.727 -23.135 817 HD22 LEU 93 HD22 LEU 93 -9.146 5.546 -24.193 818 HD23 LEU 93 HD23 LEU 93 -7.479 6.156 -24.065 819 H GLN 94 H GLN 94 -7.841 7.743 -17.508 820 HA GLN 94 HA GLN 94 -9.761 5.530 -16.893 821 HB2 GLN 94 HB2 GLN 94 -6.932 5.977 -15.882 822 HB3 GLN 94 HB3 GLN 94 -8.102 4.977 -15.015 823 HG2 GLN 94 HG2 GLN 94 -8.276 3.398 -16.802 824 HG3 GLN 94 HG3 GLN 94 -7.402 4.439 -17.925 825 HE21 GLN 94 HE21 GLN 94 -4.167 3.627 -16.697 826 HE22 GLN 94 HE22 GLN 94 -5.115 4.826 -17.589 827 H GLU 95 H GLU 95 -11.323 7.144 -16.508 828 HA GLU 95 HA GLU 95 -11.092 8.318 -13.779 829 HB2 GLU 95 HB2 GLU 95 -10.972 10.118 -15.482 830 HB3 GLU 95 HB3 GLU 95 -12.511 9.582 -16.154 831 HG2 GLU 95 HG2 GLU 95 -12.832 11.539 -14.754 832 HG3 GLU 95 HG3 GLU 95 -13.661 10.166 -14.045 833 H GLU 96 H GLU 96 -12.917 8.203 -12.475 834 HA GLU 96 HA GLU 96 -15.273 6.644 -13.383 835 HB2 GLU 96 HB2 GLU 96 -13.295 5.116 -12.622 836 HB3 GLU 96 HB3 GLU 96 -13.684 5.635 -10.992 837 HG2 GLU 96 HG2 GLU 96 -15.586 4.288 -12.970 838 HG3 GLU 96 HG3 GLU 96 -14.696 3.460 -11.702 839 H VAL 97 H VAL 97 -16.639 8.236 -13.017 840 HA VAL 97 HA VAL 97 -17.073 9.153 -10.232 841 HB VAL 97 HB VAL 97 -16.862 10.919 -12.706 842 HG11 VAL 97 HG11 VAL 97 -17.875 11.691 -9.941 843 HG12 VAL 97 HG12 VAL 97 -17.477 12.820 -11.253 844 HG13 VAL 97 HG13 VAL 97 -18.819 11.698 -11.449 845 HG21 VAL 97 HG21 VAL 97 -14.710 10.495 -11.587 846 HG22 VAL 97 HG22 VAL 97 -15.208 12.171 -11.349 847 HG23 VAL 97 HG23 VAL 97 -15.401 10.994 -10.029 848 H SER 98 H SER 98 -19.193 9.311 -9.642 849 HA SER 98 HA SER 98 -21.321 9.727 -11.533 850 HB2 SER 98 HB2 SER 98 -22.584 7.639 -11.182 851 HB3 SER 98 HB3 SER 98 -21.075 7.404 -12.070 852 HG SER 98 HG SER 98 -21.327 5.789 -10.494 853 H SER 99 H SER 99 -21.177 7.984 -8.391 854 HA SER 99 HA SER 99 -23.490 9.412 -7.398 855 HB2 SER 99 HB2 SER 99 -23.198 7.976 -5.415 856 HB3 SER 99 HB3 SER 99 -23.165 7.063 -6.933 857 HG SER 99 HG SER 99 -21.478 6.425 -5.507 858 H MET 100 H MET 100 -20.072 9.894 -6.967 859 HA MET 100 HA MET 100 -20.600 12.270 -5.246 860 HB2 MET 100 HB2 MET 100 -18.333 10.269 -4.856 861 HB3 MET 100 HB3 MET 100 -18.493 11.825 -4.032 862 HG2 MET 100 HG2 MET 100 -20.653 11.055 -3.041 863 HG3 MET 100 HG3 MET 100 -20.439 9.497 -3.837 864 HE1 MET 100 HE1 MET 100 -19.422 11.834 -0.909 865 HE2 MET 100 HE2 MET 100 -18.002 11.030 -0.207 866 HE3 MET 100 HE3 MET 100 -17.870 11.837 -1.781 867 H GLU 101 H GLU 101 -19.690 14.069 -6.025 868 HA GLU 101 HA GLU 101 -17.528 13.934 -8.072 869 HB2 GLU 101 HB2 GLU 101 -19.759 13.881 -9.175 870 HB3 GLU 101 HB3 GLU 101 -20.154 15.432 -8.437 871 HG2 GLU 101 HG2 GLU 101 -18.237 16.477 -9.671 872 HG3 GLU 101 HG3 GLU 101 -17.810 14.906 -10.328 873 H ALA 102 H ALA 102 -16.531 14.539 -5.911 874 HA ALA 102 HA ALA 102 -15.591 15.964 -4.431 875 HB1 ALA 102 HB1 ALA 102 -15.794 17.995 -6.684 876 HB2 ALA 102 HB2 ALA 102 -14.611 17.969 -5.356 877 HB3 ALA 102 HB3 ALA 102 -14.584 16.698 -6.582 878 H LYS 103 H LYS 103 -15.939 18.855 -4.176 879 HA LYS 103 HA LYS 103 -18.721 19.169 -3.162 880 HB2 LYS 103 HB2 LYS 103 -16.142 19.593 -1.595 881 HB3 LYS 103 HB3 LYS 103 -17.645 20.376 -1.133 882 HG2 LYS 103 HG2 LYS 103 -17.295 17.354 -1.324 883 HG3 LYS 103 HG3 LYS 103 -17.145 18.311 0.152 884 HD2 LYS 103 HD2 LYS 103 -19.503 19.102 -0.128 885 HD3 LYS 103 HD3 LYS 103 -19.672 18.035 -1.540 886 HE2 LYS 103 HE2 LYS 103 -19.145 16.071 -0.134 887 HE3 LYS 103 HE3 LYS 103 -18.952 17.119 1.277 888 HZ1 LYS 103 HZ1 LYS 103 -21.479 16.782 -0.256 889 HZ2 LYS 103 HZ2 LYS 103 -21.169 16.128 1.206 890 HZ3 LYS 103 HZ3 LYS 103 -21.300 17.746 1.051 891 H SER 104 H SER 104 -19.432 21.273 -2.886 892 HA SER 104 HA SER 104 -18.176 23.253 -4.724 893 HB2 SER 104 HB2 SER 104 -20.514 23.948 -5.179 894 HB3 SER 104 HB3 SER 104 -20.186 22.261 -5.595 895 HG SER 104 HG SER 104 -22.164 22.509 -4.437 896 H MET 105 H MET 105 -17.969 22.997 -1.630 897 HA MET 105 HA MET 105 -19.318 25.275 -0.499 898 HB2 MET 105 HB2 MET 105 -16.957 23.617 0.468 899 HB3 MET 105 HB3 MET 105 -17.726 24.892 1.422 900 HG2 MET 105 HG2 MET 105 -19.894 23.728 1.282 901 HG3 MET 105 HG3 MET 105 -19.153 22.431 0.339 902 HE1 MET 105 HE1 MET 105 -20.180 20.650 1.983 903 HE2 MET 105 HE2 MET 105 -19.975 20.700 3.748 904 HE3 MET 105 HE3 MET 105 -20.918 21.964 2.929 905 H THR 106 H THR 106 -18.297 27.100 0.539 906 HA THR 106 HA THR 106 -15.844 28.179 -0.718 907 HB THR 106 HB THR 106 -17.714 28.957 -2.099 908 HG1 THR 106 HG1 THR 106 -17.111 31.101 -2.037 909 HG21 THR 106 HG21 THR 106 -18.665 30.459 0.383 910 HG22 THR 106 HG22 THR 106 -19.309 30.619 -1.264 911 HG23 THR 106 HG23 THR 106 -19.514 29.098 -0.384 912 H TRP 107 H TRP 107 -14.990 29.991 0.278 913 HA TRP 107 HA TRP 107 -15.458 30.156 3.204 914 HB2 TRP 107 HB2 TRP 107 -12.830 29.572 1.821 915 HB3 TRP 107 HB3 TRP 107 -12.931 30.192 3.460 916 HD1 TRP 107 HD1 TRP 107 -13.426 28.569 5.373 917 HE1 TRP 107 HE1 TRP 107 -13.760 26.032 5.592 918 HE3 TRP 107 HE3 TRP 107 -13.872 27.386 0.415 919 HZ2 TRP 107 HZ2 TRP 107 -14.219 23.785 3.840 920 HZ3 TRP 107 HZ3 TRP 107 -14.277 25.033 -0.287 921 HH2 TRP 107 HH2 TRP 107 -14.452 23.228 1.416 Start of MODEL 17 1 H1 GLY -5 H1 GLY -5 -31.018 -58.057 14.307 2 H2 GLY -5 H2 GLY -5 -31.919 -59.135 15.147 3 H3 GLY -5 H3 GLY -5 -30.454 -58.668 15.720 4 HA2 GLY -5 HA2 GLY -5 -32.189 -57.583 16.972 5 HA3 GLY -5 HA3 GLY -5 -31.229 -56.413 16.048 6 H SER -4 H SER -4 -33.052 -54.966 16.186 7 HA SER -4 HA SER -4 -35.009 -55.324 13.998 8 HB2 SER -4 HB2 SER -4 -36.896 -54.673 15.437 9 HB3 SER -4 HB3 SER -4 -36.190 -56.220 15.925 10 HG SER -4 HG SER -4 -36.597 -54.855 17.725 11 H HIS -3 H HIS -3 -36.170 -53.368 13.467 12 HA HIS -3 HA HIS -3 -34.883 -50.787 14.221 13 HB2 HIS -3 HB2 HIS -3 -35.219 -51.892 11.399 14 HB3 HIS -3 HB3 HIS -3 -34.867 -50.206 11.759 15 HD2 HIS -3 HD2 HIS -3 -32.436 -49.583 12.756 16 HE1 HIS -3 HE1 HIS -3 -30.575 -53.313 11.843 17 HE2 HIS -3 HE2 HIS -3 -30.162 -50.901 12.552 18 H MET -2 H MET -2 -36.102 -48.910 13.509 19 HA MET -2 HA MET -2 -38.988 -49.316 12.929 20 HB2 MET -2 HB2 MET -2 -38.694 -49.151 15.405 21 HB3 MET -2 HB3 MET -2 -37.906 -47.584 15.189 22 HG2 MET -2 HG2 MET -2 -40.016 -46.712 14.147 23 HG3 MET -2 HG3 MET -2 -40.759 -48.293 14.391 24 HE1 MET -2 HE1 MET -2 -39.630 -44.917 15.919 25 HE2 MET -2 HE2 MET -2 -39.773 -45.169 17.671 26 HE3 MET -2 HE3 MET -2 -38.471 -45.966 16.767 27 H ALA -1 H ALA -1 -39.815 -47.865 11.592 28 HA ALA -1 HA ALA -1 -39.868 -46.357 9.913 29 HB1 ALA -1 HB1 ALA -1 -39.290 -44.591 12.333 30 HB2 ALA -1 HB2 ALA -1 -40.124 -44.081 10.848 31 HB3 ALA -1 HB3 ALA -1 -40.865 -45.298 11.904 32 H SER 0 H SER 0 -38.179 -47.096 8.691 33 HA SER 0 HA SER 0 -35.747 -45.350 8.573 34 HB2 SER 0 HB2 SER 0 -35.429 -47.571 9.591 35 HB3 SER 0 HB3 SER 0 -36.026 -48.330 8.110 36 HG SER 0 HG SER 0 -33.701 -48.171 8.171 37 H MET 1 H MET 1 -35.698 -44.208 6.779 38 HA MET 1 HA MET 1 -36.415 -45.356 4.142 39 HB2 MET 1 HB2 MET 1 -38.441 -44.289 5.303 40 HB3 MET 1 HB3 MET 1 -37.619 -42.739 5.133 41 HG2 MET 1 HG2 MET 1 -37.653 -43.027 2.659 42 HG3 MET 1 HG3 MET 1 -38.404 -44.612 2.854 43 HE1 MET 1 HE1 MET 1 -40.083 -43.577 0.940 44 HE2 MET 1 HE2 MET 1 -41.091 -42.140 1.217 45 HE3 MET 1 HE3 MET 1 -39.332 -41.970 1.059 46 H ASP 2 H ASP 2 -33.912 -44.312 5.605 47 HA ASP 2 HA ASP 2 -33.151 -42.034 3.804 48 HB2 ASP 2 HB2 ASP 2 -32.440 -42.548 6.698 49 HB3 ASP 2 HB3 ASP 2 -31.728 -41.296 5.678 50 HA PRO 3 HA PRO 3 -29.878 -45.080 2.918 51 HB2 PRO 3 HB2 PRO 3 -29.661 -44.775 0.224 52 HB3 PRO 3 HB3 PRO 3 -31.029 -45.659 0.970 53 HG2 PRO 3 HG2 PRO 3 -30.966 -42.780 0.026 54 HG3 PRO 3 HG3 PRO 3 -32.210 -44.023 -0.298 55 HD2 PRO 3 HD2 PRO 3 -32.427 -42.144 1.711 56 HD3 PRO 3 HD3 PRO 3 -33.148 -43.778 1.824 57 H LEU 4 H LEU 4 -29.933 -41.770 2.856 58 HA LEU 4 HA LEU 4 -27.157 -41.482 1.890 59 HB2 LEU 4 HB2 LEU 4 -29.383 -39.437 2.211 60 HB3 LEU 4 HB3 LEU 4 -27.766 -39.056 1.642 61 HG LEU 4 HG LEU 4 -29.714 -40.885 0.212 62 HD11 LEU 4 HD11 LEU 4 -28.731 -38.081 -0.442 63 HD12 LEU 4 HD12 LEU 4 -29.822 -39.072 -1.437 64 HD13 LEU 4 HD13 LEU 4 -30.350 -38.507 0.155 65 HD21 LEU 4 HD21 LEU 4 -27.417 -41.588 -0.288 66 HD22 LEU 4 HD22 LEU 4 -28.099 -40.740 -1.674 67 HD23 LEU 4 HD23 LEU 4 -26.951 -39.899 -0.613 68 H ASP 5 H ASP 5 -27.311 -42.555 4.435 69 HA ASP 5 HA ASP 5 -26.086 -40.372 6.080 70 HB2 ASP 5 HB2 ASP 5 -27.332 -43.036 6.794 71 HB3 ASP 5 HB3 ASP 5 -26.260 -42.212 7.911 72 H LYS 6 H LYS 6 -25.006 -42.524 3.944 73 HA LYS 6 HA LYS 6 -22.493 -43.174 5.468 74 HB2 LYS 6 HB2 LYS 6 -23.554 -45.155 3.462 75 HB3 LYS 6 HB3 LYS 6 -22.455 -45.368 4.805 76 HG2 LYS 6 HG2 LYS 6 -24.274 -46.362 5.737 77 HG3 LYS 6 HG3 LYS 6 -24.610 -44.710 6.244 78 HD2 LYS 6 HD2 LYS 6 -26.663 -45.559 5.378 79 HD3 LYS 6 HD3 LYS 6 -26.039 -44.487 4.113 80 HE2 LYS 6 HE2 LYS 6 -25.069 -46.502 2.950 81 HE3 LYS 6 HE3 LYS 6 -25.794 -47.531 4.189 82 HZ1 LYS 6 HZ1 LYS 6 -27.321 -45.719 2.390 83 HZ2 LYS 6 HZ2 LYS 6 -27.186 -47.343 2.185 84 HZ3 LYS 6 HZ3 LYS 6 -27.973 -46.756 3.489 85 H ILE 7 H ILE 7 -23.755 -43.266 2.165 86 HA ILE 7 HA ILE 7 -21.095 -42.488 1.079 87 HB ILE 7 HB ILE 7 -21.898 -43.562 -1.028 88 HG12 ILE 7 HG12 ILE 7 -23.677 -45.240 -0.936 89 HG13 ILE 7 HG13 ILE 7 -24.128 -44.754 0.692 90 HG21 ILE 7 HG21 ILE 7 -21.783 -45.336 1.450 91 HG22 ILE 7 HG22 ILE 7 -21.436 -45.826 -0.221 92 HG23 ILE 7 HG23 ILE 7 -20.389 -44.653 0.587 93 HD11 ILE 7 HD11 ILE 7 -24.333 -42.957 -1.765 94 HD12 ILE 7 HD12 ILE 7 -25.663 -43.919 -1.089 95 HD13 ILE 7 HD13 ILE 7 -24.966 -42.608 -0.133 96 H ILE 8 H ILE 8 -23.620 -40.844 1.981 97 HA ILE 8 HA ILE 8 -24.656 -39.422 -0.154 98 HB ILE 8 HB ILE 8 -25.463 -39.213 2.083 99 HG12 ILE 8 HG12 ILE 8 -24.682 -36.549 0.831 100 HG13 ILE 8 HG13 ILE 8 -26.082 -37.548 0.427 101 HG21 ILE 8 HG21 ILE 8 -23.150 -37.386 2.816 102 HG22 ILE 8 HG22 ILE 8 -24.473 -37.947 3.853 103 HG23 ILE 8 HG23 ILE 8 -23.253 -39.090 3.301 104 HD11 ILE 8 HD11 ILE 8 -25.604 -36.049 3.038 105 HD12 ILE 8 HD12 ILE 8 -26.782 -35.670 1.774 106 HD13 ILE 8 HD13 ILE 8 -26.977 -37.142 2.741 107 H ASN 9 H ASN 9 -23.898 -38.268 -1.718 108 HA ASN 9 HA ASN 9 -22.554 -37.146 -3.116 109 HB2 ASN 9 HB2 ASN 9 -23.415 -35.459 -1.283 110 HB3 ASN 9 HB3 ASN 9 -21.715 -35.344 -0.847 111 HD21 ASN 9 HD21 ASN 9 -20.884 -33.581 -3.900 112 HD22 ASN 9 HD22 ASN 9 -20.228 -34.805 -2.803 113 H ASP 10 H ASP 10 -21.174 -39.419 -1.687 114 HA ASP 10 HA ASP 10 -18.485 -38.444 -1.391 115 HB2 ASP 10 HB2 ASP 10 -19.656 -40.095 0.124 116 HB3 ASP 10 HB3 ASP 10 -19.498 -41.299 -1.155 117 H ILE 11 H ILE 11 -19.740 -38.720 -4.119 118 HA ILE 11 HA ILE 11 -17.365 -39.746 -5.537 119 HB ILE 11 HB ILE 11 -19.014 -41.619 -5.124 120 HG12 ILE 11 HG12 ILE 11 -18.511 -41.195 -8.084 121 HG13 ILE 11 HG13 ILE 11 -17.256 -41.633 -6.921 122 HG21 ILE 11 HG21 ILE 11 -20.741 -40.248 -7.224 123 HG22 ILE 11 HG22 ILE 11 -21.056 -41.791 -6.410 124 HG23 ILE 11 HG23 ILE 11 -21.095 -40.293 -5.484 125 HD11 ILE 11 HD11 ILE 11 -19.741 -43.267 -7.586 126 HD12 ILE 11 HD12 ILE 11 -18.068 -43.623 -8.039 127 HD13 ILE 11 HD13 ILE 11 -18.547 -43.687 -6.332 128 H LYS 12 H LYS 12 -18.618 -37.109 -5.147 129 HA LYS 12 HA LYS 12 -18.592 -36.350 -8.047 130 HB2 LYS 12 HB2 LYS 12 -20.432 -35.203 -5.909 131 HB3 LYS 12 HB3 LYS 12 -20.203 -34.523 -7.523 132 HG2 LYS 12 HG2 LYS 12 -20.955 -36.740 -8.500 133 HG3 LYS 12 HG3 LYS 12 -21.328 -37.275 -6.857 134 HD2 LYS 12 HD2 LYS 12 -23.367 -36.539 -7.868 135 HD3 LYS 12 HD3 LYS 12 -22.928 -35.350 -6.631 136 HE2 LYS 12 HE2 LYS 12 -22.009 -33.855 -8.391 137 HE3 LYS 12 HE3 LYS 12 -22.362 -35.071 -9.623 138 HZ1 LYS 12 HZ1 LYS 12 -24.405 -33.695 -7.958 139 HZ2 LYS 12 HZ2 LYS 12 -24.093 -33.373 -9.527 140 HZ3 LYS 12 HZ3 LYS 12 -24.729 -34.815 -9.106 141 H LYS 13 H LYS 13 -17.674 -35.276 -4.786 142 HA LYS 13 HA LYS 13 -15.658 -33.506 -5.905 143 HB2 LYS 13 HB2 LYS 13 -17.894 -32.209 -5.960 144 HB3 LYS 13 HB3 LYS 13 -17.852 -32.253 -4.194 145 HG2 LYS 13 HG2 LYS 13 -15.619 -31.096 -4.301 146 HG3 LYS 13 HG3 LYS 13 -15.770 -31.003 -6.053 147 HD2 LYS 13 HD2 LYS 13 -17.701 -29.548 -5.857 148 HD3 LYS 13 HD3 LYS 13 -17.782 -29.777 -4.102 149 HE2 LYS 13 HE2 LYS 13 -15.381 -28.574 -5.554 150 HE3 LYS 13 HE3 LYS 13 -16.698 -27.603 -4.893 151 HZ1 LYS 13 HZ1 LYS 13 -15.046 -29.436 -3.216 152 HZ2 LYS 13 HZ2 LYS 13 -14.784 -27.826 -3.354 153 HZ3 LYS 13 HZ3 LYS 13 -16.168 -28.379 -2.692 154 H GLU 14 H GLU 14 -14.099 -32.810 -4.429 155 HA GLU 14 HA GLU 14 -14.042 -34.101 -1.776 156 HB2 GLU 14 HB2 GLU 14 -12.036 -34.144 -3.214 157 HB3 GLU 14 HB3 GLU 14 -11.977 -32.382 -3.195 158 HG2 GLU 14 HG2 GLU 14 -10.350 -33.389 -1.647 159 HG3 GLU 14 HG3 GLU 14 -11.499 -32.363 -0.805 160 H ALA 15 H ALA 15 -13.908 -32.981 0.182 161 HA ALA 15 HA ALA 15 -15.062 -30.228 0.204 162 HB1 ALA 15 HB1 ALA 15 -16.318 -32.718 1.436 163 HB2 ALA 15 HB2 ALA 15 -16.977 -31.065 1.488 164 HB3 ALA 15 HB3 ALA 15 -16.860 -31.920 -0.057 165 H ASN 16 H ASN 16 -12.435 -31.266 1.107 166 HA ASN 16 HA ASN 16 -12.627 -31.062 4.075 167 HB2 ASN 16 HB2 ASN 16 -11.836 -33.151 2.938 168 HB3 ASN 16 HB3 ASN 16 -10.435 -32.259 2.341 169 HD21 ASN 16 HD21 ASN 16 -8.768 -32.375 5.497 170 HD22 ASN 16 HD22 ASN 16 -8.764 -31.636 3.896 171 H ASP 17 H ASP 17 -11.127 -29.370 1.358 172 HA ASP 17 HA ASP 17 -9.834 -27.453 3.239 173 HB2 ASP 17 HB2 ASP 17 -8.467 -28.843 0.900 174 HB3 ASP 17 HB3 ASP 17 -7.832 -27.428 1.733 175 H SER 18 H SER 18 -9.884 -25.375 2.622 176 HA SER 18 HA SER 18 -10.983 -24.583 -0.037 177 HB2 SER 18 HB2 SER 18 -12.148 -23.753 2.652 178 HB3 SER 18 HB3 SER 18 -12.689 -23.196 1.057 179 HG SER 18 HG SER 18 -14.000 -24.888 1.893 180 H GLY 19 H GLY 19 -8.357 -24.269 0.586 181 HA2 GLY 19 HA2 GLY 19 -8.103 -21.319 0.659 182 HA3 GLY 19 HA3 GLY 19 -7.229 -22.261 1.886 183 H VAL 20 H VAL 20 -7.749 -23.024 -1.528 184 HA VAL 20 HA VAL 20 -4.810 -22.897 -2.079 185 HB VAL 20 HB VAL 20 -6.687 -25.191 -2.709 186 HG11 VAL 20 HG11 VAL 20 -3.682 -24.837 -3.201 187 HG12 VAL 20 HG12 VAL 20 -4.501 -26.416 -3.265 188 HG13 VAL 20 HG13 VAL 20 -4.921 -25.176 -4.426 189 HG21 VAL 20 HG21 VAL 20 -6.156 -25.213 -0.334 190 HG22 VAL 20 HG22 VAL 20 -5.268 -26.499 -1.131 191 HG23 VAL 20 HG23 VAL 20 -4.426 -24.998 -0.685 192 H THR 21 H THR 21 -6.617 -20.851 -2.758 193 HA THR 21 HA THR 21 -6.310 -20.926 -5.670 194 HB THR 21 HB THR 21 -8.887 -19.801 -5.465 195 HG1 THR 21 HG1 THR 21 -10.109 -21.452 -4.587 196 HG21 THR 21 HG21 THR 21 -8.060 -22.584 -6.381 197 HG22 THR 21 HG22 THR 21 -9.521 -21.696 -6.874 198 HG23 THR 21 HG23 THR 21 -7.918 -21.095 -7.344 199 H LEU 22 H LEU 22 -6.968 -18.940 -6.760 200 HA LEU 22 HA LEU 22 -5.275 -16.884 -5.578 201 HB2 LEU 22 HB2 LEU 22 -6.401 -17.342 -8.368 202 HB3 LEU 22 HB3 LEU 22 -5.158 -16.160 -7.988 203 HG LEU 22 HG LEU 22 -4.632 -19.046 -7.241 204 HD11 LEU 22 HD11 LEU 22 -4.434 -17.967 -10.065 205 HD12 LEU 22 HD12 LEU 22 -3.742 -19.501 -9.481 206 HD13 LEU 22 HD13 LEU 22 -5.499 -19.274 -9.470 207 HD21 LEU 22 HD21 LEU 22 -3.022 -17.259 -6.632 208 HD22 LEU 22 HD22 LEU 22 -2.334 -18.440 -7.759 209 HD23 LEU 22 HD23 LEU 22 -2.849 -16.847 -8.357 210 H ALA 23 H ALA 23 -7.713 -16.830 -4.340 211 HA ALA 23 HA ALA 23 -9.266 -14.568 -5.520 212 HB1 ALA 23 HB1 ALA 23 -10.221 -17.351 -4.749 213 HB2 ALA 23 HB2 ALA 23 -11.272 -16.014 -5.268 214 HB3 ALA 23 HB3 ALA 23 -10.069 -16.693 -6.387 215 HA PRO 24 HA PRO 24 -9.018 -13.767 -1.035 216 HB2 PRO 24 HB2 PRO 24 -9.185 -11.051 -1.037 217 HB3 PRO 24 HB3 PRO 24 -7.717 -11.930 -1.563 218 HG2 PRO 24 HG2 PRO 24 -9.933 -10.801 -3.305 219 HG3 PRO 24 HG3 PRO 24 -8.163 -10.588 -3.493 220 HD2 PRO 24 HD2 PRO 24 -9.564 -12.479 -4.875 221 HD3 PRO 24 HD3 PRO 24 -7.891 -12.778 -4.315 222 H LEU 25 H LEU 25 -11.609 -12.711 -3.185 223 HA LEU 25 HA LEU 25 -13.583 -12.924 -0.990 224 HB2 LEU 25 HB2 LEU 25 -12.820 -10.456 -2.467 225 HB3 LEU 25 HB3 LEU 25 -14.549 -10.713 -2.392 226 HG LEU 25 HG LEU 25 -12.772 -10.720 0.072 227 HD11 LEU 25 HD11 LEU 25 -14.594 -8.549 -1.048 228 HD12 LEU 25 HD12 LEU 25 -13.726 -8.495 0.503 229 HD13 LEU 25 HD13 LEU 25 -12.817 -8.507 -1.017 230 HD21 LEU 25 HD21 LEU 25 -14.900 -11.985 0.382 231 HD22 LEU 25 HD22 LEU 25 -14.936 -10.460 1.269 232 HD23 LEU 25 HD23 LEU 25 -15.810 -10.614 -0.271 233 H SER 26 H SER 26 -13.214 -14.953 -2.564 234 HA SER 26 HA SER 26 -14.124 -16.406 -4.004 235 HB2 SER 26 HB2 SER 26 -15.985 -15.821 -2.271 236 HB3 SER 26 HB3 SER 26 -16.813 -15.077 -3.644 237 HG SER 26 HG SER 26 -17.390 -17.298 -3.341 238 H VAL 27 H VAL 27 -12.975 -14.270 -5.206 239 HA VAL 27 HA VAL 27 -14.060 -14.205 -7.957 240 HB VAL 27 HB VAL 27 -13.639 -11.896 -6.050 241 HG11 VAL 27 HG11 VAL 27 -13.753 -11.632 -9.100 242 HG12 VAL 27 HG12 VAL 27 -13.823 -10.290 -7.946 243 HG13 VAL 27 HG13 VAL 27 -12.350 -11.241 -8.076 244 HG21 VAL 27 HG21 VAL 27 -15.948 -12.670 -6.236 245 HG22 VAL 27 HG22 VAL 27 -15.805 -11.085 -6.984 246 HG23 VAL 27 HG23 VAL 27 -15.889 -12.536 -8.006 247 HA PRO 28 HA PRO 28 -9.606 -14.720 -8.326 248 HB2 PRO 28 HB2 PRO 28 -9.245 -14.624 -11.020 249 HB3 PRO 28 HB3 PRO 28 -10.130 -15.946 -10.209 250 HG2 PRO 28 HG2 PRO 28 -11.318 -13.469 -11.510 251 HG3 PRO 28 HG3 PRO 28 -11.762 -15.183 -11.793 252 HD2 PRO 28 HD2 PRO 28 -13.144 -13.621 -10.052 253 HD3 PRO 28 HD3 PRO 28 -12.839 -15.347 -9.701 254 H LYS 29 H LYS 29 -9.635 -12.675 -7.126 255 HA LYS 29 HA LYS 29 -8.763 -10.655 -6.552 256 HB2 LYS 29 HB2 LYS 29 -6.704 -11.411 -7.304 257 HB3 LYS 29 HB3 LYS 29 -7.094 -11.203 -8.982 258 HG2 LYS 29 HG2 LYS 29 -7.266 -8.583 -7.717 259 HG3 LYS 29 HG3 LYS 29 -5.806 -9.362 -7.179 260 HD2 LYS 29 HD2 LYS 29 -5.240 -8.173 -9.054 261 HD3 LYS 29 HD3 LYS 29 -5.190 -9.838 -9.587 262 HE2 LYS 29 HE2 LYS 29 -7.485 -7.879 -10.082 263 HE3 LYS 29 HE3 LYS 29 -6.075 -8.026 -11.142 264 HZ1 LYS 29 HZ1 LYS 29 -8.114 -10.115 -10.635 265 HZ2 LYS 29 HZ2 LYS 29 -7.810 -9.371 -12.044 266 HZ3 LYS 29 HZ3 LYS 29 -6.709 -10.421 -11.448 267 HA PRO 30 HA PRO 30 -11.627 -7.968 -8.870 268 HB2 PRO 30 HB2 PRO 30 -12.502 -6.479 -6.754 269 HB3 PRO 30 HB3 PRO 30 -13.142 -8.108 -7.119 270 HG2 PRO 30 HG2 PRO 30 -10.997 -7.358 -5.113 271 HG3 PRO 30 HG3 PRO 30 -12.418 -8.420 -4.869 272 HD2 PRO 30 HD2 PRO 30 -9.917 -9.358 -5.429 273 HD3 PRO 30 HD3 PRO 30 -11.388 -10.198 -6.010 274 H LYS 31 H LYS 31 -11.576 -5.627 -9.173 275 HA LYS 31 HA LYS 31 -8.994 -4.310 -8.402 276 HB2 LYS 31 HB2 LYS 31 -8.966 -3.084 -10.430 277 HB3 LYS 31 HB3 LYS 31 -9.027 -4.812 -10.761 278 HG2 LYS 31 HG2 LYS 31 -11.497 -4.583 -11.247 279 HG3 LYS 31 HG3 LYS 31 -11.326 -2.829 -11.025 280 HD2 LYS 31 HD2 LYS 31 -9.611 -2.797 -12.862 281 HD3 LYS 31 HD3 LYS 31 -9.854 -4.533 -13.077 282 HE2 LYS 31 HE2 LYS 31 -11.135 -3.484 -14.772 283 HE3 LYS 31 HE3 LYS 31 -12.285 -4.092 -13.579 284 HZ1 LYS 31 HZ1 LYS 31 -11.359 -1.269 -13.784 285 HZ2 LYS 31 HZ2 LYS 31 -12.807 -1.818 -14.288 286 HZ3 LYS 31 HZ3 LYS 31 -12.454 -1.816 -12.697 287 H LEU 32 H LEU 32 -9.102 -2.675 -7.086 288 HA LEU 32 HA LEU 32 -11.426 -0.874 -6.913 289 HB2 LEU 32 HB2 LEU 32 -11.620 -1.377 -4.503 290 HB3 LEU 32 HB3 LEU 32 -12.078 -2.709 -5.554 291 HG LEU 32 HG LEU 32 -9.251 -2.797 -4.603 292 HD11 LEU 32 HD11 LEU 32 -11.560 -3.246 -2.678 293 HD12 LEU 32 HD12 LEU 32 -9.853 -3.661 -2.389 294 HD13 LEU 32 HD13 LEU 32 -10.320 -1.968 -2.573 295 HD21 LEU 32 HD21 LEU 32 -10.185 -4.678 -5.872 296 HD22 LEU 32 HD22 LEU 32 -9.890 -5.199 -4.222 297 HD23 LEU 32 HD23 LEU 32 -11.542 -4.820 -4.728 298 H GLU 33 H GLU 33 -11.142 0.928 -5.531 299 HA GLU 33 HA GLU 33 -8.424 1.628 -4.592 300 HB2 GLU 33 HB2 GLU 33 -10.079 3.187 -6.632 301 HB3 GLU 33 HB3 GLU 33 -8.802 3.957 -5.707 302 HG2 GLU 33 HG2 GLU 33 -8.386 1.612 -7.601 303 HG3 GLU 33 HG3 GLU 33 -8.125 3.304 -7.987 304 H GLU 34 H GLU 34 -9.967 0.851 -2.847 305 HA GLU 34 HA GLU 34 -11.576 3.082 -1.684 306 HB2 GLU 34 HB2 GLU 34 -12.738 0.975 -2.222 307 HB3 GLU 34 HB3 GLU 34 -11.698 0.107 -1.082 308 HG2 GLU 34 HG2 GLU 34 -12.533 1.543 0.764 309 HG3 GLU 34 HG3 GLU 34 -13.504 2.465 -0.383 310 H LEU 35 H LEU 35 -10.061 4.299 -0.662 311 HA LEU 35 HA LEU 35 -8.840 3.242 1.850 312 HB2 LEU 35 HB2 LEU 35 -7.644 5.019 -0.311 313 HB3 LEU 35 HB3 LEU 35 -6.951 4.891 1.296 314 HG LEU 35 HG LEU 35 -7.385 2.332 -0.246 315 HD11 LEU 35 HD11 LEU 35 -4.993 4.106 -0.752 316 HD12 LEU 35 HD12 LEU 35 -5.347 2.505 -1.440 317 HD13 LEU 35 HD13 LEU 35 -6.350 3.885 -1.882 318 HD21 LEU 35 HD21 LEU 35 -6.517 2.299 2.088 319 HD22 LEU 35 HD22 LEU 35 -5.340 1.669 0.925 320 HD23 LEU 35 HD23 LEU 35 -5.141 3.307 1.573 321 H SER 36 H SER 36 -8.587 4.879 3.499 322 HA SER 36 HA SER 36 -10.638 6.994 3.528 323 HB2 SER 36 HB2 SER 36 -9.995 5.727 5.566 324 HB3 SER 36 HB3 SER 36 -8.377 6.450 5.486 325 HG SER 36 HG SER 36 -9.900 7.564 6.886 326 H GLU 37 H GLU 37 -9.931 9.333 4.036 327 HA GLU 37 HA GLU 37 -8.502 10.342 1.800 328 HB2 GLU 37 HB2 GLU 37 -10.206 11.579 3.036 329 HB3 GLU 37 HB3 GLU 37 -9.147 11.688 4.451 330 HG2 GLU 37 HG2 GLU 37 -7.539 13.051 3.152 331 HG3 GLU 37 HG3 GLU 37 -8.538 12.874 1.707 332 H GLN 38 H GLN 38 -7.296 9.908 5.156 333 HA GLN 38 HA GLN 38 -4.610 10.851 4.422 334 HB2 GLN 38 HB2 GLN 38 -3.946 10.170 6.662 335 HB3 GLN 38 HB3 GLN 38 -5.323 11.262 6.681 336 HG2 GLN 38 HG2 GLN 38 -6.841 9.544 7.341 337 HG3 GLN 38 HG3 GLN 38 -5.726 8.251 6.900 338 HE21 GLN 38 HE21 GLN 38 -3.824 8.402 9.906 339 HE22 GLN 38 HE22 GLN 38 -3.782 7.890 8.225 340 H GLN 39 H GLN 39 -6.249 7.724 4.629 341 HA GLN 39 HA GLN 39 -3.850 6.145 4.521 342 HB2 GLN 39 HB2 GLN 39 -6.746 5.511 3.958 343 HB3 GLN 39 HB3 GLN 39 -5.465 4.311 3.798 344 HG2 GLN 39 HG2 GLN 39 -4.800 4.663 6.159 345 HG3 GLN 39 HG3 GLN 39 -6.109 5.824 6.368 346 HE21 GLN 39 HE21 GLN 39 -7.121 2.265 7.402 347 HE22 GLN 39 HE22 GLN 39 -5.611 3.102 7.697 348 H LYS 40 H LYS 40 -6.038 7.410 2.040 349 HA LYS 40 HA LYS 40 -4.818 6.185 -0.256 350 HB2 LYS 40 HB2 LYS 40 -7.022 7.302 -0.252 351 HB3 LYS 40 HB3 LYS 40 -6.282 8.850 0.154 352 HG2 LYS 40 HG2 LYS 40 -5.131 8.932 -2.000 353 HG3 LYS 40 HG3 LYS 40 -5.750 7.336 -2.441 354 HD2 LYS 40 HD2 LYS 40 -7.514 9.745 -1.779 355 HD3 LYS 40 HD3 LYS 40 -6.983 9.375 -3.416 356 HE2 LYS 40 HE2 LYS 40 -8.612 7.457 -1.682 357 HE3 LYS 40 HE3 LYS 40 -9.320 8.611 -2.810 358 HZ1 LYS 40 HZ1 LYS 40 -7.459 6.433 -3.605 359 HZ2 LYS 40 HZ2 LYS 40 -9.075 6.438 -3.844 360 HZ3 LYS 40 HZ3 LYS 40 -8.134 7.520 -4.622 361 H ILE 41 H ILE 41 -4.031 9.241 1.480 362 HA ILE 41 HA ILE 41 -1.882 9.963 -0.297 363 HB ILE 41 HB ILE 41 -2.326 10.754 2.569 364 HG12 ILE 41 HG12 ILE 41 -2.988 12.421 0.088 365 HG13 ILE 41 HG13 ILE 41 -4.176 11.327 0.765 366 HG21 ILE 41 HG21 ILE 41 -0.562 12.024 0.439 367 HG22 ILE 41 HG22 ILE 41 -0.922 12.756 2.016 368 HG23 ILE 41 HG23 ILE 41 -0.030 11.247 1.946 369 HD11 ILE 41 HD11 ILE 41 -2.963 13.707 2.209 370 HD12 ILE 41 HD12 ILE 41 -4.626 13.511 1.621 371 HD13 ILE 41 HD13 ILE 41 -4.041 12.500 2.952 372 H ILE 42 H ILE 42 -1.871 8.093 2.840 373 HA ILE 42 HA ILE 42 0.998 7.841 2.914 374 HB ILE 42 HB ILE 42 -1.165 6.027 4.030 375 HG12 ILE 42 HG12 ILE 42 0.565 7.924 5.658 376 HG13 ILE 42 HG13 ILE 42 -0.877 8.532 4.861 377 HG21 ILE 42 HG21 ILE 42 1.843 6.085 4.550 378 HG22 ILE 42 HG22 ILE 42 0.686 5.208 5.568 379 HG23 ILE 42 HG23 ILE 42 0.898 4.731 3.889 380 HD11 ILE 42 HD11 ILE 42 -0.825 6.254 6.879 381 HD12 ILE 42 HD12 ILE 42 -1.455 7.896 7.122 382 HD13 ILE 42 HD13 ILE 42 -2.255 6.796 5.976 383 H LEU 43 H LEU 43 -1.525 5.766 1.526 384 HA LEU 43 HA LEU 43 0.118 3.702 0.475 385 HB2 LEU 43 HB2 LEU 43 -2.289 3.585 0.821 386 HB3 LEU 43 HB3 LEU 43 -2.580 4.814 -0.386 387 HG LEU 43 HG LEU 43 -3.127 2.462 -0.954 388 HD11 LEU 43 HD11 LEU 43 -1.210 3.789 -2.885 389 HD12 LEU 43 HD12 LEU 43 -2.444 2.581 -3.269 390 HD13 LEU 43 HD13 LEU 43 -2.924 4.178 -2.672 391 HD21 LEU 43 HD21 LEU 43 -1.210 1.275 -0.047 392 HD22 LEU 43 HD22 LEU 43 -1.332 0.945 -1.771 393 HD23 LEU 43 HD23 LEU 43 -0.094 2.062 -1.172 394 H ALA 44 H ALA 44 -1.078 6.700 -1.080 395 HA ALA 44 HA ALA 44 0.260 6.414 -3.564 396 HB1 ALA 44 HB1 ALA 44 -0.627 8.877 -2.024 397 HB2 ALA 44 HB2 ALA 44 -0.196 8.848 -3.748 398 HB3 ALA 44 HB3 ALA 44 -1.617 7.942 -3.173 399 H GLU 45 H GLU 45 1.289 8.380 -0.656 400 HA GLU 45 HA GLU 45 3.757 9.247 -1.758 401 HB2 GLU 45 HB2 GLU 45 2.873 8.760 1.110 402 HB3 GLU 45 HB3 GLU 45 4.469 9.400 0.695 403 HG2 GLU 45 HG2 GLU 45 3.362 11.245 -0.594 404 HG3 GLU 45 HG3 GLU 45 1.810 10.723 0.047 405 H TYR 46 H TYR 46 2.992 6.115 -0.239 406 HA TYR 46 HA TYR 46 5.721 5.257 0.062 407 HB2 TYR 46 HB2 TYR 46 3.756 4.337 1.249 408 HB3 TYR 46 HB3 TYR 46 3.142 3.675 -0.252 409 HD1 TYR 46 HD1 TYR 46 6.717 3.205 -0.167 410 HD2 TYR 46 HD2 TYR 46 2.997 1.728 1.457 411 HE1 TYR 46 HE1 TYR 46 7.795 1.041 0.339 412 HE2 TYR 46 HE2 TYR 46 4.082 -0.484 1.903 413 HH TYR 46 HH TYR 46 7.519 -1.089 1.104 414 H ILE 47 H ILE 47 3.300 4.428 -2.470 415 HA ILE 47 HA ILE 47 4.979 3.055 -4.257 416 HB ILE 47 HB ILE 47 2.356 4.537 -4.374 417 HG12 ILE 47 HG12 ILE 47 3.058 1.565 -4.487 418 HG13 ILE 47 HG13 ILE 47 2.580 2.413 -3.027 419 HG21 ILE 47 HG21 ILE 47 3.646 3.026 -6.658 420 HG22 ILE 47 HG22 ILE 47 1.907 3.399 -6.600 421 HG23 ILE 47 HG23 ILE 47 3.076 4.701 -6.658 422 HD11 ILE 47 HD11 ILE 47 0.815 1.838 -5.424 423 HD12 ILE 47 HD12 ILE 47 0.634 1.294 -3.750 424 HD13 ILE 47 HD13 ILE 47 0.396 3.008 -4.154 425 H ALA 48 H ALA 48 4.147 6.542 -3.986 426 HA ALA 48 HA ALA 48 5.401 7.336 -6.454 427 HB1 ALA 48 HB1 ALA 48 4.693 8.900 -3.937 428 HB2 ALA 48 HB2 ALA 48 5.082 9.607 -5.523 429 HB3 ALA 48 HB3 ALA 48 3.623 8.611 -5.326 430 H GLU 49 H GLU 49 6.641 6.879 -3.160 431 HA GLU 49 HA GLU 49 9.252 8.079 -3.807 432 HB2 GLU 49 HB2 GLU 49 8.129 8.275 -1.566 433 HB3 GLU 49 HB3 GLU 49 8.369 6.541 -1.341 434 HG2 GLU 49 HG2 GLU 49 10.093 7.677 -0.153 435 HG3 GLU 49 HG3 GLU 49 10.858 6.925 -1.541 436 H VAL 50 H VAL 50 7.902 4.755 -3.396 437 HA VAL 50 HA VAL 50 10.609 3.687 -4.066 438 HB VAL 50 HB VAL 50 10.249 1.798 -2.934 439 HG11 VAL 50 HG11 VAL 50 8.772 3.815 -1.230 440 HG12 VAL 50 HG12 VAL 50 9.669 2.387 -0.682 441 HG13 VAL 50 HG13 VAL 50 10.532 3.729 -1.449 442 HG21 VAL 50 HG21 VAL 50 8.038 1.091 -3.751 443 HG22 VAL 50 HG22 VAL 50 8.150 0.958 -2.002 444 HG23 VAL 50 HG23 VAL 50 7.256 2.307 -2.727 445 H GLY 51 H GLY 51 7.657 4.142 -5.622 446 HA2 GLY 51 HA2 GLY 51 7.585 4.138 -7.942 447 HA3 GLY 51 HA3 GLY 51 9.022 3.119 -8.014 448 H LEU 52 H LEU 52 6.163 2.245 -6.193 449 HA LEU 52 HA LEU 52 4.944 0.400 -6.081 450 HB2 LEU 52 HB2 LEU 52 4.234 1.743 -8.396 451 HB3 LEU 52 HB3 LEU 52 4.441 0.128 -9.012 452 HG LEU 52 HG LEU 52 2.675 0.864 -6.636 453 HD11 LEU 52 HD11 LEU 52 1.950 0.344 -9.534 454 HD12 LEU 52 HD12 LEU 52 0.793 0.568 -8.197 455 HD13 LEU 52 HD13 LEU 52 1.866 1.890 -8.669 456 HD21 LEU 52 HD21 LEU 52 3.299 -1.458 -6.476 457 HD22 LEU 52 HD22 LEU 52 1.622 -1.351 -7.006 458 HD23 LEU 52 HD23 LEU 52 2.914 -1.731 -8.178 459 H GLN 53 H GLN 53 7.877 -0.020 -6.877 460 HA GLN 53 HA GLN 53 7.724 -2.890 -7.737 461 HB2 GLN 53 HB2 GLN 53 9.680 -2.563 -9.064 462 HB3 GLN 53 HB3 GLN 53 8.490 -1.329 -9.469 463 HG2 GLN 53 HG2 GLN 53 9.815 0.190 -7.780 464 HG3 GLN 53 HG3 GLN 53 11.087 -1.029 -7.923 465 HE21 GLN 53 HE21 GLN 53 10.182 1.422 -11.119 466 HE22 GLN 53 HE22 GLN 53 8.978 1.145 -9.853 467 H ASN 54 H ASN 54 8.499 -1.021 -5.137 468 HA ASN 54 HA ASN 54 10.165 -3.218 -3.964 469 HB2 ASN 54 HB2 ASN 54 10.387 -0.261 -3.344 470 HB3 ASN 54 HB3 ASN 54 11.320 -1.534 -2.585 471 HD21 ASN 54 HD21 ASN 54 12.587 -0.004 -6.095 472 HD22 ASN 54 HD22 ASN 54 11.092 0.574 -5.370 473 H ILE 55 H ILE 55 7.123 -2.079 -3.889 474 HA ILE 55 HA ILE 55 6.737 -1.941 -0.996 475 HB ILE 55 HB ILE 55 4.388 -1.812 -1.375 476 HG12 ILE 55 HG12 ILE 55 4.902 -2.166 -4.361 477 HG13 ILE 55 HG13 ILE 55 4.131 -3.349 -3.296 478 HG21 ILE 55 HG21 ILE 55 5.681 0.045 -3.394 479 HG22 ILE 55 HG22 ILE 55 4.301 0.350 -2.306 480 HG23 ILE 55 HG23 ILE 55 5.913 0.185 -1.642 481 HD11 ILE 55 HD11 ILE 55 3.068 -0.598 -4.012 482 HD12 ILE 55 HD12 ILE 55 2.389 -2.176 -4.443 483 HD13 ILE 55 HD13 ILE 55 2.366 -1.643 -2.748 484 H THR 56 H THR 56 5.604 -3.407 0.328 485 HA THR 56 HA THR 56 5.096 -6.133 -0.730 486 HB THR 56 HB THR 56 5.889 -6.764 1.753 487 HG1 THR 56 HG1 THR 56 7.942 -5.559 1.989 488 HG21 THR 56 HG21 THR 56 7.880 -6.254 -0.503 489 HG22 THR 56 HG22 THR 56 8.093 -7.384 0.858 490 HG23 THR 56 HG23 THR 56 6.845 -7.692 -0.357 491 H ALA 57 H ALA 57 3.342 -7.193 0.232 492 HA ALA 57 HA ALA 57 1.252 -5.582 1.307 493 HB1 ALA 57 HB1 ALA 57 1.637 -8.611 1.276 494 HB2 ALA 57 HB2 ALA 57 0.116 -7.742 1.566 495 HB3 ALA 57 HB3 ALA 57 0.902 -7.640 -0.021 496 H ILE 58 H ILE 58 3.855 -7.349 2.800 497 HA ILE 58 HA ILE 58 2.888 -7.479 5.532 498 HB ILE 58 HB ILE 58 5.607 -7.575 4.154 499 HG12 ILE 58 HG12 ILE 58 5.656 -9.919 5.039 500 HG13 ILE 58 HG13 ILE 58 4.051 -9.705 5.733 501 HG21 ILE 58 HG21 ILE 58 4.991 -7.722 7.135 502 HG22 ILE 58 HG22 ILE 58 6.529 -8.284 6.421 503 HG23 ILE 58 HG23 ILE 58 6.072 -6.583 6.305 504 HD11 ILE 58 HD11 ILE 58 4.657 -9.578 2.747 505 HD12 ILE 58 HD12 ILE 58 4.128 -11.033 3.612 506 HD13 ILE 58 HD13 ILE 58 3.046 -9.642 3.519 507 H THR 59 H THR 59 4.703 -5.114 3.588 508 HA THR 59 HA THR 59 5.157 -3.347 5.890 509 HB THR 59 HB THR 59 5.734 -2.969 2.940 510 HG1 THR 59 HG1 THR 59 7.213 -4.308 3.367 511 HG21 THR 59 HG21 THR 59 6.667 -1.503 5.458 512 HG22 THR 59 HG22 THR 59 7.416 -1.327 3.854 513 HG23 THR 59 HG23 THR 59 5.736 -0.815 4.100 514 H LEU 60 H LEU 60 3.146 -3.322 2.901 515 HA LEU 60 HA LEU 60 1.720 -0.946 3.605 516 HB2 LEU 60 HB2 LEU 60 1.248 -3.228 1.703 517 HB3 LEU 60 HB3 LEU 60 -0.162 -2.312 2.209 518 HG LEU 60 HG LEU 60 2.197 -1.140 0.696 519 HD11 LEU 60 HD11 LEU 60 -0.726 -1.551 -0.009 520 HD12 LEU 60 HD12 LEU 60 0.530 -0.824 -1.038 521 HD13 LEU 60 HD13 LEU 60 0.625 -2.538 -0.605 522 HD21 LEU 60 HD21 LEU 60 1.320 0.533 2.307 523 HD22 LEU 60 HD22 LEU 60 0.913 0.909 0.648 524 HD23 LEU 60 HD23 LEU 60 -0.317 0.175 1.717 525 H SER 61 H SER 61 1.116 -4.341 4.623 526 HA SER 61 HA SER 61 -1.336 -3.808 5.901 527 HB2 SER 61 HB2 SER 61 -1.109 -5.785 7.167 528 HB3 SER 61 HB3 SER 61 -0.523 -6.083 5.541 529 HG SER 61 HG SER 61 0.821 -6.911 7.277 530 H LYS 62 H LYS 62 1.805 -2.921 6.798 531 HA LYS 62 HA LYS 62 0.995 -2.166 9.544 532 HB2 LYS 62 HB2 LYS 62 3.746 -2.587 8.338 533 HB3 LYS 62 HB3 LYS 62 3.467 -1.957 9.971 534 HG2 LYS 62 HG2 LYS 62 2.163 -3.995 10.550 535 HG3 LYS 62 HG3 LYS 62 2.485 -4.658 8.939 536 HD2 LYS 62 HD2 LYS 62 4.927 -4.574 9.403 537 HD3 LYS 62 HD3 LYS 62 4.573 -3.956 11.036 538 HE2 LYS 62 HE2 LYS 62 3.228 -6.012 11.493 539 HE3 LYS 62 HE3 LYS 62 3.626 -6.622 9.883 540 HZ1 LYS 62 HZ1 LYS 62 5.602 -6.068 12.035 541 HZ2 LYS 62 HZ2 LYS 62 5.104 -7.550 11.571 542 HZ3 LYS 62 HZ3 LYS 62 5.977 -6.628 10.546 543 H LYS 63 H LYS 63 2.128 -0.642 6.542 544 HA LYS 63 HA LYS 63 2.665 1.959 7.582 545 HB2 LYS 63 HB2 LYS 63 1.795 0.847 4.896 546 HB3 LYS 63 HB3 LYS 63 2.070 2.572 5.101 547 HG2 LYS 63 HG2 LYS 63 4.221 0.607 5.933 548 HG3 LYS 63 HG3 LYS 63 3.978 0.936 4.221 549 HD2 LYS 63 HD2 LYS 63 4.426 3.144 6.258 550 HD3 LYS 63 HD3 LYS 63 5.749 2.290 5.439 551 HE2 LYS 63 HE2 LYS 63 4.863 2.944 3.243 552 HE3 LYS 63 HE3 LYS 63 3.529 3.817 4.015 553 HZ1 LYS 63 HZ1 LYS 63 6.415 4.467 4.332 554 HZ2 LYS 63 HZ2 LYS 63 5.346 5.329 3.449 555 HZ3 LYS 63 HZ3 LYS 63 5.200 5.266 5.074 556 H LEU 64 H LEU 64 -0.402 0.441 6.754 557 HA LEU 64 HA LEU 64 -1.827 2.935 7.595 558 HB2 LEU 64 HB2 LEU 64 -2.849 1.035 5.473 559 HB3 LEU 64 HB3 LEU 64 -3.476 2.593 5.956 560 HG LEU 64 HG LEU 64 -0.990 3.375 5.194 561 HD11 LEU 64 HD11 LEU 64 -1.674 1.065 3.324 562 HD12 LEU 64 HD12 LEU 64 -0.291 2.184 3.202 563 HD13 LEU 64 HD13 LEU 64 -0.380 0.989 4.511 564 HD21 LEU 64 HD21 LEU 64 -3.077 4.222 4.354 565 HD22 LEU 64 HD22 LEU 64 -1.946 3.919 3.033 566 HD23 LEU 64 HD23 LEU 64 -3.306 2.797 3.315 567 H ASN 65 H ASN 65 -1.174 0.157 8.930 568 HA ASN 65 HA ASN 65 -2.103 -1.309 10.371 569 HB2 ASN 65 HB2 ASN 65 -4.136 0.866 10.982 570 HB3 ASN 65 HB3 ASN 65 -3.577 -0.410 12.051 571 HD21 ASN 65 HD21 ASN 65 -1.487 3.051 11.763 572 HD22 ASN 65 HD22 ASN 65 -2.952 2.775 10.826 573 H ILE 66 H ILE 66 -2.678 -2.420 8.264 574 HA ILE 66 HA ILE 66 -5.581 -3.104 8.124 575 HB ILE 66 HB ILE 66 -4.923 -3.384 5.540 576 HG12 ILE 66 HG12 ILE 66 -3.413 -0.845 6.197 577 HG13 ILE 66 HG13 ILE 66 -2.559 -2.327 5.997 578 HG21 ILE 66 HG21 ILE 66 -5.815 -0.823 6.926 579 HG22 ILE 66 HG22 ILE 66 -6.044 -1.163 5.207 580 HG23 ILE 66 HG23 ILE 66 -6.845 -2.180 6.412 581 HD11 ILE 66 HD11 ILE 66 -4.233 -0.924 3.869 582 HD12 ILE 66 HD12 ILE 66 -2.488 -1.192 3.877 583 HD13 ILE 66 HD13 ILE 66 -3.584 -2.566 3.673 584 H THR 67 H THR 67 -5.847 -5.163 6.651 585 HA THR 67 HA THR 67 -4.114 -7.228 7.820 586 HB THR 67 HB THR 67 -5.547 -8.838 7.146 587 HG1 THR 67 HG1 THR 67 -7.047 -8.549 5.437 588 HG21 THR 67 HG21 THR 67 -7.505 -6.504 7.130 589 HG22 THR 67 HG22 THR 67 -7.831 -8.197 7.550 590 HG23 THR 67 HG23 THR 67 -6.803 -7.214 8.606 591 H VAL 68 H VAL 68 -2.961 -8.842 6.539 592 HA VAL 68 HA VAL 68 -1.374 -7.725 4.387 593 HB VAL 68 HB VAL 68 -1.730 -10.593 5.327 594 HG11 VAL 68 HG11 VAL 68 0.334 -9.452 3.390 595 HG12 VAL 68 HG12 VAL 68 0.395 -11.069 4.117 596 HG13 VAL 68 HG13 VAL 68 -0.907 -10.665 2.997 597 HG21 VAL 68 HG21 VAL 68 -0.653 -9.050 6.974 598 HG22 VAL 68 HG22 VAL 68 0.491 -10.243 6.352 599 HG23 VAL 68 HG23 VAL 68 0.536 -8.581 5.735 600 H GLU 69 H GLU 69 -4.542 -9.299 4.373 601 HA GLU 69 HA GLU 69 -4.331 -10.071 1.520 602 HB2 GLU 69 HB2 GLU 69 -6.662 -10.124 3.482 603 HB3 GLU 69 HB3 GLU 69 -6.718 -10.690 1.807 604 HG2 GLU 69 HG2 GLU 69 -4.922 -12.343 2.311 605 HG3 GLU 69 HG3 GLU 69 -4.923 -11.824 3.998 606 H LYS 70 H LYS 70 -5.775 -7.573 3.573 607 HA LYS 70 HA LYS 70 -7.154 -6.145 1.552 608 HB2 LYS 70 HB2 LYS 70 -7.429 -6.105 4.074 609 HB3 LYS 70 HB3 LYS 70 -5.998 -5.094 4.179 610 HG2 LYS 70 HG2 LYS 70 -8.586 -4.426 2.725 611 HG3 LYS 70 HG3 LYS 70 -8.155 -3.939 4.370 612 HD2 LYS 70 HD2 LYS 70 -6.124 -2.754 3.317 613 HD3 LYS 70 HD3 LYS 70 -6.965 -2.932 1.771 614 HE2 LYS 70 HE2 LYS 70 -8.190 -1.659 4.265 615 HE3 LYS 70 HE3 LYS 70 -7.341 -0.739 3.013 616 HZ1 LYS 70 HZ1 LYS 70 -9.786 -2.352 2.513 617 HZ2 LYS 70 HZ2 LYS 70 -9.729 -0.720 2.641 618 HZ3 LYS 70 HZ3 LYS 70 -8.963 -1.447 1.409 619 H ALA 71 H ALA 71 -3.995 -5.648 3.034 620 HA ALA 71 HA ALA 71 -2.945 -3.578 1.409 621 HB1 ALA 71 HB1 ALA 71 -1.604 -5.910 2.861 622 HB2 ALA 71 HB2 ALA 71 -0.752 -4.508 2.218 623 HB3 ALA 71 HB3 ALA 71 -1.937 -4.297 3.525 624 H LYS 72 H LYS 72 -2.852 -7.158 0.873 625 HA LYS 72 HA LYS 72 -1.103 -6.959 -1.407 626 HB2 LYS 72 HB2 LYS 72 -1.170 -8.916 0.112 627 HB3 LYS 72 HB3 LYS 72 -2.849 -9.232 -0.323 628 HG2 LYS 72 HG2 LYS 72 -2.235 -9.851 -2.550 629 HG3 LYS 72 HG3 LYS 72 -0.567 -9.292 -2.332 630 HD2 LYS 72 HD2 LYS 72 -1.803 -11.518 -0.643 631 HD3 LYS 72 HD3 LYS 72 -0.991 -11.824 -2.192 632 HE2 LYS 72 HE2 LYS 72 1.074 -10.729 -1.294 633 HE3 LYS 72 HE3 LYS 72 0.268 -10.534 0.270 634 HZ1 LYS 72 HZ1 LYS 72 0.816 -13.139 -1.060 635 HZ2 LYS 72 HZ2 LYS 72 1.632 -12.547 0.219 636 HZ3 LYS 72 HZ3 LYS 72 0.064 -12.970 0.381 637 H ASN 73 H ASN 73 -4.619 -7.032 -1.008 638 HA ASN 73 HA ASN 73 -5.373 -7.637 -3.583 639 HB2 ASN 73 HB2 ASN 73 -7.422 -7.042 -2.876 640 HB3 ASN 73 HB3 ASN 73 -6.698 -6.602 -1.342 641 HD21 ASN 73 HD21 ASN 73 -7.243 -3.122 -1.895 642 HD22 ASN 73 HD22 ASN 73 -6.626 -4.342 -0.799 643 H TYR 74 H TYR 74 -4.242 -4.480 -2.399 644 HA TYR 74 HA TYR 74 -4.639 -3.002 -4.775 645 HB2 TYR 74 HB2 TYR 74 -2.575 -2.613 -2.577 646 HB3 TYR 74 HB3 TYR 74 -3.081 -1.388 -3.735 647 HD1 TYR 74 HD1 TYR 74 -5.969 -1.370 -3.791 648 HD2 TYR 74 HD2 TYR 74 -3.334 -2.173 -0.446 649 HE1 TYR 74 HE1 TYR 74 -7.668 -0.459 -2.227 650 HE2 TYR 74 HE2 TYR 74 -5.051 -1.243 1.105 651 HH TYR 74 HH TYR 74 -8.146 0.119 -0.041 652 H ILE 75 H ILE 75 -1.824 -4.875 -3.626 653 HA ILE 75 HA ILE 75 -0.046 -4.070 -5.747 654 HB ILE 75 HB ILE 75 0.154 -6.547 -3.990 655 HG12 ILE 75 HG12 ILE 75 1.035 -3.696 -3.343 656 HG13 ILE 75 HG13 ILE 75 -0.249 -4.584 -2.542 657 HG21 ILE 75 HG21 ILE 75 2.308 -4.828 -5.312 658 HG22 ILE 75 HG22 ILE 75 2.587 -6.290 -4.340 659 HG23 ILE 75 HG23 ILE 75 1.776 -6.423 -5.884 660 HD11 ILE 75 HD11 ILE 75 2.701 -5.186 -2.367 661 HD12 ILE 75 HD12 ILE 75 1.582 -4.678 -1.091 662 HD13 ILE 75 HD13 ILE 75 1.414 -6.292 -1.810 663 H LYS 76 H LYS 76 -2.484 -6.643 -5.439 664 HA LYS 76 HA LYS 76 -1.602 -8.150 -7.785 665 HB2 LYS 76 HB2 LYS 76 -4.138 -8.181 -6.151 666 HB3 LYS 76 HB3 LYS 76 -3.701 -9.335 -7.429 667 HG2 LYS 76 HG2 LYS 76 -1.887 -8.965 -5.036 668 HG3 LYS 76 HG3 LYS 76 -3.335 -9.949 -4.907 669 HD2 LYS 76 HD2 LYS 76 -1.174 -10.424 -7.005 670 HD3 LYS 76 HD3 LYS 76 -1.180 -11.169 -5.399 671 HE2 LYS 76 HE2 LYS 76 -3.440 -12.136 -5.864 672 HE3 LYS 76 HE3 LYS 76 -3.364 -11.487 -7.507 673 HZ1 LYS 76 HZ1 LYS 76 -1.459 -13.464 -6.361 674 HZ2 LYS 76 HZ2 LYS 76 -2.637 -13.803 -7.437 675 HZ3 LYS 76 HZ3 LYS 76 -1.378 -12.864 -7.879 676 H ASN 77 H ASN 77 -3.990 -5.533 -7.259 677 HA ASN 77 HA ASN 77 -4.847 -5.859 -10.093 678 HB2 ASN 77 HB2 ASN 77 -6.705 -4.355 -9.464 679 HB3 ASN 77 HB3 ASN 77 -6.694 -5.921 -8.651 680 HD21 ASN 77 HD21 ASN 77 -7.264 -4.305 -5.608 681 HD22 ASN 77 HD22 ASN 77 -7.828 -5.464 -6.801 682 H SER 78 H SER 78 -3.530 -3.382 -7.887 683 HA SER 78 HA SER 78 -3.163 -1.641 -10.235 684 HB2 SER 78 HB2 SER 78 -4.543 -0.900 -8.288 685 HB3 SER 78 HB3 SER 78 -3.062 -0.858 -7.312 686 HG SER 78 HG SER 78 -3.733 1.157 -8.387 687 H ASN 79 H ASN 79 -1.226 -2.592 -11.051 688 HA ASN 79 HA ASN 79 1.215 -1.983 -9.454 689 HB2 ASN 79 HB2 ASN 79 2.143 -4.209 -10.058 690 HB3 ASN 79 HB3 ASN 79 0.769 -4.220 -8.965 691 HD21 ASN 79 HD21 ASN 79 -0.705 -6.714 -10.902 692 HD22 ASN 79 HD22 ASN 79 -0.092 -6.190 -9.332 693 H ARG 80 H ARG 80 0.207 -2.757 -12.832 694 HA ARG 80 HA ARG 80 2.530 -1.160 -13.807 695 HB2 ARG 80 HB2 ARG 80 0.571 -3.060 -15.034 696 HB3 ARG 80 HB3 ARG 80 1.061 -1.707 -16.044 697 HG2 ARG 80 HG2 ARG 80 2.532 -3.551 -16.481 698 HG3 ARG 80 HG3 ARG 80 3.436 -2.245 -15.716 699 HD2 ARG 80 HD2 ARG 80 3.252 -3.466 -13.521 700 HD3 ARG 80 HD3 ARG 80 2.465 -4.803 -14.355 701 HE ARG 80 HE ARG 80 5.305 -4.074 -14.360 702 HH11 ARG 80 HH11 ARG 80 6.802 -5.344 -15.376 703 HH12 ARG 80 HH12 ARG 80 6.288 -6.582 -16.482 704 HH21 ARG 80 HH21 ARG 80 2.937 -5.946 -16.148 705 HH22 ARG 80 HH22 ARG 80 4.164 -6.917 -16.915 706 H LEU 81 H LEU 81 -0.749 -0.551 -12.999 707 HA LEU 81 HA LEU 81 -1.237 1.705 -14.676 708 HB2 LEU 81 HB2 LEU 81 -2.883 0.308 -13.448 709 HB3 LEU 81 HB3 LEU 81 -2.402 1.053 -11.930 710 HG LEU 81 HG LEU 81 -3.411 2.725 -14.272 711 HD11 LEU 81 HD11 LEU 81 -5.098 1.367 -12.128 712 HD12 LEU 81 HD12 LEU 81 -5.683 2.543 -13.329 713 HD13 LEU 81 HD13 LEU 81 -5.085 0.967 -13.861 714 HD21 LEU 81 HD21 LEU 81 -2.499 4.037 -12.381 715 HD22 LEU 81 HD22 LEU 81 -4.245 4.211 -12.448 716 HD23 LEU 81 HD23 LEU 81 -3.516 3.130 -11.242 717 H GLY 82 H GLY 82 0.247 1.507 -11.402 718 HA2 GLY 82 HA2 GLY 82 0.667 4.437 -11.365 719 HA3 GLY 82 HA3 GLY 82 0.947 3.314 -10.045 720 H ARG 83 H ARG 83 2.252 2.613 -13.248 721 HA ARG 83 HA ARG 83 5.017 2.999 -12.156 722 HB2 ARG 83 HB2 ARG 83 4.038 0.642 -12.610 723 HB3 ARG 83 HB3 ARG 83 4.356 0.995 -14.310 724 HG2 ARG 83 HG2 ARG 83 6.756 1.515 -13.666 725 HG3 ARG 83 HG3 ARG 83 6.351 1.068 -11.995 726 HD2 ARG 83 HD2 ARG 83 5.616 -1.184 -12.839 727 HD3 ARG 83 HD3 ARG 83 6.230 -0.758 -14.438 728 HE ARG 83 HE ARG 83 7.745 -1.563 -12.078 729 HH11 ARG 83 HH11 ARG 83 9.941 -1.846 -12.180 730 HH12 ARG 83 HH12 ARG 83 10.846 -1.160 -13.492 731 HH21 ARG 83 HH21 ARG 83 8.140 0.195 -15.093 732 HH22 ARG 83 HH22 ARG 83 9.864 -0.042 -15.098 733 H THR 84 H THR 84 3.720 2.661 -15.459 734 HA THR 84 HA THR 84 4.272 5.385 -16.189 735 HB THR 84 HB THR 84 6.558 4.885 -16.241 736 HG1 THR 84 HG1 THR 84 7.027 5.141 -18.402 737 HG21 THR 84 HG21 THR 84 6.015 2.380 -17.881 738 HG22 THR 84 HG22 THR 84 7.609 3.053 -17.482 739 HG23 THR 84 HG23 THR 84 6.570 2.439 -16.189 740 H ASN 85 H ASN 85 2.857 5.884 -17.694 741 HA ASN 85 HA ASN 85 1.992 3.982 -19.792 742 HB2 ASN 85 HB2 ASN 85 0.117 5.257 -17.744 743 HB3 ASN 85 HB3 ASN 85 -0.422 4.482 -19.230 744 HD21 ASN 85 HD21 ASN 85 0.703 2.157 -16.074 745 HD22 ASN 85 HD22 ASN 85 0.676 3.909 -15.963 746 H ASN 86 H ASN 86 0.653 5.027 -21.447 747 HA ASN 86 HA ASN 86 0.469 6.524 -23.115 748 HB2 ASN 86 HB2 ASN 86 -1.073 7.339 -21.204 749 HB3 ASN 86 HB3 ASN 86 0.060 8.674 -21.025 750 HD21 ASN 86 HD21 ASN 86 -0.911 10.133 -24.218 751 HD22 ASN 86 HD22 ASN 86 0.525 9.852 -23.223 752 H LEU 87 H LEU 87 3.123 5.975 -22.585 753 HA LEU 87 HA LEU 87 4.479 8.358 -23.665 754 HB2 LEU 87 HB2 LEU 87 4.523 8.284 -21.024 755 HB3 LEU 87 HB3 LEU 87 5.595 6.909 -21.215 756 HG LEU 87 HG LEU 87 7.129 8.491 -22.585 757 HD11 LEU 87 HD11 LEU 87 5.350 10.601 -21.283 758 HD12 LEU 87 HD12 LEU 87 6.837 10.891 -22.216 759 HD13 LEU 87 HD13 LEU 87 5.397 10.247 -23.016 760 HD21 LEU 87 HD21 LEU 87 7.612 7.850 -20.259 761 HD22 LEU 87 HD22 LEU 87 8.063 9.536 -20.565 762 HD23 LEU 87 HD23 LEU 87 6.572 9.162 -19.667 763 H LYS 88 H LYS 88 3.748 6.162 -25.007 764 HA LYS 88 HA LYS 88 5.998 4.265 -25.266 765 HB2 LYS 88 HB2 LYS 88 3.539 3.620 -25.294 766 HB3 LYS 88 HB3 LYS 88 3.371 4.505 -26.806 767 HG2 LYS 88 HG2 LYS 88 3.536 2.160 -27.250 768 HG3 LYS 88 HG3 LYS 88 4.983 2.943 -27.887 769 HD2 LYS 88 HD2 LYS 88 6.294 2.143 -25.947 770 HD3 LYS 88 HD3 LYS 88 4.819 1.484 -25.202 771 HE2 LYS 88 HE2 LYS 88 4.539 -0.035 -27.160 772 HE3 LYS 88 HE3 LYS 88 6.031 0.603 -27.861 773 HZ1 LYS 88 HZ1 LYS 88 5.843 -0.831 -25.262 774 HZ2 LYS 88 HZ2 LYS 88 6.436 -1.460 -26.644 775 HZ3 LYS 88 HZ3 LYS 88 7.226 -0.241 -25.904 776 H THR 89 H THR 89 4.777 7.147 -26.766 777 HA THR 89 HA THR 89 7.108 7.538 -28.330 778 HB THR 89 HB THR 89 5.974 6.044 -29.904 779 HG1 THR 89 HG1 THR 89 5.995 7.454 -31.643 780 HG21 THR 89 HG21 THR 89 3.698 8.058 -30.075 781 HG22 THR 89 HG22 THR 89 3.839 6.483 -30.892 782 HG23 THR 89 HG23 THR 89 3.597 6.559 -29.135 783 H ILE 90 H ILE 90 7.457 9.647 -28.205 784 HA ILE 90 HA ILE 90 5.243 11.611 -28.272 785 HB ILE 90 HB ILE 90 6.548 12.817 -26.430 786 HG12 ILE 90 HG12 ILE 90 8.583 11.478 -26.344 787 HG13 ILE 90 HG13 ILE 90 7.793 11.765 -24.812 788 HG21 ILE 90 HG21 ILE 90 4.978 10.364 -25.623 789 HG22 ILE 90 HG22 ILE 90 5.245 11.846 -24.675 790 HG23 ILE 90 HG23 ILE 90 4.303 11.908 -26.167 791 HD11 ILE 90 HD11 ILE 90 7.992 9.120 -26.283 792 HD12 ILE 90 HD12 ILE 90 8.637 9.573 -24.710 793 HD13 ILE 90 HD13 ILE 90 6.891 9.378 -24.910 794 H GLY 91 H GLY 91 7.896 10.803 -29.929 795 HA2 GLY 91 HA2 GLY 91 9.449 11.933 -31.220 796 HA3 GLY 91 HA3 GLY 91 8.506 13.409 -30.982 797 H ILE 92 H ILE 92 9.491 11.979 -28.060 798 HA ILE 92 HA ILE 92 10.796 12.637 -26.364 799 HB ILE 92 HB ILE 92 13.081 12.561 -28.347 800 HG12 ILE 92 HG12 ILE 92 13.099 10.057 -27.388 801 HG13 ILE 92 HG13 ILE 92 11.374 10.321 -27.189 802 HG21 ILE 92 HG21 ILE 92 12.877 11.815 -25.385 803 HG22 ILE 92 HG22 ILE 92 14.323 11.648 -26.406 804 HG23 ILE 92 HG23 ILE 92 13.713 13.241 -26.026 805 HD11 ILE 92 HD11 ILE 92 12.912 10.626 -29.813 806 HD12 ILE 92 HD12 ILE 92 12.064 9.156 -29.300 807 HD13 ILE 92 HD13 ILE 92 11.144 10.624 -29.624 808 H LEU 93 H LEU 93 9.392 14.728 -27.254 809 HA LEU 93 HA LEU 93 9.136 16.949 -27.263 810 HB2 LEU 93 HB2 LEU 93 10.236 16.119 -24.869 811 HB3 LEU 93 HB3 LEU 93 11.288 17.447 -25.270 812 HG LEU 93 HG LEU 93 9.528 18.179 -23.812 813 HD11 LEU 93 HD11 LEU 93 8.860 19.256 -26.578 814 HD12 LEU 93 HD12 LEU 93 8.485 20.014 -25.017 815 HD13 LEU 93 HD13 LEU 93 10.171 19.829 -25.521 816 HD21 LEU 93 HD21 LEU 93 7.864 16.426 -24.351 817 HD22 LEU 93 HD22 LEU 93 7.164 18.051 -24.300 818 HD23 LEU 93 HD23 LEU 93 7.469 17.271 -25.863 819 H GLN 94 H GLN 94 11.018 16.063 -29.285 820 HA GLN 94 HA GLN 94 12.618 18.551 -29.769 821 HB2 GLN 94 HB2 GLN 94 13.418 15.630 -29.793 822 HB3 GLN 94 HB3 GLN 94 14.283 16.814 -30.790 823 HG2 GLN 94 HG2 GLN 94 14.948 18.112 -28.892 824 HG3 GLN 94 HG3 GLN 94 13.883 17.220 -27.805 825 HE21 GLN 94 HE21 GLN 94 16.038 14.381 -27.497 826 HE22 GLN 94 HE22 GLN 94 14.356 14.931 -27.390 827 H GLU 95 H GLU 95 10.714 19.168 -30.963 828 HA GLU 95 HA GLU 95 10.619 17.992 -33.723 829 HB2 GLU 95 HB2 GLU 95 8.562 18.086 -31.832 830 HB3 GLU 95 HB3 GLU 95 8.208 19.462 -32.859 831 HG2 GLU 95 HG2 GLU 95 8.667 16.593 -33.793 832 HG3 GLU 95 HG3 GLU 95 7.096 17.336 -33.535 833 H GLU 96 H GLU 96 10.035 21.083 -31.950 834 HA GLU 96 HA GLU 96 11.272 22.567 -34.217 835 HB2 GLU 96 HB2 GLU 96 8.705 23.362 -32.777 836 HB3 GLU 96 HB3 GLU 96 9.554 24.326 -33.995 837 HG2 GLU 96 HG2 GLU 96 9.187 22.493 -35.659 838 HG3 GLU 96 HG3 GLU 96 8.200 21.645 -34.462 839 H VAL 97 H VAL 97 12.730 21.790 -32.149 840 HA VAL 97 HA VAL 97 13.511 24.318 -30.881 841 HB VAL 97 HB VAL 97 11.826 23.512 -29.359 842 HG11 VAL 97 HG11 VAL 97 13.354 20.891 -29.142 843 HG12 VAL 97 HG12 VAL 97 11.927 21.368 -28.201 844 HG13 VAL 97 HG13 VAL 97 11.785 21.128 -29.947 845 HG21 VAL 97 HG21 VAL 97 13.847 24.540 -28.358 846 HG22 VAL 97 HG22 VAL 97 13.019 23.403 -27.282 847 HG23 VAL 97 HG23 VAL 97 14.515 22.910 -28.090 848 H SER 98 H SER 98 15.643 24.393 -30.238 849 HA SER 98 HA SER 98 17.860 24.012 -30.451 850 HB2 SER 98 HB2 SER 98 17.082 21.318 -29.306 851 HB3 SER 98 HB3 SER 98 18.705 22.035 -29.275 852 HG SER 98 HG SER 98 17.568 22.445 -27.334 853 H SER 99 H SER 99 16.476 23.446 -32.922 854 HA SER 99 HA SER 99 18.638 22.048 -34.359 855 HB2 SER 99 HB2 SER 99 17.135 20.199 -33.705 856 HB3 SER 99 HB3 SER 99 15.768 21.023 -34.477 857 HG SER 99 HG SER 99 16.785 19.417 -35.819 858 H MET 100 H MET 100 15.315 23.376 -34.738 859 HA MET 100 HA MET 100 16.258 25.103 -36.991 860 HB2 MET 100 HB2 MET 100 13.703 23.460 -36.867 861 HB3 MET 100 HB3 MET 100 14.050 24.720 -38.065 862 HG2 MET 100 HG2 MET 100 16.064 23.479 -38.792 863 HG3 MET 100 HG3 MET 100 15.671 22.176 -37.671 864 HE1 MET 100 HE1 MET 100 12.561 21.692 -37.899 865 HE2 MET 100 HE2 MET 100 12.541 20.493 -39.208 866 HE3 MET 100 HE3 MET 100 13.812 20.427 -37.967 867 H GLU 101 H GLU 101 16.546 26.482 -35.056 868 HA GLU 101 HA GLU 101 14.165 27.696 -33.851 869 HB2 GLU 101 HB2 GLU 101 16.311 27.358 -32.630 870 HB3 GLU 101 HB3 GLU 101 17.094 28.510 -33.705 871 HG2 GLU 101 HG2 GLU 101 16.545 29.601 -31.624 872 HG3 GLU 101 HG3 GLU 101 15.544 30.300 -32.885 873 H ALA 102 H ALA 102 13.179 28.129 -35.914 874 HA ALA 102 HA ALA 102 12.519 29.291 -37.713 875 HB1 ALA 102 HB1 ALA 102 13.947 31.696 -36.527 876 HB2 ALA 102 HB2 ALA 102 12.609 31.700 -37.695 877 HB3 ALA 102 HB3 ALA 102 12.333 31.126 -36.046 878 H LYS 103 H LYS 103 13.572 31.132 -39.419 879 HA LYS 103 HA LYS 103 16.191 30.084 -40.397 880 HB2 LYS 103 HB2 LYS 103 13.623 30.308 -42.031 881 HB3 LYS 103 HB3 LYS 103 15.235 30.133 -42.732 882 HG2 LYS 103 HG2 LYS 103 15.529 27.974 -41.521 883 HG3 LYS 103 HG3 LYS 103 13.866 28.110 -40.908 884 HD2 LYS 103 HD2 LYS 103 12.996 28.126 -43.222 885 HD3 LYS 103 HD3 LYS 103 14.654 28.035 -43.857 886 HE2 LYS 103 HE2 LYS 103 14.976 25.863 -42.686 887 HE3 LYS 103 HE3 LYS 103 13.317 25.946 -42.078 888 HZ1 LYS 103 HZ1 LYS 103 14.072 25.824 -44.953 889 HZ2 LYS 103 HZ2 LYS 103 13.463 24.583 -44.087 890 HZ3 LYS 103 HZ3 LYS 103 12.538 25.894 -44.389 891 H SER 104 H SER 104 17.383 31.481 -41.646 892 HA SER 104 HA SER 104 16.618 34.365 -41.607 893 HB2 SER 104 HB2 SER 104 18.825 33.733 -40.671 894 HB3 SER 104 HB3 SER 104 19.298 33.099 -42.263 895 HG SER 104 HG SER 104 19.964 35.293 -41.915 896 H MET 105 H MET 105 16.155 35.448 -43.443 897 HA MET 105 HA MET 105 16.783 34.477 -46.118 898 HB2 MET 105 HB2 MET 105 14.468 34.245 -46.885 899 HB3 MET 105 HB3 MET 105 14.828 33.073 -45.617 900 HG2 MET 105 HG2 MET 105 13.688 34.612 -43.966 901 HG3 MET 105 HG3 MET 105 13.292 35.680 -45.313 902 HE1 MET 105 HE1 MET 105 12.564 32.359 -43.431 903 HE2 MET 105 HE2 MET 105 11.432 31.507 -44.504 904 HE3 MET 105 HE3 MET 105 13.139 31.656 -44.962 905 H THR 106 H THR 106 15.767 35.881 -47.805 906 HA THR 106 HA THR 106 14.674 38.455 -46.966 907 HB THR 106 HB THR 106 17.071 38.943 -47.048 908 HG1 THR 106 HG1 THR 106 16.893 40.706 -48.393 909 HG21 THR 106 HG21 THR 106 16.929 38.218 -50.007 910 HG22 THR 106 HG22 THR 106 18.313 38.949 -49.161 911 HG23 THR 106 HG23 THR 106 17.800 37.303 -48.757 912 H TRP 107 H TRP 107 13.781 39.638 -48.722 913 HA TRP 107 HA TRP 107 12.466 37.778 -50.655 914 HB2 TRP 107 HB2 TRP 107 11.212 38.450 -48.544 915 HB3 TRP 107 HB3 TRP 107 11.104 40.068 -49.218 916 HD1 TRP 107 HD1 TRP 107 9.617 40.296 -51.503 917 HE1 TRP 107 HE1 TRP 107 7.596 38.947 -52.346 918 HE3 TRP 107 HE3 TRP 107 10.185 36.110 -48.608 919 HZ2 TRP 107 HZ2 TRP 107 6.377 36.381 -51.816 920 HZ3 TRP 107 HZ3 TRP 107 8.571 34.225 -48.794 921 HH2 TRP 107 HH2 TRP 107 6.668 34.350 -50.390 Start of MODEL 18 1 H1 GLY -5 H1 GLY -5 -7.228 -17.782 -33.721 2 H2 GLY -5 H2 GLY -5 -8.102 -18.308 -32.440 3 H3 GLY -5 H3 GLY -5 -8.509 -18.777 -33.957 4 HA2 GLY -5 HA2 GLY -5 -7.403 -20.578 -32.802 5 HA3 GLY -5 HA3 GLY -5 -6.475 -20.021 -34.207 6 H SER -4 H SER -4 -5.615 -21.357 -31.664 7 HA SER -4 HA SER -4 -3.372 -19.555 -30.979 8 HB2 SER -4 HB2 SER -4 -3.710 -19.905 -28.560 9 HB3 SER -4 HB3 SER -4 -5.033 -18.995 -29.302 10 HG SER -4 HG SER -4 -5.813 -20.622 -27.894 11 H HIS -3 H HIS -3 -1.647 -20.592 -29.857 12 HA HIS -3 HA HIS -3 -1.470 -23.571 -30.148 13 HB2 HIS -3 HB2 HIS -3 0.541 -21.400 -30.791 14 HB3 HIS -3 HB3 HIS -3 1.081 -22.994 -30.295 15 HD2 HIS -3 HD2 HIS -3 -1.656 -21.911 -32.883 16 HE1 HIS -3 HE1 HIS -3 0.876 -24.793 -34.742 17 HE2 HIS -3 HE2 HIS -3 -1.170 -23.310 -35.065 18 H MET -2 H MET -2 0.034 -24.582 -28.683 19 HA MET -2 HA MET -2 0.432 -25.267 -26.553 20 HB2 MET -2 HB2 MET -2 2.299 -23.693 -27.054 21 HB3 MET -2 HB3 MET -2 1.463 -22.432 -26.142 22 HG2 MET -2 HG2 MET -2 1.623 -23.711 -24.098 23 HG3 MET -2 HG3 MET -2 2.142 -25.147 -24.959 24 HE1 MET -2 HE1 MET -2 4.518 -24.209 -26.887 25 HE2 MET -2 HE2 MET -2 5.887 -24.402 -25.778 26 HE3 MET -2 HE3 MET -2 4.576 -25.601 -25.780 27 H ALA -1 H ALA -1 -2.069 -25.125 -26.739 28 HA ALA -1 HA ALA -1 -3.064 -24.267 -24.111 29 HB1 ALA -1 HB1 ALA -1 -4.212 -23.238 -26.751 30 HB2 ALA -1 HB2 ALA -1 -4.881 -22.917 -25.132 31 HB3 ALA -1 HB3 ALA -1 -3.287 -22.271 -25.580 32 H SER 0 H SER 0 -5.381 -24.810 -23.861 33 HA SER 0 HA SER 0 -5.929 -27.563 -24.903 34 HB2 SER 0 HB2 SER 0 -6.125 -26.353 -22.137 35 HB3 SER 0 HB3 SER 0 -6.910 -27.892 -22.576 36 HG SER 0 HG SER 0 -4.803 -28.188 -21.666 37 H MET 1 H MET 1 -8.050 -28.244 -25.033 38 HA MET 1 HA MET 1 -10.151 -26.123 -25.246 39 HB2 MET 1 HB2 MET 1 -9.919 -28.803 -26.665 40 HB3 MET 1 HB3 MET 1 -11.271 -27.685 -26.815 41 HG2 MET 1 HG2 MET 1 -8.389 -27.117 -27.613 42 HG3 MET 1 HG3 MET 1 -9.692 -27.534 -28.712 43 HE1 MET 1 HE1 MET 1 -12.201 -25.810 -27.871 44 HE2 MET 1 HE2 MET 1 -11.911 -24.358 -28.849 45 HE3 MET 1 HE3 MET 1 -11.566 -25.963 -29.526 46 H ASP 2 H ASP 2 -12.131 -26.426 -24.330 47 HA ASP 2 HA ASP 2 -12.543 -28.775 -22.511 48 HB2 ASP 2 HB2 ASP 2 -13.233 -25.862 -22.075 49 HB3 ASP 2 HB3 ASP 2 -13.860 -27.196 -21.105 50 HA PRO 3 HA PRO 3 -16.198 -28.825 -25.242 51 HB2 PRO 3 HB2 PRO 3 -16.453 -31.493 -25.641 52 HB3 PRO 3 HB3 PRO 3 -15.116 -30.561 -26.382 53 HG2 PRO 3 HG2 PRO 3 -15.048 -32.209 -23.835 54 HG3 PRO 3 HG3 PRO 3 -13.897 -32.246 -25.205 55 HD2 PRO 3 HD2 PRO 3 -13.483 -30.768 -22.912 56 HD3 PRO 3 HD3 PRO 3 -12.859 -30.273 -24.513 57 H LEU 4 H LEU 4 -15.947 -29.367 -22.053 58 HA LEU 4 HA LEU 4 -18.679 -30.492 -21.726 59 HB2 LEU 4 HB2 LEU 4 -16.314 -30.567 -19.821 60 HB3 LEU 4 HB3 LEU 4 -17.897 -31.272 -19.520 61 HG LEU 4 HG LEU 4 -15.967 -32.176 -21.679 62 HD11 LEU 4 HD11 LEU 4 -16.855 -33.491 -19.081 63 HD12 LEU 4 HD12 LEU 4 -15.757 -34.188 -20.293 64 HD13 LEU 4 HD13 LEU 4 -15.268 -32.749 -19.385 65 HD21 LEU 4 HD21 LEU 4 -18.274 -32.579 -22.424 66 HD22 LEU 4 HD22 LEU 4 -17.525 -34.100 -21.936 67 HD23 LEU 4 HD23 LEU 4 -18.680 -33.299 -20.847 68 H ASP 5 H ASP 5 -18.456 -27.755 -22.283 69 HA ASP 5 HA ASP 5 -19.396 -26.529 -19.719 70 HB2 ASP 5 HB2 ASP 5 -18.129 -25.416 -22.224 71 HB3 ASP 5 HB3 ASP 5 -19.091 -24.372 -21.195 72 H LYS 6 H LYS 6 -20.835 -28.050 -22.140 73 HA LYS 6 HA LYS 6 -23.098 -26.086 -22.433 74 HB2 LYS 6 HB2 LYS 6 -22.638 -28.230 -24.494 75 HB3 LYS 6 HB3 LYS 6 -23.448 -26.689 -24.618 76 HG2 LYS 6 HG2 LYS 6 -21.583 -26.060 -25.716 77 HG3 LYS 6 HG3 LYS 6 -20.945 -25.791 -24.097 78 HD2 LYS 6 HD2 LYS 6 -19.289 -26.997 -25.343 79 HD3 LYS 6 HD3 LYS 6 -19.975 -28.137 -24.174 80 HE2 LYS 6 HE2 LYS 6 -21.431 -29.088 -25.948 81 HE3 LYS 6 HE3 LYS 6 -20.798 -27.917 -27.110 82 HZ1 LYS 6 HZ1 LYS 6 -19.118 -29.929 -25.704 83 HZ2 LYS 6 HZ2 LYS 6 -19.702 -30.123 -27.227 84 HZ3 LYS 6 HZ3 LYS 6 -18.632 -28.933 -26.912 85 H ILE 7 H ILE 7 -22.531 -29.554 -22.591 86 HA ILE 7 HA ILE 7 -25.232 -30.126 -21.447 87 HB ILE 7 HB ILE 7 -25.355 -32.058 -23.039 88 HG12 ILE 7 HG12 ILE 7 -24.102 -31.955 -25.152 89 HG13 ILE 7 HG13 ILE 7 -23.084 -30.662 -24.531 90 HG21 ILE 7 HG21 ILE 7 -25.230 -29.317 -24.351 91 HG22 ILE 7 HG22 ILE 7 -26.167 -30.725 -24.884 92 HG23 ILE 7 HG23 ILE 7 -26.571 -29.929 -23.359 93 HD11 ILE 7 HD11 ILE 7 -23.203 -33.476 -23.363 94 HD12 ILE 7 HD12 ILE 7 -22.002 -32.910 -24.539 95 HD13 ILE 7 HD13 ILE 7 -22.047 -32.188 -22.927 96 H ILE 8 H ILE 8 -22.290 -30.200 -20.471 97 HA ILE 8 HA ILE 8 -21.298 -32.645 -19.906 98 HB ILE 8 HB ILE 8 -20.243 -30.622 -19.219 99 HG12 ILE 8 HG12 ILE 8 -20.612 -32.586 -16.918 100 HG13 ILE 8 HG13 ILE 8 -19.465 -32.709 -18.253 101 HG21 ILE 8 HG21 ILE 8 -22.082 -30.400 -16.809 102 HG22 ILE 8 HG22 ILE 8 -20.802 -29.283 -17.312 103 HG23 ILE 8 HG23 ILE 8 -22.265 -29.422 -18.279 104 HD11 ILE 8 HD11 ILE 8 -19.443 -30.690 -15.971 105 HD12 ILE 8 HD12 ILE 8 -18.296 -32.000 -16.275 106 HD13 ILE 8 HD13 ILE 8 -18.349 -30.607 -17.370 107 H ASN 9 H ASN 9 -21.848 -34.467 -19.002 108 HA ASN 9 HA ASN 9 -23.077 -34.556 -16.375 109 HB2 ASN 9 HB2 ASN 9 -25.111 -34.677 -17.813 110 HB3 ASN 9 HB3 ASN 9 -24.404 -36.031 -18.695 111 HD21 ASN 9 HD21 ASN 9 -26.146 -38.102 -16.443 112 HD22 ASN 9 HD22 ASN 9 -25.938 -37.577 -18.118 113 H ASP 10 H ASP 10 -22.258 -36.245 -15.210 114 HA ASP 10 HA ASP 10 -21.351 -38.704 -16.429 115 HB2 ASP 10 HB2 ASP 10 -19.362 -37.186 -16.678 116 HB3 ASP 10 HB3 ASP 10 -19.336 -37.018 -14.907 117 H ILE 11 H ILE 11 -23.300 -38.862 -15.199 118 HA ILE 11 HA ILE 11 -24.686 -39.171 -13.564 119 HB ILE 11 HB ILE 11 -22.319 -40.437 -12.229 120 HG12 ILE 11 HG12 ILE 11 -24.660 -41.666 -13.751 121 HG13 ILE 11 HG13 ILE 11 -23.034 -41.442 -14.396 122 HG21 ILE 11 HG21 ILE 11 -25.294 -40.545 -11.505 123 HG22 ILE 11 HG22 ILE 11 -24.035 -41.557 -10.749 124 HG23 ILE 11 HG23 ILE 11 -24.013 -39.818 -10.518 125 HD11 ILE 11 HD11 ILE 11 -23.801 -43.306 -12.124 126 HD12 ILE 11 HD12 ILE 11 -23.256 -43.729 -13.751 127 HD13 ILE 11 HD13 ILE 11 -22.127 -42.951 -12.624 128 H LYS 12 H LYS 12 -25.492 -37.405 -12.919 129 HA LYS 12 HA LYS 12 -25.976 -35.511 -11.724 130 HB2 LYS 12 HB2 LYS 12 -24.599 -37.031 -9.488 131 HB3 LYS 12 HB3 LYS 12 -25.661 -35.654 -9.260 132 HG2 LYS 12 HG2 LYS 12 -26.554 -38.304 -10.491 133 HG3 LYS 12 HG3 LYS 12 -26.685 -37.861 -8.799 134 HD2 LYS 12 HD2 LYS 12 -28.783 -37.323 -9.463 135 HD3 LYS 12 HD3 LYS 12 -28.000 -35.755 -9.677 136 HE2 LYS 12 HE2 LYS 12 -27.760 -36.255 -12.125 137 HE3 LYS 12 HE3 LYS 12 -28.530 -37.823 -11.864 138 HZ1 LYS 12 HZ1 LYS 12 -29.820 -35.192 -11.354 139 HZ2 LYS 12 HZ2 LYS 12 -30.128 -36.156 -12.633 140 HZ3 LYS 12 HZ3 LYS 12 -30.532 -36.644 -11.131 141 H LYS 13 H LYS 13 -23.749 -35.265 -13.281 142 HA LYS 13 HA LYS 13 -21.804 -34.101 -13.722 143 HB2 LYS 13 HB2 LYS 13 -23.146 -32.034 -11.943 144 HB3 LYS 13 HB3 LYS 13 -21.844 -31.734 -13.101 145 HG2 LYS 13 HG2 LYS 13 -23.327 -32.510 -14.952 146 HG3 LYS 13 HG3 LYS 13 -24.655 -32.681 -13.785 147 HD2 LYS 13 HD2 LYS 13 -24.436 -30.250 -13.213 148 HD3 LYS 13 HD3 LYS 13 -23.116 -30.112 -14.376 149 HE2 LYS 13 HE2 LYS 13 -25.036 -29.250 -15.459 150 HE3 LYS 13 HE3 LYS 13 -24.689 -30.811 -16.204 151 HZ1 LYS 13 HZ1 LYS 13 -26.762 -30.334 -14.123 152 HZ2 LYS 13 HZ2 LYS 13 -27.059 -30.530 -15.714 153 HZ3 LYS 13 HZ3 LYS 13 -26.470 -31.776 -14.842 154 H GLU 14 H GLU 14 -21.137 -36.010 -11.920 155 HA GLU 14 HA GLU 14 -19.759 -35.126 -9.612 156 HB2 GLU 14 HB2 GLU 14 -20.297 -37.479 -10.139 157 HB3 GLU 14 HB3 GLU 14 -19.072 -37.477 -11.418 158 HG2 GLU 14 HG2 GLU 14 -17.314 -37.008 -9.724 159 HG3 GLU 14 HG3 GLU 14 -18.542 -36.952 -8.460 160 H ALA 15 H ALA 15 -18.109 -33.794 -9.373 161 HA ALA 15 HA ALA 15 -15.757 -33.752 -11.121 162 HB1 ALA 15 HB1 ALA 15 -17.578 -31.314 -10.807 163 HB2 ALA 15 HB2 ALA 15 -16.000 -31.340 -11.627 164 HB3 ALA 15 HB3 ALA 15 -17.358 -32.256 -12.300 165 H ASN 16 H ASN 16 -14.199 -31.996 -10.289 166 HA ASN 16 HA ASN 16 -14.363 -31.590 -7.337 167 HB2 ASN 16 HB2 ASN 16 -13.165 -33.707 -7.833 168 HB3 ASN 16 HB3 ASN 16 -12.016 -32.824 -8.837 169 HD21 ASN 16 HD21 ASN 16 -10.317 -31.370 -6.006 170 HD22 ASN 16 HD22 ASN 16 -10.739 -31.070 -7.693 171 H ASP 17 H ASP 17 -14.750 -29.410 -7.608 172 HA ASP 17 HA ASP 17 -12.369 -27.766 -8.314 173 HB2 ASP 17 HB2 ASP 17 -15.237 -27.222 -9.177 174 HB3 ASP 17 HB3 ASP 17 -13.952 -26.018 -9.187 175 H SER 18 H SER 18 -11.764 -26.708 -6.565 176 HA SER 18 HA SER 18 -13.725 -25.937 -4.443 177 HB2 SER 18 HB2 SER 18 -11.127 -27.455 -4.004 178 HB3 SER 18 HB3 SER 18 -12.257 -26.912 -2.749 179 HG SER 18 HG SER 18 -12.575 -29.113 -3.286 180 H GLY 19 H GLY 19 -12.728 -24.098 -6.222 181 HA2 GLY 19 HA2 GLY 19 -12.004 -21.896 -6.085 182 HA3 GLY 19 HA3 GLY 19 -11.471 -22.170 -4.422 183 H VAL 20 H VAL 20 -10.672 -22.821 -7.800 184 HA VAL 20 HA VAL 20 -7.788 -23.180 -7.168 185 HB VAL 20 HB VAL 20 -9.173 -25.096 -8.015 186 HG11 VAL 20 HG11 VAL 20 -9.171 -23.579 -10.658 187 HG12 VAL 20 HG12 VAL 20 -9.758 -25.232 -10.378 188 HG13 VAL 20 HG13 VAL 20 -10.585 -23.863 -9.623 189 HG21 VAL 20 HG21 VAL 20 -6.701 -25.085 -8.243 190 HG22 VAL 20 HG22 VAL 20 -7.555 -26.048 -9.460 191 HG23 VAL 20 HG23 VAL 20 -6.890 -24.471 -9.903 192 H THR 21 H THR 21 -9.507 -20.735 -8.076 193 HA THR 21 HA THR 21 -8.137 -20.034 -10.608 194 HB THR 21 HB THR 21 -10.558 -18.659 -9.504 195 HG1 THR 21 HG1 THR 21 -11.764 -20.139 -10.705 196 HG21 THR 21 HG21 THR 21 -9.504 -19.146 -12.328 197 HG22 THR 21 HG22 THR 21 -11.029 -18.319 -11.931 198 HG23 THR 21 HG23 THR 21 -9.488 -17.588 -11.467 199 H LEU 22 H LEU 22 -7.115 -18.141 -11.044 200 HA LEU 22 HA LEU 22 -6.015 -16.682 -8.798 201 HB2 LEU 22 HB2 LEU 22 -4.405 -15.861 -10.326 202 HB3 LEU 22 HB3 LEU 22 -4.599 -17.581 -10.605 203 HG LEU 22 HG LEU 22 -6.001 -15.520 -12.367 204 HD11 LEU 22 HD11 LEU 22 -3.230 -16.722 -12.749 205 HD12 LEU 22 HD12 LEU 22 -4.103 -15.698 -13.917 206 HD13 LEU 22 HD13 LEU 22 -3.588 -15.023 -12.366 207 HD21 LEU 22 HD21 LEU 22 -6.839 -17.767 -12.741 208 HD22 LEU 22 HD22 LEU 22 -5.803 -17.321 -14.084 209 HD23 LEU 22 HD23 LEU 22 -5.178 -18.413 -12.831 210 H ALA 23 H ALA 23 -8.730 -16.123 -9.103 211 HA ALA 23 HA ALA 23 -8.710 -13.191 -9.502 212 HB1 ALA 23 HB1 ALA 23 -10.608 -15.086 -10.953 213 HB2 ALA 23 HB2 ALA 23 -10.737 -13.315 -10.932 214 HB3 ALA 23 HB3 ALA 23 -9.333 -14.091 -11.693 215 HA PRO 24 HA PRO 24 -11.313 -13.544 -5.911 216 HB2 PRO 24 HB2 PRO 24 -12.259 -11.010 -5.631 217 HB3 PRO 24 HB3 PRO 24 -10.529 -11.419 -5.432 218 HG2 PRO 24 HG2 PRO 24 -11.903 -10.289 -7.897 219 HG3 PRO 24 HG3 PRO 24 -10.407 -9.719 -7.110 220 HD2 PRO 24 HD2 PRO 24 -10.374 -11.403 -9.274 221 HD3 PRO 24 HD3 PRO 24 -9.148 -11.513 -7.976 222 H LEU 25 H LEU 25 -12.830 -12.011 -8.765 223 HA LEU 25 HA LEU 25 -15.279 -13.587 -8.444 224 HB2 LEU 25 HB2 LEU 25 -15.523 -11.569 -6.929 225 HB3 LEU 25 HB3 LEU 25 -15.382 -10.540 -8.350 226 HG LEU 25 HG LEU 25 -17.503 -11.460 -9.247 227 HD11 LEU 25 HD11 LEU 25 -17.521 -13.171 -6.726 228 HD12 LEU 25 HD12 LEU 25 -18.913 -12.928 -7.806 229 HD13 LEU 25 HD13 LEU 25 -17.476 -13.748 -8.412 230 HD21 LEU 25 HD21 LEU 25 -17.557 -9.534 -7.707 231 HD22 LEU 25 HD22 LEU 25 -19.009 -10.536 -7.559 232 HD23 LEU 25 HD23 LEU 25 -17.731 -10.640 -6.325 233 H SER 26 H SER 26 -13.724 -14.127 -10.360 234 HA SER 26 HA SER 26 -13.172 -14.169 -12.563 235 HB2 SER 26 HB2 SER 26 -15.709 -14.211 -12.790 236 HB3 SER 26 HB3 SER 26 -15.601 -12.495 -13.217 237 HG SER 26 HG SER 26 -15.532 -13.937 -15.050 238 H VAL 27 H VAL 27 -12.906 -12.663 -14.578 239 HA VAL 27 HA VAL 27 -11.458 -11.245 -15.561 240 HB VAL 27 HB VAL 27 -12.542 -9.411 -13.434 241 HG11 VAL 27 HG11 VAL 27 -10.993 -8.453 -15.870 242 HG12 VAL 27 HG12 VAL 27 -11.815 -7.469 -14.670 243 HG13 VAL 27 HG13 VAL 27 -10.392 -8.389 -14.189 244 HG21 VAL 27 HG21 VAL 27 -14.171 -10.228 -15.077 245 HG22 VAL 27 HG22 VAL 27 -13.873 -8.502 -15.300 246 HG23 VAL 27 HG23 VAL 27 -13.128 -9.676 -16.406 247 HA PRO 28 HA PRO 28 -7.489 -11.591 -13.483 248 HB2 PRO 28 HB2 PRO 28 -5.858 -10.071 -15.086 249 HB3 PRO 28 HB3 PRO 28 -6.491 -11.677 -15.536 250 HG2 PRO 28 HG2 PRO 28 -7.668 -8.971 -16.267 251 HG3 PRO 28 HG3 PRO 28 -7.262 -10.333 -17.364 252 HD2 PRO 28 HD2 PRO 28 -9.775 -10.036 -16.489 253 HD3 PRO 28 HD3 PRO 28 -9.050 -11.657 -16.525 254 H LYS 29 H LYS 29 -8.685 -10.490 -11.794 255 HA LYS 29 HA LYS 29 -8.877 -9.102 -10.035 256 HB2 LYS 29 HB2 LYS 29 -6.563 -9.962 -9.880 257 HB3 LYS 29 HB3 LYS 29 -5.967 -8.508 -10.670 258 HG2 LYS 29 HG2 LYS 29 -5.631 -8.413 -8.274 259 HG3 LYS 29 HG3 LYS 29 -6.713 -7.138 -8.766 260 HD2 LYS 29 HD2 LYS 29 -8.634 -8.347 -7.877 261 HD3 LYS 29 HD3 LYS 29 -7.635 -9.802 -7.613 262 HE2 LYS 29 HE2 LYS 29 -6.252 -8.536 -5.983 263 HE3 LYS 29 HE3 LYS 29 -7.283 -7.118 -6.208 264 HZ1 LYS 29 HZ1 LYS 29 -8.199 -9.759 -5.167 265 HZ2 LYS 29 HZ2 LYS 29 -7.953 -8.439 -4.251 266 HZ3 LYS 29 HZ3 LYS 29 -9.158 -8.439 -5.348 267 HA PRO 30 HA PRO 30 -9.802 -5.377 -12.493 268 HB2 PRO 30 HB2 PRO 30 -12.338 -4.887 -11.555 269 HB3 PRO 30 HB3 PRO 30 -11.954 -6.026 -12.881 270 HG2 PRO 30 HG2 PRO 30 -12.428 -6.633 -9.949 271 HG3 PRO 30 HG3 PRO 30 -13.054 -7.518 -11.380 272 HD2 PRO 30 HD2 PRO 30 -10.884 -8.362 -9.965 273 HD3 PRO 30 HD3 PRO 30 -10.985 -8.590 -11.734 274 H LYS 31 H LYS 31 -9.261 -3.432 -11.991 275 HA LYS 31 HA LYS 31 -8.099 -2.614 -9.704 276 HB2 LYS 31 HB2 LYS 31 -8.038 -0.366 -10.689 277 HB3 LYS 31 HB3 LYS 31 -7.806 -1.604 -11.923 278 HG2 LYS 31 HG2 LYS 31 -10.331 -1.382 -12.430 279 HG3 LYS 31 HG3 LYS 31 -10.317 0.054 -11.407 280 HD2 LYS 31 HD2 LYS 31 -8.641 -0.366 -13.923 281 HD3 LYS 31 HD3 LYS 31 -10.160 0.533 -13.830 282 HE2 LYS 31 HE2 LYS 31 -9.113 2.112 -12.199 283 HE3 LYS 31 HE3 LYS 31 -7.575 1.253 -12.378 284 HZ1 LYS 31 HZ1 LYS 31 -9.032 2.630 -14.577 285 HZ2 LYS 31 HZ2 LYS 31 -7.686 3.189 -13.844 286 HZ3 LYS 31 HZ3 LYS 31 -7.616 1.834 -14.754 287 H LEU 32 H LEU 32 -8.391 -1.158 -8.008 288 HA LEU 32 HA LEU 32 -11.155 -0.601 -7.104 289 HB2 LEU 32 HB2 LEU 32 -10.221 -2.809 -6.285 290 HB3 LEU 32 HB3 LEU 32 -8.852 -1.931 -5.606 291 HG LEU 32 HG LEU 32 -10.531 -0.625 -4.220 292 HD11 LEU 32 HD11 LEU 32 -12.355 -2.917 -5.088 293 HD12 LEU 32 HD12 LEU 32 -12.721 -1.736 -3.807 294 HD13 LEU 32 HD13 LEU 32 -12.594 -1.206 -5.490 295 HD21 LEU 32 HD21 LEU 32 -9.145 -2.298 -3.225 296 HD22 LEU 32 HD22 LEU 32 -10.774 -2.449 -2.546 297 HD23 LEU 32 HD23 LEU 32 -10.216 -3.603 -3.783 298 H GLU 33 H GLU 33 -11.361 1.157 -5.684 299 HA GLU 33 HA GLU 33 -8.974 2.657 -4.788 300 HB2 GLU 33 HB2 GLU 33 -10.027 4.817 -5.506 301 HB3 GLU 33 HB3 GLU 33 -9.360 3.814 -6.784 302 HG2 GLU 33 HG2 GLU 33 -11.593 3.072 -7.469 303 HG3 GLU 33 HG3 GLU 33 -12.339 3.962 -6.145 304 H GLU 34 H GLU 34 -9.619 1.514 -2.853 305 HA GLU 34 HA GLU 34 -11.870 2.794 -1.367 306 HB2 GLU 34 HB2 GLU 34 -12.291 0.459 -2.260 307 HB3 GLU 34 HB3 GLU 34 -10.972 -0.112 -1.234 308 HG2 GLU 34 HG2 GLU 34 -12.278 0.971 0.732 309 HG3 GLU 34 HG3 GLU 34 -13.604 1.169 -0.406 310 H LEU 35 H LEU 35 -10.157 4.288 -0.734 311 HA LEU 35 HA LEU 35 -8.752 3.402 1.756 312 HB2 LEU 35 HB2 LEU 35 -7.834 5.257 -0.471 313 HB3 LEU 35 HB3 LEU 35 -7.031 5.148 1.084 314 HG LEU 35 HG LEU 35 -7.398 2.529 -0.334 315 HD11 LEU 35 HD11 LEU 35 -5.366 4.533 -1.353 316 HD12 LEU 35 HD12 LEU 35 -5.581 2.842 -1.861 317 HD13 LEU 35 HD13 LEU 35 -6.841 4.027 -2.211 318 HD21 LEU 35 HD21 LEU 35 -6.184 2.724 1.806 319 HD22 LEU 35 HD22 LEU 35 -5.129 2.157 0.502 320 HD23 LEU 35 HD23 LEU 35 -5.025 3.842 1.047 321 H SER 36 H SER 36 -8.655 4.955 3.439 322 HA SER 36 HA SER 36 -10.725 7.056 3.500 323 HB2 SER 36 HB2 SER 36 -10.153 5.680 5.492 324 HB3 SER 36 HB3 SER 36 -8.534 6.406 5.505 325 HG SER 36 HG SER 36 -10.102 7.450 6.905 326 H GLU 37 H GLU 37 -9.982 9.363 4.193 327 HA GLU 37 HA GLU 37 -8.523 10.477 2.030 328 HB2 GLU 37 HB2 GLU 37 -10.210 11.666 3.350 329 HB3 GLU 37 HB3 GLU 37 -9.130 11.689 4.754 330 HG2 GLU 37 HG2 GLU 37 -7.517 13.088 3.503 331 HG3 GLU 37 HG3 GLU 37 -8.529 12.991 2.060 332 H GLN 38 H GLN 38 -7.321 9.840 5.361 333 HA GLN 38 HA GLN 38 -4.619 10.760 4.657 334 HB2 GLN 38 HB2 GLN 38 -3.964 9.926 6.861 335 HB3 GLN 38 HB3 GLN 38 -5.291 11.077 6.936 336 HG2 GLN 38 HG2 GLN 38 -6.879 9.422 7.541 337 HG3 GLN 38 HG3 GLN 38 -5.863 8.090 6.995 338 HE21 GLN 38 HE21 GLN 38 -3.900 7.920 9.959 339 HE22 GLN 38 HE22 GLN 38 -3.919 7.518 8.248 340 H GLN 39 H GLN 39 -6.283 7.626 4.778 341 HA GLN 39 HA GLN 39 -3.901 6.032 4.508 342 HB2 GLN 39 HB2 GLN 39 -6.821 5.479 3.985 343 HB3 GLN 39 HB3 GLN 39 -5.563 4.278 3.680 344 HG2 GLN 39 HG2 GLN 39 -4.806 4.412 6.026 345 HG3 GLN 39 HG3 GLN 39 -6.066 5.595 6.386 346 HE21 GLN 39 HE21 GLN 39 -7.142 1.973 7.148 347 HE22 GLN 39 HE22 GLN 39 -5.566 2.694 7.406 348 H LYS 40 H LYS 40 -6.107 7.494 2.139 349 HA LYS 40 HA LYS 40 -4.981 6.391 -0.242 350 HB2 LYS 40 HB2 LYS 40 -7.127 7.608 -0.088 351 HB3 LYS 40 HB3 LYS 40 -6.288 9.100 0.344 352 HG2 LYS 40 HG2 LYS 40 -5.174 9.121 -1.875 353 HG3 LYS 40 HG3 LYS 40 -6.035 7.642 -2.325 354 HD2 LYS 40 HD2 LYS 40 -7.368 10.282 -1.541 355 HD3 LYS 40 HD3 LYS 40 -7.044 9.773 -3.206 356 HE2 LYS 40 HE2 LYS 40 -8.463 7.749 -2.853 357 HE3 LYS 40 HE3 LYS 40 -8.836 8.307 -1.215 358 HZ1 LYS 40 HZ1 LYS 40 -9.509 9.779 -3.708 359 HZ2 LYS 40 HZ2 LYS 40 -10.571 8.957 -2.784 360 HZ3 LYS 40 HZ3 LYS 40 -9.850 10.298 -2.197 361 H ILE 41 H ILE 41 -4.046 9.303 1.651 362 HA ILE 41 HA ILE 41 -1.909 10.069 -0.131 363 HB ILE 41 HB ILE 41 -2.305 10.747 2.773 364 HG12 ILE 41 HG12 ILE 41 -2.985 12.537 0.387 365 HG13 ILE 41 HG13 ILE 41 -4.176 11.424 1.027 366 HG21 ILE 41 HG21 ILE 41 -0.560 12.088 0.671 367 HG22 ILE 41 HG22 ILE 41 -0.884 12.754 2.284 368 HG23 ILE 41 HG23 ILE 41 -0.008 11.241 2.132 369 HD11 ILE 41 HD11 ILE 41 -2.915 13.713 2.572 370 HD12 ILE 41 HD12 ILE 41 -4.586 13.568 1.995 371 HD13 ILE 41 HD13 ILE 41 -4.000 12.483 3.266 372 H ILE 42 H ILE 42 -1.934 8.076 2.911 373 HA ILE 42 HA ILE 42 0.930 7.732 2.968 374 HB ILE 42 HB ILE 42 -1.274 5.942 4.033 375 HG12 ILE 42 HG12 ILE 42 0.477 7.763 5.725 376 HG13 ILE 42 HG13 ILE 42 -0.943 8.428 4.938 377 HG21 ILE 42 HG21 ILE 42 1.735 5.959 4.559 378 HG22 ILE 42 HG22 ILE 42 0.566 5.066 5.550 379 HG23 ILE 42 HG23 ILE 42 0.782 4.634 3.858 380 HD11 ILE 42 HD11 ILE 42 -0.962 6.086 6.880 381 HD12 ILE 42 HD12 ILE 42 -1.558 7.734 7.170 382 HD13 ILE 42 HD13 ILE 42 -2.370 6.690 5.981 383 H LEU 43 H LEU 43 -1.683 5.855 1.479 384 HA LEU 43 HA LEU 43 -0.140 3.751 0.376 385 HB2 LEU 43 HB2 LEU 43 -2.595 3.819 0.642 386 HB3 LEU 43 HB3 LEU 43 -2.734 5.045 -0.592 387 HG LEU 43 HG LEU 43 -3.382 2.703 -1.143 388 HD11 LEU 43 HD11 LEU 43 -1.325 3.949 -2.975 389 HD12 LEU 43 HD12 LEU 43 -2.523 2.723 -3.423 390 HD13 LEU 43 HD13 LEU 43 -3.047 4.333 -2.890 391 HD21 LEU 43 HD21 LEU 43 -1.540 1.519 -0.051 392 HD22 LEU 43 HD22 LEU 43 -1.647 1.065 -1.760 393 HD23 LEU 43 HD23 LEU 43 -0.364 2.165 -1.211 394 H ALA 44 H ALA 44 -1.136 6.868 -1.065 395 HA ALA 44 HA ALA 44 0.212 6.566 -3.552 396 HB1 ALA 44 HB1 ALA 44 -0.656 9.028 -1.988 397 HB2 ALA 44 HB2 ALA 44 -0.209 9.011 -3.710 398 HB3 ALA 44 HB3 ALA 44 -1.650 8.123 -3.157 399 H GLU 45 H GLU 45 1.228 8.404 -0.562 400 HA GLU 45 HA GLU 45 3.655 9.270 -1.745 401 HB2 GLU 45 HB2 GLU 45 4.137 10.282 0.258 402 HB3 GLU 45 HB3 GLU 45 2.388 10.194 0.243 403 HG2 GLU 45 HG2 GLU 45 2.744 9.570 2.395 404 HG3 GLU 45 HG3 GLU 45 2.762 7.982 1.648 405 H TYR 46 H TYR 46 2.927 6.179 -0.299 406 HA TYR 46 HA TYR 46 5.660 5.315 0.059 407 HB2 TYR 46 HB2 TYR 46 3.685 4.388 1.226 408 HB3 TYR 46 HB3 TYR 46 3.063 3.760 -0.291 409 HD1 TYR 46 HD1 TYR 46 2.880 1.720 1.265 410 HD2 TYR 46 HD2 TYR 46 6.655 3.310 -0.143 411 HE1 TYR 46 HE1 TYR 46 4.005 -0.437 1.792 412 HE2 TYR 46 HE2 TYR 46 7.765 1.182 0.444 413 HH TYR 46 HH TYR 46 5.976 -1.583 1.847 414 H ILE 47 H ILE 47 3.215 4.485 -2.465 415 HA ILE 47 HA ILE 47 4.914 3.133 -4.236 416 HB ILE 47 HB ILE 47 2.261 4.572 -4.424 417 HG12 ILE 47 HG12 ILE 47 2.955 1.599 -4.409 418 HG13 ILE 47 HG13 ILE 47 2.512 2.501 -2.969 419 HG21 ILE 47 HG21 ILE 47 3.573 2.906 -6.592 420 HG22 ILE 47 HG22 ILE 47 1.845 3.323 -6.586 421 HG23 ILE 47 HG23 ILE 47 3.046 4.593 -6.713 422 HD11 ILE 47 HD11 ILE 47 0.695 1.882 -5.317 423 HD12 ILE 47 HD12 ILE 47 0.541 1.384 -3.625 424 HD13 ILE 47 HD13 ILE 47 0.323 3.089 -4.070 425 H ALA 48 H ALA 48 4.060 6.617 -3.976 426 HA ALA 48 HA ALA 48 5.295 7.431 -6.448 427 HB1 ALA 48 HB1 ALA 48 4.650 8.964 -3.897 428 HB2 ALA 48 HB2 ALA 48 5.016 9.690 -5.480 429 HB3 ALA 48 HB3 ALA 48 3.548 8.709 -5.268 430 H GLU 49 H GLU 49 6.615 6.753 -3.249 431 HA GLU 49 HA GLU 49 9.230 7.982 -3.905 432 HB2 GLU 49 HB2 GLU 49 8.268 8.280 -1.674 433 HB3 GLU 49 HB3 GLU 49 8.274 6.527 -1.412 434 HG2 GLU 49 HG2 GLU 49 10.706 6.467 -1.522 435 HG3 GLU 49 HG3 GLU 49 10.772 8.157 -2.032 436 H VAL 50 H VAL 50 7.811 4.689 -3.493 437 HA VAL 50 HA VAL 50 10.469 3.568 -4.273 438 HB VAL 50 HB VAL 50 10.146 1.717 -3.050 439 HG11 VAL 50 HG11 VAL 50 8.811 3.814 -1.323 440 HG12 VAL 50 HG12 VAL 50 9.729 2.393 -0.790 441 HG13 VAL 50 HG13 VAL 50 10.555 3.701 -1.652 442 HG21 VAL 50 HG21 VAL 50 7.860 1.052 -3.694 443 HG22 VAL 50 HG22 VAL 50 8.093 0.977 -1.952 444 HG23 VAL 50 HG23 VAL 50 7.190 2.331 -2.662 445 H GLY 51 H GLY 51 7.484 4.089 -5.667 446 HA2 GLY 51 HA2 GLY 51 7.272 4.052 -7.963 447 HA3 GLY 51 HA3 GLY 51 8.690 3.011 -8.098 448 H LEU 52 H LEU 52 5.963 2.108 -6.130 449 HA LEU 52 HA LEU 52 4.747 0.284 -5.972 450 HB2 LEU 52 HB2 LEU 52 3.946 1.504 -8.353 451 HB3 LEU 52 HB3 LEU 52 4.145 -0.151 -8.861 452 HG LEU 52 HG LEU 52 2.438 0.772 -6.513 453 HD11 LEU 52 HD11 LEU 52 1.601 -0.138 -9.289 454 HD12 LEU 52 HD12 LEU 52 0.525 0.319 -7.944 455 HD13 LEU 52 HD13 LEU 52 1.567 1.538 -8.687 456 HD21 LEU 52 HD21 LEU 52 3.134 -1.558 -6.202 457 HD22 LEU 52 HD22 LEU 52 1.414 -1.456 -6.577 458 HD23 LEU 52 HD23 LEU 52 2.570 -1.956 -7.834 459 H GLN 53 H GLN 53 7.660 -0.022 -7.055 460 HA GLN 53 HA GLN 53 7.635 -2.863 -7.987 461 HB2 GLN 53 HB2 GLN 53 9.633 -0.587 -8.115 462 HB3 GLN 53 HB3 GLN 53 10.087 -2.243 -8.517 463 HG2 GLN 53 HG2 GLN 53 8.698 -2.350 -10.404 464 HG3 GLN 53 HG3 GLN 53 7.681 -1.012 -9.879 465 HE21 GLN 53 HE21 GLN 53 9.846 1.557 -11.071 466 HE22 GLN 53 HE22 GLN 53 8.512 1.159 -9.973 467 H ASN 54 H ASN 54 8.381 -1.021 -5.191 468 HA ASN 54 HA ASN 54 9.954 -3.285 -4.004 469 HB2 ASN 54 HB2 ASN 54 10.305 -0.321 -3.504 470 HB3 ASN 54 HB3 ASN 54 11.266 -1.604 -2.794 471 HD21 ASN 54 HD21 ASN 54 12.232 -0.209 -6.467 472 HD22 ASN 54 HD22 ASN 54 10.836 0.438 -5.613 473 H ILE 55 H ILE 55 6.963 -2.073 -3.786 474 HA ILE 55 HA ILE 55 6.731 -1.947 -0.860 475 HB ILE 55 HB ILE 55 4.383 -1.737 -1.121 476 HG12 ILE 55 HG12 ILE 55 4.723 -2.200 -4.117 477 HG13 ILE 55 HG13 ILE 55 3.931 -3.290 -2.967 478 HG21 ILE 55 HG21 ILE 55 5.544 0.058 -3.272 479 HG22 ILE 55 HG22 ILE 55 4.291 0.415 -2.053 480 HG23 ILE 55 HG23 ILE 55 5.959 0.211 -1.556 481 HD11 ILE 55 HD11 ILE 55 3.016 -0.508 -3.752 482 HD12 ILE 55 HD12 ILE 55 2.220 -2.049 -4.096 483 HD13 ILE 55 HD13 ILE 55 2.300 -1.463 -2.421 484 H THR 56 H THR 56 5.571 -3.459 0.444 485 HA THR 56 HA THR 56 5.175 -6.169 -0.690 486 HB THR 56 HB THR 56 6.090 -6.828 1.753 487 HG1 THR 56 HG1 THR 56 7.850 -5.522 2.301 488 HG21 THR 56 HG21 THR 56 8.008 -6.051 -0.492 489 HG22 THR 56 HG22 THR 56 8.337 -7.200 0.825 490 HG23 THR 56 HG23 THR 56 7.113 -7.584 -0.397 491 H ALA 57 H ALA 57 3.476 -7.335 0.204 492 HA ALA 57 HA ALA 57 1.326 -5.895 1.322 493 HB1 ALA 57 HB1 ALA 57 1.882 -8.899 1.343 494 HB2 ALA 57 HB2 ALA 57 0.306 -8.110 1.570 495 HB3 ALA 57 HB3 ALA 57 1.131 -7.996 0.007 496 H ILE 58 H ILE 58 3.992 -7.546 2.881 497 HA ILE 58 HA ILE 58 2.978 -7.711 5.581 498 HB ILE 58 HB ILE 58 5.765 -7.578 4.347 499 HG12 ILE 58 HG12 ILE 58 5.936 -9.948 5.141 500 HG13 ILE 58 HG13 ILE 58 4.275 -9.889 5.718 501 HG21 ILE 58 HG21 ILE 58 4.975 -7.959 7.281 502 HG22 ILE 58 HG22 ILE 58 6.596 -8.320 6.638 503 HG23 ILE 58 HG23 ILE 58 5.990 -6.668 6.613 504 HD11 ILE 58 HD11 ILE 58 5.074 -9.564 2.792 505 HD12 ILE 58 HD12 ILE 58 4.636 -11.108 3.550 506 HD13 ILE 58 HD13 ILE 58 3.430 -9.825 3.445 507 H THR 59 H THR 59 5.017 -5.309 3.859 508 HA THR 59 HA THR 59 5.181 -3.541 6.169 509 HB THR 59 HB THR 59 6.012 -3.268 3.268 510 HG1 THR 59 HG1 THR 59 7.978 -3.840 4.042 511 HG21 THR 59 HG21 THR 59 6.728 -1.530 5.672 512 HG22 THR 59 HG22 THR 59 7.515 -1.472 4.072 513 HG23 THR 59 HG23 THR 59 5.812 -1.016 4.236 514 H LEU 60 H LEU 60 3.449 -3.475 3.031 515 HA LEU 60 HA LEU 60 2.050 -1.067 3.440 516 HB2 LEU 60 HB2 LEU 60 2.459 -2.423 1.332 517 HB3 LEU 60 HB3 LEU 60 1.250 -3.560 1.885 518 HG LEU 60 HG LEU 60 -0.447 -1.640 1.779 519 HD11 LEU 60 HD11 LEU 60 1.888 -0.264 0.382 520 HD12 LEU 60 HD12 LEU 60 0.224 0.324 0.450 521 HD13 LEU 60 HD13 LEU 60 1.166 0.242 1.936 522 HD21 LEU 60 HD21 LEU 60 -0.201 -3.282 -0.031 523 HD22 LEU 60 HD22 LEU 60 -0.541 -1.672 -0.697 524 HD23 LEU 60 HD23 LEU 60 1.107 -2.335 -0.744 525 H SER 61 H SER 61 1.221 -4.410 4.497 526 HA SER 61 HA SER 61 -1.266 -3.960 5.676 527 HB2 SER 61 HB2 SER 61 -0.430 -6.153 5.503 528 HB3 SER 61 HB3 SER 61 0.999 -5.771 6.475 529 HG SER 61 HG SER 61 -0.487 -6.866 7.731 530 H LYS 62 H LYS 62 1.855 -2.959 6.698 531 HA LYS 62 HA LYS 62 0.891 -2.141 9.365 532 HB2 LYS 62 HB2 LYS 62 3.709 -2.570 8.326 533 HB3 LYS 62 HB3 LYS 62 3.330 -1.934 9.934 534 HG2 LYS 62 HG2 LYS 62 2.036 -3.971 10.473 535 HG3 LYS 62 HG3 LYS 62 2.392 -4.642 8.873 536 HD2 LYS 62 HD2 LYS 62 4.828 -4.539 9.388 537 HD3 LYS 62 HD3 LYS 62 4.430 -3.929 11.014 538 HE2 LYS 62 HE2 LYS 62 3.108 -6.003 11.444 539 HE3 LYS 62 HE3 LYS 62 3.534 -6.602 9.836 540 HZ1 LYS 62 HZ1 LYS 62 5.476 -6.034 12.017 541 HZ2 LYS 62 HZ2 LYS 62 5.002 -7.520 11.541 542 HZ3 LYS 62 HZ3 LYS 62 5.877 -6.584 10.530 543 H LYS 63 H LYS 63 2.149 -0.667 6.392 544 HA LYS 63 HA LYS 63 2.662 1.970 7.345 545 HB2 LYS 63 HB2 LYS 63 1.691 0.790 4.719 546 HB3 LYS 63 HB3 LYS 63 2.008 2.512 4.880 547 HG2 LYS 63 HG2 LYS 63 4.126 0.385 5.418 548 HG3 LYS 63 HG3 LYS 63 3.805 1.074 3.834 549 HD2 LYS 63 HD2 LYS 63 4.252 3.367 4.862 550 HD3 LYS 63 HD3 LYS 63 4.842 2.492 6.301 551 HE2 LYS 63 HE2 LYS 63 6.493 1.296 4.900 552 HE3 LYS 63 HE3 LYS 63 5.880 2.112 3.455 553 HZ1 LYS 63 HZ1 LYS 63 7.158 3.483 5.763 554 HZ2 LYS 63 HZ2 LYS 63 7.863 3.216 4.316 555 HZ3 LYS 63 HZ3 LYS 63 6.590 4.232 4.425 556 H LEU 64 H LEU 64 -0.376 0.415 6.383 557 HA LEU 64 HA LEU 64 -1.873 2.891 7.142 558 HB2 LEU 64 HB2 LEU 64 -2.741 0.763 5.165 559 HB3 LEU 64 HB3 LEU 64 -3.534 2.275 5.530 560 HG LEU 64 HG LEU 64 -0.987 3.127 4.789 561 HD11 LEU 64 HD11 LEU 64 -1.782 0.856 2.904 562 HD12 LEU 64 HD12 LEU 64 -0.415 1.981 2.714 563 HD13 LEU 64 HD13 LEU 64 -0.426 0.788 4.027 564 HD21 LEU 64 HD21 LEU 64 -3.129 4.045 4.081 565 HD22 LEU 64 HD22 LEU 64 -2.007 3.822 2.743 566 HD23 LEU 64 HD23 LEU 64 -3.366 2.685 2.955 567 H ASN 65 H ASN 65 -1.163 0.171 8.640 568 HA ASN 65 HA ASN 65 -2.038 -1.173 10.211 569 HB2 ASN 65 HB2 ASN 65 -4.034 1.058 10.742 570 HB3 ASN 65 HB3 ASN 65 -3.471 -0.163 11.874 571 HD21 ASN 65 HD21 ASN 65 -1.309 3.221 11.311 572 HD22 ASN 65 HD22 ASN 65 -2.796 2.920 10.419 573 H ILE 66 H ILE 66 -2.699 -2.366 8.128 574 HA ILE 66 HA ILE 66 -5.619 -3.019 8.134 575 HB ILE 66 HB ILE 66 -5.039 -3.417 5.557 576 HG12 ILE 66 HG12 ILE 66 -3.255 -1.030 6.138 577 HG13 ILE 66 HG13 ILE 66 -2.605 -2.602 5.891 578 HG21 ILE 66 HG21 ILE 66 -5.700 -0.742 6.842 579 HG22 ILE 66 HG22 ILE 66 -6.013 -1.159 5.150 580 HG23 ILE 66 HG23 ILE 66 -6.837 -2.050 6.430 581 HD11 ILE 66 HD11 ILE 66 -4.166 -0.967 3.859 582 HD12 ILE 66 HD12 ILE 66 -2.471 -1.467 3.790 583 HD13 ILE 66 HD13 ILE 66 -3.757 -2.680 3.622 584 H THR 67 H THR 67 -5.643 -5.137 6.417 585 HA THR 67 HA THR 67 -3.997 -7.193 7.802 586 HB THR 67 HB THR 67 -5.407 -8.832 7.119 587 HG1 THR 67 HG1 THR 67 -6.944 -8.535 5.440 588 HG21 THR 67 HG21 THR 67 -7.397 -6.525 7.167 589 HG22 THR 67 HG22 THR 67 -7.694 -8.228 7.569 590 HG23 THR 67 HG23 THR 67 -6.661 -7.244 8.622 591 H VAL 68 H VAL 68 -2.857 -8.806 6.532 592 HA VAL 68 HA VAL 68 -1.247 -7.749 4.385 593 HB VAL 68 HB VAL 68 -1.725 -10.621 5.266 594 HG11 VAL 68 HG11 VAL 68 0.490 -9.490 3.502 595 HG12 VAL 68 HG12 VAL 68 0.424 -11.139 4.147 596 HG13 VAL 68 HG13 VAL 68 -0.781 -10.617 2.968 597 HG21 VAL 68 HG21 VAL 68 -0.707 -9.224 7.037 598 HG22 VAL 68 HG22 VAL 68 0.479 -10.355 6.389 599 HG23 VAL 68 HG23 VAL 68 0.527 -8.651 5.891 600 H GLU 69 H GLU 69 -4.441 -9.269 4.352 601 HA GLU 69 HA GLU 69 -4.226 -10.004 1.487 602 HB2 GLU 69 HB2 GLU 69 -6.525 -10.167 3.477 603 HB3 GLU 69 HB3 GLU 69 -6.606 -10.670 1.782 604 HG2 GLU 69 HG2 GLU 69 -4.753 -12.295 2.186 605 HG3 GLU 69 HG3 GLU 69 -4.747 -11.850 3.894 606 H LYS 70 H LYS 70 -5.692 -7.528 3.584 607 HA LYS 70 HA LYS 70 -7.108 -6.176 1.520 608 HB2 LYS 70 HB2 LYS 70 -7.447 -6.126 4.039 609 HB3 LYS 70 HB3 LYS 70 -6.084 -5.024 4.156 610 HG2 LYS 70 HG2 LYS 70 -8.585 -4.539 2.493 611 HG3 LYS 70 HG3 LYS 70 -8.403 -4.082 4.194 612 HD2 LYS 70 HD2 LYS 70 -6.397 -2.679 3.462 613 HD3 LYS 70 HD3 LYS 70 -6.971 -2.870 1.804 614 HE2 LYS 70 HE2 LYS 70 -8.874 -1.981 4.001 615 HE3 LYS 70 HE3 LYS 70 -7.747 -0.815 3.319 616 HZ1 LYS 70 HZ1 LYS 70 -9.715 -2.326 1.682 617 HZ2 LYS 70 HZ2 LYS 70 -9.885 -0.778 2.159 618 HZ3 LYS 70 HZ3 LYS 70 -8.680 -1.155 1.148 619 H ALA 71 H ALA 71 -3.976 -5.609 3.027 620 HA ALA 71 HA ALA 71 -2.980 -3.530 1.368 621 HB1 ALA 71 HB1 ALA 71 -1.515 -5.835 2.737 622 HB2 ALA 71 HB2 ALA 71 -0.773 -4.349 2.129 623 HB3 ALA 71 HB3 ALA 71 -1.929 -4.271 3.467 624 H LYS 72 H LYS 72 -2.794 -7.112 0.857 625 HA LYS 72 HA LYS 72 -1.159 -6.931 -1.491 626 HB2 LYS 72 HB2 LYS 72 -1.196 -8.891 -0.023 627 HB3 LYS 72 HB3 LYS 72 -2.921 -9.133 -0.314 628 HG2 LYS 72 HG2 LYS 72 -2.526 -9.788 -2.580 629 HG3 LYS 72 HG3 LYS 72 -0.812 -9.354 -2.486 630 HD2 LYS 72 HD2 LYS 72 -2.022 -11.378 -0.559 631 HD3 LYS 72 HD3 LYS 72 -1.583 -11.886 -2.192 632 HE2 LYS 72 HE2 LYS 72 0.358 -10.556 -0.248 633 HE3 LYS 72 HE3 LYS 72 0.125 -12.301 -0.362 634 HZ1 LYS 72 HZ1 LYS 72 1.056 -10.596 -2.608 635 HZ2 LYS 72 HZ2 LYS 72 1.992 -11.605 -1.727 636 HZ3 LYS 72 HZ3 LYS 72 0.824 -12.215 -2.681 637 H ASN 73 H ASN 73 -4.649 -6.825 -0.980 638 HA ASN 73 HA ASN 73 -5.511 -7.296 -3.544 639 HB2 ASN 73 HB2 ASN 73 -7.493 -6.668 -2.673 640 HB3 ASN 73 HB3 ASN 73 -6.665 -6.250 -1.195 641 HD21 ASN 73 HD21 ASN 73 -7.297 -2.787 -1.675 642 HD22 ASN 73 HD22 ASN 73 -6.690 -4.038 -0.607 643 H TYR 74 H TYR 74 -3.974 -4.329 -2.349 644 HA TYR 74 HA TYR 74 -4.430 -2.726 -4.681 645 HB2 TYR 74 HB2 TYR 74 -2.300 -2.506 -2.522 646 HB3 TYR 74 HB3 TYR 74 -2.793 -1.222 -3.620 647 HD1 TYR 74 HD1 TYR 74 -2.870 -1.958 -0.387 648 HD2 TYR 74 HD2 TYR 74 -5.746 -1.261 -3.532 649 HE1 TYR 74 HE1 TYR 74 -4.472 -1.040 1.289 650 HE2 TYR 74 HE2 TYR 74 -7.340 -0.315 -1.847 651 HH TYR 74 HH TYR 74 -6.470 -0.008 1.603 652 H ILE 75 H ILE 75 -1.730 -4.751 -3.543 653 HA ILE 75 HA ILE 75 0.159 -4.099 -5.601 654 HB ILE 75 HB ILE 75 -0.043 -6.587 -3.845 655 HG12 ILE 75 HG12 ILE 75 1.362 -3.930 -3.333 656 HG13 ILE 75 HG13 ILE 75 -0.068 -4.504 -2.490 657 HG21 ILE 75 HG21 ILE 75 2.366 -5.365 -5.271 658 HG22 ILE 75 HG22 ILE 75 2.412 -6.766 -4.178 659 HG23 ILE 75 HG23 ILE 75 1.566 -6.895 -5.699 660 HD11 ILE 75 HD11 ILE 75 2.725 -5.635 -2.264 661 HD12 ILE 75 HD12 ILE 75 1.737 -4.845 -1.029 662 HD13 ILE 75 HD13 ILE 75 1.264 -6.444 -1.639 663 H LYS 76 H LYS 76 -2.560 -6.317 -5.515 664 HA LYS 76 HA LYS 76 -1.795 -7.633 -8.063 665 HB2 LYS 76 HB2 LYS 76 -4.150 -7.987 -6.179 666 HB3 LYS 76 HB3 LYS 76 -3.754 -9.053 -7.542 667 HG2 LYS 76 HG2 LYS 76 -1.920 -8.711 -5.148 668 HG3 LYS 76 HG3 LYS 76 -3.244 -9.854 -5.219 669 HD2 LYS 76 HD2 LYS 76 -1.331 -11.094 -5.756 670 HD3 LYS 76 HD3 LYS 76 -2.174 -10.869 -7.291 671 HE2 LYS 76 HE2 LYS 76 -0.581 -9.066 -7.902 672 HE3 LYS 76 HE3 LYS 76 0.196 -9.197 -6.321 673 HZ1 LYS 76 HZ1 LYS 76 0.113 -11.354 -8.370 674 HZ2 LYS 76 HZ2 LYS 76 1.414 -10.427 -8.033 675 HZ3 LYS 76 HZ3 LYS 76 0.851 -11.473 -6.917 676 H ASN 77 H ASN 77 -3.915 -5.072 -6.990 677 HA ASN 77 HA ASN 77 -5.496 -4.992 -9.477 678 HB2 ASN 77 HB2 ASN 77 -5.356 -3.386 -6.884 679 HB3 ASN 77 HB3 ASN 77 -6.159 -2.725 -8.298 680 HD21 ASN 77 HD21 ASN 77 -8.415 -5.014 -6.129 681 HD22 ASN 77 HD22 ASN 77 -6.995 -4.206 -5.505 682 H SER 78 H SER 78 -2.894 -3.161 -7.856 683 HA SER 78 HA SER 78 -2.127 -2.118 -10.540 684 HB2 SER 78 HB2 SER 78 -1.835 -0.688 -7.874 685 HB3 SER 78 HB3 SER 78 -1.236 -0.096 -9.438 686 HG SER 78 HG SER 78 -3.291 0.792 -8.876 687 H ASN 79 H ASN 79 -0.284 -2.695 -11.309 688 HA ASN 79 HA ASN 79 1.952 -3.499 -9.517 689 HB2 ASN 79 HB2 ASN 79 0.255 -5.399 -9.981 690 HB3 ASN 79 HB3 ASN 79 0.856 -5.409 -11.631 691 HD21 ASN 79 HD21 ASN 79 3.091 -6.827 -8.512 692 HD22 ASN 79 HD22 ASN 79 1.534 -6.002 -8.290 693 H ARG 80 H ARG 80 1.159 -3.885 -12.994 694 HA ARG 80 HA ARG 80 3.838 -2.837 -13.766 695 HB2 ARG 80 HB2 ARG 80 1.664 -4.172 -15.439 696 HB3 ARG 80 HB3 ARG 80 3.305 -3.810 -15.959 697 HG2 ARG 80 HG2 ARG 80 2.484 -5.851 -13.852 698 HG3 ARG 80 HG3 ARG 80 3.099 -6.163 -15.475 699 HD2 ARG 80 HD2 ARG 80 5.252 -4.964 -14.786 700 HD3 ARG 80 HD3 ARG 80 4.612 -4.922 -13.142 701 HE ARG 80 HE ARG 80 4.951 -7.204 -12.897 702 HH11 ARG 80 HH11 ARG 80 5.948 -9.138 -13.374 703 HH12 ARG 80 HH12 ARG 80 6.529 -9.448 -14.985 704 HH21 ARG 80 HH21 ARG 80 5.569 -6.416 -16.261 705 HH22 ARG 80 HH22 ARG 80 6.326 -7.955 -16.577 706 H LEU 81 H LEU 81 0.700 -1.646 -13.535 707 HA LEU 81 HA LEU 81 0.807 0.164 -15.835 708 HB2 LEU 81 HB2 LEU 81 -1.263 -1.022 -15.165 709 HB3 LEU 81 HB3 LEU 81 -1.212 -0.237 -13.587 710 HG LEU 81 HG LEU 81 -1.463 1.991 -14.734 711 HD11 LEU 81 HD11 LEU 81 -1.995 0.250 -17.181 712 HD12 LEU 81 HD12 LEU 81 -2.330 1.993 -17.061 713 HD13 LEU 81 HD13 LEU 81 -0.663 1.416 -16.980 714 HD21 LEU 81 HD21 LEU 81 -3.351 0.873 -13.715 715 HD22 LEU 81 HD22 LEU 81 -3.855 1.722 -15.187 716 HD23 LEU 81 HD23 LEU 81 -3.653 -0.050 -15.209 717 H GLY 82 H GLY 82 0.750 0.605 -12.267 718 HA2 GLY 82 HA2 GLY 82 1.345 2.406 -10.968 719 HA3 GLY 82 HA3 GLY 82 2.137 3.121 -12.379 720 H ARG 83 H ARG 83 0.361 3.890 -14.098 721 HA ARG 83 HA ARG 83 -1.817 5.446 -12.755 722 HB2 ARG 83 HB2 ARG 83 0.288 6.633 -14.617 723 HB3 ARG 83 HB3 ARG 83 -1.096 7.496 -13.951 724 HG2 ARG 83 HG2 ARG 83 1.196 6.337 -12.302 725 HG3 ARG 83 HG3 ARG 83 1.067 8.010 -12.820 726 HD2 ARG 83 HD2 ARG 83 -0.830 8.437 -11.424 727 HD3 ARG 83 HD3 ARG 83 -1.127 6.723 -11.164 728 HE ARG 83 HE ARG 83 0.415 6.634 -9.494 729 HH11 ARG 83 HH11 ARG 83 1.836 7.383 -7.983 730 HH12 ARG 83 HH12 ARG 83 2.570 8.949 -8.171 731 HH21 ARG 83 HH21 ARG 83 0.981 9.698 -11.112 732 HH22 ARG 83 HH22 ARG 83 2.107 10.225 -9.893 733 H THR 84 H THR 84 -3.400 6.294 -14.077 734 HA THR 84 HA THR 84 -4.333 4.451 -16.068 735 HB THR 84 HB THR 84 -5.677 5.656 -14.354 736 HG1 THR 84 HG1 THR 84 -7.448 5.797 -15.619 737 HG21 THR 84 HG21 THR 84 -5.622 8.016 -16.278 738 HG22 THR 84 HG22 THR 84 -6.495 7.886 -14.740 739 HG23 THR 84 HG23 THR 84 -4.725 7.962 -14.743 740 H ASN 85 H ASN 85 -2.340 7.189 -16.528 741 HA ASN 85 HA ASN 85 -3.297 7.623 -19.309 742 HB2 ASN 85 HB2 ASN 85 -1.387 9.259 -17.591 743 HB3 ASN 85 HB3 ASN 85 -1.919 9.673 -19.216 744 HD21 ASN 85 HD21 ASN 85 -4.215 10.807 -16.159 745 HD22 ASN 85 HD22 ASN 85 -2.564 10.238 -15.963 746 H ASN 86 H ASN 86 -2.257 6.825 -20.989 747 HA ASN 86 HA ASN 86 0.647 6.775 -21.115 748 HB2 ASN 86 HB2 ASN 86 0.283 4.552 -20.142 749 HB3 ASN 86 HB3 ASN 86 -0.881 4.150 -21.396 750 HD21 ASN 86 HD21 ASN 86 1.733 2.867 -23.399 751 HD22 ASN 86 HD22 ASN 86 0.074 2.723 -22.842 752 H LEU 87 H LEU 87 -1.882 5.155 -22.955 753 HA LEU 87 HA LEU 87 -1.732 7.063 -25.194 754 HB2 LEU 87 HB2 LEU 87 0.147 5.201 -25.325 755 HB3 LEU 87 HB3 LEU 87 -1.170 4.097 -25.673 756 HG LEU 87 HG LEU 87 -1.725 5.618 -27.690 757 HD11 LEU 87 HD11 LEU 87 1.053 6.715 -27.068 758 HD12 LEU 87 HD12 LEU 87 0.062 7.080 -28.499 759 HD13 LEU 87 HD13 LEU 87 -0.455 7.624 -26.897 760 HD21 LEU 87 HD21 LEU 87 -0.531 3.480 -27.931 761 HD22 LEU 87 HD22 LEU 87 0.093 4.692 -29.062 762 HD23 LEU 87 HD23 LEU 87 1.015 4.290 -27.593 763 H LYS 88 H LYS 88 -3.775 6.608 -23.442 764 HA LYS 88 HA LYS 88 -5.838 4.857 -24.648 765 HB2 LYS 88 HB2 LYS 88 -5.443 4.964 -22.201 766 HB3 LYS 88 HB3 LYS 88 -5.839 6.689 -22.208 767 HG2 LYS 88 HG2 LYS 88 -8.155 6.194 -22.855 768 HG3 LYS 88 HG3 LYS 88 -7.756 4.479 -23.070 769 HD2 LYS 88 HD2 LYS 88 -8.897 4.746 -20.963 770 HD3 LYS 88 HD3 LYS 88 -7.211 4.314 -20.642 771 HE2 LYS 88 HE2 LYS 88 -6.696 6.731 -20.216 772 HE3 LYS 88 HE3 LYS 88 -8.392 7.128 -20.533 773 HZ1 LYS 88 HZ1 LYS 88 -7.356 5.472 -18.289 774 HZ2 LYS 88 HZ2 LYS 88 -8.051 6.930 -18.178 775 HZ3 LYS 88 HZ3 LYS 88 -8.956 5.647 -18.625 776 H THR 89 H THR 89 -4.890 8.202 -24.576 777 HA THR 89 HA THR 89 -6.662 8.886 -26.705 778 HB THR 89 HB THR 89 -8.213 9.264 -24.853 779 HG1 THR 89 HG1 THR 89 -8.668 11.400 -25.359 780 HG21 THR 89 HG21 THR 89 -6.289 11.366 -23.779 781 HG22 THR 89 HG22 THR 89 -7.845 10.849 -23.088 782 HG23 THR 89 HG23 THR 89 -6.455 9.745 -23.077 783 H ILE 90 H ILE 90 -5.488 10.068 -27.996 784 HA ILE 90 HA ILE 90 -3.568 12.091 -27.011 785 HB ILE 90 HB ILE 90 -2.059 11.233 -28.913 786 HG12 ILE 90 HG12 ILE 90 -3.579 9.614 -29.958 787 HG13 ILE 90 HG13 ILE 90 -1.959 9.057 -29.605 788 HG21 ILE 90 HG21 ILE 90 -2.204 9.589 -26.380 789 HG22 ILE 90 HG22 ILE 90 -0.795 9.830 -27.440 790 HG23 ILE 90 HG23 ILE 90 -1.474 11.194 -26.549 791 HD11 ILE 90 HD11 ILE 90 -4.510 8.186 -28.205 792 HD12 ILE 90 HD12 ILE 90 -3.408 7.239 -29.196 793 HD13 ILE 90 HD13 ILE 90 -2.884 7.797 -27.603 794 H GLY 91 H GLY 91 -6.272 11.879 -28.732 795 HA2 GLY 91 HA2 GLY 91 -7.203 12.984 -30.533 796 HA3 GLY 91 HA3 GLY 91 -5.823 14.088 -30.514 797 H ILE 92 H ILE 92 -4.918 10.823 -30.843 798 HA ILE 92 HA ILE 92 -3.801 9.684 -32.403 799 HB ILE 92 HB ILE 92 -6.136 10.210 -34.253 800 HG12 ILE 92 HG12 ILE 92 -6.933 7.958 -33.103 801 HG13 ILE 92 HG13 ILE 92 -5.969 8.498 -31.740 802 HG21 ILE 92 HG21 ILE 92 -4.308 7.791 -33.832 803 HG22 ILE 92 HG22 ILE 92 -5.700 7.856 -34.935 804 HG23 ILE 92 HG23 ILE 92 -4.307 8.855 -35.254 805 HD11 ILE 92 HD11 ILE 92 -8.224 10.115 -33.026 806 HD12 ILE 92 HD12 ILE 92 -8.442 9.004 -31.661 807 HD13 ILE 92 HD13 ILE 92 -7.444 10.438 -31.458 808 H LEU 93 H LEU 93 -2.909 12.286 -32.179 809 HA LEU 93 HA LEU 93 -1.650 13.896 -33.073 810 HB2 LEU 93 HB2 LEU 93 -0.378 11.603 -33.314 811 HB3 LEU 93 HB3 LEU 93 -0.592 11.863 -35.037 812 HG LEU 93 HG LEU 93 0.619 14.116 -34.724 813 HD11 LEU 93 HD11 LEU 93 1.250 12.893 -31.999 814 HD12 LEU 93 HD12 LEU 93 2.037 14.322 -32.705 815 HD13 LEU 93 HD13 LEU 93 0.325 14.384 -32.278 816 HD21 LEU 93 HD21 LEU 93 1.741 12.114 -35.618 817 HD22 LEU 93 HD22 LEU 93 2.840 13.063 -34.606 818 HD23 LEU 93 HD23 LEU 93 2.113 11.570 -33.967 819 H GLN 94 H GLN 94 -4.281 13.735 -34.325 820 HA GLN 94 HA GLN 94 -3.733 14.970 -36.993 821 HB2 GLN 94 HB2 GLN 94 -5.756 13.991 -37.824 822 HB3 GLN 94 HB3 GLN 94 -4.676 12.741 -37.225 823 HG2 GLN 94 HG2 GLN 94 -6.026 12.246 -35.375 824 HG3 GLN 94 HG3 GLN 94 -6.876 13.792 -35.421 825 HE21 GLN 94 HE21 GLN 94 -9.174 12.774 -37.993 826 HE22 GLN 94 HE22 GLN 94 -8.349 14.180 -37.327 827 H GLU 95 H GLU 95 -3.844 16.465 -34.544 828 HA GLU 95 HA GLU 95 -6.410 17.714 -34.190 829 HB2 GLU 95 HB2 GLU 95 -3.592 18.531 -33.382 830 HB3 GLU 95 HB3 GLU 95 -5.038 19.388 -32.859 831 HG2 GLU 95 HG2 GLU 95 -4.528 16.433 -32.282 832 HG3 GLU 95 HG3 GLU 95 -4.103 17.748 -31.198 833 H GLU 96 H GLU 96 -3.885 18.400 -36.512 834 HA GLU 96 HA GLU 96 -5.528 20.594 -37.632 835 HB2 GLU 96 HB2 GLU 96 -3.841 21.609 -36.058 836 HB3 GLU 96 HB3 GLU 96 -2.553 20.974 -37.083 837 HG2 GLU 96 HG2 GLU 96 -3.473 22.309 -39.001 838 HG3 GLU 96 HG3 GLU 96 -4.764 22.900 -37.957 839 H VAL 97 H VAL 97 -6.060 18.924 -39.086 840 HA VAL 97 HA VAL 97 -4.364 18.960 -41.464 841 HB VAL 97 HB VAL 97 -3.562 16.982 -40.202 842 HG11 VAL 97 HG11 VAL 97 -6.331 15.795 -40.628 843 HG12 VAL 97 HG12 VAL 97 -4.910 14.991 -39.930 844 HG13 VAL 97 HG13 VAL 97 -5.671 16.344 -39.072 845 HG21 VAL 97 HG21 VAL 97 -3.463 17.037 -42.683 846 HG22 VAL 97 HG22 VAL 97 -3.553 15.409 -41.995 847 HG23 VAL 97 HG23 VAL 97 -4.993 16.120 -42.735 848 H SER 98 H SER 98 -5.519 18.312 -43.368 849 HA SER 98 HA SER 98 -7.171 18.411 -44.855 850 HB2 SER 98 HB2 SER 98 -8.918 17.189 -42.710 851 HB3 SER 98 HB3 SER 98 -9.260 17.242 -44.447 852 HG SER 98 HG SER 98 -8.297 15.253 -43.808 853 H SER 99 H SER 99 -8.403 19.823 -41.805 854 HA SER 99 HA SER 99 -10.350 21.493 -43.205 855 HB2 SER 99 HB2 SER 99 -9.429 21.509 -40.309 856 HB3 SER 99 HB3 SER 99 -10.840 22.365 -40.961 857 HG SER 99 HG SER 99 -11.401 20.334 -40.032 858 H MET 100 H MET 100 -7.021 21.965 -42.318 859 HA MET 100 HA MET 100 -7.116 24.766 -43.277 860 HB2 MET 100 HB2 MET 100 -7.386 24.554 -40.691 861 HB3 MET 100 HB3 MET 100 -5.672 24.133 -40.684 862 HG2 MET 100 HG2 MET 100 -5.176 26.312 -41.807 863 HG3 MET 100 HG3 MET 100 -6.905 26.666 -41.858 864 HE1 MET 100 HE1 MET 100 -6.471 29.026 -40.788 865 HE2 MET 100 HE2 MET 100 -5.544 29.283 -39.294 866 HE3 MET 100 HE3 MET 100 -4.728 28.674 -40.752 867 H GLU 101 H GLU 101 -6.101 22.311 -44.468 868 HA GLU 101 HA GLU 101 -3.181 22.358 -44.196 869 HB2 GLU 101 HB2 GLU 101 -4.836 20.326 -44.440 870 HB3 GLU 101 HB3 GLU 101 -4.642 20.589 -46.160 871 HG2 GLU 101 HG2 GLU 101 -2.440 20.081 -44.101 872 HG3 GLU 101 HG3 GLU 101 -3.107 18.888 -45.200 873 H ALA 102 H ALA 102 -3.443 24.729 -44.922 874 HA ALA 102 HA ALA 102 -2.519 24.975 -47.709 875 HB1 ALA 102 HB1 ALA 102 -4.981 26.463 -46.673 876 HB2 ALA 102 HB2 ALA 102 -4.202 26.712 -48.250 877 HB3 ALA 102 HB3 ALA 102 -4.990 25.167 -47.890 878 H LYS 103 H LYS 103 -1.769 27.181 -48.199 879 HA LYS 103 HA LYS 103 -1.094 28.926 -45.873 880 HB2 LYS 103 HB2 LYS 103 0.820 28.033 -48.071 881 HB3 LYS 103 HB3 LYS 103 1.096 29.442 -47.041 882 HG2 LYS 103 HG2 LYS 103 0.934 27.964 -45.019 883 HG3 LYS 103 HG3 LYS 103 0.867 26.557 -46.083 884 HD2 LYS 103 HD2 LYS 103 3.126 28.610 -45.974 885 HD3 LYS 103 HD3 LYS 103 3.159 27.055 -45.158 886 HE2 LYS 103 HE2 LYS 103 2.928 27.396 -48.186 887 HE3 LYS 103 HE3 LYS 103 4.450 27.181 -47.324 888 HZ1 LYS 103 HZ1 LYS 103 2.235 25.202 -47.334 889 HZ2 LYS 103 HZ2 LYS 103 3.639 25.067 -48.154 890 HZ3 LYS 103 HZ3 LYS 103 3.647 25.032 -46.525 891 H SER 104 H SER 104 -0.905 31.096 -46.310 892 HA SER 104 HA SER 104 -1.770 32.139 -48.966 893 HB2 SER 104 HB2 SER 104 -2.965 32.962 -46.290 894 HB3 SER 104 HB3 SER 104 -3.273 33.747 -47.850 895 HG SER 104 HG SER 104 -4.905 32.219 -47.303 896 H MET 105 H MET 105 -1.004 34.180 -49.473 897 HA MET 105 HA MET 105 0.973 35.500 -47.672 898 HB2 MET 105 HB2 MET 105 1.484 34.383 -50.458 899 HB3 MET 105 HB3 MET 105 2.505 35.625 -49.729 900 HG2 MET 105 HG2 MET 105 3.083 34.196 -47.872 901 HG3 MET 105 HG3 MET 105 1.987 32.930 -48.416 902 HE1 MET 105 HE1 MET 105 2.332 32.340 -51.352 903 HE2 MET 105 HE2 MET 105 3.712 31.222 -51.354 904 HE3 MET 105 HE3 MET 105 2.485 31.112 -50.074 905 H THR 106 H THR 106 1.741 37.569 -48.558 906 HA THR 106 HA THR 106 -0.041 38.944 -50.471 907 HB THR 106 HB THR 106 -0.984 39.345 -48.216 908 HG1 THR 106 HG1 THR 106 -1.171 41.540 -48.520 909 HG21 THR 106 HG21 THR 106 1.580 40.907 -47.673 910 HG22 THR 106 HG22 THR 106 0.135 40.843 -46.643 911 HG23 THR 106 HG23 THR 106 1.115 39.388 -46.875 912 H TRP 107 H TRP 107 0.757 41.076 -51.036 913 HA TRP 107 HA TRP 107 3.694 40.917 -51.547 914 HB2 TRP 107 HB2 TRP 107 2.155 40.057 -53.367 915 HB3 TRP 107 HB3 TRP 107 1.596 41.708 -53.584 916 HD1 TRP 107 HD1 TRP 107 3.101 43.253 -55.049 917 HE1 TRP 107 HE1 TRP 107 5.296 42.959 -56.358 918 HE3 TRP 107 HE3 TRP 107 4.544 38.716 -53.173 919 HZ2 TRP 107 HZ2 TRP 107 7.409 40.994 -56.562 920 HZ3 TRP 107 HZ3 TRP 107 6.659 37.650 -53.943 921 HH2 TRP 107 HH2 TRP 107 8.094 38.778 -55.632 Start of MODEL 19 1 H1 GLY -5 H1 GLY -5 22.664 -58.630 -38.115 2 H2 GLY -5 H2 GLY -5 22.901 -58.688 -39.736 3 H3 GLY -5 H3 GLY -5 22.242 -57.354 -39.048 4 HA2 GLY -5 HA2 GLY -5 24.997 -58.321 -38.635 5 HA3 GLY -5 HA3 GLY -5 24.538 -56.931 -39.632 6 H SER -4 H SER -4 26.281 -56.189 -37.963 7 HA SER -4 HA SER -4 24.992 -55.134 -35.472 8 HB2 SER -4 HB2 SER -4 27.844 -56.119 -35.811 9 HB3 SER -4 HB3 SER -4 27.107 -55.497 -34.322 10 HG SER -4 HG SER -4 27.096 -57.788 -34.393 11 H HIS -3 H HIS -3 25.259 -53.720 -38.053 12 HA HIS -3 HA HIS -3 27.160 -51.515 -37.342 13 HB2 HIS -3 HB2 HIS -3 27.571 -52.850 -39.438 14 HB3 HIS -3 HB3 HIS -3 26.060 -52.212 -40.082 15 HD2 HIS -3 HD2 HIS -3 26.032 -49.575 -40.760 16 HE1 HIS -3 HE1 HIS -3 30.229 -48.910 -40.346 17 HE2 HIS -3 HE2 HIS -3 28.048 -47.933 -41.227 18 H MET -2 H MET -2 26.345 -49.592 -36.805 19 HA MET -2 HA MET -2 23.777 -48.566 -37.808 20 HB2 MET -2 HB2 MET -2 23.199 -50.083 -35.869 21 HB3 MET -2 HB3 MET -2 24.209 -49.076 -34.828 22 HG2 MET -2 HG2 MET -2 22.734 -47.137 -35.290 23 HG3 MET -2 HG3 MET -2 21.764 -48.138 -36.382 24 HE1 MET -2 HE1 MET -2 19.529 -47.496 -35.146 25 HE2 MET -2 HE2 MET -2 19.313 -47.585 -33.384 26 HE3 MET -2 HE3 MET -2 20.466 -46.424 -34.077 27 H ALA -1 H ALA -1 23.719 -46.394 -37.890 28 HA ALA -1 HA ALA -1 25.359 -44.783 -36.121 29 HB1 ALA -1 HB1 ALA -1 25.816 -44.706 -39.149 30 HB2 ALA -1 HB2 ALA -1 26.557 -43.605 -37.968 31 HB3 ALA -1 HB3 ALA -1 26.971 -45.327 -37.948 32 H SER 0 H SER 0 25.022 -42.497 -36.279 33 HA SER 0 HA SER 0 22.659 -41.476 -37.689 34 HB2 SER 0 HB2 SER 0 21.445 -40.883 -35.690 35 HB3 SER 0 HB3 SER 0 21.781 -42.631 -35.676 36 HG SER 0 HG SER 0 22.188 -41.660 -33.640 37 H MET 1 H MET 1 22.430 -39.166 -37.523 38 HA MET 1 HA MET 1 24.709 -37.592 -36.451 39 HB2 MET 1 HB2 MET 1 23.953 -37.681 -39.405 40 HB3 MET 1 HB3 MET 1 24.992 -36.458 -38.660 41 HG2 MET 1 HG2 MET 1 26.555 -38.252 -37.931 42 HG3 MET 1 HG3 MET 1 25.579 -39.428 -38.823 43 HE1 MET 1 HE1 MET 1 27.820 -40.209 -40.028 44 HE2 MET 1 HE2 MET 1 28.893 -39.107 -40.919 45 HE3 MET 1 HE3 MET 1 28.740 -38.961 -39.155 46 H ASP 2 H ASP 2 22.642 -37.281 -35.081 47 HA ASP 2 HA ASP 2 21.031 -34.982 -36.140 48 HB2 ASP 2 HB2 ASP 2 20.082 -37.384 -34.562 49 HB3 ASP 2 HB3 ASP 2 19.132 -35.926 -34.851 50 HA PRO 3 HA PRO 3 22.672 -33.478 -32.180 51 HB2 PRO 3 HB2 PRO 3 22.876 -30.826 -32.723 52 HB3 PRO 3 HB3 PRO 3 23.948 -32.024 -33.513 53 HG2 PRO 3 HG2 PRO 3 21.390 -30.809 -34.612 54 HG3 PRO 3 HG3 PRO 3 22.985 -30.936 -35.416 55 HD2 PRO 3 HD2 PRO 3 20.962 -32.755 -35.807 56 HD3 PRO 3 HD3 PRO 3 22.689 -33.219 -35.852 57 H LEU 4 H LEU 4 19.631 -33.027 -33.404 58 HA LEU 4 HA LEU 4 18.626 -31.609 -30.964 59 HB2 LEU 4 HB2 LEU 4 17.499 -31.712 -33.789 60 HB3 LEU 4 HB3 LEU 4 16.700 -30.954 -32.417 61 HG LEU 4 HG LEU 4 19.369 -30.057 -33.550 62 HD11 LEU 4 HD11 LEU 4 16.590 -28.831 -33.754 63 HD12 LEU 4 HD12 LEU 4 18.098 -28.128 -34.381 64 HD13 LEU 4 HD13 LEU 4 17.476 -29.635 -35.069 65 HD21 LEU 4 HD21 LEU 4 19.218 -29.495 -31.166 66 HD22 LEU 4 HD22 LEU 4 18.991 -28.042 -32.139 67 HD23 LEU 4 HD23 LEU 4 17.582 -28.833 -31.401 68 H ASP 5 H ASP 5 19.209 -34.216 -30.649 69 HA ASP 5 HA ASP 5 16.531 -35.539 -30.515 70 HB2 ASP 5 HB2 ASP 5 18.921 -36.428 -31.719 71 HB3 ASP 5 HB3 ASP 5 18.857 -37.301 -30.197 72 H LYS 6 H LYS 6 18.403 -33.875 -28.549 73 HA LYS 6 HA LYS 6 18.153 -35.709 -26.182 74 HB2 LYS 6 HB2 LYS 6 20.243 -33.536 -26.252 75 HB3 LYS 6 HB3 LYS 6 20.166 -35.002 -25.309 76 HG2 LYS 6 HG2 LYS 6 21.721 -35.742 -26.762 77 HG3 LYS 6 HG3 LYS 6 20.330 -36.116 -27.773 78 HD2 LYS 6 HD2 LYS 6 21.957 -35.010 -29.144 79 HD3 LYS 6 HD3 LYS 6 20.638 -33.856 -28.896 80 HE2 LYS 6 HE2 LYS 6 21.950 -32.718 -27.126 81 HE3 LYS 6 HE3 LYS 6 23.246 -33.905 -27.303 82 HZ1 LYS 6 HZ1 LYS 6 22.343 -32.097 -29.488 83 HZ2 LYS 6 HZ2 LYS 6 23.651 -31.812 -28.538 84 HZ3 LYS 6 HZ3 LYS 6 23.636 -33.103 -29.532 85 H ILE 7 H ILE 7 18.448 -32.273 -26.915 86 HA ILE 7 HA ILE 7 16.565 -31.552 -24.714 87 HB ILE 7 HB ILE 7 18.030 -29.562 -24.284 88 HG12 ILE 7 HG12 ILE 7 20.434 -29.723 -24.851 89 HG13 ILE 7 HG13 ILE 7 20.112 -31.070 -25.936 90 HG21 ILE 7 HG21 ILE 7 19.349 -32.259 -23.801 91 HG22 ILE 7 HG22 ILE 7 19.564 -30.769 -22.864 92 HG23 ILE 7 HG23 ILE 7 17.997 -31.586 -22.865 93 HD11 ILE 7 HD11 ILE 7 18.987 -28.259 -26.293 94 HD12 ILE 7 HD12 ILE 7 20.448 -28.882 -27.083 95 HD13 ILE 7 HD13 ILE 7 18.881 -29.607 -27.458 96 H ILE 8 H ILE 8 16.438 -31.749 -27.790 97 HA ILE 8 HA ILE 8 16.052 -29.341 -29.053 98 HB ILE 8 HB ILE 8 15.917 -31.393 -30.192 99 HG12 ILE 8 HG12 ILE 8 13.440 -29.660 -30.522 100 HG13 ILE 8 HG13 ILE 8 15.009 -29.485 -31.307 101 HG21 ILE 8 HG21 ILE 8 13.135 -31.987 -29.134 102 HG22 ILE 8 HG22 ILE 8 14.150 -32.986 -30.180 103 HG23 ILE 8 HG23 ILE 8 14.609 -32.745 -28.500 104 HD11 ILE 8 HD11 ILE 8 12.931 -31.659 -31.794 105 HD12 ILE 8 HD12 ILE 8 13.420 -30.359 -32.889 106 HD13 ILE 8 HD13 ILE 8 14.554 -31.668 -32.515 107 H ASN 9 H ASN 9 15.125 -27.570 -28.095 108 HA ASN 9 HA ASN 9 12.202 -27.547 -27.612 109 HB2 ASN 9 HB2 ASN 9 13.765 -28.175 -25.485 110 HB3 ASN 9 HB3 ASN 9 13.927 -26.429 -25.404 111 HD21 ASN 9 HD21 ASN 9 10.363 -26.053 -24.597 112 HD22 ASN 9 HD22 ASN 9 11.549 -25.325 -25.687 113 H ASP 10 H ASP 10 14.777 -25.947 -28.997 114 HA ASP 10 HA ASP 10 14.189 -23.369 -27.900 115 HB2 ASP 10 HB2 ASP 10 16.482 -24.316 -28.389 116 HB3 ASP 10 HB3 ASP 10 16.155 -24.096 -30.106 117 H ILE 11 H ILE 11 12.306 -24.689 -29.858 118 HA ILE 11 HA ILE 11 11.503 -22.288 -31.344 119 HB ILE 11 HB ILE 11 13.205 -23.504 -32.729 120 HG12 ILE 11 HG12 ILE 11 12.165 -23.449 -34.869 121 HG13 ILE 11 HG13 ILE 11 10.548 -23.495 -34.191 122 HG21 ILE 11 HG21 ILE 11 11.141 -25.720 -32.993 123 HG22 ILE 11 HG22 ILE 11 12.697 -25.605 -33.833 124 HG23 ILE 11 HG23 ILE 11 12.664 -25.819 -32.081 125 HD11 ILE 11 HD11 ILE 11 12.562 -21.245 -33.738 126 HD12 ILE 11 HD12 ILE 11 11.256 -21.225 -34.940 127 HD13 ILE 11 HD13 ILE 11 10.857 -21.255 -33.215 128 H LYS 12 H LYS 12 10.371 -23.703 -29.146 129 HA LYS 12 HA LYS 12 7.733 -24.372 -30.382 130 HB2 LYS 12 HB2 LYS 12 9.115 -26.284 -29.279 131 HB3 LYS 12 HB3 LYS 12 8.716 -25.523 -27.749 132 HG2 LYS 12 HG2 LYS 12 7.089 -27.218 -28.040 133 HG3 LYS 12 HG3 LYS 12 6.256 -25.715 -28.397 134 HD2 LYS 12 HD2 LYS 12 5.561 -27.339 -30.031 135 HD3 LYS 12 HD3 LYS 12 6.556 -26.150 -30.850 136 HE2 LYS 12 HE2 LYS 12 7.234 -28.243 -31.710 137 HE3 LYS 12 HE3 LYS 12 8.527 -27.737 -30.621 138 HZ1 LYS 12 HZ1 LYS 12 6.373 -29.682 -29.955 139 HZ2 LYS 12 HZ2 LYS 12 7.920 -30.069 -30.289 140 HZ3 LYS 12 HZ3 LYS 12 7.568 -29.237 -28.931 141 H LYS 13 H LYS 13 9.182 -22.958 -27.482 142 HA LYS 13 HA LYS 13 8.285 -21.815 -25.691 143 HB2 LYS 13 HB2 LYS 13 7.112 -20.247 -28.017 144 HB3 LYS 13 HB3 LYS 13 7.107 -19.700 -26.335 145 HG2 LYS 13 HG2 LYS 13 9.602 -19.899 -26.278 146 HG3 LYS 13 HG3 LYS 13 9.578 -20.235 -28.023 147 HD2 LYS 13 HD2 LYS 13 8.498 -18.056 -28.446 148 HD3 LYS 13 HD3 LYS 13 8.397 -17.744 -26.700 149 HE2 LYS 13 HE2 LYS 13 10.887 -17.852 -26.555 150 HE3 LYS 13 HE3 LYS 13 10.968 -18.073 -28.308 151 HZ1 LYS 13 HZ1 LYS 13 9.821 -15.694 -26.937 152 HZ2 LYS 13 HZ2 LYS 13 11.267 -15.740 -27.687 153 HZ3 LYS 13 HZ3 LYS 13 9.896 -15.890 -28.558 154 H GLU 14 H GLU 14 6.943 -24.106 -25.772 155 HA GLU 14 HA GLU 14 4.071 -23.425 -25.269 156 HB2 GLU 14 HB2 GLU 14 4.461 -25.084 -27.015 157 HB3 GLU 14 HB3 GLU 14 5.343 -26.111 -25.873 158 HG2 GLU 14 HG2 GLU 14 3.292 -26.370 -24.513 159 HG3 GLU 14 HG3 GLU 14 2.430 -25.253 -25.574 160 H ALA 15 H ALA 15 3.221 -23.582 -23.296 161 HA ALA 15 HA ALA 15 4.334 -25.256 -21.180 162 HB1 ALA 15 HB1 ALA 15 4.249 -22.217 -20.876 163 HB2 ALA 15 HB2 ALA 15 4.647 -23.386 -19.599 164 HB3 ALA 15 HB3 ALA 15 5.728 -23.203 -20.991 165 H ASN 16 H ASN 16 3.013 -24.928 -19.121 166 HA ASN 16 HA ASN 16 0.283 -23.882 -19.457 167 HB2 ASN 16 HB2 ASN 16 0.260 -26.294 -20.217 168 HB3 ASN 16 HB3 ASN 16 0.841 -26.759 -18.618 169 HD21 ASN 16 HD21 ASN 16 -2.620 -27.231 -17.919 170 HD22 ASN 16 HD22 ASN 16 -1.099 -28.040 -18.274 171 H ASP 17 H ASP 17 -0.844 -23.692 -17.384 172 HA ASP 17 HA ASP 17 0.739 -23.975 -14.904 173 HB2 ASP 17 HB2 ASP 17 1.328 -21.742 -15.870 174 HB3 ASP 17 HB3 ASP 17 -0.369 -21.279 -15.783 175 H SER 18 H SER 18 -0.585 -25.238 -13.824 176 HA SER 18 HA SER 18 -3.427 -24.425 -13.360 177 HB2 SER 18 HB2 SER 18 -2.421 -27.232 -13.966 178 HB3 SER 18 HB3 SER 18 -4.038 -26.829 -13.362 179 HG SER 18 HG SER 18 -4.099 -27.022 -15.599 180 H GLY 19 H GLY 19 -3.244 -23.706 -11.340 181 HA2 GLY 19 HA2 GLY 19 -3.736 -25.100 -9.168 182 HA3 GLY 19 HA3 GLY 19 -1.989 -25.363 -9.193 183 H VAL 20 H VAL 20 -1.682 -22.487 -10.268 184 HA VAL 20 HA VAL 20 -2.550 -20.869 -7.944 185 HB VAL 20 HB VAL 20 -0.343 -21.603 -7.348 186 HG11 VAL 20 HG11 VAL 20 0.765 -20.318 -9.875 187 HG12 VAL 20 HG12 VAL 20 1.686 -21.058 -8.553 188 HG13 VAL 20 HG13 VAL 20 0.651 -22.064 -9.573 189 HG21 VAL 20 HG21 VAL 20 -1.053 -19.303 -6.760 190 HG22 VAL 20 HG22 VAL 20 0.704 -19.444 -6.946 191 HG23 VAL 20 HG23 VAL 20 -0.259 -18.689 -8.232 192 H THR 21 H THR 21 -3.561 -19.113 -8.621 193 HA THR 21 HA THR 21 -2.509 -17.526 -10.831 194 HB THR 21 HB THR 21 -5.300 -17.737 -11.496 195 HG1 THR 21 HG1 THR 21 -5.393 -19.843 -12.238 196 HG21 THR 21 HG21 THR 21 -2.774 -18.618 -12.945 197 HG22 THR 21 HG22 THR 21 -4.362 -18.314 -13.701 198 HG23 THR 21 HG23 THR 21 -3.467 -16.981 -12.945 199 H LEU 22 H LEU 22 -3.512 -15.524 -11.197 200 HA LEU 22 HA LEU 22 -4.425 -14.257 -8.750 201 HB2 LEU 22 HB2 LEU 22 -3.909 -12.204 -9.834 202 HB3 LEU 22 HB3 LEU 22 -2.584 -13.329 -10.105 203 HG LEU 22 HG LEU 22 -4.672 -13.113 -12.282 204 HD11 LEU 22 HD11 LEU 22 -2.538 -11.001 -11.779 205 HD12 LEU 22 HD12 LEU 22 -3.561 -11.137 -13.230 206 HD13 LEU 22 HD13 LEU 22 -4.296 -10.765 -11.664 207 HD21 LEU 22 HD21 LEU 22 -2.734 -14.645 -12.563 208 HD22 LEU 22 HD22 LEU 22 -2.700 -13.329 -13.734 209 HD23 LEU 22 HD23 LEU 22 -1.627 -13.279 -12.321 210 H ALA 23 H ALA 23 -6.395 -15.949 -9.743 211 HA ALA 23 HA ALA 23 -8.455 -14.124 -10.904 212 HB1 ALA 23 HB1 ALA 23 -7.970 -17.056 -11.478 213 HB2 ALA 23 HB2 ALA 23 -9.266 -16.049 -12.167 214 HB3 ALA 23 HB3 ALA 23 -7.569 -15.681 -12.533 215 HA PRO 24 HA PRO 24 -10.329 -15.583 -6.991 216 HB2 PRO 24 HB2 PRO 24 -11.665 -13.328 -6.257 217 HB3 PRO 24 HB3 PRO 24 -9.899 -13.525 -6.044 218 HG2 PRO 24 HG2 PRO 24 -11.352 -12.117 -8.308 219 HG3 PRO 24 HG3 PRO 24 -9.987 -11.511 -7.323 220 HD2 PRO 24 HD2 PRO 24 -9.617 -12.664 -9.769 221 HD3 PRO 24 HD3 PRO 24 -8.436 -12.886 -8.454 222 H LEU 25 H LEU 25 -12.013 -13.889 -9.654 223 HA LEU 25 HA LEU 25 -14.257 -15.784 -9.537 224 HB2 LEU 25 HB2 LEU 25 -14.562 -13.761 -7.868 225 HB3 LEU 25 HB3 LEU 25 -14.981 -12.843 -9.299 226 HG LEU 25 HG LEU 25 -16.326 -15.396 -8.282 227 HD11 LEU 25 HD11 LEU 25 -17.300 -12.511 -8.318 228 HD12 LEU 25 HD12 LEU 25 -18.209 -13.921 -7.725 229 HD13 LEU 25 HD13 LEU 25 -16.738 -13.405 -6.888 230 HD21 LEU 25 HD21 LEU 25 -16.624 -15.319 -10.708 231 HD22 LEU 25 HD22 LEU 25 -18.140 -14.911 -9.905 232 HD23 LEU 25 HD23 LEU 25 -17.146 -13.619 -10.614 233 H SER 26 H SER 26 -12.970 -16.181 -11.537 234 HA SER 26 HA SER 26 -12.643 -16.116 -13.774 235 HB2 SER 26 HB2 SER 26 -15.131 -16.655 -13.371 236 HB3 SER 26 HB3 SER 26 -15.455 -15.054 -14.054 237 HG SER 26 HG SER 26 -15.463 -16.731 -15.643 238 H VAL 27 H VAL 27 -11.479 -13.936 -12.685 239 HA VAL 27 HA VAL 27 -11.350 -12.034 -14.914 240 HB VAL 27 HB VAL 27 -13.217 -11.271 -13.442 241 HG11 VAL 27 HG11 VAL 27 -11.097 -10.655 -11.350 242 HG12 VAL 27 HG12 VAL 27 -12.824 -10.260 -11.279 243 HG13 VAL 27 HG13 VAL 27 -12.306 -11.949 -11.224 244 HG21 VAL 27 HG21 VAL 27 -11.992 -9.646 -14.824 245 HG22 VAL 27 HG22 VAL 27 -12.564 -8.924 -13.316 246 HG23 VAL 27 HG23 VAL 27 -10.852 -9.351 -13.483 247 HA PRO 28 HA PRO 28 -7.154 -12.214 -13.227 248 HB2 PRO 28 HB2 PRO 28 -5.808 -10.481 -14.824 249 HB3 PRO 28 HB3 PRO 28 -6.506 -12.006 -15.438 250 HG2 PRO 28 HG2 PRO 28 -7.754 -9.237 -15.556 251 HG3 PRO 28 HG3 PRO 28 -7.521 -10.400 -16.901 252 HD2 PRO 28 HD2 PRO 28 -9.872 -10.216 -15.540 253 HD3 PRO 28 HD3 PRO 28 -9.260 -11.786 -16.131 254 H LYS 29 H LYS 29 -8.358 -11.347 -11.363 255 HA LYS 29 HA LYS 29 -8.709 -10.144 -9.554 256 HB2 LYS 29 HB2 LYS 29 -6.236 -10.186 -9.492 257 HB3 LYS 29 HB3 LYS 29 -6.210 -8.583 -10.240 258 HG2 LYS 29 HG2 LYS 29 -5.961 -8.096 -7.949 259 HG3 LYS 29 HG3 LYS 29 -7.701 -7.851 -8.213 260 HD2 LYS 29 HD2 LYS 29 -8.066 -10.196 -7.415 261 HD3 LYS 29 HD3 LYS 29 -6.336 -10.269 -7.056 262 HE2 LYS 29 HE2 LYS 29 -6.580 -8.367 -5.479 263 HE3 LYS 29 HE3 LYS 29 -8.300 -8.253 -5.869 264 HZ1 LYS 29 HZ1 LYS 29 -7.012 -10.614 -4.584 265 HZ2 LYS 29 HZ2 LYS 29 -7.961 -9.526 -3.820 266 HZ3 LYS 29 HZ3 LYS 29 -8.599 -10.499 -4.953 267 HA PRO 30 HA PRO 30 -11.035 -6.588 -11.034 268 HB2 PRO 30 HB2 PRO 30 -12.773 -6.247 -8.987 269 HB3 PRO 30 HB3 PRO 30 -12.871 -7.654 -10.092 270 HG2 PRO 30 HG2 PRO 30 -11.576 -7.529 -7.349 271 HG3 PRO 30 HG3 PRO 30 -12.720 -8.757 -7.977 272 HD2 PRO 30 HD2 PRO 30 -9.996 -9.086 -7.993 273 HD3 PRO 30 HD3 PRO 30 -11.054 -9.794 -9.248 274 H LYS 31 H LYS 31 -10.999 -4.373 -10.717 275 HA LYS 31 HA LYS 31 -8.876 -3.259 -9.043 276 HB2 LYS 31 HB2 LYS 31 -10.931 -1.964 -10.879 277 HB3 LYS 31 HB3 LYS 31 -9.638 -1.092 -10.037 278 HG2 LYS 31 HG2 LYS 31 -7.916 -2.316 -11.240 279 HG3 LYS 31 HG3 LYS 31 -9.109 -3.397 -11.954 280 HD2 LYS 31 HD2 LYS 31 -8.437 -1.890 -13.629 281 HD3 LYS 31 HD3 LYS 31 -10.099 -1.497 -13.226 282 HE2 LYS 31 HE2 LYS 31 -7.722 0.012 -12.040 283 HE3 LYS 31 HE3 LYS 31 -8.360 0.395 -13.637 284 HZ1 LYS 31 HZ1 LYS 31 -9.923 0.580 -11.118 285 HZ2 LYS 31 HZ2 LYS 31 -9.365 1.822 -11.991 286 HZ3 LYS 31 HZ3 LYS 31 -10.524 0.859 -12.618 287 H LEU 32 H LEU 32 -8.991 -2.088 -7.215 288 HA LEU 32 HA LEU 32 -11.586 -1.458 -5.940 289 HB2 LEU 32 HB2 LEU 32 -10.699 -3.761 -5.274 290 HB3 LEU 32 HB3 LEU 32 -9.231 -2.956 -4.729 291 HG LEU 32 HG LEU 32 -10.988 -1.466 -3.366 292 HD11 LEU 32 HD11 LEU 32 -12.349 -4.187 -3.577 293 HD12 LEU 32 HD12 LEU 32 -12.834 -2.854 -2.503 294 HD13 LEU 32 HD13 LEU 32 -12.970 -2.670 -4.262 295 HD21 LEU 32 HD21 LEU 32 -9.115 -2.734 -2.438 296 HD22 LEU 32 HD22 LEU 32 -10.563 -2.884 -1.417 297 HD23 LEU 32 HD23 LEU 32 -10.083 -4.223 -2.492 298 H GLU 33 H GLU 33 -11.509 0.532 -5.015 299 HA GLU 33 HA GLU 33 -8.931 1.836 -4.322 300 HB2 GLU 33 HB2 GLU 33 -10.962 2.952 -6.320 301 HB3 GLU 33 HB3 GLU 33 -9.620 3.869 -5.621 302 HG2 GLU 33 HG2 GLU 33 -7.989 2.345 -6.666 303 HG3 GLU 33 HG3 GLU 33 -9.301 1.378 -7.347 304 H GLU 34 H GLU 34 -10.081 1.048 -2.355 305 HA GLU 34 HA GLU 34 -11.978 3.108 -1.282 306 HB2 GLU 34 HB2 GLU 34 -12.116 0.088 -1.048 307 HB3 GLU 34 HB3 GLU 34 -12.988 1.195 0.034 308 HG2 GLU 34 HG2 GLU 34 -14.010 2.279 -2.003 309 HG3 GLU 34 HG3 GLU 34 -13.301 0.993 -2.983 310 H LEU 35 H LEU 35 -10.208 4.215 -0.561 311 HA LEU 35 HA LEU 35 -9.298 3.411 2.175 312 HB2 LEU 35 HB2 LEU 35 -7.862 4.963 -0.013 313 HB3 LEU 35 HB3 LEU 35 -7.259 4.794 1.629 314 HG LEU 35 HG LEU 35 -7.800 2.375 -0.160 315 HD11 LEU 35 HD11 LEU 35 -5.172 3.822 0.240 316 HD12 LEU 35 HD12 LEU 35 -5.481 2.336 -0.702 317 HD13 LEU 35 HD13 LEU 35 -6.177 3.869 -1.236 318 HD21 LEU 35 HD21 LEU 35 -7.635 1.822 2.211 319 HD22 LEU 35 HD22 LEU 35 -6.149 1.317 1.388 320 HD23 LEU 35 HD23 LEU 35 -6.138 2.780 2.360 321 H SER 36 H SER 36 -8.990 5.183 3.657 322 HA SER 36 HA SER 36 -10.915 7.410 3.386 323 HB2 SER 36 HB2 SER 36 -8.823 6.796 5.512 324 HB3 SER 36 HB3 SER 36 -10.008 8.115 5.582 325 HG SER 36 HG SER 36 -10.735 6.252 6.711 326 H GLU 37 H GLU 37 -10.101 9.739 3.657 327 HA GLU 37 HA GLU 37 -8.423 10.423 1.525 328 HB2 GLU 37 HB2 GLU 37 -10.047 11.916 2.624 329 HB3 GLU 37 HB3 GLU 37 -8.995 12.042 4.040 330 HG2 GLU 37 HG2 GLU 37 -7.241 13.114 2.655 331 HG3 GLU 37 HG3 GLU 37 -8.241 12.913 1.214 332 H GLN 38 H GLN 38 -7.447 10.140 4.961 333 HA GLN 38 HA GLN 38 -4.668 10.849 4.498 334 HB2 GLN 38 HB2 GLN 38 -5.892 11.029 6.704 335 HB3 GLN 38 HB3 GLN 38 -5.922 9.264 6.781 336 HG2 GLN 38 HG2 GLN 38 -3.324 9.394 6.594 337 HG3 GLN 38 HG3 GLN 38 -3.509 11.121 6.892 338 HE21 GLN 38 HE21 GLN 38 -4.154 8.399 9.926 339 HE22 GLN 38 HE22 GLN 38 -4.088 7.848 8.258 340 H GLN 39 H GLN 39 -6.442 7.734 4.722 341 HA GLN 39 HA GLN 39 -4.109 6.071 4.518 342 HB2 GLN 39 HB2 GLN 39 -7.042 5.543 4.082 343 HB3 GLN 39 HB3 GLN 39 -5.791 4.318 3.837 344 HG2 GLN 39 HG2 GLN 39 -4.967 4.681 6.160 345 HG3 GLN 39 HG3 GLN 39 -6.315 5.781 6.452 346 HE21 GLN 39 HE21 GLN 39 -7.053 2.095 7.397 347 HE22 GLN 39 HE22 GLN 39 -5.546 2.964 7.592 348 H LYS 40 H LYS 40 -6.244 7.443 2.006 349 HA LYS 40 HA LYS 40 -4.989 6.135 -0.241 350 HB2 LYS 40 HB2 LYS 40 -7.171 7.279 -0.316 351 HB3 LYS 40 HB3 LYS 40 -6.408 8.836 0.027 352 HG2 LYS 40 HG2 LYS 40 -5.157 8.731 -2.093 353 HG3 LYS 40 HG3 LYS 40 -5.849 7.143 -2.454 354 HD2 LYS 40 HD2 LYS 40 -7.485 9.692 -2.057 355 HD3 LYS 40 HD3 LYS 40 -6.912 9.113 -3.631 356 HE2 LYS 40 HE2 LYS 40 -8.147 6.967 -3.275 357 HE3 LYS 40 HE3 LYS 40 -8.789 7.606 -1.753 358 HZ1 LYS 40 HZ1 LYS 40 -9.263 8.799 -4.437 359 HZ2 LYS 40 HZ2 LYS 40 -10.351 7.930 -3.586 360 HZ3 LYS 40 HZ3 LYS 40 -9.860 9.386 -3.034 361 H ILE 41 H ILE 41 -4.191 9.214 1.491 362 HA ILE 41 HA ILE 41 -1.955 9.841 -0.219 363 HB ILE 41 HB ILE 41 -2.528 10.715 2.598 364 HG12 ILE 41 HG12 ILE 41 -2.877 12.362 0.045 365 HG13 ILE 41 HG13 ILE 41 -4.176 11.337 0.616 366 HG21 ILE 41 HG21 ILE 41 -0.517 11.815 0.596 367 HG22 ILE 41 HG22 ILE 41 -0.974 12.630 2.106 368 HG23 ILE 41 HG23 ILE 41 -0.162 11.077 2.174 369 HD11 ILE 41 HD11 ILE 41 -2.972 13.665 2.157 370 HD12 ILE 41 HD12 ILE 41 -4.577 13.565 1.412 371 HD13 ILE 41 HD13 ILE 41 -4.185 12.530 2.799 372 H ILE 42 H ILE 42 -2.117 7.949 2.899 373 HA ILE 42 HA ILE 42 0.736 7.618 3.080 374 HB ILE 42 HB ILE 42 -1.475 5.800 4.073 375 HG12 ILE 42 HG12 ILE 42 0.205 7.659 5.799 376 HG13 ILE 42 HG13 ILE 42 -1.223 8.283 4.990 377 HG21 ILE 42 HG21 ILE 42 1.521 5.876 4.673 378 HG22 ILE 42 HG22 ILE 42 0.351 4.961 5.639 379 HG23 ILE 42 HG23 ILE 42 0.613 4.529 3.955 380 HD11 ILE 42 HD11 ILE 42 -1.220 5.916 6.905 381 HD12 ILE 42 HD12 ILE 42 -1.810 7.554 7.239 382 HD13 ILE 42 HD13 ILE 42 -2.625 6.543 6.023 383 H LEU 43 H LEU 43 -1.790 5.689 1.521 384 HA LEU 43 HA LEU 43 -0.159 3.604 0.501 385 HB2 LEU 43 HB2 LEU 43 -2.637 3.652 0.675 386 HB3 LEU 43 HB3 LEU 43 -2.735 4.837 -0.604 387 HG LEU 43 HG LEU 43 -3.311 2.432 -1.096 388 HD11 LEU 43 HD11 LEU 43 -1.190 3.620 -2.918 389 HD12 LEU 43 HD12 LEU 43 -2.423 2.426 -3.347 390 HD13 LEU 43 HD13 LEU 43 -2.907 4.071 -2.889 391 HD21 LEU 43 HD21 LEU 43 -1.323 1.476 0.099 392 HD22 LEU 43 HD22 LEU 43 -1.560 0.832 -1.541 393 HD23 LEU 43 HD23 LEU 43 -0.286 2.031 -1.224 394 H ALA 44 H ALA 44 -1.123 6.706 -1.004 395 HA ALA 44 HA ALA 44 0.327 6.331 -3.436 396 HB1 ALA 44 HB1 ALA 44 -0.698 8.820 -2.016 397 HB2 ALA 44 HB2 ALA 44 -0.193 8.747 -3.722 398 HB3 ALA 44 HB3 ALA 44 -1.614 7.824 -3.170 399 H GLU 45 H GLU 45 1.165 8.304 -0.487 400 HA GLU 45 HA GLU 45 3.584 9.270 -1.589 401 HB2 GLU 45 HB2 GLU 45 3.990 10.285 0.400 402 HB3 GLU 45 HB3 GLU 45 2.236 10.120 0.424 403 HG2 GLU 45 HG2 GLU 45 2.527 8.080 1.878 404 HG3 GLU 45 HG3 GLU 45 4.256 8.407 1.936 405 H TYR 46 H TYR 46 2.939 6.157 -0.156 406 HA TYR 46 HA TYR 46 5.670 5.418 0.376 407 HB2 TYR 46 HB2 TYR 46 3.689 4.398 1.426 408 HB3 TYR 46 HB3 TYR 46 3.167 3.764 -0.126 409 HD1 TYR 46 HD1 TYR 46 2.969 1.657 1.281 410 HD2 TYR 46 HD2 TYR 46 6.777 3.502 0.350 411 HE1 TYR 46 HE1 TYR 46 4.156 -0.475 1.775 412 HE2 TYR 46 HE2 TYR 46 7.930 1.369 0.846 413 HH TYR 46 HH TYR 46 6.151 -1.558 1.860 414 H ILE 47 H ILE 47 3.459 4.415 -2.336 415 HA ILE 47 HA ILE 47 5.405 3.270 -4.007 416 HB ILE 47 HB ILE 47 2.723 4.591 -4.444 417 HG12 ILE 47 HG12 ILE 47 3.443 1.645 -4.597 418 HG13 ILE 47 HG13 ILE 47 3.108 2.382 -3.047 419 HG21 ILE 47 HG21 ILE 47 4.329 3.001 -6.486 420 HG22 ILE 47 HG22 ILE 47 2.605 3.377 -6.654 421 HG23 ILE 47 HG23 ILE 47 3.782 4.682 -6.637 422 HD11 ILE 47 HD11 ILE 47 1.128 2.271 -5.360 423 HD12 ILE 47 HD12 ILE 47 1.069 1.349 -3.845 424 HD13 ILE 47 HD13 ILE 47 0.864 3.110 -3.826 425 H ALA 48 H ALA 48 4.317 6.687 -3.697 426 HA ALA 48 HA ALA 48 5.717 7.713 -5.969 427 HB1 ALA 48 HB1 ALA 48 4.879 9.038 -3.364 428 HB2 ALA 48 HB2 ALA 48 5.282 9.883 -4.877 429 HB3 ALA 48 HB3 ALA 48 3.850 8.832 -4.799 430 H GLU 49 H GLU 49 6.912 6.756 -2.810 431 HA GLU 49 HA GLU 49 9.483 8.192 -3.197 432 HB2 GLU 49 HB2 GLU 49 8.290 8.374 -1.056 433 HB3 GLU 49 HB3 GLU 49 8.421 6.624 -0.820 434 HG2 GLU 49 HG2 GLU 49 10.848 6.773 -0.692 435 HG3 GLU 49 HG3 GLU 49 10.820 8.468 -1.191 436 H VAL 50 H VAL 50 8.199 4.828 -3.249 437 HA VAL 50 HA VAL 50 10.998 3.888 -3.766 438 HB VAL 50 HB VAL 50 10.596 1.885 -2.639 439 HG11 VAL 50 HG11 VAL 50 9.426 4.046 -0.851 440 HG12 VAL 50 HG12 VAL 50 10.286 2.577 -0.356 441 HG13 VAL 50 HG13 VAL 50 11.156 3.854 -1.223 442 HG21 VAL 50 HG21 VAL 50 8.280 1.363 -3.200 443 HG22 VAL 50 HG22 VAL 50 8.517 1.307 -1.464 444 HG23 VAL 50 HG23 VAL 50 7.687 2.690 -2.201 445 H GLY 51 H GLY 51 7.822 3.984 -5.128 446 HA2 GLY 51 HA2 GLY 51 7.145 3.240 -7.213 447 HA3 GLY 51 HA3 GLY 51 8.616 2.293 -7.404 448 H LEU 52 H LEU 52 5.783 1.609 -7.821 449 HA LEU 52 HA LEU 52 4.689 0.032 -5.811 450 HB2 LEU 52 HB2 LEU 52 3.630 0.975 -7.976 451 HB3 LEU 52 HB3 LEU 52 4.397 -0.351 -8.833 452 HG LEU 52 HG LEU 52 2.991 -1.919 -7.258 453 HD11 LEU 52 HD11 LEU 52 1.351 0.626 -7.040 454 HD12 LEU 52 HD12 LEU 52 0.962 -0.978 -6.379 455 HD13 LEU 52 HD13 LEU 52 2.317 -0.053 -5.715 456 HD21 LEU 52 HD21 LEU 52 2.567 -1.662 -9.639 457 HD22 LEU 52 HD22 LEU 52 1.049 -1.729 -8.714 458 HD23 LEU 52 HD23 LEU 52 1.639 -0.171 -9.340 459 H GLN 53 H GLN 53 7.312 -0.664 -7.625 460 HA GLN 53 HA GLN 53 7.223 -3.618 -7.622 461 HB2 GLN 53 HB2 GLN 53 9.190 -3.518 -8.987 462 HB3 GLN 53 HB3 GLN 53 8.017 -2.352 -9.591 463 HG2 GLN 53 HG2 GLN 53 9.334 -0.567 -8.231 464 HG3 GLN 53 HG3 GLN 53 10.570 -1.812 -8.014 465 HE21 GLN 53 HE21 GLN 53 10.151 0.003 -11.652 466 HE22 GLN 53 HE22 GLN 53 8.870 0.185 -10.460 467 H ASN 54 H ASN 54 8.421 -1.167 -5.480 468 HA ASN 54 HA ASN 54 10.244 -3.129 -4.146 469 HB2 ASN 54 HB2 ASN 54 10.257 -0.095 -4.087 470 HB3 ASN 54 HB3 ASN 54 11.362 -1.124 -3.186 471 HD21 ASN 54 HD21 ASN 54 12.405 -0.103 -6.857 472 HD22 ASN 54 HD22 ASN 54 11.173 0.714 -5.885 473 H ILE 55 H ILE 55 7.281 -1.634 -3.736 474 HA ILE 55 HA ILE 55 7.157 -1.737 -0.825 475 HB ILE 55 HB ILE 55 4.749 -1.574 -1.056 476 HG12 ILE 55 HG12 ILE 55 5.173 -1.686 -4.061 477 HG13 ILE 55 HG13 ILE 55 4.474 -3.000 -3.112 478 HG21 ILE 55 HG21 ILE 55 5.907 0.382 -3.073 479 HG22 ILE 55 HG22 ILE 55 4.670 0.646 -1.817 480 HG23 ILE 55 HG23 ILE 55 6.351 0.421 -1.362 481 HD11 ILE 55 HD11 ILE 55 3.266 -0.221 -3.387 482 HD12 ILE 55 HD12 ILE 55 2.746 -1.694 -4.225 483 HD13 ILE 55 HD13 ILE 55 2.596 -1.585 -2.466 484 H THR 56 H THR 56 6.010 -3.274 0.466 485 HA THR 56 HA THR 56 5.517 -5.965 -0.704 486 HB THR 56 HB THR 56 6.244 -6.688 1.748 487 HG1 THR 56 HG1 THR 56 8.199 -5.414 2.204 488 HG21 THR 56 HG21 THR 56 8.321 -5.936 -0.360 489 HG22 THR 56 HG22 THR 56 8.530 -7.131 0.942 490 HG23 THR 56 HG23 THR 56 7.362 -7.432 -0.352 491 H ALA 57 H ALA 57 3.657 -6.987 0.060 492 HA ALA 57 HA ALA 57 1.587 -5.408 1.186 493 HB1 ALA 57 HB1 ALA 57 1.878 -8.442 0.991 494 HB2 ALA 57 HB2 ALA 57 0.371 -7.546 1.268 495 HB3 ALA 57 HB3 ALA 57 1.226 -7.376 -0.275 496 H ILE 58 H ILE 58 4.080 -7.352 2.695 497 HA ILE 58 HA ILE 58 2.997 -7.603 5.358 498 HB ILE 58 HB ILE 58 5.823 -7.503 4.213 499 HG12 ILE 58 HG12 ILE 58 5.893 -9.909 4.918 500 HG13 ILE 58 HG13 ILE 58 4.210 -9.818 5.428 501 HG21 ILE 58 HG21 ILE 58 4.937 -7.979 7.104 502 HG22 ILE 58 HG22 ILE 58 6.565 -8.354 6.488 503 HG23 ILE 58 HG23 ILE 58 6.001 -6.687 6.515 504 HD11 ILE 58 HD11 ILE 58 5.152 -9.401 2.556 505 HD12 ILE 58 HD12 ILE 58 4.620 -10.954 3.226 506 HD13 ILE 58 HD13 ILE 58 3.469 -9.621 3.122 507 H THR 59 H THR 59 5.156 -5.208 3.812 508 HA THR 59 HA THR 59 5.286 -3.479 6.135 509 HB THR 59 HB THR 59 6.053 -3.063 3.232 510 HG1 THR 59 HG1 THR 59 7.597 -4.280 3.748 511 HG21 THR 59 HG21 THR 59 6.831 -1.506 5.734 512 HG22 THR 59 HG22 THR 59 7.615 -1.352 4.143 513 HG23 THR 59 HG23 THR 59 5.913 -0.887 4.333 514 H LEU 60 H LEU 60 3.491 -3.348 3.021 515 HA LEU 60 HA LEU 60 2.193 -0.878 3.556 516 HB2 LEU 60 HB2 LEU 60 2.660 -2.110 1.389 517 HB3 LEU 60 HB3 LEU 60 1.255 -3.090 1.692 518 HG LEU 60 HG LEU 60 0.961 -0.073 1.784 519 HD11 LEU 60 HD11 LEU 60 1.163 -1.744 -0.748 520 HD12 LEU 60 HD12 LEU 60 0.677 -0.043 -0.670 521 HD13 LEU 60 HD13 LEU 60 2.320 -0.491 -0.223 522 HD21 LEU 60 HD21 LEU 60 -0.960 -1.600 2.248 523 HD22 LEU 60 HD22 LEU 60 -1.239 -0.617 0.813 524 HD23 LEU 60 HD23 LEU 60 -0.762 -2.312 0.629 525 H SER 61 H SER 61 1.227 -4.233 4.383 526 HA SER 61 HA SER 61 -1.223 -3.750 5.649 527 HB2 SER 61 HB2 SER 61 -0.354 -5.972 5.337 528 HB3 SER 61 HB3 SER 61 0.997 -5.629 6.434 529 HG SER 61 HG SER 61 -0.542 -6.710 7.595 530 H LYS 62 H LYS 62 1.924 -2.912 6.644 531 HA LYS 62 HA LYS 62 1.036 -2.176 9.363 532 HB2 LYS 62 HB2 LYS 62 3.818 -2.589 8.232 533 HB3 LYS 62 HB3 LYS 62 3.495 -2.005 9.871 534 HG2 LYS 62 HG2 LYS 62 2.221 -4.043 10.402 535 HG3 LYS 62 HG3 LYS 62 2.467 -4.660 8.760 536 HD2 LYS 62 HD2 LYS 62 4.933 -4.604 9.131 537 HD3 LYS 62 HD3 LYS 62 4.640 -4.064 10.802 538 HE2 LYS 62 HE2 LYS 62 3.320 -6.143 11.217 539 HE3 LYS 62 HE3 LYS 62 3.641 -6.672 9.561 540 HZ1 LYS 62 HZ1 LYS 62 5.719 -6.225 11.641 541 HZ2 LYS 62 HZ2 LYS 62 5.198 -7.682 11.128 542 HZ3 LYS 62 HZ3 LYS 62 6.024 -6.709 10.110 543 H LYS 63 H LYS 63 2.065 -0.622 6.387 544 HA LYS 63 HA LYS 63 2.680 1.991 7.463 545 HB2 LYS 63 HB2 LYS 63 1.760 0.927 4.770 546 HB3 LYS 63 HB3 LYS 63 2.166 2.624 5.021 547 HG2 LYS 63 HG2 LYS 63 4.297 0.837 6.013 548 HG3 LYS 63 HG3 LYS 63 3.904 0.513 4.319 549 HD2 LYS 63 HD2 LYS 63 4.278 2.801 3.700 550 HD3 LYS 63 HD3 LYS 63 4.556 3.290 5.382 551 HE2 LYS 63 HE2 LYS 63 6.227 1.204 3.932 552 HE3 LYS 63 HE3 LYS 63 6.604 2.928 3.867 553 HZ1 LYS 63 HZ1 LYS 63 6.494 1.331 6.375 554 HZ2 LYS 63 HZ2 LYS 63 7.856 1.839 5.633 555 HZ3 LYS 63 HZ3 LYS 63 6.835 2.927 6.286 556 H LEU 64 H LEU 64 -0.291 0.452 6.349 557 HA LEU 64 HA LEU 64 -1.894 2.875 7.020 558 HB2 LEU 64 HB2 LEU 64 -2.439 0.457 5.267 559 HB3 LEU 64 HB3 LEU 64 -3.587 1.760 5.562 560 HG LEU 64 HG LEU 64 -1.181 3.070 4.788 561 HD11 LEU 64 HD11 LEU 64 -1.819 0.800 2.870 562 HD12 LEU 64 HD12 LEU 64 -0.692 2.149 2.582 563 HD13 LEU 64 HD13 LEU 64 -0.339 0.958 3.837 564 HD21 LEU 64 HD21 LEU 64 -3.459 3.792 4.307 565 HD22 LEU 64 HD22 LEU 64 -2.421 3.757 2.880 566 HD23 LEU 64 HD23 LEU 64 -3.636 2.475 3.115 567 H ASN 65 H ASN 65 -1.061 0.125 8.619 568 HA ASN 65 HA ASN 65 -1.872 -1.155 10.265 569 HB2 ASN 65 HB2 ASN 65 -3.857 1.064 10.872 570 HB3 ASN 65 HB3 ASN 65 -3.240 -0.154 11.976 571 HD21 ASN 65 HD21 ASN 65 -1.123 3.249 11.331 572 HD22 ASN 65 HD22 ASN 65 -2.628 2.929 10.476 573 H ILE 66 H ILE 66 -2.648 -2.144 8.004 574 HA ILE 66 HA ILE 66 -5.562 -2.839 8.187 575 HB ILE 66 HB ILE 66 -5.433 -3.224 5.753 576 HG12 ILE 66 HG12 ILE 66 -2.613 -2.037 5.971 577 HG13 ILE 66 HG13 ILE 66 -3.151 -3.597 5.365 578 HG21 ILE 66 HG21 ILE 66 -4.809 -0.362 6.508 579 HG22 ILE 66 HG22 ILE 66 -5.770 -0.951 5.130 580 HG23 ILE 66 HG23 ILE 66 -6.369 -1.177 6.770 581 HD11 ILE 66 HD11 ILE 66 -3.723 -0.938 4.025 582 HD12 ILE 66 HD12 ILE 66 -2.523 -2.143 3.563 583 HD13 ILE 66 HD13 ILE 66 -4.257 -2.535 3.450 584 H THR 67 H THR 67 -5.386 -4.972 6.302 585 HA THR 67 HA THR 67 -3.750 -6.995 7.738 586 HB THR 67 HB THR 67 -5.139 -8.691 6.718 587 HG1 THR 67 HG1 THR 67 -7.033 -7.905 5.555 588 HG21 THR 67 HG21 THR 67 -6.997 -6.555 7.842 589 HG22 THR 67 HG22 THR 67 -7.264 -8.310 7.795 590 HG23 THR 67 HG23 THR 67 -5.989 -7.639 8.827 591 H VAL 68 H VAL 68 -2.613 -8.585 6.421 592 HA VAL 68 HA VAL 68 -1.222 -7.571 4.111 593 HB VAL 68 HB VAL 68 -1.580 -10.442 5.046 594 HG11 VAL 68 HG11 VAL 68 0.468 -9.230 3.134 595 HG12 VAL 68 HG12 VAL 68 0.537 -10.874 3.798 596 HG13 VAL 68 HG13 VAL 68 -0.778 -10.431 2.716 597 HG21 VAL 68 HG21 VAL 68 -0.482 -9.049 6.765 598 HG22 VAL 68 HG22 VAL 68 0.692 -10.131 6.021 599 HG23 VAL 68 HG23 VAL 68 0.653 -8.419 5.549 600 H GLU 69 H GLU 69 -4.448 -8.888 4.411 601 HA GLU 69 HA GLU 69 -4.550 -9.948 1.665 602 HB2 GLU 69 HB2 GLU 69 -6.668 -9.648 3.840 603 HB3 GLU 69 HB3 GLU 69 -6.942 -10.346 2.239 604 HG2 GLU 69 HG2 GLU 69 -5.226 -12.090 2.707 605 HG3 GLU 69 HG3 GLU 69 -5.002 -11.429 4.329 606 H LYS 70 H LYS 70 -5.650 -7.045 3.545 607 HA LYS 70 HA LYS 70 -6.818 -5.784 1.238 608 HB2 LYS 70 HB2 LYS 70 -5.648 -4.654 3.820 609 HB3 LYS 70 HB3 LYS 70 -6.183 -3.633 2.490 610 HG2 LYS 70 HG2 LYS 70 -8.455 -4.983 2.739 611 HG3 LYS 70 HG3 LYS 70 -7.830 -5.268 4.385 612 HD2 LYS 70 HD2 LYS 70 -7.364 -2.746 4.492 613 HD3 LYS 70 HD3 LYS 70 -8.232 -2.579 2.971 614 HE2 LYS 70 HE2 LYS 70 -9.360 -3.566 5.619 615 HE3 LYS 70 HE3 LYS 70 -9.585 -1.964 4.901 616 HZ1 LYS 70 HZ1 LYS 70 -10.582 -4.512 3.731 617 HZ2 LYS 70 HZ2 LYS 70 -11.499 -3.373 4.449 618 HZ3 LYS 70 HZ3 LYS 70 -10.753 -3.036 3.039 619 H ALA 71 H ALA 71 -3.656 -5.535 2.814 620 HA ALA 71 HA ALA 71 -2.541 -3.596 1.178 621 HB1 ALA 71 HB1 ALA 71 -1.177 -5.912 2.625 622 HB2 ALA 71 HB2 ALA 71 -0.394 -4.414 2.117 623 HB3 ALA 71 HB3 ALA 71 -1.659 -4.368 3.356 624 H LYS 72 H LYS 72 -2.548 -7.120 0.668 625 HA LYS 72 HA LYS 72 -0.883 -7.063 -1.706 626 HB2 LYS 72 HB2 LYS 72 -0.969 -8.938 -0.070 627 HB3 LYS 72 HB3 LYS 72 -2.681 -9.183 -0.424 628 HG2 LYS 72 HG2 LYS 72 -2.168 -9.891 -2.685 629 HG3 LYS 72 HG3 LYS 72 -0.443 -9.557 -2.450 630 HD2 LYS 72 HD2 LYS 72 -2.060 -11.495 -0.725 631 HD3 LYS 72 HD3 LYS 72 -1.223 -12.017 -2.186 632 HE2 LYS 72 HE2 LYS 72 0.171 -10.691 0.190 633 HE3 LYS 72 HE3 LYS 72 -0.030 -12.433 0.017 634 HZ1 LYS 72 HZ1 LYS 72 1.445 -10.730 -1.920 635 HZ2 LYS 72 HZ2 LYS 72 2.122 -11.736 -0.825 636 HZ3 LYS 72 HZ3 LYS 72 1.235 -12.349 -2.043 637 H ASN 73 H ASN 73 -4.391 -6.946 -1.069 638 HA ASN 73 HA ASN 73 -5.215 -7.667 -3.646 639 HB2 ASN 73 HB2 ASN 73 -7.255 -7.328 -2.790 640 HB3 ASN 73 HB3 ASN 73 -6.514 -6.735 -1.320 641 HD21 ASN 73 HD21 ASN 73 -7.280 -3.329 -1.984 642 HD22 ASN 73 HD22 ASN 73 -6.291 -4.415 -1.026 643 H TYR 74 H TYR 74 -4.207 -4.447 -2.485 644 HA TYR 74 HA TYR 74 -4.732 -2.959 -4.809 645 HB2 TYR 74 HB2 TYR 74 -2.481 -2.580 -2.792 646 HB3 TYR 74 HB3 TYR 74 -3.118 -1.354 -3.884 647 HD1 TYR 74 HD1 TYR 74 -3.075 -2.308 -0.588 648 HD2 TYR 74 HD2 TYR 74 -5.908 -1.215 -3.670 649 HE1 TYR 74 HE1 TYR 74 -4.733 -1.638 1.152 650 HE2 TYR 74 HE2 TYR 74 -7.562 -0.564 -1.910 651 HH TYR 74 HH TYR 74 -6.904 -1.011 1.570 652 H ILE 75 H ILE 75 -1.695 -4.549 -3.704 653 HA ILE 75 HA ILE 75 -0.127 -3.957 -5.992 654 HB ILE 75 HB ILE 75 0.121 -6.246 -3.991 655 HG12 ILE 75 HG12 ILE 75 1.402 -3.477 -3.947 656 HG13 ILE 75 HG13 ILE 75 0.021 -3.924 -2.966 657 HG21 ILE 75 HG21 ILE 75 2.232 -4.992 -5.811 658 HG22 ILE 75 HG22 ILE 75 2.545 -6.223 -4.568 659 HG23 ILE 75 HG23 ILE 75 1.567 -6.633 -5.960 660 HD11 ILE 75 HD11 ILE 75 2.820 -5.034 -2.684 661 HD12 ILE 75 HD12 ILE 75 1.904 -4.038 -1.544 662 HD13 ILE 75 HD13 ILE 75 1.386 -5.700 -1.861 663 H LYS 76 H LYS 76 -2.549 -6.426 -5.520 664 HA LYS 76 HA LYS 76 -1.768 -8.053 -7.821 665 HB2 LYS 76 HB2 LYS 76 -2.667 -8.862 -5.543 666 HB3 LYS 76 HB3 LYS 76 -4.236 -8.276 -6.071 667 HG2 LYS 76 HG2 LYS 76 -4.193 -10.595 -6.498 668 HG3 LYS 76 HG3 LYS 76 -4.050 -9.823 -8.070 669 HD2 LYS 76 HD2 LYS 76 -2.565 -11.711 -7.997 670 HD3 LYS 76 HD3 LYS 76 -1.548 -10.268 -7.979 671 HE2 LYS 76 HE2 LYS 76 -1.254 -10.497 -5.529 672 HE3 LYS 76 HE3 LYS 76 -2.386 -11.858 -5.507 673 HZ1 LYS 76 HZ1 LYS 76 0.240 -11.847 -6.903 674 HZ2 LYS 76 HZ2 LYS 76 -0.100 -12.649 -5.524 675 HZ3 LYS 76 HZ3 LYS 76 -0.815 -13.094 -6.913 676 H ASN 77 H ASN 77 -4.110 -5.420 -7.226 677 HA ASN 77 HA ASN 77 -5.284 -5.983 -9.889 678 HB2 ASN 77 HB2 ASN 77 -7.090 -4.498 -9.304 679 HB3 ASN 77 HB3 ASN 77 -6.935 -5.883 -8.251 680 HD21 ASN 77 HD21 ASN 77 -7.570 -3.897 -5.572 681 HD22 ASN 77 HD22 ASN 77 -8.221 -5.046 -6.732 682 H SER 78 H SER 78 -3.527 -3.431 -8.055 683 HA SER 78 HA SER 78 -3.919 -1.441 -10.083 684 HB2 SER 78 HB2 SER 78 -2.902 0.060 -8.647 685 HB3 SER 78 HB3 SER 78 -3.670 -1.112 -7.559 686 HG SER 78 HG SER 78 -1.529 -0.618 -6.933 687 H ASN 79 H ASN 79 -1.724 -3.915 -10.111 688 HA ASN 79 HA ASN 79 0.714 -2.673 -10.743 689 HB2 ASN 79 HB2 ASN 79 1.478 -4.982 -11.215 690 HB3 ASN 79 HB3 ASN 79 0.557 -4.826 -9.723 691 HD21 ASN 79 HD21 ASN 79 -1.671 -7.320 -10.615 692 HD22 ASN 79 HD22 ASN 79 -0.688 -6.503 -9.390 693 H ARG 80 H ARG 80 -1.672 -2.223 -12.746 694 HA ARG 80 HA ARG 80 0.017 -2.294 -15.226 695 HB2 ARG 80 HB2 ARG 80 -2.980 -1.834 -15.076 696 HB3 ARG 80 HB3 ARG 80 -2.003 -2.164 -16.506 697 HG2 ARG 80 HG2 ARG 80 -2.728 -4.096 -14.269 698 HG3 ARG 80 HG3 ARG 80 -3.249 -4.146 -15.950 699 HD2 ARG 80 HD2 ARG 80 -0.917 -4.631 -16.670 700 HD3 ARG 80 HD3 ARG 80 -0.375 -4.519 -14.996 701 HE ARG 80 HE ARG 80 -1.319 -6.535 -14.440 702 HH11 ARG 80 HH11 ARG 80 -1.988 -8.603 -14.911 703 HH12 ARG 80 HH12 ARG 80 -2.609 -8.989 -16.492 704 HH21 ARG 80 HH21 ARG 80 -2.214 -5.830 -17.763 705 HH22 ARG 80 HH22 ARG 80 -2.737 -7.463 -18.070 706 H LEU 81 H LEU 81 -0.764 -0.181 -12.788 707 HA LEU 81 HA LEU 81 -0.930 2.225 -14.502 708 HB2 LEU 81 HB2 LEU 81 -2.166 1.479 -12.161 709 HB3 LEU 81 HB3 LEU 81 -0.874 2.490 -11.531 710 HG LEU 81 HG LEU 81 -2.918 3.298 -13.651 711 HD11 LEU 81 HD11 LEU 81 -2.730 4.036 -10.695 712 HD12 LEU 81 HD12 LEU 81 -3.943 4.617 -11.863 713 HD13 LEU 81 HD13 LEU 81 -3.899 2.905 -11.405 714 HD21 LEU 81 HD21 LEU 81 -0.882 4.635 -13.901 715 HD22 LEU 81 HD22 LEU 81 -2.163 5.619 -13.192 716 HD23 LEU 81 HD23 LEU 81 -0.866 4.983 -12.155 717 H GLY 82 H GLY 82 1.218 0.927 -11.962 718 HA2 GLY 82 HA2 GLY 82 3.355 2.870 -12.623 719 HA3 GLY 82 HA3 GLY 82 3.381 1.680 -11.324 720 H ARG 83 H ARG 83 5.517 2.108 -13.084 721 HA ARG 83 HA ARG 83 7.059 1.091 -14.362 722 HB2 ARG 83 HB2 ARG 83 6.319 -0.702 -12.530 723 HB3 ARG 83 HB3 ARG 83 5.872 -1.636 -13.943 724 HG2 ARG 83 HG2 ARG 83 8.636 -0.399 -13.480 725 HG3 ARG 83 HG3 ARG 83 8.195 -1.987 -12.875 726 HD2 ARG 83 HD2 ARG 83 8.329 -1.210 -15.807 727 HD3 ARG 83 HD3 ARG 83 9.543 -2.114 -14.903 728 HE ARG 83 HE ARG 83 7.019 -3.434 -14.640 729 HH11 ARG 83 HH11 ARG 83 6.555 -5.305 -15.736 730 HH12 ARG 83 HH12 ARG 83 7.457 -5.726 -17.162 731 HH21 ARG 83 HH21 ARG 83 9.475 -2.954 -17.089 732 HH22 ARG 83 HH22 ARG 83 9.072 -4.437 -17.913 733 H THR 84 H THR 84 4.918 2.126 -15.780 734 HA THR 84 HA THR 84 5.583 1.133 -18.413 735 HB THR 84 HB THR 84 4.141 -0.635 -18.088 736 HG1 THR 84 HG1 THR 84 2.437 -0.282 -19.468 737 HG21 THR 84 HG21 THR 84 2.205 1.238 -16.729 738 HG22 THR 84 HG22 THR 84 1.778 -0.413 -17.266 739 HG23 THR 84 HG23 THR 84 3.071 -0.173 -16.080 740 H ASN 85 H ASN 85 6.283 3.361 -18.050 741 HA ASN 85 HA ASN 85 4.327 5.242 -19.221 742 HB2 ASN 85 HB2 ASN 85 5.984 5.853 -16.730 743 HB3 ASN 85 HB3 ASN 85 5.150 7.066 -17.694 744 HD21 ASN 85 HD21 ASN 85 2.999 4.825 -15.069 745 HD22 ASN 85 HD22 ASN 85 4.745 4.653 -15.217 746 H ASN 86 H ASN 86 5.212 6.599 -20.705 747 HA ASN 86 HA ASN 86 8.136 6.324 -21.328 748 HB2 ASN 86 HB2 ASN 86 6.786 4.843 -22.703 749 HB3 ASN 86 HB3 ASN 86 5.651 6.137 -23.084 750 HD21 ASN 86 HD21 ASN 86 9.261 6.108 -25.046 751 HD22 ASN 86 HD22 ASN 86 9.149 5.287 -23.496 752 H LEU 87 H LEU 87 5.648 8.628 -20.785 753 HA LEU 87 HA LEU 87 7.132 10.755 -22.241 754 HB2 LEU 87 HB2 LEU 87 5.080 9.460 -23.441 755 HB3 LEU 87 HB3 LEU 87 4.117 10.539 -22.450 756 HG LEU 87 HG LEU 87 5.426 12.479 -23.526 757 HD11 LEU 87 HD11 LEU 87 6.284 10.246 -25.435 758 HD12 LEU 87 HD12 LEU 87 6.561 11.988 -25.666 759 HD13 LEU 87 HD13 LEU 87 7.371 11.121 -24.355 760 HD21 LEU 87 HD21 LEU 87 3.155 11.858 -24.246 761 HD22 LEU 87 HD22 LEU 87 4.140 12.375 -25.624 762 HD23 LEU 87 HD23 LEU 87 3.827 10.644 -25.359 763 H LYS 88 H LYS 88 7.070 10.220 -19.501 764 HA LYS 88 HA LYS 88 5.363 12.221 -18.157 765 HB2 LYS 88 HB2 LYS 88 5.725 9.951 -17.236 766 HB3 LYS 88 HB3 LYS 88 7.466 10.252 -17.128 767 HG2 LYS 88 HG2 LYS 88 7.129 11.991 -15.479 768 HG3 LYS 88 HG3 LYS 88 5.361 11.923 -15.714 769 HD2 LYS 88 HD2 LYS 88 5.349 9.591 -14.825 770 HD3 LYS 88 HD3 LYS 88 7.103 9.662 -14.633 771 HE2 LYS 88 HE2 LYS 88 6.137 10.035 -12.479 772 HE3 LYS 88 HE3 LYS 88 6.843 11.557 -13.024 773 HZ1 LYS 88 HZ1 LYS 88 3.949 10.873 -13.166 774 HZ2 LYS 88 HZ2 LYS 88 4.624 11.863 -12.061 775 HZ3 LYS 88 HZ3 LYS 88 4.599 12.302 -13.629 776 H THR 89 H THR 89 8.571 11.935 -19.448 777 HA THR 89 HA THR 89 9.052 14.716 -19.096 778 HB THR 89 HB THR 89 9.910 14.011 -16.929 779 HG1 THR 89 HG1 THR 89 11.980 14.845 -17.186 780 HG21 THR 89 HG21 THR 89 11.902 12.238 -18.400 781 HG22 THR 89 HG22 THR 89 11.760 12.484 -16.643 782 HG23 THR 89 HG23 THR 89 10.476 11.634 -17.521 783 H ILE 90 H ILE 90 9.882 15.346 -20.923 784 HA ILE 90 HA ILE 90 11.830 13.715 -22.432 785 HB ILE 90 HB ILE 90 10.507 14.539 -24.509 786 HG12 ILE 90 HG12 ILE 90 8.889 16.000 -23.306 787 HG13 ILE 90 HG13 ILE 90 8.279 14.923 -24.542 788 HG21 ILE 90 HG21 ILE 90 9.406 12.231 -22.893 789 HG22 ILE 90 HG22 ILE 90 9.249 12.491 -24.646 790 HG23 ILE 90 HG23 ILE 90 10.840 12.207 -23.932 791 HD11 ILE 90 HD11 ILE 90 7.873 14.591 -21.547 792 HD12 ILE 90 HD12 ILE 90 6.681 14.980 -22.783 793 HD13 ILE 90 HD13 ILE 90 7.421 13.376 -22.759 794 H GLY 91 H GLY 91 11.562 16.571 -20.954 795 HA2 GLY 91 HA2 GLY 91 12.527 18.654 -21.208 796 HA3 GLY 91 HA3 GLY 91 13.439 18.031 -22.588 797 H ILE 92 H ILE 92 10.093 17.629 -22.992 798 HA ILE 92 HA ILE 92 8.568 18.471 -24.430 799 HB ILE 92 HB ILE 92 9.220 21.118 -23.095 800 HG12 ILE 92 HG12 ILE 92 7.128 20.210 -21.657 801 HG13 ILE 92 HG13 ILE 92 7.771 18.641 -22.101 802 HG21 ILE 92 HG21 ILE 92 6.646 20.022 -24.330 803 HG22 ILE 92 HG22 ILE 92 6.766 21.523 -23.385 804 HG23 ILE 92 HG23 ILE 92 7.587 21.412 -24.915 805 HD11 ILE 92 HD11 ILE 92 9.311 20.857 -20.662 806 HD12 ILE 92 HD12 ILE 92 8.500 19.494 -19.871 807 HD13 ILE 92 HD13 ILE 92 9.884 19.192 -20.919 808 H LEU 93 H LEU 93 10.810 17.953 -25.746 809 HA LEU 93 HA LEU 93 12.037 18.259 -27.584 810 HB2 LEU 93 HB2 LEU 93 9.518 18.155 -28.302 811 HB3 LEU 93 HB3 LEU 93 9.737 19.842 -28.740 812 HG LEU 93 HG LEU 93 11.644 19.072 -30.288 813 HD11 LEU 93 HD11 LEU 93 10.464 16.328 -29.662 814 HD12 LEU 93 HD12 LEU 93 11.621 16.691 -30.959 815 HD13 LEU 93 HD13 LEU 93 12.113 16.863 -29.273 816 HD21 LEU 93 HD21 LEU 93 9.386 19.594 -31.119 817 HD22 LEU 93 HD22 LEU 93 10.105 18.249 -32.018 818 HD23 LEU 93 HD23 LEU 93 8.865 17.928 -30.783 819 H GLN 94 H GLN 94 12.398 20.384 -25.595 820 HA GLN 94 HA GLN 94 13.683 22.482 -27.286 821 HB2 GLN 94 HB2 GLN 94 11.768 22.850 -24.953 822 HB3 GLN 94 HB3 GLN 94 12.899 24.115 -25.473 823 HG2 GLN 94 HG2 GLN 94 11.940 24.003 -27.784 824 HG3 GLN 94 HG3 GLN 94 10.698 22.901 -27.176 825 HE21 GLN 94 HE21 GLN 94 9.059 25.521 -25.261 826 HE22 GLN 94 HE22 GLN 94 9.398 23.789 -25.215 827 H GLU 95 H GLU 95 15.282 20.594 -26.668 828 HA GLU 95 HA GLU 95 16.788 21.309 -24.199 829 HB2 GLU 95 HB2 GLU 95 16.339 18.907 -24.722 830 HB3 GLU 95 HB3 GLU 95 17.266 19.081 -26.210 831 HG2 GLU 95 HG2 GLU 95 18.703 18.081 -24.592 832 HG3 GLU 95 HG3 GLU 95 19.276 19.728 -24.816 833 H GLU 96 H GLU 96 18.017 23.070 -24.448 834 HA GLU 96 HA GLU 96 19.729 23.419 -26.876 835 HB2 GLU 96 HB2 GLU 96 17.962 25.547 -25.597 836 HB3 GLU 96 HB3 GLU 96 19.191 25.836 -26.839 837 HG2 GLU 96 HG2 GLU 96 17.957 24.292 -28.379 838 HG3 GLU 96 HG3 GLU 96 16.669 24.164 -27.175 839 H VAL 97 H VAL 97 21.095 22.298 -25.245 840 HA VAL 97 HA VAL 97 22.663 24.334 -23.760 841 HB VAL 97 HB VAL 97 21.937 21.556 -22.740 842 HG11 VAL 97 HG11 VAL 97 23.760 23.668 -21.505 843 HG12 VAL 97 HG12 VAL 97 23.190 22.197 -20.688 844 HG13 VAL 97 HG13 VAL 97 24.247 22.060 -22.092 845 HG21 VAL 97 HG21 VAL 97 20.115 23.151 -22.391 846 HG22 VAL 97 HG22 VAL 97 20.903 22.808 -20.849 847 HG23 VAL 97 HG23 VAL 97 21.244 24.334 -21.698 848 H SER 98 H SER 98 24.860 24.134 -23.847 849 HA SER 98 HA SER 98 26.084 21.656 -24.872 850 HB2 SER 98 HB2 SER 98 27.374 22.794 -26.597 851 HB3 SER 98 HB3 SER 98 25.623 22.881 -26.884 852 HG SER 98 HG SER 98 26.638 24.907 -27.249 853 H SER 99 H SER 99 27.010 25.042 -24.038 854 HA SER 99 HA SER 99 28.778 24.007 -21.879 855 HB2 SER 99 HB2 SER 99 30.158 24.120 -23.946 856 HB3 SER 99 HB3 SER 99 29.781 25.847 -24.088 857 HG SER 99 HG SER 99 31.777 25.446 -22.991 858 H MET 100 H MET 100 28.141 25.055 -20.143 859 HA MET 100 HA MET 100 27.288 26.561 -18.709 860 HB2 MET 100 HB2 MET 100 28.969 28.533 -20.287 861 HB3 MET 100 HB3 MET 100 28.334 28.773 -18.654 862 HG2 MET 100 HG2 MET 100 29.586 26.765 -17.884 863 HG3 MET 100 HG3 MET 100 30.307 26.621 -19.492 864 HE1 MET 100 HE1 MET 100 32.690 26.537 -18.338 865 HE2 MET 100 HE2 MET 100 33.288 27.777 -17.214 866 HE3 MET 100 HE3 MET 100 31.933 26.730 -16.740 867 H GLU 101 H GLU 101 25.613 26.115 -21.099 868 HA GLU 101 HA GLU 101 24.116 28.618 -21.496 869 HB2 GLU 101 HB2 GLU 101 23.775 25.789 -22.522 870 HB3 GLU 101 HB3 GLU 101 22.636 27.087 -22.891 871 HG2 GLU 101 HG2 GLU 101 25.594 27.152 -23.603 872 HG3 GLU 101 HG3 GLU 101 24.312 26.625 -24.677 873 H ALA 102 H ALA 102 23.860 28.754 -19.082 874 HA ALA 102 HA ALA 102 21.207 27.664 -18.284 875 HB1 ALA 102 HB1 ALA 102 23.733 27.549 -16.578 876 HB2 ALA 102 HB2 ALA 102 22.102 27.066 -16.064 877 HB3 ALA 102 HB3 ALA 102 22.929 26.159 -17.343 878 H LYS 103 H LYS 103 20.217 28.787 -16.505 879 HA LYS 103 HA LYS 103 21.161 31.562 -15.932 880 HB2 LYS 103 HB2 LYS 103 18.370 30.760 -16.868 881 HB3 LYS 103 HB3 LYS 103 18.757 32.307 -16.110 882 HG2 LYS 103 HG2 LYS 103 20.386 32.793 -17.935 883 HG3 LYS 103 HG3 LYS 103 19.897 31.289 -18.746 884 HD2 LYS 103 HD2 LYS 103 17.569 32.110 -18.899 885 HD3 LYS 103 HD3 LYS 103 18.027 33.599 -18.045 886 HE2 LYS 103 HE2 LYS 103 19.633 34.141 -19.865 887 HE3 LYS 103 HE3 LYS 103 19.149 32.674 -20.727 888 HZ1 LYS 103 HZ1 LYS 103 17.338 34.942 -20.076 889 HZ2 LYS 103 HZ2 LYS 103 17.955 34.625 -21.551 890 HZ3 LYS 103 HZ3 LYS 103 16.892 33.589 -20.876 891 H SER 104 H SER 104 20.519 32.435 -14.007 892 HA SER 104 HA SER 104 19.715 30.600 -11.843 893 HB2 SER 104 HB2 SER 104 20.424 33.556 -11.789 894 HB3 SER 104 HB3 SER 104 20.161 32.517 -10.375 895 HG SER 104 HG SER 104 22.391 32.717 -10.899 896 H MET 105 H MET 105 18.075 31.315 -10.255 897 HA MET 105 HA MET 105 15.838 32.969 -11.287 898 HB2 MET 105 HB2 MET 105 15.674 30.255 -11.583 899 HB3 MET 105 HB3 MET 105 15.069 30.416 -9.929 900 HG2 MET 105 HG2 MET 105 13.368 32.057 -10.764 901 HG3 MET 105 HG3 MET 105 14.061 31.935 -12.378 902 HE1 MET 105 HE1 MET 105 11.808 30.320 -9.652 903 HE2 MET 105 HE2 MET 105 11.505 28.689 -10.282 904 HE3 MET 105 HE3 MET 105 13.117 29.113 -9.665 905 H THR 106 H THR 106 14.073 32.857 -9.349 906 HA THR 106 HA THR 106 15.499 33.673 -6.847 907 HB THR 106 HB THR 106 12.834 34.654 -7.875 908 HG1 THR 106 HG1 THR 106 13.935 36.512 -8.477 909 HG21 THR 106 HG21 THR 106 14.668 35.694 -5.669 910 HG22 THR 106 HG22 THR 106 13.240 36.555 -6.287 911 HG23 THR 106 HG23 THR 106 13.036 35.007 -5.468 912 H TRP 107 H TRP 107 14.673 33.158 -4.923 913 HA TRP 107 HA TRP 107 12.877 30.799 -4.816 914 HB2 TRP 107 HB2 TRP 107 15.132 31.639 -2.988 915 HB3 TRP 107 HB3 TRP 107 13.969 30.389 -2.583 916 HD1 TRP 107 HD1 TRP 107 14.262 28.038 -3.594 917 HE1 TRP 107 HE1 TRP 107 16.066 26.878 -5.009 918 HE3 TRP 107 HE3 TRP 107 16.909 32.160 -5.045 919 HZ2 TRP 107 HZ2 TRP 107 18.375 27.647 -6.566 920 HZ3 TRP 107 HZ3 TRP 107 18.924 31.923 -6.490 921 HH2 TRP 107 HH2 TRP 107 19.663 29.676 -7.255 Start of MODEL 20 1 H1 GLY -5 H1 GLY -5 2.211 -32.505 28.245 2 H2 GLY -5 H2 GLY -5 2.203 -30.877 28.065 3 H3 GLY -5 H3 GLY -5 0.819 -31.731 27.859 4 HA2 GLY -5 HA2 GLY -5 0.764 -30.606 29.978 5 HA3 GLY -5 HA3 GLY -5 0.787 -32.368 30.179 6 H SER -4 H SER -4 1.785 -32.443 32.167 7 HA SER -4 HA SER -4 4.424 -31.125 32.562 8 HB2 SER -4 HB2 SER -4 2.582 -32.490 34.550 9 HB3 SER -4 HB3 SER -4 4.110 -31.671 34.929 10 HG SER -4 HG SER -4 2.284 -30.300 35.239 11 H HIS -3 H HIS -3 6.188 -32.227 33.407 12 HA HIS -3 HA HIS -3 7.861 -33.701 33.260 13 HB2 HIS -3 HB2 HIS -3 5.675 -35.662 33.931 14 HB3 HIS -3 HB3 HIS -3 7.273 -36.230 33.497 15 HD2 HIS -3 HD2 HIS -3 6.033 -33.416 35.929 16 HE1 HIS -3 HE1 HIS -3 9.082 -35.651 37.906 17 HE2 HIS -3 HE2 HIS -3 7.454 -33.704 38.134 18 H MET -2 H MET -2 9.005 -35.260 32.032 19 HA MET -2 HA MET -2 8.412 -34.821 29.187 20 HB2 MET -2 HB2 MET -2 10.613 -34.248 30.377 21 HB3 MET -2 HB3 MET -2 10.952 -35.977 30.385 22 HG2 MET -2 HG2 MET -2 12.041 -34.963 28.495 23 HG3 MET -2 HG3 MET -2 10.731 -35.963 27.874 24 HE1 MET -2 HE1 MET -2 11.104 -34.714 25.517 25 HE2 MET -2 HE2 MET -2 11.044 -32.948 25.324 26 HE3 MET -2 HE3 MET -2 12.365 -33.693 26.249 27 H ALA -1 H ALA -1 6.553 -36.363 29.608 28 HA ALA -1 HA ALA -1 7.286 -38.972 28.446 29 HB1 ALA -1 HB1 ALA -1 5.674 -38.660 31.019 30 HB2 ALA -1 HB2 ALA -1 5.957 -40.189 30.155 31 HB3 ALA -1 HB3 ALA -1 7.319 -39.321 30.893 32 H SER 0 H SER 0 5.515 -40.166 27.568 33 HA SER 0 HA SER 0 2.850 -38.992 27.313 34 HB2 SER 0 HB2 SER 0 4.192 -37.838 25.528 35 HB3 SER 0 HB3 SER 0 4.541 -39.424 24.814 36 HG SER 0 HG SER 0 2.707 -38.319 23.886 37 H MET 1 H MET 1 1.376 -40.488 26.181 38 HA MET 1 HA MET 1 2.296 -43.290 25.937 39 HB2 MET 1 HB2 MET 1 1.275 -42.583 28.317 40 HB3 MET 1 HB3 MET 1 -0.244 -42.941 27.507 41 HG2 MET 1 HG2 MET 1 2.196 -44.749 27.784 42 HG3 MET 1 HG3 MET 1 0.704 -44.888 28.703 43 HE1 MET 1 HE1 MET 1 0.980 -47.524 28.093 44 HE2 MET 1 HE2 MET 1 0.994 -48.137 26.424 45 HE3 MET 1 HE3 MET 1 2.363 -47.179 27.029 46 H ASP 2 H ASP 2 2.066 -42.111 23.798 47 HA ASP 2 HA ASP 2 1.119 -41.971 21.729 48 HB2 ASP 2 HB2 ASP 2 0.106 -44.687 22.598 49 HB3 ASP 2 HB3 ASP 2 0.271 -44.110 20.935 50 HA PRO 3 HA PRO 3 -3.095 -40.571 23.095 51 HB2 PRO 3 HB2 PRO 3 -2.999 -37.957 22.263 52 HB3 PRO 3 HB3 PRO 3 -2.223 -38.530 23.769 53 HG2 PRO 3 HG2 PRO 3 -0.931 -38.212 21.032 54 HG3 PRO 3 HG3 PRO 3 -0.375 -37.522 22.595 55 HD2 PRO 3 HD2 PRO 3 0.657 -39.828 21.665 56 HD3 PRO 3 HD3 PRO 3 0.269 -39.663 23.405 57 H LEU 4 H LEU 4 -1.822 -41.286 20.177 58 HA LEU 4 HA LEU 4 -4.391 -41.001 18.775 59 HB2 LEU 4 HB2 LEU 4 -3.456 -40.185 16.763 60 HB3 LEU 4 HB3 LEU 4 -3.136 -39.068 18.068 61 HG LEU 4 HG LEU 4 -1.023 -41.049 17.099 62 HD11 LEU 4 HD11 LEU 4 -1.544 -38.198 16.161 63 HD12 LEU 4 HD12 LEU 4 -0.152 -39.213 15.703 64 HD13 LEU 4 HD13 LEU 4 -1.787 -39.673 15.201 65 HD21 LEU 4 HD21 LEU 4 -0.468 -40.035 19.236 66 HD22 LEU 4 HD22 LEU 4 0.531 -39.303 17.984 67 HD23 LEU 4 HD23 LEU 4 -0.879 -38.420 18.618 68 H ASP 5 H ASP 5 -3.166 -43.303 20.045 69 HA ASP 5 HA ASP 5 -2.891 -45.101 17.689 70 HB2 ASP 5 HB2 ASP 5 -1.674 -45.044 20.271 71 HB3 ASP 5 HB3 ASP 5 -2.713 -46.447 20.266 72 H LYS 6 H LYS 6 -5.396 -43.905 19.278 73 HA LYS 6 HA LYS 6 -6.994 -46.452 19.457 74 HB2 LYS 6 HB2 LYS 6 -7.130 -44.194 21.507 75 HB3 LYS 6 HB3 LYS 6 -7.885 -45.782 21.558 76 HG2 LYS 6 HG2 LYS 6 -6.104 -46.273 22.878 77 HG3 LYS 6 HG3 LYS 6 -5.356 -46.605 21.324 78 HD2 LYS 6 HD2 LYS 6 -3.728 -45.295 22.267 79 HD3 LYS 6 HD3 LYS 6 -4.653 -44.014 21.453 80 HE2 LYS 6 HE2 LYS 6 -5.599 -43.245 23.458 81 HE3 LYS 6 HE3 LYS 6 -5.392 -44.792 24.285 82 HZ1 LYS 6 HZ1 LYS 6 -3.069 -43.120 23.517 83 HZ2 LYS 6 HZ2 LYS 6 -3.787 -43.021 24.997 84 HZ3 LYS 6 HZ3 LYS 6 -3.067 -44.399 24.509 85 H ILE 7 H ILE 7 -7.539 -42.965 19.745 86 HA ILE 7 HA ILE 7 -10.094 -43.237 18.244 87 HB ILE 7 HB ILE 7 -10.760 -41.124 19.353 88 HG12 ILE 7 HG12 ILE 7 -9.661 -40.430 21.434 89 HG13 ILE 7 HG13 ILE 7 -8.320 -41.531 21.150 90 HG21 ILE 7 HG21 ILE 7 -10.027 -43.422 21.215 91 HG22 ILE 7 HG22 ILE 7 -11.299 -42.208 21.471 92 HG23 ILE 7 HG23 ILE 7 -11.437 -43.363 20.137 93 HD11 ILE 7 HD11 ILE 7 -9.048 -39.186 19.336 94 HD12 ILE 7 HD12 ILE 7 -7.825 -39.138 20.620 95 HD13 ILE 7 HD13 ILE 7 -7.583 -40.200 19.230 96 H ILE 8 H ILE 8 -7.124 -42.675 17.365 97 HA ILE 8 HA ILE 8 -6.921 -40.305 15.976 98 HB ILE 8 HB ILE 8 -5.176 -41.937 16.091 99 HG12 ILE 8 HG12 ILE 8 -5.839 -41.234 13.202 100 HG13 ILE 8 HG13 ILE 8 -5.111 -40.151 14.392 101 HG21 ILE 8 HG21 ILE 8 -6.549 -43.591 13.935 102 HG22 ILE 8 HG22 ILE 8 -5.030 -43.951 14.777 103 HG23 ILE 8 HG23 ILE 8 -6.552 -44.017 15.657 104 HD11 ILE 8 HD11 ILE 8 -3.854 -42.672 13.239 105 HD12 ILE 8 HD12 ILE 8 -3.395 -40.993 12.923 106 HD13 ILE 8 HD13 ILE 8 -3.139 -41.683 14.536 107 H ASN 9 H ASN 9 -7.830 -39.292 14.374 108 HA ASN 9 HA ASN 9 -9.343 -40.590 12.206 109 HB2 ASN 9 HB2 ASN 9 -10.892 -40.246 14.260 110 HB3 ASN 9 HB3 ASN 9 -10.755 -38.519 13.921 111 HD21 ASN 9 HD21 ASN 9 -12.695 -38.811 10.851 112 HD22 ASN 9 HD22 ASN 9 -11.257 -37.992 11.484 113 H ASP 10 H ASP 10 -6.979 -39.464 11.950 114 HA ASP 10 HA ASP 10 -7.392 -36.672 11.019 115 HB2 ASP 10 HB2 ASP 10 -4.920 -38.046 12.122 116 HB3 ASP 10 HB3 ASP 10 -4.973 -36.381 11.538 117 H ILE 11 H ILE 11 -7.667 -39.279 9.584 118 HA ILE 11 HA ILE 11 -6.595 -38.543 7.006 119 HB ILE 11 HB ILE 11 -4.614 -39.503 8.205 120 HG12 ILE 11 HG12 ILE 11 -5.335 -41.169 5.776 121 HG13 ILE 11 HG13 ILE 11 -4.827 -39.480 5.725 122 HG21 ILE 11 HG21 ILE 11 -5.947 -42.224 8.079 123 HG22 ILE 11 HG22 ILE 11 -4.359 -41.813 8.743 124 HG23 ILE 11 HG23 ILE 11 -5.814 -41.231 9.545 125 HD11 ILE 11 HD11 ILE 11 -3.181 -41.827 6.758 126 HD12 ILE 11 HD12 ILE 11 -2.931 -40.911 5.264 127 HD13 ILE 11 HD13 ILE 11 -2.678 -40.120 6.833 128 H LYS 12 H LYS 12 -9.178 -38.759 7.765 129 HA LYS 12 HA LYS 12 -10.070 -41.200 6.291 130 HB2 LYS 12 HB2 LYS 12 -9.955 -41.810 8.665 131 HB3 LYS 12 HB3 LYS 12 -10.982 -40.436 9.100 132 HG2 LYS 12 HG2 LYS 12 -12.869 -41.401 7.870 133 HG3 LYS 12 HG3 LYS 12 -11.846 -42.724 7.273 134 HD2 LYS 12 HD2 LYS 12 -11.580 -43.595 9.540 135 HD3 LYS 12 HD3 LYS 12 -12.453 -42.196 10.217 136 HE2 LYS 12 HE2 LYS 12 -14.462 -42.794 8.931 137 HE3 LYS 12 HE3 LYS 12 -13.620 -44.167 8.204 138 HZ1 LYS 12 HZ1 LYS 12 -14.190 -43.873 11.109 139 HZ2 LYS 12 HZ2 LYS 12 -14.985 -44.870 10.091 140 HZ3 LYS 12 HZ3 LYS 12 -13.414 -45.143 10.431 141 H LYS 13 H LYS 13 -11.092 -38.072 7.597 142 HA LYS 13 HA LYS 13 -13.421 -38.068 5.769 143 HB2 LYS 13 HB2 LYS 13 -13.905 -38.932 8.135 144 HB3 LYS 13 HB3 LYS 13 -13.653 -37.276 8.691 145 HG2 LYS 13 HG2 LYS 13 -15.535 -36.519 7.253 146 HG3 LYS 13 HG3 LYS 13 -15.698 -38.153 6.589 147 HD2 LYS 13 HD2 LYS 13 -16.264 -39.032 8.817 148 HD3 LYS 13 HD3 LYS 13 -16.070 -37.430 9.537 149 HE2 LYS 13 HE2 LYS 13 -18.079 -38.101 7.335 150 HE3 LYS 13 HE3 LYS 13 -18.455 -38.165 9.058 151 HZ1 LYS 13 HZ1 LYS 13 -17.600 -35.716 7.610 152 HZ2 LYS 13 HZ2 LYS 13 -19.114 -36.040 8.122 153 HZ3 LYS 13 HZ3 LYS 13 -17.926 -35.793 9.210 154 H GLU 14 H GLU 14 -11.080 -36.759 5.261 155 HA GLU 14 HA GLU 14 -11.751 -33.858 5.588 156 HB2 GLU 14 HB2 GLU 14 -8.996 -35.140 5.736 157 HB3 GLU 14 HB3 GLU 14 -9.353 -33.418 5.801 158 HG2 GLU 14 HG2 GLU 14 -9.502 -33.547 8.000 159 HG3 GLU 14 HG3 GLU 14 -10.977 -34.467 7.846 160 H ALA 15 H ALA 15 -10.896 -32.416 4.026 161 HA ALA 15 HA ALA 15 -10.824 -33.531 1.282 162 HB1 ALA 15 HB1 ALA 15 -11.216 -30.694 2.298 163 HB2 ALA 15 HB2 ALA 15 -11.391 -31.250 0.618 164 HB3 ALA 15 HB3 ALA 15 -12.512 -31.833 1.864 165 H ASN 16 H ASN 16 -9.528 -32.077 -0.273 166 HA ASN 16 HA ASN 16 -6.697 -31.803 0.663 167 HB2 ASN 16 HB2 ASN 16 -7.845 -33.316 -1.715 168 HB3 ASN 16 HB3 ASN 16 -6.127 -32.949 -1.530 169 HD21 ASN 16 HD21 ASN 16 -5.609 -35.344 1.085 170 HD22 ASN 16 HD22 ASN 16 -5.008 -33.825 0.438 171 H ASP 17 H ASP 17 -7.553 -29.499 0.740 172 HA ASP 17 HA ASP 17 -7.803 -28.127 -1.853 173 HB2 ASP 17 HB2 ASP 17 -7.927 -27.045 0.982 174 HB3 ASP 17 HB3 ASP 17 -8.296 -26.137 -0.487 175 H SER 18 H SER 18 -5.340 -29.313 -1.670 176 HA SER 18 HA SER 18 -3.373 -27.437 -0.724 177 HB2 SER 18 HB2 SER 18 -2.998 -30.003 -2.306 178 HB3 SER 18 HB3 SER 18 -1.721 -29.086 -1.481 179 HG SER 18 HG SER 18 -2.463 -30.785 -0.166 180 H GLY 19 H GLY 19 -4.198 -25.664 -2.059 181 HA2 GLY 19 HA2 GLY 19 -3.362 -24.025 -3.562 182 HA3 GLY 19 HA3 GLY 19 -2.545 -25.270 -4.503 183 H VAL 20 H VAL 20 -5.535 -23.581 -3.918 184 HA VAL 20 HA VAL 20 -6.536 -24.248 -6.602 185 HB VAL 20 HB VAL 20 -7.498 -25.967 -5.175 186 HG11 VAL 20 HG11 VAL 20 -8.920 -23.781 -3.611 187 HG12 VAL 20 HG12 VAL 20 -9.133 -25.532 -3.441 188 HG13 VAL 20 HG13 VAL 20 -7.590 -24.791 -2.999 189 HG21 VAL 20 HG21 VAL 20 -8.776 -25.110 -7.115 190 HG22 VAL 20 HG22 VAL 20 -9.817 -25.727 -5.821 191 HG23 VAL 20 HG23 VAL 20 -9.628 -23.978 -6.038 192 H THR 21 H THR 21 -7.575 -22.623 -7.557 193 HA THR 21 HA THR 21 -8.281 -20.557 -8.084 194 HB THR 21 HB THR 21 -9.331 -20.319 -5.283 195 HG1 THR 21 HG1 THR 21 -11.143 -21.338 -6.116 196 HG21 THR 21 HG21 THR 21 -10.202 -19.090 -7.932 197 HG22 THR 21 HG22 THR 21 -11.237 -19.147 -6.487 198 HG23 THR 21 HG23 THR 21 -9.738 -18.234 -6.436 199 H LEU 22 H LEU 22 -8.119 -18.184 -7.771 200 HA LEU 22 HA LEU 22 -5.626 -17.372 -6.384 201 HB2 LEU 22 HB2 LEU 22 -4.894 -16.144 -8.263 202 HB3 LEU 22 HB3 LEU 22 -5.179 -17.800 -8.761 203 HG LEU 22 HG LEU 22 -7.253 -15.624 -9.291 204 HD11 LEU 22 HD11 LEU 22 -4.894 -16.412 -11.049 205 HD12 LEU 22 HD12 LEU 22 -6.231 -15.331 -11.511 206 HD13 LEU 22 HD13 LEU 22 -5.116 -14.851 -10.225 207 HD21 LEU 22 HD21 LEU 22 -8.052 -17.918 -9.706 208 HD22 LEU 22 HD22 LEU 22 -7.809 -17.078 -11.233 209 HD23 LEU 22 HD23 LEU 22 -6.606 -18.262 -10.682 210 H ALA 23 H ALA 23 -8.140 -17.057 -5.295 211 HA ALA 23 HA ALA 23 -8.906 -14.226 -5.614 212 HB1 ALA 23 HB1 ALA 23 -10.140 -16.508 -4.030 213 HB2 ALA 23 HB2 ALA 23 -10.826 -14.877 -4.197 214 HB3 ALA 23 HB3 ALA 23 -10.658 -15.920 -5.626 215 HA PRO 24 HA PRO 24 -6.682 -13.235 -1.764 216 HB2 PRO 24 HB2 PRO 24 -7.333 -10.609 -1.497 217 HB3 PRO 24 HB3 PRO 24 -6.211 -11.198 -2.760 218 HG2 PRO 24 HG2 PRO 24 -9.165 -10.567 -3.043 219 HG3 PRO 24 HG3 PRO 24 -7.816 -10.058 -4.106 220 HD2 PRO 24 HD2 PRO 24 -9.403 -12.232 -4.648 221 HD3 PRO 24 HD3 PRO 24 -7.671 -12.178 -5.101 222 H LEU 25 H LEU 25 -10.127 -12.722 -2.275 223 HA LEU 25 HA LEU 25 -10.747 -13.762 0.391 224 HB2 LEU 25 HB2 LEU 25 -10.582 -11.351 0.847 225 HB3 LEU 25 HB3 LEU 25 -11.683 -11.005 -0.482 226 HG LEU 25 HG LEU 25 -13.522 -12.171 0.728 227 HD11 LEU 25 HD11 LEU 25 -11.475 -12.446 2.974 228 HD12 LEU 25 HD12 LEU 25 -13.222 -12.730 3.132 229 HD13 LEU 25 HD13 LEU 25 -12.257 -13.779 2.093 230 HD21 LEU 25 HD21 LEU 25 -13.180 -9.748 0.999 231 HD22 LEU 25 HD22 LEU 25 -13.821 -10.479 2.478 232 HD23 LEU 25 HD23 LEU 25 -12.099 -10.045 2.379 233 H SER 26 H SER 26 -12.292 -12.150 -2.237 234 HA SER 26 HA SER 26 -13.795 -14.515 -3.127 235 HB2 SER 26 HB2 SER 26 -15.980 -13.426 -2.957 236 HB3 SER 26 HB3 SER 26 -15.218 -13.603 -1.363 237 HG SER 26 HG SER 26 -16.155 -11.520 -1.669 238 H VAL 27 H VAL 27 -14.707 -14.286 -5.192 239 HA VAL 27 HA VAL 27 -14.324 -14.059 -7.386 240 HB VAL 27 HB VAL 27 -14.036 -11.163 -6.638 241 HG11 VAL 27 HG11 VAL 27 -14.270 -12.168 -9.497 242 HG12 VAL 27 HG12 VAL 27 -14.277 -10.496 -8.950 243 HG13 VAL 27 HG13 VAL 27 -12.800 -11.443 -8.788 244 HG21 VAL 27 HG21 VAL 27 -16.267 -12.134 -6.348 245 HG22 VAL 27 HG22 VAL 27 -16.257 -10.963 -7.669 246 HG23 VAL 27 HG23 VAL 27 -16.253 -12.702 -8.032 247 HA PRO 28 HA PRO 28 -9.920 -14.712 -7.788 248 HB2 PRO 28 HB2 PRO 28 -9.612 -15.032 -10.491 249 HB3 PRO 28 HB3 PRO 28 -10.394 -16.234 -9.428 250 HG2 PRO 28 HG2 PRO 28 -11.761 -14.076 -11.076 251 HG3 PRO 28 HG3 PRO 28 -12.117 -15.836 -11.047 252 HD2 PRO 28 HD2 PRO 28 -13.563 -14.148 -9.547 253 HD3 PRO 28 HD3 PRO 28 -13.038 -15.704 -8.862 254 H LYS 29 H LYS 29 -9.844 -12.548 -6.933 255 HA LYS 29 HA LYS 29 -8.929 -10.499 -6.662 256 HB2 LYS 29 HB2 LYS 29 -6.937 -11.611 -7.539 257 HB3 LYS 29 HB3 LYS 29 -7.367 -11.169 -9.176 258 HG2 LYS 29 HG2 LYS 29 -7.279 -8.756 -7.515 259 HG3 LYS 29 HG3 LYS 29 -5.842 -9.677 -7.237 260 HD2 LYS 29 HD2 LYS 29 -5.281 -8.275 -8.909 261 HD3 LYS 29 HD3 LYS 29 -5.436 -9.806 -9.737 262 HE2 LYS 29 HE2 LYS 29 -7.731 -7.817 -9.653 263 HE3 LYS 29 HE3 LYS 29 -6.325 -7.460 -10.660 264 HZ1 LYS 29 HZ1 LYS 29 -8.134 -9.776 -10.926 265 HZ2 LYS 29 HZ2 LYS 29 -7.874 -8.614 -12.030 266 HZ3 LYS 29 HZ3 LYS 29 -6.689 -9.704 -11.732 267 HA PRO 30 HA PRO 30 -11.665 -8.110 -9.413 268 HB2 PRO 30 HB2 PRO 30 -13.128 -6.818 -7.507 269 HB3 PRO 30 HB3 PRO 30 -13.507 -8.477 -8.053 270 HG2 PRO 30 HG2 PRO 30 -12.002 -7.624 -5.570 271 HG3 PRO 30 HG3 PRO 30 -13.269 -8.875 -5.726 272 HD2 PRO 30 HD2 PRO 30 -10.549 -9.399 -5.711 273 HD3 PRO 30 HD3 PRO 30 -11.741 -10.441 -6.542 274 H LYS 31 H LYS 31 -11.054 -6.050 -10.102 275 HA LYS 31 HA LYS 31 -8.840 -4.633 -8.822 276 HB2 LYS 31 HB2 LYS 31 -10.622 -3.869 -11.150 277 HB3 LYS 31 HB3 LYS 31 -9.267 -2.906 -10.543 278 HG2 LYS 31 HG2 LYS 31 -7.798 -4.993 -10.879 279 HG3 LYS 31 HG3 LYS 31 -9.140 -5.664 -11.816 280 HD2 LYS 31 HD2 LYS 31 -7.633 -3.068 -12.378 281 HD3 LYS 31 HD3 LYS 31 -7.449 -4.588 -13.258 282 HE2 LYS 31 HE2 LYS 31 -9.803 -4.453 -14.022 283 HE3 LYS 31 HE3 LYS 31 -10.022 -2.948 -13.120 284 HZ1 LYS 31 HZ1 LYS 31 -8.114 -3.311 -15.369 285 HZ2 LYS 31 HZ2 LYS 31 -9.532 -2.509 -15.453 286 HZ3 LYS 31 HZ3 LYS 31 -8.323 -1.923 -14.529 287 H LEU 32 H LEU 32 -9.002 -3.488 -7.062 288 HA LEU 32 HA LEU 32 -11.089 -1.422 -6.770 289 HB2 LEU 32 HB2 LEU 32 -11.775 -2.155 -4.623 290 HB3 LEU 32 HB3 LEU 32 -11.866 -3.537 -5.696 291 HG LEU 32 HG LEU 32 -9.293 -3.790 -4.606 292 HD11 LEU 32 HD11 LEU 32 -11.216 -2.919 -2.408 293 HD12 LEU 32 HD12 LEU 32 -9.578 -3.567 -2.186 294 HD13 LEU 32 HD13 LEU 32 -9.795 -2.002 -2.971 295 HD21 LEU 32 HD21 LEU 32 -10.824 -5.620 -4.982 296 HD22 LEU 32 HD22 LEU 32 -10.196 -5.654 -3.336 297 HD23 LEU 32 HD23 LEU 32 -11.857 -5.077 -3.635 298 H GLU 33 H GLU 33 -10.530 0.318 -5.474 299 HA GLU 33 HA GLU 33 -7.991 0.400 -3.978 300 HB2 GLU 33 HB2 GLU 33 -8.570 2.317 -6.278 301 HB3 GLU 33 HB3 GLU 33 -7.343 2.571 -5.028 302 HG2 GLU 33 HG2 GLU 33 -6.257 0.413 -5.731 303 HG3 GLU 33 HG3 GLU 33 -7.367 0.363 -7.112 304 H GLU 34 H GLU 34 -9.643 0.348 -2.298 305 HA GLU 34 HA GLU 34 -11.046 2.946 -1.856 306 HB2 GLU 34 HB2 GLU 34 -12.498 1.000 -2.361 307 HB3 GLU 34 HB3 GLU 34 -11.794 0.128 -1.001 308 HG2 GLU 34 HG2 GLU 34 -13.882 0.969 -0.275 309 HG3 GLU 34 HG3 GLU 34 -12.653 1.932 0.533 310 H LEU 35 H LEU 35 -10.056 4.143 -0.454 311 HA LEU 35 HA LEU 35 -9.193 3.161 2.208 312 HB2 LEU 35 HB2 LEU 35 -7.510 4.684 0.179 313 HB3 LEU 35 HB3 LEU 35 -7.139 4.674 1.892 314 HG LEU 35 HG LEU 35 -7.211 2.209 0.113 315 HD11 LEU 35 HD11 LEU 35 -4.883 3.721 1.339 316 HD12 LEU 35 HD12 LEU 35 -4.792 2.217 0.396 317 HD13 LEU 35 HD13 LEU 35 -5.350 3.710 -0.379 318 HD21 LEU 35 HD21 LEU 35 -7.751 1.535 2.386 319 HD22 LEU 35 HD22 LEU 35 -6.060 1.125 2.084 320 HD23 LEU 35 HD23 LEU 35 -6.462 2.539 3.061 321 H SER 36 H SER 36 -8.794 4.897 3.738 322 HA SER 36 HA SER 36 -10.799 7.058 3.596 323 HB2 SER 36 HB2 SER 36 -8.620 6.434 5.631 324 HB3 SER 36 HB3 SER 36 -9.833 7.720 5.791 325 HG SER 36 HG SER 36 -10.458 5.779 6.867 326 H GLU 37 H GLU 37 -10.072 9.414 3.928 327 HA GLU 37 HA GLU 37 -8.520 10.225 1.756 328 HB2 GLU 37 HB2 GLU 37 -10.222 11.546 3.066 329 HB3 GLU 37 HB3 GLU 37 -9.016 11.763 4.333 330 HG2 GLU 37 HG2 GLU 37 -8.987 13.751 3.097 331 HG3 GLU 37 HG3 GLU 37 -7.538 12.901 2.584 332 H GLN 38 H GLN 38 -7.406 9.963 5.153 333 HA GLN 38 HA GLN 38 -4.682 10.832 4.620 334 HB2 GLN 38 HB2 GLN 38 -5.828 10.900 6.873 335 HB3 GLN 38 HB3 GLN 38 -5.824 9.135 6.888 336 HG2 GLN 38 HG2 GLN 38 -3.217 9.356 6.633 337 HG3 GLN 38 HG3 GLN 38 -3.463 11.043 7.074 338 HE21 GLN 38 HE21 GLN 38 -3.975 8.054 9.881 339 HE22 GLN 38 HE22 GLN 38 -3.941 7.642 8.173 340 H GLN 39 H GLN 39 -6.285 7.640 4.840 341 HA GLN 39 HA GLN 39 -3.922 6.061 4.539 342 HB2 GLN 39 HB2 GLN 39 -6.837 5.508 4.085 343 HB3 GLN 39 HB3 GLN 39 -5.569 4.328 3.732 344 HG2 GLN 39 HG2 GLN 39 -4.752 4.454 6.057 345 HG3 GLN 39 HG3 GLN 39 -6.045 5.588 6.460 346 HE21 GLN 39 HE21 GLN 39 -6.991 1.935 7.205 347 HE22 GLN 39 HE22 GLN 39 -5.456 2.735 7.479 348 H LYS 40 H LYS 40 -6.170 7.387 2.100 349 HA LYS 40 HA LYS 40 -4.932 6.210 -0.210 350 HB2 LYS 40 HB2 LYS 40 -7.167 7.183 -0.194 351 HB3 LYS 40 HB3 LYS 40 -6.521 8.787 0.181 352 HG2 LYS 40 HG2 LYS 40 -5.337 8.856 -1.982 353 HG3 LYS 40 HG3 LYS 40 -5.927 7.238 -2.384 354 HD2 LYS 40 HD2 LYS 40 -7.726 9.645 -1.830 355 HD3 LYS 40 HD3 LYS 40 -7.167 9.170 -3.442 356 HE2 LYS 40 HE2 LYS 40 -8.230 6.929 -3.140 357 HE3 LYS 40 HE3 LYS 40 -8.862 7.455 -1.572 358 HZ1 LYS 40 HZ1 LYS 40 -9.514 8.720 -4.184 359 HZ2 LYS 40 HZ2 LYS 40 -10.509 7.741 -3.339 360 HZ3 LYS 40 HZ3 LYS 40 -10.101 9.204 -2.738 361 H ILE 41 H ILE 41 -4.195 9.266 1.544 362 HA ILE 41 HA ILE 41 -2.067 10.054 -0.233 363 HB ILE 41 HB ILE 41 -2.491 10.754 2.654 364 HG12 ILE 41 HG12 ILE 41 -3.081 12.535 0.239 365 HG13 ILE 41 HG13 ILE 41 -4.298 11.420 0.818 366 HG21 ILE 41 HG21 ILE 41 -0.679 12.053 0.587 367 HG22 ILE 41 HG22 ILE 41 -1.055 12.754 2.173 368 HG23 ILE 41 HG23 ILE 41 -0.182 11.236 2.084 369 HD11 ILE 41 HD11 ILE 41 -3.096 13.693 2.438 370 HD12 ILE 41 HD12 ILE 41 -4.737 13.577 1.775 371 HD13 ILE 41 HD13 ILE 41 -4.232 12.475 3.067 372 H ILE 42 H ILE 42 -2.018 8.057 2.820 373 HA ILE 42 HA ILE 42 0.853 7.820 2.863 374 HB ILE 42 HB ILE 42 -1.274 5.941 3.940 375 HG12 ILE 42 HG12 ILE 42 0.443 7.823 5.601 376 HG13 ILE 42 HG13 ILE 42 -1.036 8.415 4.862 377 HG21 ILE 42 HG21 ILE 42 1.741 6.047 4.435 378 HG22 ILE 42 HG22 ILE 42 0.613 5.107 5.421 379 HG23 ILE 42 HG23 ILE 42 0.824 4.700 3.726 380 HD11 ILE 42 HD11 ILE 42 -0.887 6.047 6.769 381 HD12 ILE 42 HD12 ILE 42 -1.506 7.668 7.130 382 HD13 ILE 42 HD13 ILE 42 -2.346 6.635 5.948 383 H LEU 43 H LEU 43 -1.672 5.781 1.422 384 HA LEU 43 HA LEU 43 -0.052 3.735 0.310 385 HB2 LEU 43 HB2 LEU 43 -2.482 3.652 0.525 386 HB3 LEU 43 HB3 LEU 43 -2.697 4.972 -0.593 387 HG LEU 43 HG LEU 43 -3.298 2.677 -1.378 388 HD11 LEU 43 HD11 LEU 43 -1.198 4.001 -3.129 389 HD12 LEU 43 HD12 LEU 43 -2.524 2.945 -3.629 390 HD13 LEU 43 HD13 LEU 43 -2.878 4.543 -2.951 391 HD21 LEU 43 HD21 LEU 43 -1.575 1.356 -0.459 392 HD22 LEU 43 HD22 LEU 43 -1.483 1.202 -2.215 393 HD23 LEU 43 HD23 LEU 43 -0.286 2.200 -1.353 394 H ALA 44 H ALA 44 -1.138 6.818 -1.161 395 HA ALA 44 HA ALA 44 0.314 6.563 -3.595 396 HB1 ALA 44 HB1 ALA 44 -0.692 8.988 -2.055 397 HB2 ALA 44 HB2 ALA 44 -0.203 8.994 -3.767 398 HB3 ALA 44 HB3 ALA 44 -1.620 8.048 -3.244 399 H GLU 45 H GLU 45 1.168 8.511 -0.635 400 HA GLU 45 HA GLU 45 3.665 9.419 -1.650 401 HB2 GLU 45 HB2 GLU 45 2.627 9.030 1.177 402 HB3 GLU 45 HB3 GLU 45 4.194 9.753 0.836 403 HG2 GLU 45 HG2 GLU 45 1.580 10.863 -0.276 404 HG3 GLU 45 HG3 GLU 45 2.320 11.392 1.230 405 H TYR 46 H TYR 46 2.890 6.289 -0.166 406 HA TYR 46 HA TYR 46 5.631 5.534 0.330 407 HB2 TYR 46 HB2 TYR 46 3.738 4.557 1.502 408 HB3 TYR 46 HB3 TYR 46 3.072 3.942 -0.003 409 HD1 TYR 46 HD1 TYR 46 6.727 3.574 0.469 410 HD2 TYR 46 HD2 TYR 46 2.850 1.804 1.139 411 HE1 TYR 46 HE1 TYR 46 7.805 1.374 0.870 412 HE2 TYR 46 HE2 TYR 46 3.944 -0.426 1.487 413 HH TYR 46 HH TYR 46 7.486 -0.845 1.290 414 H ILE 47 H ILE 47 3.358 4.579 -2.348 415 HA ILE 47 HA ILE 47 5.261 3.277 -4.000 416 HB ILE 47 HB ILE 47 2.629 4.677 -4.406 417 HG12 ILE 47 HG12 ILE 47 3.330 1.732 -4.677 418 HG13 ILE 47 HG13 ILE 47 2.998 2.417 -3.103 419 HG21 ILE 47 HG21 ILE 47 4.220 3.179 -6.526 420 HG22 ILE 47 HG22 ILE 47 2.490 3.542 -6.670 421 HG23 ILE 47 HG23 ILE 47 3.650 4.859 -6.600 422 HD11 ILE 47 HD11 ILE 47 0.997 2.463 -5.404 423 HD12 ILE 47 HD12 ILE 47 0.992 1.339 -4.030 424 HD13 ILE 47 HD13 ILE 47 0.745 3.073 -3.769 425 H ALA 48 H ALA 48 4.355 6.739 -3.723 426 HA ALA 48 HA ALA 48 5.857 7.644 -5.997 427 HB1 ALA 48 HB1 ALA 48 4.965 9.085 -3.469 428 HB2 ALA 48 HB2 ALA 48 5.479 9.864 -4.983 429 HB3 ALA 48 HB3 ALA 48 3.999 8.881 -4.947 430 H GLU 49 H GLU 49 6.888 6.742 -2.769 431 HA GLU 49 HA GLU 49 9.508 8.093 -3.062 432 HB2 GLU 49 HB2 GLU 49 8.138 8.190 -0.948 433 HB3 GLU 49 HB3 GLU 49 8.413 6.459 -0.751 434 HG2 GLU 49 HG2 GLU 49 9.949 7.630 0.649 435 HG3 GLU 49 HG3 GLU 49 10.888 6.923 -0.650 436 H VAL 50 H VAL 50 8.150 4.762 -3.238 437 HA VAL 50 HA VAL 50 10.956 3.766 -3.606 438 HB VAL 50 HB VAL 50 10.465 1.752 -2.549 439 HG11 VAL 50 HG11 VAL 50 9.247 3.895 -0.770 440 HG12 VAL 50 HG12 VAL 50 10.060 2.402 -0.267 441 HG13 VAL 50 HG13 VAL 50 10.989 3.683 -1.064 442 HG21 VAL 50 HG21 VAL 50 8.169 1.288 -3.236 443 HG22 VAL 50 HG22 VAL 50 8.337 1.170 -1.494 444 HG23 VAL 50 HG23 VAL 50 7.556 2.592 -2.214 445 H GLY 51 H GLY 51 7.770 3.812 -5.027 446 HA2 GLY 51 HA2 GLY 51 7.294 3.192 -7.242 447 HA3 GLY 51 HA3 GLY 51 8.692 2.127 -7.296 448 H LEU 52 H LEU 52 5.795 1.759 -7.886 449 HA LEU 52 HA LEU 52 4.366 0.355 -6.008 450 HB2 LEU 52 HB2 LEU 52 3.588 1.449 -8.126 451 HB3 LEU 52 HB3 LEU 52 4.399 0.200 -9.061 452 HG LEU 52 HG LEU 52 2.767 -1.491 -8.232 453 HD11 LEU 52 HD11 LEU 52 1.401 0.926 -6.972 454 HD12 LEU 52 HD12 LEU 52 0.741 -0.719 -7.053 455 HD13 LEU 52 HD13 LEU 52 2.167 -0.393 -6.060 456 HD21 LEU 52 HD21 LEU 52 2.413 -0.255 -10.325 457 HD22 LEU 52 HD22 LEU 52 0.861 -0.559 -9.511 458 HD23 LEU 52 HD23 LEU 52 1.619 1.047 -9.427 459 H GLN 53 H GLN 53 6.889 -0.786 -7.766 460 HA GLN 53 HA GLN 53 6.363 -3.690 -7.405 461 HB2 GLN 53 HB2 GLN 53 8.172 -4.073 -8.953 462 HB3 GLN 53 HB3 GLN 53 6.973 -3.002 -9.648 463 HG2 GLN 53 HG2 GLN 53 9.591 -2.021 -8.408 464 HG3 GLN 53 HG3 GLN 53 9.429 -2.464 -10.097 465 HE21 GLN 53 HE21 GLN 53 9.037 1.230 -9.893 466 HE22 GLN 53 HE22 GLN 53 10.301 0.107 -9.415 467 H ASN 54 H ASN 54 8.008 -1.258 -5.697 468 HA ASN 54 HA ASN 54 9.859 -3.221 -4.417 469 HB2 ASN 54 HB2 ASN 54 9.929 -0.189 -4.445 470 HB3 ASN 54 HB3 ASN 54 11.102 -1.220 -3.637 471 HD21 ASN 54 HD21 ASN 54 12.010 -0.172 -7.261 472 HD22 ASN 54 HD22 ASN 54 10.959 0.697 -6.132 473 H ILE 55 H ILE 55 7.020 -1.499 -3.863 474 HA ILE 55 HA ILE 55 7.007 -1.640 -0.960 475 HB ILE 55 HB ILE 55 4.615 -1.437 -1.039 476 HG12 ILE 55 HG12 ILE 55 4.811 -1.780 -4.047 477 HG13 ILE 55 HG13 ILE 55 4.094 -2.939 -2.922 478 HG21 ILE 55 HG21 ILE 55 5.677 0.435 -3.186 479 HG22 ILE 55 HG22 ILE 55 4.438 0.743 -1.940 480 HG23 ILE 55 HG23 ILE 55 6.116 0.558 -1.474 481 HD11 ILE 55 HD11 ILE 55 3.054 -0.158 -3.527 482 HD12 ILE 55 HD12 ILE 55 2.334 -1.696 -3.995 483 HD13 ILE 55 HD13 ILE 55 2.394 -1.246 -2.272 484 H THR 56 H THR 56 5.888 -3.179 0.379 485 HA THR 56 HA THR 56 5.412 -5.862 -0.831 486 HB THR 56 HB THR 56 6.192 -6.556 1.654 487 HG1 THR 56 HG1 THR 56 8.196 -5.296 1.961 488 HG21 THR 56 HG21 THR 56 8.186 -5.908 -0.566 489 HG22 THR 56 HG22 THR 56 8.431 -7.068 0.763 490 HG23 THR 56 HG23 THR 56 7.205 -7.388 -0.473 491 H ALA 57 H ALA 57 3.655 -7.031 0.045 492 HA ALA 57 HA ALA 57 1.491 -5.554 1.120 493 HB1 ALA 57 HB1 ALA 57 2.034 -8.560 1.125 494 HB2 ALA 57 HB2 ALA 57 0.466 -7.769 1.391 495 HB3 ALA 57 HB3 ALA 57 1.262 -7.649 -0.192 496 H ILE 58 H ILE 58 4.137 -7.227 2.670 497 HA ILE 58 HA ILE 58 3.092 -7.407 5.368 498 HB ILE 58 HB ILE 58 5.884 -7.420 4.136 499 HG12 ILE 58 HG12 ILE 58 5.920 -9.811 4.888 500 HG13 ILE 58 HG13 ILE 58 4.257 -9.673 5.448 501 HG21 ILE 58 HG21 ILE 58 5.031 -7.765 7.047 502 HG22 ILE 58 HG22 ILE 58 6.632 -8.266 6.435 503 HG23 ILE 58 HG23 ILE 58 6.163 -6.566 6.391 504 HD11 ILE 58 HD11 ILE 58 5.112 -9.341 2.538 505 HD12 ILE 58 HD12 ILE 58 4.575 -10.868 3.263 506 HD13 ILE 58 HD13 ILE 58 3.446 -9.517 3.165 507 H THR 59 H THR 59 5.009 -5.009 3.548 508 HA THR 59 HA THR 59 5.325 -3.253 5.887 509 HB THR 59 HB THR 59 5.963 -2.841 2.953 510 HG1 THR 59 HG1 THR 59 7.533 -4.054 3.405 511 HG21 THR 59 HG21 THR 59 6.776 -1.303 5.469 512 HG22 THR 59 HG22 THR 59 7.518 -1.095 3.862 513 HG23 THR 59 HG23 THR 59 5.811 -0.682 4.106 514 H LEU 60 H LEU 60 3.404 -3.326 2.875 515 HA LEU 60 HA LEU 60 2.000 -0.914 3.333 516 HB2 LEU 60 HB2 LEU 60 2.298 -2.258 1.170 517 HB3 LEU 60 HB3 LEU 60 1.063 -3.350 1.764 518 HG LEU 60 HG LEU 60 -0.526 -1.357 1.838 519 HD11 LEU 60 HD11 LEU 60 1.723 -0.029 0.263 520 HD12 LEU 60 HD12 LEU 60 0.122 0.647 0.594 521 HD13 LEU 60 HD13 LEU 60 1.234 0.425 1.919 522 HD21 LEU 60 HD21 LEU 60 -0.501 -2.934 -0.059 523 HD22 LEU 60 HD22 LEU 60 -0.855 -1.282 -0.598 524 HD23 LEU 60 HD23 LEU 60 0.759 -1.977 -0.850 525 H SER 61 H SER 61 1.251 -4.271 4.422 526 HA SER 61 HA SER 61 -1.227 -3.685 5.651 527 HB2 SER 61 HB2 SER 61 -1.019 -5.653 6.915 528 HB3 SER 61 HB3 SER 61 -0.400 -5.961 5.298 529 HG SER 61 HG SER 61 0.921 -6.780 7.049 530 H LYS 62 H LYS 62 1.932 -2.832 6.559 531 HA LYS 62 HA LYS 62 1.146 -2.084 9.310 532 HB2 LYS 62 HB2 LYS 62 3.878 -2.385 8.035 533 HB3 LYS 62 HB3 LYS 62 3.616 -1.803 9.686 534 HG2 LYS 62 HG2 LYS 62 2.492 -3.895 10.310 535 HG3 LYS 62 HG3 LYS 62 2.641 -4.505 8.656 536 HD2 LYS 62 HD2 LYS 62 5.142 -4.274 8.856 537 HD3 LYS 62 HD3 LYS 62 4.907 -3.848 10.570 538 HE2 LYS 62 HE2 LYS 62 3.748 -6.033 10.924 539 HE3 LYS 62 HE3 LYS 62 3.992 -6.432 9.217 540 HZ1 LYS 62 HZ1 LYS 62 6.170 -5.995 11.195 541 HZ2 LYS 62 HZ2 LYS 62 5.704 -7.445 10.612 542 HZ3 LYS 62 HZ3 LYS 62 6.402 -6.354 9.617 543 H LYS 63 H LYS 63 2.251 -0.519 6.314 544 HA LYS 63 HA LYS 63 2.788 2.096 7.347 545 HB2 LYS 63 HB2 LYS 63 1.925 0.950 4.673 546 HB3 LYS 63 HB3 LYS 63 2.189 2.679 4.859 547 HG2 LYS 63 HG2 LYS 63 4.352 0.655 5.556 548 HG3 LYS 63 HG3 LYS 63 4.054 1.178 3.898 549 HD2 LYS 63 HD2 LYS 63 4.395 3.564 4.680 550 HD3 LYS 63 HD3 LYS 63 4.926 2.886 6.244 551 HE2 LYS 63 HE2 LYS 63 6.685 1.588 5.068 552 HE3 LYS 63 HE3 LYS 63 6.139 2.240 3.517 553 HZ1 LYS 63 HZ1 LYS 63 7.248 3.863 5.749 554 HZ2 LYS 63 HZ2 LYS 63 8.041 3.482 4.376 555 HZ3 LYS 63 HZ3 LYS 63 6.741 4.466 4.317 556 H LEU 64 H LEU 64 -0.223 0.538 6.370 557 HA LEU 64 HA LEU 64 -1.762 2.993 7.106 558 HB2 LEU 64 HB2 LEU 64 -2.478 0.813 5.124 559 HB3 LEU 64 HB3 LEU 64 -3.439 2.227 5.515 560 HG LEU 64 HG LEU 64 -1.059 3.396 4.782 561 HD11 LEU 64 HD11 LEU 64 -1.435 1.030 2.883 562 HD12 LEU 64 HD12 LEU 64 -0.210 2.319 2.781 563 HD13 LEU 64 HD13 LEU 64 -0.152 1.113 4.081 564 HD21 LEU 64 HD21 LEU 64 -3.286 3.952 3.970 565 HD22 LEU 64 HD22 LEU 64 -2.114 3.833 2.659 566 HD23 LEU 64 HD23 LEU 64 -3.293 2.519 2.914 567 H ASN 65 H ASN 65 -1.022 0.227 8.588 568 HA ASN 65 HA ASN 65 -1.901 -1.124 10.156 569 HB2 ASN 65 HB2 ASN 65 -3.880 1.113 10.711 570 HB3 ASN 65 HB3 ASN 65 -3.333 -0.130 11.825 571 HD21 ASN 65 HD21 ASN 65 -1.131 3.238 11.317 572 HD22 ASN 65 HD22 ASN 65 -2.622 2.969 10.421 573 H ILE 66 H ILE 66 -2.544 -2.363 8.147 574 HA ILE 66 HA ILE 66 -5.449 -3.047 8.124 575 HB ILE 66 HB ILE 66 -4.878 -3.337 5.514 576 HG12 ILE 66 HG12 ILE 66 -3.364 -0.795 6.117 577 HG13 ILE 66 HG13 ILE 66 -2.492 -2.267 5.916 578 HG21 ILE 66 HG21 ILE 66 -5.725 -0.781 6.938 579 HG22 ILE 66 HG22 ILE 66 -5.981 -1.090 5.220 580 HG23 ILE 66 HG23 ILE 66 -6.769 -2.126 6.422 581 HD11 ILE 66 HD11 ILE 66 -4.188 -0.859 3.816 582 HD12 ILE 66 HD12 ILE 66 -2.454 -1.203 3.781 583 HD13 ILE 66 HD13 ILE 66 -3.619 -2.526 3.611 584 H THR 67 H THR 67 -5.760 -5.115 6.658 585 HA THR 67 HA THR 67 -3.976 -7.184 7.743 586 HB THR 67 HB THR 67 -5.407 -8.799 7.073 587 HG1 THR 67 HG1 THR 67 -6.976 -8.483 5.429 588 HG21 THR 67 HG21 THR 67 -7.387 -6.488 7.203 589 HG22 THR 67 HG22 THR 67 -7.679 -8.197 7.583 590 HG23 THR 67 HG23 THR 67 -6.618 -7.236 8.626 591 H VAL 68 H VAL 68 -2.863 -8.773 6.428 592 HA VAL 68 HA VAL 68 -1.315 -7.639 4.269 593 HB VAL 68 HB VAL 68 -1.671 -10.518 5.174 594 HG11 VAL 68 HG11 VAL 68 0.380 -9.361 3.231 595 HG12 VAL 68 HG12 VAL 68 0.437 -10.989 3.937 596 HG13 VAL 68 HG13 VAL 68 -0.873 -10.563 2.836 597 HG21 VAL 68 HG21 VAL 68 -0.571 -8.997 6.827 598 HG22 VAL 68 HG22 VAL 68 0.560 -10.187 6.179 599 HG23 VAL 68 HG23 VAL 68 0.606 -8.519 5.582 600 H GLU 69 H GLU 69 -4.504 -9.185 4.248 601 HA GLU 69 HA GLU 69 -4.265 -9.858 1.360 602 HB2 GLU 69 HB2 GLU 69 -6.609 -10.078 3.284 603 HB3 GLU 69 HB3 GLU 69 -6.616 -10.627 1.614 604 HG2 GLU 69 HG2 GLU 69 -4.838 -11.718 3.839 605 HG3 GLU 69 HG3 GLU 69 -6.324 -12.451 3.260 606 H LYS 70 H LYS 70 -5.784 -7.496 3.500 607 HA LYS 70 HA LYS 70 -7.280 -6.055 1.575 608 HB2 LYS 70 HB2 LYS 70 -7.431 -6.062 4.100 609 HB3 LYS 70 HB3 LYS 70 -5.996 -5.051 4.160 610 HG2 LYS 70 HG2 LYS 70 -8.642 -4.350 2.835 611 HG3 LYS 70 HG3 LYS 70 -8.159 -3.919 4.482 612 HD2 LYS 70 HD2 LYS 70 -6.167 -2.690 3.405 613 HD3 LYS 70 HD3 LYS 70 -7.054 -2.821 1.883 614 HE2 LYS 70 HE2 LYS 70 -8.195 -1.611 4.447 615 HE3 LYS 70 HE3 LYS 70 -7.395 -0.669 3.182 616 HZ1 LYS 70 HZ1 LYS 70 -9.863 -2.265 2.760 617 HZ2 LYS 70 HZ2 LYS 70 -9.788 -0.634 2.885 618 HZ3 LYS 70 HZ3 LYS 70 -9.076 -1.369 1.625 619 H ALA 71 H ALA 71 -4.071 -5.675 2.861 620 HA ALA 71 HA ALA 71 -3.118 -3.507 1.245 621 HB1 ALA 71 HB1 ALA 71 -1.596 -5.752 2.652 622 HB2 ALA 71 HB2 ALA 71 -0.913 -4.227 2.074 623 HB3 ALA 71 HB3 ALA 71 -2.092 -4.220 3.391 624 H LYS 72 H LYS 72 -2.752 -7.107 0.804 625 HA LYS 72 HA LYS 72 -1.056 -6.806 -1.477 626 HB2 LYS 72 HB2 LYS 72 -1.030 -8.751 0.070 627 HB3 LYS 72 HB3 LYS 72 -2.673 -9.183 -0.411 628 HG2 LYS 72 HG2 LYS 72 -1.897 -9.703 -2.666 629 HG3 LYS 72 HG3 LYS 72 -0.253 -9.175 -2.261 630 HD2 LYS 72 HD2 LYS 72 -1.733 -11.436 -0.828 631 HD3 LYS 72 HD3 LYS 72 -0.668 -11.688 -2.222 632 HE2 LYS 72 HE2 LYS 72 1.221 -10.676 -0.948 633 HE3 LYS 72 HE3 LYS 72 0.159 -10.477 0.454 634 HZ1 LYS 72 HZ1 LYS 72 0.862 -13.083 -0.793 635 HZ2 LYS 72 HZ2 LYS 72 1.459 -12.525 0.617 636 HZ3 LYS 72 HZ3 LYS 72 -0.125 -12.903 0.496 637 H ASN 73 H ASN 73 -4.585 -7.068 -1.124 638 HA ASN 73 HA ASN 73 -4.999 -7.755 -3.803 639 HB2 ASN 73 HB2 ASN 73 -7.247 -7.392 -3.508 640 HB3 ASN 73 HB3 ASN 73 -6.683 -7.712 -1.877 641 HD21 ASN 73 HD21 ASN 73 -8.310 -4.812 -0.799 642 HD22 ASN 73 HD22 ASN 73 -7.935 -6.512 -0.530 643 H TYR 74 H TYR 74 -4.367 -4.499 -2.457 644 HA TYR 74 HA TYR 74 -4.732 -2.987 -4.817 645 HB2 TYR 74 HB2 TYR 74 -2.618 -2.598 -2.658 646 HB3 TYR 74 HB3 TYR 74 -3.195 -1.382 -3.783 647 HD1 TYR 74 HD1 TYR 74 -6.133 -1.636 -3.692 648 HD2 TYR 74 HD2 TYR 74 -3.204 -1.934 -0.516 649 HE1 TYR 74 HE1 TYR 74 -7.815 -0.830 -2.061 650 HE2 TYR 74 HE2 TYR 74 -4.887 -1.001 1.083 651 HH TYR 74 HH TYR 74 -8.209 -0.147 0.060 652 H ILE 75 H ILE 75 -1.901 -4.818 -3.629 653 HA ILE 75 HA ILE 75 -0.125 -4.018 -5.756 654 HB ILE 75 HB ILE 75 0.036 -6.392 -3.852 655 HG12 ILE 75 HG12 ILE 75 1.185 -3.574 -3.589 656 HG13 ILE 75 HG13 ILE 75 -0.182 -4.186 -2.671 657 HG21 ILE 75 HG21 ILE 75 2.218 -4.993 -5.470 658 HG22 ILE 75 HG22 ILE 75 2.472 -6.315 -4.307 659 HG23 ILE 75 HG23 ILE 75 1.578 -6.624 -5.778 660 HD11 ILE 75 HD11 ILE 75 2.683 -5.124 -2.419 661 HD12 ILE 75 HD12 ILE 75 1.685 -4.274 -1.231 662 HD13 ILE 75 HD13 ILE 75 1.278 -5.939 -1.682 663 H LYS 76 H LYS 76 -2.531 -6.661 -5.454 664 HA LYS 76 HA LYS 76 -1.715 -8.059 -7.867 665 HB2 LYS 76 HB2 LYS 76 -3.078 -8.677 -5.585 666 HB3 LYS 76 HB3 LYS 76 -4.400 -8.286 -6.657 667 HG2 LYS 76 HG2 LYS 76 -3.968 -10.657 -6.764 668 HG3 LYS 76 HG3 LYS 76 -3.387 -9.986 -8.298 669 HD2 LYS 76 HD2 LYS 76 -1.048 -10.026 -7.373 670 HD3 LYS 76 HD3 LYS 76 -1.660 -10.695 -5.863 671 HE2 LYS 76 HE2 LYS 76 -1.943 -12.017 -8.604 672 HE3 LYS 76 HE3 LYS 76 -0.623 -12.340 -7.480 673 HZ1 LYS 76 HZ1 LYS 76 -3.491 -12.877 -6.915 674 HZ2 LYS 76 HZ2 LYS 76 -2.349 -13.995 -7.238 675 HZ3 LYS 76 HZ3 LYS 76 -2.264 -13.131 -5.859 676 H ASN 77 H ASN 77 -3.894 -5.418 -7.099 677 HA ASN 77 HA ASN 77 -5.385 -5.561 -9.625 678 HB2 ASN 77 HB2 ASN 77 -5.457 -3.768 -7.133 679 HB3 ASN 77 HB3 ASN 77 -6.513 -3.536 -8.524 680 HD21 ASN 77 HD21 ASN 77 -8.282 -5.713 -6.072 681 HD22 ASN 77 HD22 ASN 77 -7.326 -4.262 -5.727 682 H SER 78 H SER 78 -3.437 -3.190 -7.895 683 HA SER 78 HA SER 78 -2.636 -1.928 -10.453 684 HB2 SER 78 HB2 SER 78 -2.337 -0.926 -7.598 685 HB3 SER 78 HB3 SER 78 -1.787 -0.058 -9.046 686 HG SER 78 HG SER 78 -3.957 0.509 -8.225 687 H ASN 79 H ASN 79 -1.009 -2.811 -11.403 688 HA ASN 79 HA ASN 79 1.448 -3.512 -9.871 689 HB2 ASN 79 HB2 ASN 79 -0.320 -5.418 -10.176 690 HB3 ASN 79 HB3 ASN 79 0.144 -5.404 -11.878 691 HD21 ASN 79 HD21 ASN 79 2.687 -6.771 -8.962 692 HD22 ASN 79 HD22 ASN 79 1.207 -5.872 -8.584 693 H ARG 80 H ARG 80 3.165 -2.677 -10.853 694 HA ARG 80 HA ARG 80 4.501 -1.460 -12.211 695 HB2 ARG 80 HB2 ARG 80 3.413 -3.360 -14.323 696 HB3 ARG 80 HB3 ARG 80 4.632 -2.149 -14.651 697 HG2 ARG 80 HG2 ARG 80 5.839 -4.073 -14.349 698 HG3 ARG 80 HG3 ARG 80 6.091 -3.170 -12.855 699 HD2 ARG 80 HD2 ARG 80 4.595 -4.666 -11.646 700 HD3 ARG 80 HD3 ARG 80 4.053 -5.407 -13.167 701 HE ARG 80 HE ARG 80 6.939 -5.594 -12.687 702 HH11 ARG 80 HH11 ARG 80 7.856 -7.607 -12.678 703 HH12 ARG 80 HH12 ARG 80 6.870 -9.012 -12.408 704 HH21 ARG 80 HH21 ARG 80 3.926 -7.280 -12.051 705 HH22 ARG 80 HH22 ARG 80 4.701 -8.846 -12.112 706 H LEU 81 H LEU 81 1.180 -1.311 -13.175 707 HA LEU 81 HA LEU 81 1.487 0.871 -15.047 708 HB2 LEU 81 HB2 LEU 81 -0.078 -1.059 -15.145 709 HB3 LEU 81 HB3 LEU 81 -0.977 -0.418 -13.782 710 HG LEU 81 HG LEU 81 -0.656 1.075 -16.427 711 HD11 LEU 81 HD11 LEU 81 -2.880 -0.804 -15.511 712 HD12 LEU 81 HD12 LEU 81 -2.885 0.164 -17.004 713 HD13 LEU 81 HD13 LEU 81 -1.702 -1.134 -16.802 714 HD21 LEU 81 HD21 LEU 81 -1.509 2.560 -14.664 715 HD22 LEU 81 HD22 LEU 81 -2.839 2.126 -15.718 716 HD23 LEU 81 HD23 LEU 81 -2.674 1.326 -14.141 717 H GLY 82 H GLY 82 0.335 0.672 -11.674 718 HA2 GLY 82 HA2 GLY 82 0.027 2.355 -10.081 719 HA3 GLY 82 HA3 GLY 82 0.819 3.485 -11.182 720 H ARG 83 H ARG 83 -0.538 5.177 -11.328 721 HA ARG 83 HA ARG 83 -3.484 4.865 -11.499 722 HB2 ARG 83 HB2 ARG 83 -2.005 6.743 -10.285 723 HB3 ARG 83 HB3 ARG 83 -2.122 7.531 -11.846 724 HG2 ARG 83 HG2 ARG 83 -4.486 6.593 -10.137 725 HG3 ARG 83 HG3 ARG 83 -3.794 8.204 -10.119 726 HD2 ARG 83 HD2 ARG 83 -5.678 8.454 -11.413 727 HD3 ARG 83 HD3 ARG 83 -4.366 8.395 -12.597 728 HE ARG 83 HE ARG 83 -5.281 5.756 -12.364 729 HH11 ARG 83 HH11 ARG 83 -6.737 4.794 -13.695 730 HH12 ARG 83 HH12 ARG 83 -7.913 5.750 -14.549 731 HH21 ARG 83 HH21 ARG 83 -6.780 8.764 -13.355 732 HH22 ARG 83 HH22 ARG 83 -7.926 7.947 -14.384 733 H THR 84 H THR 84 -0.930 6.318 -13.470 734 HA THR 84 HA THR 84 -1.611 4.882 -15.843 735 HB THR 84 HB THR 84 -3.448 6.254 -16.180 736 HG1 THR 84 HG1 THR 84 -2.882 7.438 -17.997 737 HG21 THR 84 HG21 THR 84 -1.793 8.716 -15.511 738 HG22 THR 84 HG22 THR 84 -3.461 8.723 -16.130 739 HG23 THR 84 HG23 THR 84 -3.115 8.020 -14.543 740 H ASN 85 H ASN 85 0.256 4.618 -16.826 741 HA ASN 85 HA ASN 85 2.272 6.799 -16.955 742 HB2 ASN 85 HB2 ASN 85 2.736 3.992 -15.870 743 HB3 ASN 85 HB3 ASN 85 4.041 5.036 -16.442 744 HD21 ASN 85 HD21 ASN 85 2.380 5.792 -12.813 745 HD22 ASN 85 HD22 ASN 85 1.705 4.532 -13.853 746 H ASN 86 H ASN 86 3.774 6.639 -18.617 747 HA ASN 86 HA ASN 86 3.404 4.691 -20.798 748 HB2 ASN 86 HB2 ASN 86 1.699 6.606 -21.029 749 HB3 ASN 86 HB3 ASN 86 3.068 7.698 -21.229 750 HD21 ASN 86 HD21 ASN 86 2.312 7.072 -24.676 751 HD22 ASN 86 HD22 ASN 86 2.059 8.193 -23.345 752 H LEU 87 H LEU 87 5.038 5.363 -22.652 753 HA LEU 87 HA LEU 87 7.171 5.511 -23.310 754 HB2 LEU 87 HB2 LEU 87 6.482 7.967 -22.674 755 HB3 LEU 87 HB3 LEU 87 7.630 7.772 -21.362 756 HG LEU 87 HG LEU 87 9.408 7.244 -23.141 757 HD11 LEU 87 HD11 LEU 87 7.219 8.285 -24.997 758 HD12 LEU 87 HD12 LEU 87 8.924 8.044 -25.436 759 HD13 LEU 87 HD13 LEU 87 7.918 6.651 -25.028 760 HD21 LEU 87 HD21 LEU 87 9.228 9.453 -22.070 761 HD22 LEU 87 HD22 LEU 87 9.680 9.613 -23.774 762 HD23 LEU 87 HD23 LEU 87 8.010 9.950 -23.266 763 H LYS 88 H LYS 88 6.656 3.693 -21.140 764 HA LYS 88 HA LYS 88 9.416 3.322 -20.038 765 HB2 LYS 88 HB2 LYS 88 8.488 2.571 -17.942 766 HB3 LYS 88 HB3 LYS 88 7.957 4.210 -18.283 767 HG2 LYS 88 HG2 LYS 88 5.738 3.502 -18.873 768 HG3 LYS 88 HG3 LYS 88 6.191 1.798 -18.922 769 HD2 LYS 88 HD2 LYS 88 6.260 3.492 -16.392 770 HD3 LYS 88 HD3 LYS 88 4.883 2.491 -16.889 771 HE2 LYS 88 HE2 LYS 88 6.288 0.465 -16.851 772 HE3 LYS 88 HE3 LYS 88 7.701 1.427 -16.404 773 HZ1 LYS 88 HZ1 LYS 88 5.262 1.064 -14.728 774 HZ2 LYS 88 HZ2 LYS 88 6.737 0.431 -14.449 775 HZ3 LYS 88 HZ3 LYS 88 6.521 2.043 -14.340 776 H THR 89 H THR 89 7.464 1.977 -22.234 777 HA THR 89 HA THR 89 8.650 -0.615 -22.030 778 HB THR 89 HB THR 89 6.804 -0.998 -20.471 779 HG1 THR 89 HG1 THR 89 6.066 -2.829 -21.536 780 HG21 THR 89 HG21 THR 89 4.879 -0.563 -22.792 781 HG22 THR 89 HG22 THR 89 4.489 -1.024 -21.123 782 HG23 THR 89 HG23 THR 89 5.109 0.598 -21.465 783 H ILE 90 H ILE 90 9.045 -1.228 -23.968 784 HA ILE 90 HA ILE 90 7.304 -0.568 -26.283 785 HB ILE 90 HB ILE 90 9.515 -0.326 -27.552 786 HG12 ILE 90 HG12 ILE 90 10.965 -1.106 -25.620 787 HG13 ILE 90 HG13 ILE 90 11.505 0.192 -26.661 788 HG21 ILE 90 HG21 ILE 90 8.657 1.890 -25.657 789 HG22 ILE 90 HG22 ILE 90 9.615 2.090 -27.140 790 HG23 ILE 90 HG23 ILE 90 7.948 1.503 -27.233 791 HD11 ILE 90 HD11 ILE 90 10.391 0.624 -23.856 792 HD12 ILE 90 HD12 ILE 90 12.092 0.631 -24.334 793 HD13 ILE 90 HD13 ILE 90 11.006 1.877 -24.955 794 H GLY 91 H GLY 91 8.167 -3.102 -24.551 795 HA2 GLY 91 HA2 GLY 91 8.528 -5.343 -24.915 796 HA3 GLY 91 HA3 GLY 91 8.094 -5.095 -26.610 797 H ILE 92 H ILE 92 10.668 -3.096 -25.793 798 HA ILE 92 HA ILE 92 12.825 -2.960 -26.455 799 HB ILE 92 HB ILE 92 13.128 -5.705 -25.221 800 HG12 ILE 92 HG12 ILE 92 11.776 -4.309 -23.679 801 HG13 ILE 92 HG13 ILE 92 13.357 -4.683 -23.044 802 HG21 ILE 92 HG21 ILE 92 15.038 -3.331 -25.464 803 HG22 ILE 92 HG22 ILE 92 15.317 -4.725 -24.399 804 HG23 ILE 92 HG23 ILE 92 15.255 -4.950 -26.135 805 HD11 ILE 92 HD11 ILE 92 12.637 -2.006 -24.318 806 HD12 ILE 92 HD12 ILE 92 12.637 -2.352 -22.581 807 HD13 ILE 92 HD13 ILE 92 14.153 -2.411 -23.487 808 H LEU 93 H LEU 93 11.146 -3.669 -28.484 809 HA LEU 93 HA LEU 93 10.977 -4.402 -30.576 810 HB2 LEU 93 HB2 LEU 93 13.309 -3.003 -30.263 811 HB3 LEU 93 HB3 LEU 93 13.910 -4.435 -31.079 812 HG LEU 93 HG LEU 93 11.688 -2.568 -32.042 813 HD11 LEU 93 HD11 LEU 93 14.549 -2.942 -33.022 814 HD12 LEU 93 HD12 LEU 93 13.335 -1.841 -33.718 815 HD13 LEU 93 HD13 LEU 93 13.941 -1.564 -32.077 816 HD21 LEU 93 HD21 LEU 93 11.306 -4.809 -32.973 817 HD22 LEU 93 HD22 LEU 93 11.885 -3.708 -34.229 818 HD23 LEU 93 HD23 LEU 93 13.000 -4.893 -33.510 819 H GLN 94 H GLN 94 11.194 -6.539 -28.599 820 HA GLN 94 HA GLN 94 11.956 -8.849 -30.341 821 HB2 GLN 94 HB2 GLN 94 12.739 -8.238 -27.474 822 HB3 GLN 94 HB3 GLN 94 12.804 -9.880 -28.122 823 HG2 GLN 94 HG2 GLN 94 14.414 -9.307 -29.795 824 HG3 GLN 94 HG3 GLN 94 14.257 -7.580 -29.474 825 HE21 GLN 94 HE21 GLN 94 16.312 -7.583 -26.569 826 HE22 GLN 94 HE22 GLN 94 15.032 -6.717 -27.435 827 H GLU 95 H GLU 95 9.302 -7.601 -29.689 828 HA GLU 95 HA GLU 95 7.896 -10.072 -28.817 829 HB2 GLU 95 HB2 GLU 95 8.175 -8.558 -26.857 830 HB3 GLU 95 HB3 GLU 95 7.318 -7.284 -27.732 831 HG2 GLU 95 HG2 GLU 95 5.283 -8.676 -27.805 832 HG3 GLU 95 HG3 GLU 95 6.151 -10.022 -27.063 833 H GLU 96 H GLU 96 5.943 -10.430 -29.798 834 HA GLU 96 HA GLU 96 4.488 -10.497 -31.519 835 HB2 GLU 96 HB2 GLU 96 3.547 -8.766 -29.967 836 HB3 GLU 96 HB3 GLU 96 4.145 -7.519 -31.064 837 HG2 GLU 96 HG2 GLU 96 2.733 -8.471 -32.891 838 HG3 GLU 96 HG3 GLU 96 2.229 -9.777 -31.822 839 H VAL 97 H VAL 97 6.444 -11.042 -32.754 840 HA VAL 97 HA VAL 97 6.519 -9.390 -35.235 841 HB VAL 97 HB VAL 97 8.923 -10.830 -34.072 842 HG11 VAL 97 HG11 VAL 97 8.681 -8.838 -36.373 843 HG12 VAL 97 HG12 VAL 97 10.183 -9.595 -35.797 844 HG13 VAL 97 HG13 VAL 97 8.934 -10.585 -36.557 845 HG21 VAL 97 HG21 VAL 97 8.499 -8.918 -32.635 846 HG22 VAL 97 HG22 VAL 97 9.882 -8.565 -33.669 847 HG23 VAL 97 HG23 VAL 97 8.295 -7.853 -34.044 848 H SER 98 H SER 98 4.770 -10.877 -35.742 849 HA SER 98 HA SER 98 5.740 -12.868 -37.565 850 HB2 SER 98 HB2 SER 98 5.923 -14.290 -35.618 851 HB3 SER 98 HB3 SER 98 4.247 -13.959 -35.153 852 HG SER 98 HG SER 98 4.509 -15.961 -36.304 853 H SER 99 H SER 99 2.610 -12.629 -35.769 854 HA SER 99 HA SER 99 1.085 -12.946 -38.191 855 HB2 SER 99 HB2 SER 99 0.407 -13.715 -35.915 856 HB3 SER 99 HB3 SER 99 0.129 -12.023 -35.457 857 HG SER 99 HG SER 99 -1.783 -13.122 -36.185 858 H MET 100 H MET 100 2.045 -10.119 -36.333 859 HA MET 100 HA MET 100 1.161 -8.349 -38.559 860 HB2 MET 100 HB2 MET 100 0.981 -7.718 -35.583 861 HB3 MET 100 HB3 MET 100 0.790 -6.542 -36.890 862 HG2 MET 100 HG2 MET 100 -1.149 -7.820 -37.765 863 HG3 MET 100 HG3 MET 100 -0.955 -8.999 -36.470 864 HE1 MET 100 HE1 MET 100 -2.154 -5.430 -37.488 865 HE2 MET 100 HE2 MET 100 -2.540 -4.672 -35.929 866 HE3 MET 100 HE3 MET 100 -0.846 -4.960 -36.374 867 H GLU 101 H GLU 101 2.719 -7.007 -39.285 868 HA GLU 101 HA GLU 101 5.168 -6.446 -37.762 869 HB2 GLU 101 HB2 GLU 101 5.333 -8.779 -38.940 870 HB3 GLU 101 HB3 GLU 101 5.487 -7.860 -40.433 871 HG2 GLU 101 HG2 GLU 101 7.450 -6.632 -39.337 872 HG3 GLU 101 HG3 GLU 101 7.269 -7.706 -37.955 873 H ALA 102 H ALA 102 3.199 -4.705 -38.517 874 HA ALA 102 HA ALA 102 2.501 -2.954 -39.762 875 HB1 ALA 102 HB1 ALA 102 5.440 -2.540 -40.418 876 HB2 ALA 102 HB2 ALA 102 4.143 -1.324 -40.453 877 HB3 ALA 102 HB3 ALA 102 4.641 -2.036 -38.912 878 H LYS 103 H LYS 103 4.068 -2.142 -42.330 879 HA LYS 103 HA LYS 103 3.019 -4.242 -44.185 880 HB2 LYS 103 HB2 LYS 103 2.777 -1.226 -44.554 881 HB3 LYS 103 HB3 LYS 103 2.342 -2.457 -45.747 882 HG2 LYS 103 HG2 LYS 103 0.662 -3.388 -44.131 883 HG3 LYS 103 HG3 LYS 103 1.028 -2.046 -43.027 884 HD2 LYS 103 HD2 LYS 103 0.411 -0.435 -44.854 885 HD3 LYS 103 HD3 LYS 103 -0.103 -1.799 -45.854 886 HE2 LYS 103 HE2 LYS 103 -1.242 -1.063 -43.114 887 HE3 LYS 103 HE3 LYS 103 -1.969 -0.627 -44.661 888 HZ1 LYS 103 HZ1 LYS 103 -1.585 -3.409 -43.690 889 HZ2 LYS 103 HZ2 LYS 103 -3.004 -2.612 -43.767 890 HZ3 LYS 103 HZ3 LYS 103 -2.224 -3.007 -45.142 891 H SER 104 H SER 104 4.039 -4.395 -46.183 892 HA SER 104 HA SER 104 6.890 -3.466 -46.260 893 HB2 SER 104 HB2 SER 104 5.746 -6.138 -47.149 894 HB3 SER 104 HB3 SER 104 7.436 -5.622 -47.301 895 HG SER 104 HG SER 104 7.070 -6.910 -45.425 896 H MET 105 H MET 105 7.883 -3.272 -48.314 897 HA MET 105 HA MET 105 6.191 -3.193 -50.735 898 HB2 MET 105 HB2 MET 105 6.833 -0.991 -51.359 899 HB3 MET 105 HB3 MET 105 6.124 -0.882 -49.756 900 HG2 MET 105 HG2 MET 105 9.113 -0.904 -50.392 901 HG3 MET 105 HG3 MET 105 8.155 0.541 -50.137 902 HE1 MET 105 HE1 MET 105 6.322 -0.073 -47.591 903 HE2 MET 105 HE2 MET 105 7.393 0.545 -46.319 904 HE3 MET 105 HE3 MET 105 7.256 1.417 -47.860 905 H THR 106 H THR 106 7.383 -3.007 -52.702 906 HA THR 106 HA THR 106 10.303 -3.384 -52.639 907 HB THR 106 HB THR 106 8.644 -5.235 -54.372 908 HG1 THR 106 HG1 THR 106 8.965 -6.863 -52.883 909 HG21 THR 106 HG21 THR 106 11.510 -5.287 -53.318 910 HG22 THR 106 HG22 THR 106 10.774 -6.587 -54.287 911 HG23 THR 106 HG23 THR 106 11.008 -4.987 -54.998 912 H TRP 107 H TRP 107 11.351 -2.676 -54.427 913 HA TRP 107 HA TRP 107 9.726 -1.139 -56.380 914 HB2 TRP 107 HB2 TRP 107 10.876 0.107 -54.404 915 HB3 TRP 107 HB3 TRP 107 12.359 -0.130 -55.312 916 HD1 TRP 107 HD1 TRP 107 12.521 1.196 -57.676 917 HE1 TRP 107 HE1 TRP 107 11.346 3.312 -58.548 918 HE3 TRP 107 HE3 TRP 107 8.637 1.378 -54.348 919 HZ2 TRP 107 HZ2 TRP 107 9.017 4.887 -57.873 920 HZ3 TRP 107 HZ3 TRP 107 6.949 3.205 -54.482 921 HH2 TRP 107 HH2 TRP 107 7.130 4.958 -56.234 Start of MODEL 21 1 H1 GLY -5 H1 GLY -5 -17.823 -20.291 41.387 2 H2 GLY -5 H2 GLY -5 -17.036 -18.966 41.940 3 H3 GLY -5 H3 GLY -5 -18.115 -19.738 42.902 4 HA2 GLY -5 HA2 GLY -5 -15.904 -20.277 43.625 5 HA3 GLY -5 HA3 GLY -5 -16.720 -21.711 42.975 6 H SER -4 H SER -4 -14.626 -22.638 42.577 7 HA SER -4 HA SER -4 -12.517 -21.345 41.263 8 HB2 SER -4 HB2 SER -4 -13.047 -24.336 41.394 9 HB3 SER -4 HB3 SER -4 -11.479 -23.543 41.150 10 HG SER -4 HG SER -4 -11.818 -24.161 43.344 11 H HIS -3 H HIS -3 -15.074 -23.346 39.788 12 HA HIS -3 HA HIS -3 -14.365 -22.335 37.105 13 HB2 HIS -3 HB2 HIS -3 -12.965 -24.394 37.462 14 HB3 HIS -3 HB3 HIS -3 -14.438 -25.332 37.668 15 HD2 HIS -3 HD2 HIS -3 -16.001 -25.654 35.418 16 HE1 HIS -3 HE1 HIS -3 -13.032 -24.384 32.628 17 HE2 HIS -3 HE2 HIS -3 -15.293 -25.528 32.879 18 H MET -2 H MET -2 -16.313 -21.412 36.693 19 HA MET -2 HA MET -2 -18.685 -23.132 36.465 20 HB2 MET -2 HB2 MET -2 -18.573 -22.197 38.849 21 HB3 MET -2 HB3 MET -2 -18.856 -20.599 38.152 22 HG2 MET -2 HG2 MET -2 -21.044 -21.327 37.320 23 HG3 MET -2 HG3 MET -2 -20.658 -23.002 37.679 24 HE1 MET -2 HE1 MET -2 -21.901 -19.563 38.994 25 HE2 MET -2 HE2 MET -2 -21.825 -19.738 40.760 26 HE3 MET -2 HE3 MET -2 -20.325 -19.620 39.817 27 H ALA -1 H ALA -1 -17.186 -22.150 34.423 28 HA ALA -1 HA ALA -1 -19.201 -20.596 32.983 29 HB1 ALA -1 HB1 ALA -1 -16.390 -19.514 33.474 30 HB2 ALA -1 HB2 ALA -1 -17.613 -18.772 32.408 31 HB3 ALA -1 HB3 ALA -1 -17.891 -18.867 34.163 32 H SER 0 H SER 0 -19.057 -20.685 30.778 33 HA SER 0 HA SER 0 -16.765 -21.820 29.369 34 HB2 SER 0 HB2 SER 0 -17.968 -23.856 30.147 35 HB3 SER 0 HB3 SER 0 -19.435 -23.286 29.332 36 HG SER 0 HG SER 0 -18.181 -24.757 28.043 37 H MET 1 H MET 1 -16.630 -20.846 27.431 38 HA MET 1 HA MET 1 -19.003 -19.907 25.955 39 HB2 MET 1 HB2 MET 1 -18.267 -18.162 27.729 40 HB3 MET 1 HB3 MET 1 -16.852 -17.895 26.714 41 HG2 MET 1 HG2 MET 1 -18.362 -17.229 24.845 42 HG3 MET 1 HG3 MET 1 -19.764 -17.594 25.850 43 HE1 MET 1 HE1 MET 1 -20.610 -15.157 25.054 44 HE2 MET 1 HE2 MET 1 -19.707 -13.657 25.366 45 HE3 MET 1 HE3 MET 1 -19.075 -14.849 24.210 46 H ASP 2 H ASP 2 -16.645 -21.829 25.549 47 HA ASP 2 HA ASP 2 -15.582 -20.695 23.002 48 HB2 ASP 2 HB2 ASP 2 -14.091 -20.298 25.029 49 HB3 ASP 2 HB3 ASP 2 -13.811 -22.040 25.051 50 HA PRO 3 HA PRO 3 -16.467 -25.020 21.949 51 HB2 PRO 3 HB2 PRO 3 -16.694 -24.814 19.252 52 HB3 PRO 3 HB3 PRO 3 -17.900 -24.066 20.345 53 HG2 PRO 3 HG2 PRO 3 -15.507 -22.738 19.027 54 HG3 PRO 3 HG3 PRO 3 -17.207 -22.174 19.049 55 HD2 PRO 3 HD2 PRO 3 -15.306 -21.283 20.828 56 HD3 PRO 3 HD3 PRO 3 -17.034 -21.434 21.262 57 H LEU 4 H LEU 4 -13.586 -23.450 21.588 58 HA LEU 4 HA LEU 4 -12.262 -25.732 20.205 59 HB2 LEU 4 HB2 LEU 4 -11.268 -22.887 20.585 60 HB3 LEU 4 HB3 LEU 4 -10.460 -24.163 19.691 61 HG LEU 4 HG LEU 4 -13.109 -22.896 18.915 62 HD11 LEU 4 HD11 LEU 4 -10.331 -22.677 17.688 63 HD12 LEU 4 HD12 LEU 4 -11.821 -21.930 17.065 64 HD13 LEU 4 HD13 LEU 4 -11.163 -21.415 18.626 65 HD21 LEU 4 HD21 LEU 4 -13.036 -25.229 18.138 66 HD22 LEU 4 HD22 LEU 4 -12.804 -24.128 16.778 67 HD23 LEU 4 HD23 LEU 4 -11.404 -24.976 17.473 68 H ASP 5 H ASP 5 -13.023 -26.060 22.885 69 HA ASP 5 HA ASP 5 -10.407 -26.085 24.306 70 HB2 ASP 5 HB2 ASP 5 -13.118 -25.493 25.106 71 HB3 ASP 5 HB3 ASP 5 -12.596 -26.906 25.992 72 H LYS 6 H LYS 6 -11.869 -28.157 22.369 73 HA LYS 6 HA LYS 6 -11.322 -30.604 24.034 74 HB2 LYS 6 HB2 LYS 6 -13.310 -30.711 21.775 75 HB3 LYS 6 HB3 LYS 6 -13.152 -31.702 23.202 76 HG2 LYS 6 HG2 LYS 6 -14.952 -30.539 23.903 77 HG3 LYS 6 HG3 LYS 6 -13.742 -29.367 24.419 78 HD2 LYS 6 HD2 LYS 6 -15.496 -28.176 23.296 79 HD3 LYS 6 HD3 LYS 6 -14.089 -28.150 22.223 80 HE2 LYS 6 HE2 LYS 6 -15.053 -30.005 20.890 81 HE3 LYS 6 HE3 LYS 6 -16.429 -30.101 21.993 82 HZ1 LYS 6 HZ1 LYS 6 -15.752 -27.680 20.404 83 HZ2 LYS 6 HZ2 LYS 6 -16.878 -28.787 19.952 84 HZ3 LYS 6 HZ3 LYS 6 -17.102 -27.903 21.305 85 H ILE 7 H ILE 7 -11.599 -29.677 20.647 86 HA ILE 7 HA ILE 7 -9.415 -31.563 19.877 87 HB ILE 7 HB ILE 7 -10.752 -32.087 17.825 88 HG12 ILE 7 HG12 ILE 7 -13.213 -31.857 17.926 89 HG13 ILE 7 HG13 ILE 7 -13.081 -30.809 19.334 90 HG21 ILE 7 HG21 ILE 7 -12.068 -32.874 20.451 91 HG22 ILE 7 HG22 ILE 7 -12.109 -33.760 18.916 92 HG23 ILE 7 HG23 ILE 7 -10.580 -33.585 19.787 93 HD11 ILE 7 HD11 ILE 7 -11.933 -30.161 16.585 94 HD12 ILE 7 HD12 ILE 7 -13.504 -29.607 17.190 95 HD13 ILE 7 HD13 ILE 7 -12.025 -29.063 17.989 96 H ILE 8 H ILE 8 -9.712 -28.518 20.223 97 HA ILE 8 HA ILE 8 -9.387 -27.032 17.977 98 HB ILE 8 HB ILE 8 -9.238 -26.170 20.233 99 HG12 ILE 8 HG12 ILE 8 -6.915 -25.320 18.448 100 HG13 ILE 8 HG13 ILE 8 -8.588 -24.772 18.327 101 HG21 ILE 8 HG21 ILE 8 -6.313 -26.988 20.342 102 HG22 ILE 8 HG22 ILE 8 -7.278 -26.205 21.610 103 HG23 ILE 8 HG23 ILE 8 -7.613 -27.877 21.160 104 HD11 ILE 8 HD11 ILE 8 -6.620 -24.184 20.578 105 HD12 ILE 8 HD12 ILE 8 -7.269 -23.055 19.381 106 HD13 ILE 8 HD13 ILE 8 -8.340 -23.734 20.618 107 H ASN 9 H ASN 9 -8.126 -26.899 16.256 108 HA ASN 9 HA ASN 9 -5.365 -28.018 16.252 109 HB2 ASN 9 HB2 ASN 9 -7.141 -29.708 15.551 110 HB3 ASN 9 HB3 ASN 9 -7.449 -28.689 14.146 111 HD21 ASN 9 HD21 ASN 9 -4.798 -30.271 12.414 112 HD22 ASN 9 HD22 ASN 9 -6.348 -29.446 12.342 113 H ASP 10 H ASP 10 -7.029 -25.264 15.620 114 HA ASP 10 HA ASP 10 -5.754 -24.680 13.088 115 HB2 ASP 10 HB2 ASP 10 -8.123 -24.052 13.725 116 HB3 ASP 10 HB3 ASP 10 -7.455 -22.873 14.851 117 H ILE 11 H ILE 11 -4.250 -24.886 15.710 118 HA ILE 11 HA ILE 11 -2.371 -22.646 15.329 119 HB ILE 11 HB ILE 11 -4.255 -21.867 16.791 120 HG12 ILE 11 HG12 ILE 11 -1.620 -21.746 18.284 121 HG13 ILE 11 HG13 ILE 11 -1.939 -20.870 16.784 122 HG21 ILE 11 HG21 ILE 11 -3.128 -23.729 18.918 123 HG22 ILE 11 HG22 ILE 11 -4.480 -22.595 19.086 124 HG23 ILE 11 HG23 ILE 11 -4.643 -23.992 18.027 125 HD11 ILE 11 HD11 ILE 11 -3.464 -20.554 19.402 126 HD12 ILE 11 HD12 ILE 11 -2.316 -19.414 18.684 127 HD13 ILE 11 HD13 ILE 11 -3.864 -19.726 17.877 128 H LYS 12 H LYS 12 -2.188 -25.504 14.966 129 HA LYS 12 HA LYS 12 0.184 -25.969 16.741 130 HB2 LYS 12 HB2 LYS 12 -1.909 -27.970 15.810 131 HB3 LYS 12 HB3 LYS 12 -0.337 -28.445 16.469 132 HG2 LYS 12 HG2 LYS 12 -0.804 -27.191 18.555 133 HG3 LYS 12 HG3 LYS 12 -2.419 -26.781 17.959 134 HD2 LYS 12 HD2 LYS 12 -1.401 -29.636 18.282 135 HD3 LYS 12 HD3 LYS 12 -2.292 -28.755 19.541 136 HE2 LYS 12 HE2 LYS 12 -4.180 -28.429 17.957 137 HE3 LYS 12 HE3 LYS 12 -3.319 -29.383 16.737 138 HZ1 LYS 12 HZ1 LYS 12 -4.189 -30.396 19.391 139 HZ2 LYS 12 HZ2 LYS 12 -4.941 -30.699 17.980 140 HZ3 LYS 12 HZ3 LYS 12 -3.434 -31.288 18.239 141 H LYS 13 H LYS 13 -1.096 -26.589 13.492 142 HA LYS 13 HA LYS 13 1.647 -26.660 12.448 143 HB2 LYS 13 HB2 LYS 13 0.896 -29.019 13.079 144 HB3 LYS 13 HB3 LYS 13 -0.319 -28.900 11.804 145 HG2 LYS 13 HG2 LYS 13 1.520 -28.536 10.139 146 HG3 LYS 13 HG3 LYS 13 2.709 -28.684 11.431 147 HD2 LYS 13 HD2 LYS 13 0.753 -30.827 10.496 148 HD3 LYS 13 HD3 LYS 13 2.465 -30.767 10.101 149 HE2 LYS 13 HE2 LYS 13 1.310 -31.134 12.906 150 HE3 LYS 13 HE3 LYS 13 1.892 -32.430 11.865 151 HZ1 LYS 13 HZ1 LYS 13 3.584 -30.224 12.916 152 HZ2 LYS 13 HZ2 LYS 13 3.604 -31.772 13.427 153 HZ3 LYS 13 HZ3 LYS 13 4.106 -31.413 11.919 154 H GLU 14 H GLU 14 1.891 -26.062 10.339 155 HA GLU 14 HA GLU 14 -0.499 -24.947 8.930 156 HB2 GLU 14 HB2 GLU 14 1.233 -23.360 9.837 157 HB3 GLU 14 HB3 GLU 14 2.384 -24.030 8.681 158 HG2 GLU 14 HG2 GLU 14 0.832 -23.341 6.815 159 HG3 GLU 14 HG3 GLU 14 -0.290 -22.702 8.013 160 H ALA 15 H ALA 15 -0.544 -27.417 8.441 161 HA ALA 15 HA ALA 15 0.847 -27.934 5.840 162 HB1 ALA 15 HB1 ALA 15 0.288 -29.906 8.090 163 HB2 ALA 15 HB2 ALA 15 1.103 -30.262 6.552 164 HB3 ALA 15 HB3 ALA 15 1.868 -29.171 7.718 165 H ASN 16 H ASN 16 -2.119 -27.155 6.825 166 HA ASN 16 HA ASN 16 -3.608 -29.313 5.420 167 HB2 ASN 16 HB2 ASN 16 -4.275 -28.679 7.725 168 HB3 ASN 16 HB3 ASN 16 -4.601 -27.033 7.173 169 HD21 ASN 16 HD21 ASN 16 -7.222 -30.052 6.244 170 HD22 ASN 16 HD22 ASN 16 -5.624 -30.444 6.858 171 H ASP 17 H ASP 17 -3.965 -29.060 3.331 172 HA ASP 17 HA ASP 17 -5.026 -26.519 2.219 173 HB2 ASP 17 HB2 ASP 17 -2.605 -28.013 1.125 174 HB3 ASP 17 HB3 ASP 17 -3.559 -26.868 0.190 175 H SER 18 H SER 18 -6.679 -26.873 0.876 176 HA SER 18 HA SER 18 -6.831 -29.294 -0.771 177 HB2 SER 18 HB2 SER 18 -7.900 -29.988 1.370 178 HB3 SER 18 HB3 SER 18 -9.089 -28.686 1.177 179 HG SER 18 HG SER 18 -9.808 -30.734 0.343 180 H GLY 19 H GLY 19 -6.801 -28.139 -2.589 181 HA2 GLY 19 HA2 GLY 19 -7.702 -27.116 -4.426 182 HA3 GLY 19 HA3 GLY 19 -9.286 -27.182 -3.617 183 H VAL 20 H VAL 20 -6.407 -25.428 -2.609 184 HA VAL 20 HA VAL 20 -7.910 -22.887 -2.520 185 HB VAL 20 HB VAL 20 -5.193 -23.730 -1.498 186 HG11 VAL 20 HG11 VAL 20 -6.704 -21.090 -1.123 187 HG12 VAL 20 HG12 VAL 20 -5.284 -21.581 -0.169 188 HG13 VAL 20 HG13 VAL 20 -5.121 -21.301 -1.903 189 HG21 VAL 20 HG21 VAL 20 -7.093 -24.762 -0.300 190 HG22 VAL 20 HG22 VAL 20 -6.279 -23.572 0.726 191 HG23 VAL 20 HG23 VAL 20 -7.823 -23.164 -0.059 192 H THR 21 H THR 21 -7.429 -21.088 -3.622 193 HA THR 21 HA THR 21 -5.194 -21.043 -5.596 194 HB THR 21 HB THR 21 -7.469 -21.609 -6.635 195 HG1 THR 21 HG1 THR 21 -6.921 -20.398 -8.397 196 HG21 THR 21 HG21 THR 21 -7.904 -18.602 -6.396 197 HG22 THR 21 HG22 THR 21 -8.995 -19.821 -7.085 198 HG23 THR 21 HG23 THR 21 -8.716 -19.779 -5.329 199 H LEU 22 H LEU 22 -5.295 -18.636 -6.576 200 HA LEU 22 HA LEU 22 -4.330 -17.045 -4.386 201 HB2 LEU 22 HB2 LEU 22 -3.359 -15.672 -6.084 202 HB3 LEU 22 HB3 LEU 22 -3.190 -17.340 -6.577 203 HG LEU 22 HG LEU 22 -5.659 -16.080 -7.660 204 HD11 LEU 22 HD11 LEU 22 -2.946 -14.984 -8.508 205 HD12 LEU 22 HD12 LEU 22 -4.494 -14.703 -9.339 206 HD13 LEU 22 HD13 LEU 22 -4.254 -14.075 -7.705 207 HD21 LEU 22 HD21 LEU 22 -4.755 -18.253 -8.447 208 HD22 LEU 22 HD22 LEU 22 -4.861 -17.063 -9.749 209 HD23 LEU 22 HD23 LEU 22 -3.286 -17.430 -9.011 210 H ALA 23 H ALA 23 -7.130 -17.312 -4.257 211 HA ALA 23 HA ALA 23 -8.343 -14.740 -5.040 212 HB1 ALA 23 HB1 ALA 23 -9.471 -17.327 -3.917 213 HB2 ALA 23 HB2 ALA 23 -10.446 -15.912 -4.370 214 HB3 ALA 23 HB3 ALA 23 -9.506 -16.774 -5.607 215 HA PRO 24 HA PRO 24 -7.973 -13.356 -0.733 216 HB2 PRO 24 HB2 PRO 24 -9.039 -10.859 -0.926 217 HB3 PRO 24 HB3 PRO 24 -7.442 -11.293 -1.607 218 HG2 PRO 24 HG2 PRO 24 -10.095 -11.094 -3.054 219 HG3 PRO 24 HG3 PRO 24 -8.499 -10.450 -3.551 220 HD2 PRO 24 HD2 PRO 24 -9.521 -12.839 -4.477 221 HD3 PRO 24 HD3 PRO 24 -7.767 -12.546 -4.278 222 H LEU 25 H LEU 25 -11.096 -13.020 -2.455 223 HA LEU 25 HA LEU 25 -12.490 -14.449 -0.338 224 HB2 LEU 25 HB2 LEU 25 -12.535 -12.034 0.444 225 HB3 LEU 25 HB3 LEU 25 -13.397 -11.636 -1.042 226 HG LEU 25 HG LEU 25 -15.229 -13.251 -0.312 227 HD11 LEU 25 HD11 LEU 25 -13.697 -13.131 2.327 228 HD12 LEU 25 HD12 LEU 25 -15.335 -13.785 2.106 229 HD13 LEU 25 HD13 LEU 25 -13.960 -14.586 1.340 230 HD21 LEU 25 HD21 LEU 25 -15.435 -10.816 -0.046 231 HD22 LEU 25 HD22 LEU 25 -16.189 -11.665 1.311 232 HD23 LEU 25 HD23 LEU 25 -14.597 -10.899 1.520 233 H SER 26 H SER 26 -12.843 -15.955 -1.935 234 HA SER 26 HA SER 26 -13.948 -17.025 -3.574 235 HB2 SER 26 HB2 SER 26 -16.270 -17.026 -3.186 236 HB3 SER 26 HB3 SER 26 -15.498 -16.501 -1.669 237 HG SER 26 HG SER 26 -17.356 -15.264 -2.230 238 H VAL 27 H VAL 27 -12.550 -14.914 -4.741 239 HA VAL 27 HA VAL 27 -13.960 -14.557 -7.313 240 HB VAL 27 HB VAL 27 -14.602 -12.710 -5.697 241 HG11 VAL 27 HG11 VAL 27 -11.809 -11.615 -6.201 242 HG12 VAL 27 HG12 VAL 27 -13.111 -10.884 -5.242 243 HG13 VAL 27 HG13 VAL 27 -12.318 -12.360 -4.675 244 HG21 VAL 27 HG21 VAL 27 -14.854 -12.425 -8.127 245 HG22 VAL 27 HG22 VAL 27 -14.474 -10.908 -7.305 246 HG23 VAL 27 HG23 VAL 27 -13.206 -11.743 -8.219 247 HA PRO 28 HA PRO 28 -9.638 -14.882 -8.596 248 HB2 PRO 28 HB2 PRO 28 -9.778 -14.378 -11.264 249 HB3 PRO 28 HB3 PRO 28 -10.509 -15.824 -10.517 250 HG2 PRO 28 HG2 PRO 28 -11.899 -13.197 -11.167 251 HG3 PRO 28 HG3 PRO 28 -12.392 -14.854 -11.652 252 HD2 PRO 28 HD2 PRO 28 -13.443 -13.659 -9.468 253 HD3 PRO 28 HD3 PRO 28 -13.060 -15.400 -9.453 254 H LYS 29 H LYS 29 -9.699 -12.923 -7.076 255 HA LYS 29 HA LYS 29 -8.964 -10.949 -6.341 256 HB2 LYS 29 HB2 LYS 29 -6.894 -11.494 -7.222 257 HB3 LYS 29 HB3 LYS 29 -7.331 -11.102 -8.860 258 HG2 LYS 29 HG2 LYS 29 -7.592 -8.710 -7.149 259 HG3 LYS 29 HG3 LYS 29 -6.051 -9.469 -6.939 260 HD2 LYS 29 HD2 LYS 29 -5.832 -7.848 -8.585 261 HD3 LYS 29 HD3 LYS 29 -5.618 -9.398 -9.382 262 HE2 LYS 29 HE2 LYS 29 -8.152 -7.692 -9.462 263 HE3 LYS 29 HE3 LYS 29 -6.813 -7.556 -10.607 264 HZ1 LYS 29 HZ1 LYS 29 -8.594 -9.908 -10.284 265 HZ2 LYS 29 HZ2 LYS 29 -8.447 -8.959 -11.587 266 HZ3 LYS 29 HZ3 LYS 29 -7.213 -9.948 -11.185 267 HA PRO 30 HA PRO 30 -11.835 -7.969 -8.146 268 HB2 PRO 30 HB2 PRO 30 -12.322 -6.433 -5.997 269 HB3 PRO 30 HB3 PRO 30 -12.844 -8.145 -6.037 270 HG2 PRO 30 HG2 PRO 30 -10.338 -7.003 -4.751 271 HG3 PRO 30 HG3 PRO 30 -11.544 -8.112 -4.027 272 HD2 PRO 30 HD2 PRO 30 -9.182 -8.926 -5.221 273 HD3 PRO 30 HD3 PRO 30 -10.655 -9.938 -5.159 274 H LYS 31 H LYS 31 -11.904 -5.669 -8.519 275 HA LYS 31 HA LYS 31 -9.287 -4.181 -8.434 276 HB2 LYS 31 HB2 LYS 31 -10.238 -2.736 -10.151 277 HB3 LYS 31 HB3 LYS 31 -10.227 -4.418 -10.678 278 HG2 LYS 31 HG2 LYS 31 -12.687 -4.559 -10.044 279 HG3 LYS 31 HG3 LYS 31 -12.658 -2.820 -9.748 280 HD2 LYS 31 HD2 LYS 31 -12.029 -4.141 -12.416 281 HD3 LYS 31 HD3 LYS 31 -13.593 -3.465 -11.939 282 HE2 LYS 31 HE2 LYS 31 -12.474 -1.236 -11.577 283 HE3 LYS 31 HE3 LYS 31 -10.980 -1.922 -12.234 284 HZ1 LYS 31 HZ1 LYS 31 -13.564 -1.709 -13.696 285 HZ2 LYS 31 HZ2 LYS 31 -12.253 -0.777 -13.955 286 HZ3 LYS 31 HZ3 LYS 31 -12.202 -2.369 -14.312 287 H LEU 32 H LEU 32 -9.093 -2.643 -6.919 288 HA LEU 32 HA LEU 32 -11.534 -1.473 -5.653 289 HB2 LEU 32 HB2 LEU 32 -8.904 -2.407 -4.488 290 HB3 LEU 32 HB3 LEU 32 -9.741 -1.044 -3.768 291 HG LEU 32 HG LEU 32 -11.819 -2.444 -3.597 292 HD11 LEU 32 HD11 LEU 32 -9.903 -4.663 -4.366 293 HD12 LEU 32 HD12 LEU 32 -11.375 -4.954 -3.411 294 HD13 LEU 32 HD13 LEU 32 -11.498 -4.297 -5.038 295 HD21 LEU 32 HD21 LEU 32 -10.379 -1.926 -1.688 296 HD22 LEU 32 HD22 LEU 32 -11.001 -3.581 -1.542 297 HD23 LEU 32 HD23 LEU 32 -9.331 -3.298 -2.086 298 H GLU 33 H GLU 33 -11.600 0.610 -5.099 299 HA GLU 33 HA GLU 33 -9.379 2.425 -5.556 300 HB2 GLU 33 HB2 GLU 33 -10.725 3.978 -7.013 301 HB3 GLU 33 HB3 GLU 33 -10.311 2.460 -7.793 302 HG2 GLU 33 HG2 GLU 33 -12.583 1.575 -7.387 303 HG3 GLU 33 HG3 GLU 33 -13.031 3.055 -6.544 304 H GLU 34 H GLU 34 -10.149 1.644 -3.298 305 HA GLU 34 HA GLU 34 -11.614 3.893 -2.013 306 HB2 GLU 34 HB2 GLU 34 -13.197 2.057 -2.488 307 HB3 GLU 34 HB3 GLU 34 -12.213 0.951 -1.516 308 HG2 GLU 34 HG2 GLU 34 -12.556 2.357 0.466 309 HG3 GLU 34 HG3 GLU 34 -13.402 3.565 -0.503 310 H LEU 35 H LEU 35 -9.965 4.767 -1.039 311 HA LEU 35 HA LEU 35 -8.841 3.459 1.394 312 HB2 LEU 35 HB2 LEU 35 -7.529 5.351 -0.598 313 HB3 LEU 35 HB3 LEU 35 -6.890 5.091 1.013 314 HG LEU 35 HG LEU 35 -7.350 2.596 -0.584 315 HD11 LEU 35 HD11 LEU 35 -5.071 4.467 -1.287 316 HD12 LEU 35 HD12 LEU 35 -5.365 2.830 -1.918 317 HD13 LEU 35 HD13 LEU 35 -6.484 4.135 -2.313 318 HD21 LEU 35 HD21 LEU 35 -6.313 2.571 1.664 319 HD22 LEU 35 HD22 LEU 35 -5.205 1.974 0.420 320 HD23 LEU 35 HD23 LEU 35 -4.997 3.614 1.066 321 H SER 36 H SER 36 -8.595 4.974 3.173 322 HA SER 36 HA SER 36 -10.600 7.149 3.257 323 HB2 SER 36 HB2 SER 36 -10.130 5.703 5.229 324 HB3 SER 36 HB3 SER 36 -8.491 6.380 5.307 325 HG SER 36 HG SER 36 -10.062 7.448 6.682 326 H GLU 37 H GLU 37 -9.829 9.441 3.935 327 HA GLU 37 HA GLU 37 -8.226 10.459 1.839 328 HB2 GLU 37 HB2 GLU 37 -9.911 11.739 3.093 329 HB3 GLU 37 HB3 GLU 37 -8.867 11.749 4.522 330 HG2 GLU 37 HG2 GLU 37 -7.160 13.047 3.283 331 HG3 GLU 37 HG3 GLU 37 -8.139 12.960 1.816 332 H GLN 38 H GLN 38 -7.216 9.869 5.233 333 HA GLN 38 HA GLN 38 -4.453 10.684 4.791 334 HB2 GLN 38 HB2 GLN 38 -5.667 10.674 7.017 335 HB3 GLN 38 HB3 GLN 38 -5.683 8.912 6.951 336 HG2 GLN 38 HG2 GLN 38 -3.067 9.130 6.749 337 HG3 GLN 38 HG3 GLN 38 -3.317 10.785 7.294 338 HE21 GLN 38 HE21 GLN 38 -3.928 7.629 9.893 339 HE22 GLN 38 HE22 GLN 38 -3.871 7.324 8.165 340 H GLN 39 H GLN 39 -6.149 7.526 4.823 341 HA GLN 39 HA GLN 39 -3.824 5.890 4.483 342 HB2 GLN 39 HB2 GLN 39 -6.755 5.459 3.917 343 HB3 GLN 39 HB3 GLN 39 -5.540 4.229 3.558 344 HG2 GLN 39 HG2 GLN 39 -4.757 4.268 5.907 345 HG3 GLN 39 HG3 GLN 39 -5.995 5.458 6.313 346 HE21 GLN 39 HE21 GLN 39 -7.085 1.798 6.913 347 HE22 GLN 39 HE22 GLN 39 -5.485 2.481 7.147 348 H LYS 40 H LYS 40 -5.922 7.497 2.098 349 HA LYS 40 HA LYS 40 -4.718 6.400 -0.258 350 HB2 LYS 40 HB2 LYS 40 -6.918 7.574 -0.136 351 HB3 LYS 40 HB3 LYS 40 -6.094 9.091 0.226 352 HG2 LYS 40 HG2 LYS 40 -4.939 8.999 -1.968 353 HG3 LYS 40 HG3 LYS 40 -5.760 7.478 -2.346 354 HD2 LYS 40 HD2 LYS 40 -7.171 10.120 -1.747 355 HD3 LYS 40 HD3 LYS 40 -6.777 9.542 -3.376 356 HE2 LYS 40 HE2 LYS 40 -8.152 7.496 -2.968 357 HE3 LYS 40 HE3 LYS 40 -8.605 8.130 -1.379 358 HZ1 LYS 40 HZ1 LYS 40 -9.213 9.444 -3.977 359 HZ2 LYS 40 HZ2 LYS 40 -10.292 8.647 -3.050 360 HZ3 LYS 40 HZ3 LYS 40 -9.628 10.037 -2.512 361 H ILE 41 H ILE 41 -3.952 9.393 1.626 362 HA ILE 41 HA ILE 41 -1.790 10.192 -0.080 363 HB ILE 41 HB ILE 41 -2.203 10.755 2.838 364 HG12 ILE 41 HG12 ILE 41 -2.749 12.668 0.515 365 HG13 ILE 41 HG13 ILE 41 -3.992 11.556 1.047 366 HG21 ILE 41 HG21 ILE 41 -0.353 12.120 0.845 367 HG22 ILE 41 HG22 ILE 41 -0.716 12.749 2.465 368 HG23 ILE 41 HG23 ILE 41 0.122 11.218 2.299 369 HD11 ILE 41 HD11 ILE 41 -2.726 13.725 2.763 370 HD12 ILE 41 HD12 ILE 41 -4.371 13.680 2.106 371 HD13 ILE 41 HD13 ILE 41 -3.888 12.507 3.344 372 H ILE 42 H ILE 42 -1.785 8.140 2.919 373 HA ILE 42 HA ILE 42 1.080 7.816 2.965 374 HB ILE 42 HB ILE 42 -1.164 6.068 4.002 375 HG12 ILE 42 HG12 ILE 42 0.704 7.768 5.687 376 HG13 ILE 42 HG13 ILE 42 -0.748 8.463 4.972 377 HG21 ILE 42 HG21 ILE 42 1.842 5.854 4.518 378 HG22 ILE 42 HG22 ILE 42 0.611 4.995 5.455 379 HG23 ILE 42 HG23 ILE 42 0.806 4.625 3.754 380 HD11 ILE 42 HD11 ILE 42 -0.719 6.066 6.852 381 HD12 ILE 42 HD12 ILE 42 -1.245 7.711 7.230 382 HD13 ILE 42 HD13 ILE 42 -2.151 6.737 6.043 383 H LEU 43 H LEU 43 -1.500 5.824 1.531 384 HA LEU 43 HA LEU 43 0.092 3.764 0.409 385 HB2 LEU 43 HB2 LEU 43 -2.320 3.682 0.760 386 HB3 LEU 43 HB3 LEU 43 -2.592 4.975 -0.382 387 HG LEU 43 HG LEU 43 -3.227 2.681 -1.079 388 HD11 LEU 43 HD11 LEU 43 -1.256 3.998 -2.965 389 HD12 LEU 43 HD12 LEU 43 -2.589 2.914 -3.380 390 HD13 LEU 43 HD13 LEU 43 -2.928 4.514 -2.697 391 HD21 LEU 43 HD21 LEU 43 -1.454 1.341 -0.274 392 HD22 LEU 43 HD22 LEU 43 -1.449 1.200 -2.030 393 HD23 LEU 43 HD23 LEU 43 -0.217 2.199 -1.221 394 H ALA 44 H ALA 44 -1.093 6.789 -1.089 395 HA ALA 44 HA ALA 44 0.217 6.535 -3.590 396 HB1 ALA 44 HB1 ALA 44 -0.659 8.978 -2.006 397 HB2 ALA 44 HB2 ALA 44 -0.255 8.969 -3.739 398 HB3 ALA 44 HB3 ALA 44 -1.663 8.053 -3.150 399 H GLU 45 H GLU 45 1.250 8.491 -0.673 400 HA GLU 45 HA GLU 45 3.720 9.335 -1.806 401 HB2 GLU 45 HB2 GLU 45 2.832 8.916 1.070 402 HB3 GLU 45 HB3 GLU 45 4.406 9.579 0.658 403 HG2 GLU 45 HG2 GLU 45 1.805 10.840 -0.306 404 HG3 GLU 45 HG3 GLU 45 2.606 11.276 1.199 405 H TYR 46 H TYR 46 2.940 6.228 -0.227 406 HA TYR 46 HA TYR 46 5.661 5.361 0.058 407 HB2 TYR 46 HB2 TYR 46 3.713 4.429 1.256 408 HB3 TYR 46 HB3 TYR 46 3.079 3.779 -0.245 409 HD1 TYR 46 HD1 TYR 46 6.684 3.358 -0.080 410 HD2 TYR 46 HD2 TYR 46 2.922 1.767 1.316 411 HE1 TYR 46 HE1 TYR 46 7.796 1.223 0.478 412 HE2 TYR 46 HE2 TYR 46 4.047 -0.408 1.829 413 HH TYR 46 HH TYR 46 7.546 -0.904 1.287 414 H ILE 47 H ILE 47 3.227 4.503 -2.465 415 HA ILE 47 HA ILE 47 4.937 3.094 -4.207 416 HB ILE 47 HB ILE 47 2.311 4.555 -4.411 417 HG12 ILE 47 HG12 ILE 47 3.000 1.578 -4.493 418 HG13 ILE 47 HG13 ILE 47 2.556 2.433 -3.021 419 HG21 ILE 47 HG21 ILE 47 3.649 2.961 -6.618 420 HG22 ILE 47 HG22 ILE 47 1.912 3.348 -6.615 421 HG23 ILE 47 HG23 ILE 47 3.090 4.641 -6.693 422 HD11 ILE 47 HD11 ILE 47 0.751 1.882 -5.397 423 HD12 ILE 47 HD12 ILE 47 0.594 1.319 -3.727 424 HD13 ILE 47 HD13 ILE 47 0.355 3.038 -4.104 425 H ALA 48 H ALA 48 4.089 6.582 -4.011 426 HA ALA 48 HA ALA 48 5.368 7.307 -6.501 427 HB1 ALA 48 HB1 ALA 48 4.532 8.964 -4.087 428 HB2 ALA 48 HB2 ALA 48 4.936 9.601 -5.699 429 HB3 ALA 48 HB3 ALA 48 3.509 8.563 -5.484 430 H GLU 49 H GLU 49 6.506 7.051 -3.143 431 HA GLU 49 HA GLU 49 9.108 8.285 -3.744 432 HB2 GLU 49 HB2 GLU 49 8.064 8.552 -1.553 433 HB3 GLU 49 HB3 GLU 49 8.114 6.797 -1.287 434 HG2 GLU 49 HG2 GLU 49 10.542 6.812 -1.274 435 HG3 GLU 49 HG3 GLU 49 10.584 8.504 -1.786 436 H VAL 50 H VAL 50 7.838 4.933 -3.331 437 HA VAL 50 HA VAL 50 10.598 3.942 -3.897 438 HB VAL 50 HB VAL 50 10.213 1.998 -2.843 439 HG11 VAL 50 HG11 VAL 50 8.675 3.992 -1.161 440 HG12 VAL 50 HG12 VAL 50 9.551 2.554 -0.599 441 HG13 VAL 50 HG13 VAL 50 10.441 3.906 -1.318 442 HG21 VAL 50 HG21 VAL 50 8.056 1.275 -3.742 443 HG22 VAL 50 HG22 VAL 50 8.081 1.142 -1.986 444 HG23 VAL 50 HG23 VAL 50 7.209 2.477 -2.757 445 H GLY 51 H GLY 51 7.613 4.194 -5.542 446 HA2 GLY 51 HA2 GLY 51 7.589 4.174 -7.866 447 HA3 GLY 51 HA3 GLY 51 9.047 3.190 -7.911 448 H LEU 52 H LEU 52 6.135 2.311 -6.123 449 HA LEU 52 HA LEU 52 4.903 0.461 -6.019 450 HB2 LEU 52 HB2 LEU 52 4.354 1.692 -8.428 451 HB3 LEU 52 HB3 LEU 52 4.655 0.063 -8.971 452 HG LEU 52 HG LEU 52 2.590 0.892 -6.879 453 HD11 LEU 52 HD11 LEU 52 2.250 0.031 -9.780 454 HD12 LEU 52 HD12 LEU 52 0.941 0.421 -8.642 455 HD13 LEU 52 HD13 LEU 52 2.067 1.685 -9.154 456 HD21 LEU 52 HD21 LEU 52 3.218 -1.421 -6.465 457 HD22 LEU 52 HD22 LEU 52 1.607 -1.349 -7.180 458 HD23 LEU 52 HD23 LEU 52 2.998 -1.819 -8.185 459 H GLN 53 H GLN 53 7.891 0.092 -6.747 460 HA GLN 53 HA GLN 53 7.897 -2.760 -7.648 461 HB2 GLN 53 HB2 GLN 53 9.973 -2.276 -8.752 462 HB3 GLN 53 HB3 GLN 53 8.804 -1.024 -9.176 463 HG2 GLN 53 HG2 GLN 53 9.872 0.294 -7.164 464 HG3 GLN 53 HG3 GLN 53 11.193 -0.867 -7.313 465 HE21 GLN 53 HE21 GLN 53 10.631 1.875 -10.356 466 HE22 GLN 53 HE22 GLN 53 9.210 1.259 -9.506 467 H ASN 54 H ASN 54 8.469 -0.972 -4.877 468 HA ASN 54 HA ASN 54 10.192 -3.120 -3.699 469 HB2 ASN 54 HB2 ASN 54 10.255 -0.150 -3.060 470 HB3 ASN 54 HB3 ASN 54 11.178 -1.380 -2.221 471 HD21 ASN 54 HD21 ASN 54 12.708 0.185 -5.576 472 HD22 ASN 54 HD22 ASN 54 11.174 0.764 -4.948 473 H ILE 55 H ILE 55 7.135 -1.945 -3.677 474 HA ILE 55 HA ILE 55 6.671 -1.934 -0.797 475 HB ILE 55 HB ILE 55 4.364 -1.717 -1.181 476 HG12 ILE 55 HG12 ILE 55 4.807 -2.143 -4.168 477 HG13 ILE 55 HG13 ILE 55 4.035 -3.291 -3.064 478 HG21 ILE 55 HG21 ILE 55 5.636 0.067 -3.281 479 HG22 ILE 55 HG22 ILE 55 4.317 0.432 -2.140 480 HG23 ILE 55 HG23 ILE 55 5.955 0.234 -1.545 481 HD11 ILE 55 HD11 ILE 55 3.012 -0.525 -3.769 482 HD12 ILE 55 HD12 ILE 55 2.306 -2.086 -4.215 483 HD13 ILE 55 HD13 ILE 55 2.306 -1.575 -2.509 484 H THR 56 H THR 56 5.559 -3.456 0.462 485 HA THR 56 HA THR 56 5.131 -6.158 -0.698 486 HB THR 56 HB THR 56 6.054 -6.872 1.722 487 HG1 THR 56 HG1 THR 56 8.055 -5.612 1.971 488 HG21 THR 56 HG21 THR 56 7.941 -6.185 -0.576 489 HG22 THR 56 HG22 THR 56 8.242 -7.369 0.720 490 HG23 THR 56 HG23 THR 56 6.962 -7.664 -0.466 491 H ALA 57 H ALA 57 3.403 -7.283 0.234 492 HA ALA 57 HA ALA 57 1.326 -5.754 1.371 493 HB1 ALA 57 HB1 ALA 57 1.777 -8.772 1.382 494 HB2 ALA 57 HB2 ALA 57 0.234 -7.932 1.655 495 HB3 ALA 57 HB3 ALA 57 1.024 -7.834 0.069 496 H ILE 58 H ILE 58 3.951 -7.478 2.909 497 HA ILE 58 HA ILE 58 2.952 -7.608 5.627 498 HB ILE 58 HB ILE 58 5.714 -7.603 4.331 499 HG12 ILE 58 HG12 ILE 58 5.813 -9.963 5.184 500 HG13 ILE 58 HG13 ILE 58 4.164 -9.823 5.786 501 HG21 ILE 58 HG21 ILE 58 4.986 -7.836 7.289 502 HG22 ILE 58 HG22 ILE 58 6.568 -8.333 6.629 503 HG23 ILE 58 HG23 ILE 58 6.062 -6.647 6.537 504 HD11 ILE 58 HD11 ILE 58 4.936 -9.598 2.843 505 HD12 ILE 58 HD12 ILE 58 4.430 -11.098 3.641 506 HD13 ILE 58 HD13 ILE 58 3.288 -9.758 3.520 507 H THR 59 H THR 59 4.872 -5.266 3.764 508 HA THR 59 HA THR 59 5.275 -3.469 6.040 509 HB THR 59 HB THR 59 5.840 -3.117 3.072 510 HG1 THR 59 HG1 THR 59 7.345 -4.434 3.450 511 HG21 THR 59 HG21 THR 59 6.855 -1.656 5.553 512 HG22 THR 59 HG22 THR 59 7.553 -1.504 3.922 513 HG23 THR 59 HG23 THR 59 5.890 -0.963 4.220 514 H LEU 60 H LEU 60 3.403 -3.433 2.997 515 HA LEU 60 HA LEU 60 2.062 -1.012 3.434 516 HB2 LEU 60 HB2 LEU 60 2.393 -2.389 1.298 517 HB3 LEU 60 HB3 LEU 60 1.093 -3.428 1.846 518 HG LEU 60 HG LEU 60 -0.450 -1.439 1.775 519 HD11 LEU 60 HD11 LEU 60 1.974 -0.110 0.508 520 HD12 LEU 60 HD12 LEU 60 0.358 0.584 0.591 521 HD13 LEU 60 HD13 LEU 60 1.259 0.362 2.079 522 HD21 LEU 60 HD21 LEU 60 -0.295 -2.968 -0.119 523 HD22 LEU 60 HD22 LEU 60 -0.539 -1.305 -0.681 524 HD23 LEU 60 HD23 LEU 60 1.071 -2.055 -0.769 525 H SER 61 H SER 61 1.170 -4.324 4.542 526 HA SER 61 HA SER 61 -1.343 -3.637 5.618 527 HB2 SER 61 HB2 SER 61 -1.294 -5.593 6.922 528 HB3 SER 61 HB3 SER 61 -0.616 -5.955 5.347 529 HG SER 61 HG SER 61 0.597 -6.814 7.143 530 H LYS 62 H LYS 62 1.781 -2.934 6.704 531 HA LYS 62 HA LYS 62 0.862 -2.079 9.389 532 HB2 LYS 62 HB2 LYS 62 3.655 -2.638 8.336 533 HB3 LYS 62 HB3 LYS 62 3.322 -1.951 9.933 534 HG2 LYS 62 HG2 LYS 62 1.912 -3.926 10.496 535 HG3 LYS 62 HG3 LYS 62 2.312 -4.651 8.929 536 HD2 LYS 62 HD2 LYS 62 4.723 -4.616 9.538 537 HD3 LYS 62 HD3 LYS 62 4.296 -3.910 11.117 538 HE2 LYS 62 HE2 LYS 62 2.876 -5.912 11.596 539 HE3 LYS 62 HE3 LYS 62 3.362 -6.615 10.048 540 HZ1 LYS 62 HZ1 LYS 62 5.211 -5.972 12.288 541 HZ2 LYS 62 HZ2 LYS 62 4.717 -7.470 11.875 542 HZ3 LYS 62 HZ3 LYS 62 5.668 -6.619 10.858 543 H LYS 63 H LYS 63 2.099 -0.649 6.408 544 HA LYS 63 HA LYS 63 2.629 2.001 7.406 545 HB2 LYS 63 HB2 LYS 63 1.750 0.832 4.731 546 HB3 LYS 63 HB3 LYS 63 2.131 2.543 4.913 547 HG2 LYS 63 HG2 LYS 63 4.162 0.465 5.775 548 HG3 LYS 63 HG3 LYS 63 3.958 0.806 4.065 549 HD2 LYS 63 HD2 LYS 63 4.498 2.979 6.111 550 HD3 LYS 63 HD3 LYS 63 5.787 2.032 5.338 551 HE2 LYS 63 HE2 LYS 63 5.054 2.742 3.124 552 HE3 LYS 63 HE3 LYS 63 3.735 3.694 3.825 553 HZ1 LYS 63 HZ1 LYS 63 6.636 4.173 4.288 554 HZ2 LYS 63 HZ2 LYS 63 5.671 5.091 3.345 555 HZ3 LYS 63 HZ3 LYS 63 5.432 5.051 4.960 556 H LEU 64 H LEU 64 -0.273 0.355 6.404 557 HA LEU 64 HA LEU 64 -1.958 2.789 6.770 558 HB2 LEU 64 HB2 LEU 64 -2.123 0.281 5.094 559 HB3 LEU 64 HB3 LEU 64 -3.448 1.448 5.159 560 HG LEU 64 HG LEU 64 -0.618 2.175 4.286 561 HD11 LEU 64 HD11 LEU 64 -2.955 1.349 2.523 562 HD12 LEU 64 HD12 LEU 64 -1.356 1.930 1.994 563 HD13 LEU 64 HD13 LEU 64 -1.494 0.383 2.834 564 HD21 LEU 64 HD21 LEU 64 -2.099 4.057 4.919 565 HD22 LEU 64 HD22 LEU 64 -1.750 4.024 3.181 566 HD23 LEU 64 HD23 LEU 64 -3.321 3.456 3.768 567 H ASN 65 H ASN 65 -1.235 0.113 8.545 568 HA ASN 65 HA ASN 65 -2.176 -1.141 10.148 569 HB2 ASN 65 HB2 ASN 65 -4.138 1.152 10.520 570 HB3 ASN 65 HB3 ASN 65 -3.674 -0.053 11.712 571 HD21 ASN 65 HD21 ASN 65 -1.363 3.231 11.168 572 HD22 ASN 65 HD22 ASN 65 -2.818 2.962 10.214 573 H ILE 66 H ILE 66 -2.761 -2.471 8.196 574 HA ILE 66 HA ILE 66 -5.654 -3.200 8.145 575 HB ILE 66 HB ILE 66 -4.997 -3.571 5.550 576 HG12 ILE 66 HG12 ILE 66 -3.665 -0.917 6.038 577 HG13 ILE 66 HG13 ILE 66 -2.669 -2.332 6.054 578 HG21 ILE 66 HG21 ILE 66 -5.996 -0.997 6.828 579 HG22 ILE 66 HG22 ILE 66 -6.181 -1.409 5.118 580 HG23 ILE 66 HG23 ILE 66 -6.968 -2.409 6.352 581 HD11 ILE 66 HD11 ILE 66 -4.280 -1.229 3.730 582 HD12 ILE 66 HD12 ILE 66 -2.540 -1.568 3.826 583 HD13 ILE 66 HD13 ILE 66 -3.691 -2.906 3.735 584 H THR 67 H THR 67 -5.833 -5.315 6.671 585 HA THR 67 HA THR 67 -4.049 -7.332 7.862 586 HB THR 67 HB THR 67 -5.461 -8.958 7.231 587 HG1 THR 67 HG1 THR 67 -6.900 -8.782 5.467 588 HG21 THR 67 HG21 THR 67 -7.464 -6.668 7.053 589 HG22 THR 67 HG22 THR 67 -7.771 -8.351 7.526 590 HG23 THR 67 HG23 THR 67 -6.803 -7.308 8.582 591 H VAL 68 H VAL 68 -2.878 -8.928 6.576 592 HA VAL 68 HA VAL 68 -1.277 -7.800 4.443 593 HB VAL 68 HB VAL 68 -1.661 -10.683 5.335 594 HG11 VAL 68 HG11 VAL 68 0.480 -9.506 3.507 595 HG12 VAL 68 HG12 VAL 68 0.483 -11.149 4.175 596 HG13 VAL 68 HG13 VAL 68 -0.765 -10.683 3.019 597 HG21 VAL 68 HG21 VAL 68 -0.640 -9.203 7.059 598 HG22 VAL 68 HG22 VAL 68 0.535 -10.358 6.425 599 HG23 VAL 68 HG23 VAL 68 0.574 -8.672 5.872 600 H GLU 69 H GLU 69 -4.410 -9.454 4.413 601 HA GLU 69 HA GLU 69 -4.146 -10.230 1.562 602 HB2 GLU 69 HB2 GLU 69 -6.483 -10.408 3.509 603 HB3 GLU 69 HB3 GLU 69 -6.479 -11.014 1.846 604 HG2 GLU 69 HG2 GLU 69 -4.577 -12.523 2.406 605 HG3 GLU 69 HG3 GLU 69 -4.629 -11.969 4.079 606 H LYS 70 H LYS 70 -5.692 -7.794 3.593 607 HA LYS 70 HA LYS 70 -7.108 -6.409 1.558 608 HB2 LYS 70 HB2 LYS 70 -7.403 -6.347 4.081 609 HB3 LYS 70 HB3 LYS 70 -5.991 -5.306 4.180 610 HG2 LYS 70 HG2 LYS 70 -8.590 -4.721 2.711 611 HG3 LYS 70 HG3 LYS 70 -8.147 -4.161 4.329 612 HD2 LYS 70 HD2 LYS 70 -6.162 -2.971 3.227 613 HD3 LYS 70 HD3 LYS 70 -6.968 -3.253 1.678 614 HE2 LYS 70 HE2 LYS 70 -8.284 -1.896 4.071 615 HE3 LYS 70 HE3 LYS 70 -7.427 -1.013 2.800 616 HZ1 LYS 70 HZ1 LYS 70 -9.817 -2.718 2.336 617 HZ2 LYS 70 HZ2 LYS 70 -9.799 -1.084 2.354 618 HZ3 LYS 70 HZ3 LYS 70 -8.996 -1.880 1.184 619 H ALA 71 H ALA 71 -3.957 -5.794 3.069 620 HA ALA 71 HA ALA 71 -3.023 -3.690 1.432 621 HB1 ALA 71 HB1 ALA 71 -1.467 -5.952 2.776 622 HB2 ALA 71 HB2 ALA 71 -0.806 -4.401 2.235 623 HB3 ALA 71 HB3 ALA 71 -1.983 -4.444 3.554 624 H LYS 72 H LYS 72 -2.785 -7.253 0.893 625 HA LYS 72 HA LYS 72 -1.090 -6.998 -1.409 626 HB2 LYS 72 HB2 LYS 72 -1.134 -8.948 0.136 627 HB3 LYS 72 HB3 LYS 72 -2.773 -9.341 -0.383 628 HG2 LYS 72 HG2 LYS 72 -2.012 -9.887 -2.584 629 HG3 LYS 72 HG3 LYS 72 -0.400 -9.220 -2.288 630 HD2 LYS 72 HD2 LYS 72 -1.517 -11.547 -0.654 631 HD3 LYS 72 HD3 LYS 72 -0.668 -11.789 -2.197 632 HE2 LYS 72 HE2 LYS 72 1.301 -10.544 -1.263 633 HE3 LYS 72 HE3 LYS 72 0.466 -10.448 0.295 634 HZ1 LYS 72 HZ1 LYS 72 1.231 -12.972 -1.082 635 HZ2 LYS 72 HZ2 LYS 72 1.984 -12.346 0.219 636 HZ3 LYS 72 HZ3 LYS 72 0.453 -12.895 0.352 637 H ASN 73 H ASN 73 -4.612 -7.076 -0.977 638 HA ASN 73 HA ASN 73 -5.385 -7.641 -3.553 639 HB2 ASN 73 HB2 ASN 73 -7.428 -7.028 -2.830 640 HB3 ASN 73 HB3 ASN 73 -6.691 -6.610 -1.295 641 HD21 ASN 73 HD21 ASN 73 -7.033 -3.086 -1.883 642 HD22 ASN 73 HD22 ASN 73 -6.414 -4.328 -0.806 643 H TYR 74 H TYR 74 -4.183 -4.526 -2.351 644 HA TYR 74 HA TYR 74 -4.608 -2.997 -4.700 645 HB2 TYR 74 HB2 TYR 74 -2.511 -2.673 -2.518 646 HB3 TYR 74 HB3 TYR 74 -2.974 -1.431 -3.673 647 HD1 TYR 74 HD1 TYR 74 -5.832 -1.249 -3.717 648 HD2 TYR 74 HD2 TYR 74 -3.232 -2.211 -0.398 649 HE1 TYR 74 HE1 TYR 74 -7.464 -0.194 -2.137 650 HE2 TYR 74 HE2 TYR 74 -4.912 -1.211 1.179 651 HH TYR 74 HH TYR 74 -7.958 0.286 0.027 652 H ILE 75 H ILE 75 -1.853 -4.950 -3.576 653 HA ILE 75 HA ILE 75 -0.048 -4.283 -5.719 654 HB ILE 75 HB ILE 75 -0.026 -6.708 -3.880 655 HG12 ILE 75 HG12 ILE 75 1.163 -3.926 -3.451 656 HG13 ILE 75 HG13 ILE 75 -0.182 -4.608 -2.550 657 HG21 ILE 75 HG21 ILE 75 2.235 -5.302 -5.377 658 HG22 ILE 75 HG22 ILE 75 2.403 -6.717 -4.315 659 HG23 ILE 75 HG23 ILE 75 1.523 -6.869 -5.821 660 HD11 ILE 75 HD11 ILE 75 2.697 -5.511 -2.411 661 HD12 ILE 75 HD12 ILE 75 1.692 -4.778 -1.151 662 HD13 ILE 75 HD13 ILE 75 1.326 -6.419 -1.722 663 H LYS 76 H LYS 76 -2.681 -6.671 -5.415 664 HA LYS 76 HA LYS 76 -1.961 -8.149 -7.843 665 HB2 LYS 76 HB2 LYS 76 -4.476 -8.151 -6.212 666 HB3 LYS 76 HB3 LYS 76 -3.993 -9.269 -7.529 667 HG2 LYS 76 HG2 LYS 76 -1.884 -9.638 -5.914 668 HG3 LYS 76 HG3 LYS 76 -3.085 -9.149 -4.704 669 HD2 LYS 76 HD2 LYS 76 -4.634 -10.932 -5.599 670 HD3 LYS 76 HD3 LYS 76 -3.300 -11.470 -6.648 671 HE2 LYS 76 HE2 LYS 76 -1.888 -11.665 -4.515 672 HE3 LYS 76 HE3 LYS 76 -3.379 -11.398 -3.599 673 HZ1 LYS 76 HZ1 LYS 76 -2.841 -13.642 -5.461 674 HZ2 LYS 76 HZ2 LYS 76 -2.982 -13.755 -3.840 675 HZ3 LYS 76 HZ3 LYS 76 -4.299 -13.406 -4.751 676 H ASN 77 H ASN 77 -4.030 -5.305 -7.256 677 HA ASN 77 HA ASN 77 -4.980 -5.545 -10.085 678 HB2 ASN 77 HB2 ASN 77 -6.827 -4.048 -9.388 679 HB3 ASN 77 HB3 ASN 77 -6.806 -5.624 -8.621 680 HD21 ASN 77 HD21 ASN 77 -7.298 -4.143 -5.518 681 HD22 ASN 77 HD22 ASN 77 -7.891 -5.246 -6.747 682 H SER 78 H SER 78 -3.766 -3.084 -7.797 683 HA SER 78 HA SER 78 -3.526 -1.103 -9.790 684 HB2 SER 78 HB2 SER 78 -3.633 -0.897 -7.226 685 HB3 SER 78 HB3 SER 78 -1.866 -1.068 -7.268 686 HG SER 78 HG SER 78 -2.611 1.134 -7.355 687 H ASN 79 H ASN 79 -1.274 -3.707 -9.287 688 HA ASN 79 HA ASN 79 1.119 -2.370 -9.960 689 HB2 ASN 79 HB2 ASN 79 2.139 -4.481 -10.173 690 HB3 ASN 79 HB3 ASN 79 0.915 -4.654 -8.928 691 HD21 ASN 79 HD21 ASN 79 -0.881 -7.119 -10.748 692 HD22 ASN 79 HD22 ASN 79 -0.657 -6.227 -9.245 693 H ARG 80 H ARG 80 -1.432 -3.112 -12.120 694 HA ARG 80 HA ARG 80 0.040 -3.159 -14.630 695 HB2 ARG 80 HB2 ARG 80 -2.854 -2.733 -13.804 696 HB3 ARG 80 HB3 ARG 80 -2.357 -2.402 -15.456 697 HG2 ARG 80 HG2 ARG 80 -3.301 -4.644 -15.222 698 HG3 ARG 80 HG3 ARG 80 -1.649 -4.655 -15.838 699 HD2 ARG 80 HD2 ARG 80 -0.788 -5.364 -13.659 700 HD3 ARG 80 HD3 ARG 80 -2.380 -5.192 -12.929 701 HE ARG 80 HE ARG 80 -3.053 -7.215 -13.848 702 HH11 ARG 80 HH11 ARG 80 -2.847 -9.150 -14.910 703 HH12 ARG 80 HH12 ARG 80 -1.458 -9.451 -15.909 704 HH21 ARG 80 HH21 ARG 80 0.020 -6.414 -15.339 705 HH22 ARG 80 HH22 ARG 80 0.114 -7.944 -16.168 706 H LEU 81 H LEU 81 -0.566 -0.586 -12.458 707 HA LEU 81 HA LEU 81 -0.669 1.591 -14.333 708 HB2 LEU 81 HB2 LEU 81 -1.339 1.412 -11.797 709 HB3 LEU 81 HB3 LEU 81 0.370 1.687 -11.485 710 HG LEU 81 HG LEU 81 0.056 3.836 -12.980 711 HD11 LEU 81 HD11 LEU 81 -2.836 3.203 -12.222 712 HD12 LEU 81 HD12 LEU 81 -2.256 4.721 -12.947 713 HD13 LEU 81 HD13 LEU 81 -2.183 3.214 -13.872 714 HD21 LEU 81 HD21 LEU 81 0.453 3.891 -10.578 715 HD22 LEU 81 HD22 LEU 81 -0.780 5.089 -11.017 716 HD23 LEU 81 HD23 LEU 81 -1.265 3.551 -10.254 717 H GLY 82 H GLY 82 2.031 -0.167 -12.874 718 HA2 GLY 82 HA2 GLY 82 4.030 1.821 -13.664 719 HA3 GLY 82 HA3 GLY 82 4.314 0.286 -12.850 720 H ARG 83 H ARG 83 6.165 0.192 -14.332 721 HA ARG 83 HA ARG 83 5.505 -0.968 -17.023 722 HB2 ARG 83 HB2 ARG 83 7.718 0.931 -16.313 723 HB3 ARG 83 HB3 ARG 83 7.817 -0.171 -17.705 724 HG2 ARG 83 HG2 ARG 83 5.784 0.722 -18.682 725 HG3 ARG 83 HG3 ARG 83 5.503 1.747 -17.263 726 HD2 ARG 83 HD2 ARG 83 6.455 3.113 -18.979 727 HD3 ARG 83 HD3 ARG 83 7.617 2.906 -17.665 728 HE ARG 83 HE ARG 83 9.073 1.778 -19.068 729 HH11 ARG 83 HH11 ARG 83 9.935 1.210 -21.020 730 HH12 ARG 83 HH12 ARG 83 8.934 1.178 -22.442 731 HH21 ARG 83 HH21 ARG 83 6.064 2.144 -20.835 732 HH22 ARG 83 HH22 ARG 83 6.801 1.692 -22.348 733 H THR 84 H THR 84 8.756 -1.013 -15.884 734 HA THR 84 HA THR 84 8.655 -3.681 -14.692 735 HB THR 84 HB THR 84 8.546 -4.364 -16.963 736 HG1 THR 84 HG1 THR 84 10.446 -5.547 -17.046 737 HG21 THR 84 HG21 THR 84 11.065 -2.778 -17.620 738 HG22 THR 84 HG22 THR 84 10.135 -3.832 -18.699 739 HG23 THR 84 HG23 THR 84 9.423 -2.320 -18.123 740 H ASN 85 H ASN 85 10.014 -3.592 -13.069 741 HA ASN 85 HA ASN 85 12.629 -2.169 -13.278 742 HB2 ASN 85 HB2 ASN 85 10.472 -1.640 -11.187 743 HB3 ASN 85 HB3 ASN 85 12.127 -1.043 -11.108 744 HD21 ASN 85 HD21 ASN 85 9.474 0.972 -13.377 745 HD22 ASN 85 HD22 ASN 85 8.987 -0.479 -12.511 746 H ASN 86 H ASN 86 11.717 -5.085 -12.972 747 HA ASN 86 HA ASN 86 12.853 -5.747 -10.294 748 HB2 ASN 86 HB2 ASN 86 10.443 -6.247 -10.817 749 HB3 ASN 86 HB3 ASN 86 10.989 -7.365 -12.066 750 HD21 ASN 86 HD21 ASN 86 11.121 -9.939 -9.661 751 HD22 ASN 86 HD22 ASN 86 10.778 -9.442 -11.312 752 H LEU 87 H LEU 87 14.411 -5.363 -12.919 753 HA LEU 87 HA LEU 87 16.043 -7.802 -12.855 754 HB2 LEU 87 HB2 LEU 87 14.245 -6.937 -15.109 755 HB3 LEU 87 HB3 LEU 87 15.852 -7.458 -15.575 756 HG LEU 87 HG LEU 87 13.961 -9.170 -13.911 757 HD11 LEU 87 HD11 LEU 87 14.591 -9.250 -16.890 758 HD12 LEU 87 HD12 LEU 87 13.604 -10.430 -15.995 759 HD13 LEU 87 HD13 LEU 87 13.047 -8.758 -16.157 760 HD21 LEU 87 HD21 LEU 87 16.344 -9.807 -13.635 761 HD22 LEU 87 HD22 LEU 87 15.488 -11.005 -14.600 762 HD23 LEU 87 HD23 LEU 87 16.548 -9.830 -15.403 763 H LYS 88 H LYS 88 17.990 -7.574 -14.119 764 HA LYS 88 HA LYS 88 19.077 -4.787 -14.199 765 HB2 LYS 88 HB2 LYS 88 21.188 -5.726 -13.309 766 HB3 LYS 88 HB3 LYS 88 19.843 -5.853 -12.178 767 HG2 LYS 88 HG2 LYS 88 19.558 -8.201 -12.600 768 HG3 LYS 88 HG3 LYS 88 20.663 -8.158 -13.990 769 HD2 LYS 88 HD2 LYS 88 22.541 -7.541 -12.461 770 HD3 LYS 88 HD3 LYS 88 21.438 -7.695 -11.075 771 HE2 LYS 88 HE2 LYS 88 21.041 -10.069 -11.644 772 HE3 LYS 88 HE3 LYS 88 22.062 -9.916 -13.079 773 HZ1 LYS 88 HZ1 LYS 88 23.011 -9.590 -10.282 774 HZ2 LYS 88 HZ2 LYS 88 23.291 -10.888 -11.229 775 HZ3 LYS 88 HZ3 LYS 88 23.949 -9.448 -11.612 776 H THR 89 H THR 89 18.099 -6.860 -16.312 777 HA THR 89 HA THR 89 20.057 -6.077 -18.266 778 HB THR 89 HB THR 89 21.002 -8.232 -17.536 779 HG1 THR 89 HG1 THR 89 21.215 -8.965 -19.648 780 HG21 THR 89 HG21 THR 89 18.556 -9.545 -18.799 781 HG22 THR 89 HG22 THR 89 19.974 -10.345 -18.086 782 HG23 THR 89 HG23 THR 89 18.845 -9.460 -17.045 783 H ILE 90 H ILE 90 18.970 -5.297 -19.824 784 HA ILE 90 HA ILE 90 16.351 -6.382 -20.701 785 HB ILE 90 HB ILE 90 15.728 -3.896 -20.976 786 HG12 ILE 90 HG12 ILE 90 18.069 -3.038 -20.411 787 HG13 ILE 90 HG13 ILE 90 16.645 -2.180 -19.864 788 HG21 ILE 90 HG21 ILE 90 15.809 -5.084 -18.188 789 HG22 ILE 90 HG22 ILE 90 14.742 -3.778 -18.748 790 HG23 ILE 90 HG23 ILE 90 14.598 -5.399 -19.444 791 HD11 ILE 90 HD11 ILE 90 18.348 -3.957 -18.065 792 HD12 ILE 90 HD12 ILE 90 18.388 -2.195 -18.156 793 HD13 ILE 90 HD13 ILE 90 16.930 -3.005 -17.577 794 H GLY 91 H GLY 91 19.265 -6.239 -21.822 795 HA2 GLY 91 HA2 GLY 91 20.216 -6.045 -23.963 796 HA3 GLY 91 HA3 GLY 91 18.681 -5.429 -24.595 797 H ILE 92 H ILE 92 18.943 -3.489 -22.133 798 HA ILE 92 HA ILE 92 19.072 -1.269 -21.978 799 HB ILE 92 HB ILE 92 21.731 -1.368 -23.443 800 HG12 ILE 92 HG12 ILE 92 22.500 -0.991 -20.931 801 HG13 ILE 92 HG13 ILE 92 20.996 -1.808 -20.522 802 HG21 ILE 92 HG21 ILE 92 20.480 0.707 -21.581 803 HG22 ILE 92 HG22 ILE 92 22.094 0.792 -22.319 804 HG23 ILE 92 HG23 ILE 92 20.663 0.875 -23.340 805 HD11 ILE 92 HD11 ILE 92 23.200 -2.954 -22.306 806 HD12 ILE 92 HD12 ILE 92 23.023 -3.277 -20.573 807 HD13 ILE 92 HD13 ILE 92 21.782 -3.839 -21.694 808 H LEU 93 H LEU 93 17.270 -0.799 -23.055 809 HA LEU 93 HA LEU 93 16.836 -0.959 -25.842 810 HB2 LEU 93 HB2 LEU 93 15.452 0.581 -23.618 811 HB3 LEU 93 HB3 LEU 93 14.847 0.578 -25.269 812 HG LEU 93 HG LEU 93 15.240 -1.978 -23.656 813 HD11 LEU 93 HD11 LEU 93 12.720 -0.320 -24.100 814 HD12 LEU 93 HD12 LEU 93 12.794 -1.920 -23.322 815 HD13 LEU 93 HD13 LEU 93 13.582 -0.531 -22.559 816 HD21 LEU 93 HD21 LEU 93 15.151 -2.342 -26.104 817 HD22 LEU 93 HD22 LEU 93 13.666 -2.914 -25.341 818 HD23 LEU 93 HD23 LEU 93 13.670 -1.364 -26.207 819 H GLN 94 H GLN 94 18.428 -0.035 -26.997 820 HA GLN 94 HA GLN 94 18.634 2.960 -27.038 821 HB2 GLN 94 HB2 GLN 94 20.547 0.756 -27.836 822 HB3 GLN 94 HB3 GLN 94 20.763 2.439 -28.358 823 HG2 GLN 94 HG2 GLN 94 20.847 3.201 -26.035 824 HG3 GLN 94 HG3 GLN 94 20.527 1.571 -25.456 825 HE21 GLN 94 HE21 GLN 94 24.160 1.960 -25.086 826 HE22 GLN 94 HE22 GLN 94 22.693 2.556 -24.322 827 H GLU 95 H GLU 95 18.976 0.404 -29.563 828 HA GLU 95 HA GLU 95 16.879 1.598 -31.201 829 HB2 GLU 95 HB2 GLU 95 18.265 2.109 -33.134 830 HB3 GLU 95 HB3 GLU 95 18.703 3.084 -31.756 831 HG2 GLU 95 HG2 GLU 95 20.724 2.530 -32.801 832 HG3 GLU 95 HG3 GLU 95 20.673 1.585 -31.324 833 H GLU 96 H GLU 96 16.484 0.370 -33.215 834 HA GLU 96 HA GLU 96 17.730 -2.266 -33.473 835 HB2 GLU 96 HB2 GLU 96 15.817 -2.443 -31.741 836 HB3 GLU 96 HB3 GLU 96 14.711 -2.164 -33.081 837 HG2 GLU 96 HG2 GLU 96 15.705 -4.200 -34.223 838 HG3 GLU 96 HG3 GLU 96 16.757 -4.424 -32.829 839 H VAL 97 H VAL 97 18.295 -0.502 -35.219 840 HA VAL 97 HA VAL 97 16.658 -1.233 -37.601 841 HB VAL 97 HB VAL 97 17.683 1.589 -37.094 842 HG11 VAL 97 HG11 VAL 97 15.954 0.431 -39.331 843 HG12 VAL 97 HG12 VAL 97 16.307 2.155 -39.092 844 HG13 VAL 97 HG13 VAL 97 17.617 1.051 -39.495 845 HG21 VAL 97 HG21 VAL 97 15.750 1.178 -35.640 846 HG22 VAL 97 HG22 VAL 97 15.286 2.235 -36.974 847 HG23 VAL 97 HG23 VAL 97 14.830 0.517 -37.011 848 H SER 98 H SER 98 17.767 -1.856 -39.335 849 HA SER 98 HA SER 98 20.733 -1.434 -39.429 850 HB2 SER 98 HB2 SER 98 19.953 -3.776 -39.032 851 HB3 SER 98 HB3 SER 98 19.201 -3.750 -40.638 852 HG SER 98 HG SER 98 21.346 -4.601 -40.677 853 H SER 99 H SER 99 20.308 0.603 -40.395 854 HA SER 99 HA SER 99 20.073 2.108 -42.078 855 HB2 SER 99 HB2 SER 99 22.208 0.844 -42.455 856 HB3 SER 99 HB3 SER 99 21.391 -0.039 -43.756 857 HG SER 99 HG SER 99 22.522 1.860 -44.481 858 H MET 100 H MET 100 17.757 2.026 -42.054 859 HA MET 100 HA MET 100 15.667 1.898 -42.913 860 HB2 MET 100 HB2 MET 100 17.150 2.160 -45.543 861 HB3 MET 100 HB3 MET 100 15.399 2.289 -45.341 862 HG2 MET 100 HG2 MET 100 15.679 4.179 -43.797 863 HG3 MET 100 HG3 MET 100 17.432 4.063 -43.955 864 HE1 MET 100 HE1 MET 100 14.041 4.882 -45.754 865 HE2 MET 100 HE2 MET 100 14.568 5.475 -47.343 866 HE3 MET 100 HE3 MET 100 14.715 3.752 -46.954 867 H GLU 101 H GLU 101 15.948 -0.357 -41.974 868 HA GLU 101 HA GLU 101 15.557 -2.559 -43.865 869 HB2 GLU 101 HB2 GLU 101 16.770 -2.685 -41.631 870 HB3 GLU 101 HB3 GLU 101 15.187 -2.643 -40.855 871 HG2 GLU 101 HG2 GLU 101 14.562 -4.738 -42.055 872 HG3 GLU 101 HG3 GLU 101 16.073 -4.677 -42.961 873 H ALA 102 H ALA 102 13.760 -0.759 -44.594 874 HA ALA 102 HA ALA 102 11.121 -1.929 -43.988 875 HB1 ALA 102 HB1 ALA 102 11.749 1.034 -43.586 876 HB2 ALA 102 HB2 ALA 102 10.139 0.288 -43.486 877 HB3 ALA 102 HB3 ALA 102 11.384 -0.139 -42.299 878 H LYS 103 H LYS 103 9.484 -1.326 -45.507 879 HA LYS 103 HA LYS 103 10.546 -0.624 -48.227 880 HB2 LYS 103 HB2 LYS 103 8.260 -2.423 -47.354 881 HB3 LYS 103 HB3 LYS 103 8.577 -1.953 -49.031 882 HG2 LYS 103 HG2 LYS 103 10.825 -2.949 -48.930 883 HG3 LYS 103 HG3 LYS 103 10.571 -3.441 -47.257 884 HD2 LYS 103 HD2 LYS 103 8.908 -4.371 -49.638 885 HD3 LYS 103 HD3 LYS 103 10.242 -5.281 -48.942 886 HE2 LYS 103 HE2 LYS 103 7.703 -4.505 -47.430 887 HE3 LYS 103 HE3 LYS 103 7.954 -6.049 -48.240 888 HZ1 LYS 103 HZ1 LYS 103 9.611 -5.046 -45.987 889 HZ2 LYS 103 HZ2 LYS 103 8.493 -6.228 -45.897 890 HZ3 LYS 103 HZ3 LYS 103 9.849 -6.462 -46.770 891 H SER 104 H SER 104 10.312 1.518 -48.266 892 HA SER 104 HA SER 104 7.557 2.684 -48.225 893 HB2 SER 104 HB2 SER 104 10.011 3.870 -46.874 894 HB3 SER 104 HB3 SER 104 8.418 4.640 -47.017 895 HG SER 104 HG SER 104 8.670 3.614 -44.995 896 H MET 105 H MET 105 8.220 2.107 -50.595 897 HA MET 105 HA MET 105 9.167 4.605 -51.894 898 HB2 MET 105 HB2 MET 105 10.629 3.460 -53.403 899 HB3 MET 105 HB3 MET 105 11.122 3.050 -51.758 900 HG2 MET 105 HG2 MET 105 9.889 0.889 -51.957 901 HG3 MET 105 HG3 MET 105 9.448 1.294 -53.616 902 HE1 MET 105 HE1 MET 105 11.978 2.447 -55.038 903 HE2 MET 105 HE2 MET 105 12.726 0.948 -55.622 904 HE3 MET 105 HE3 MET 105 10.960 1.132 -55.673 905 H THR 106 H THR 106 8.600 4.858 -54.073 906 HA THR 106 HA THR 106 6.758 2.964 -55.360 907 HB THR 106 HB THR 106 5.971 5.889 -55.288 908 HG1 THR 106 HG1 THR 106 4.467 5.426 -53.712 909 HG21 THR 106 HG21 THR 106 4.463 3.290 -55.841 910 HG22 THR 106 HG22 THR 106 3.713 4.905 -55.822 911 HG23 THR 106 HG23 THR 106 4.927 4.517 -57.045 912 H TRP 107 H TRP 107 6.749 3.055 -57.561 913 HA TRP 107 HA TRP 107 8.732 4.864 -58.820 914 HB2 TRP 107 HB2 TRP 107 9.504 2.448 -58.252 915 HB3 TRP 107 HB3 TRP 107 8.506 1.959 -59.613 916 HD1 TRP 107 HD1 TRP 107 9.501 2.426 -62.012 917 HE1 TRP 107 HE1 TRP 107 11.759 3.292 -62.894 918 HE3 TRP 107 HE3 TRP 107 11.428 4.218 -57.627 919 HZ2 TRP 107 HZ2 TRP 107 14.108 4.593 -61.817 920 HZ3 TRP 107 HZ3 TRP 107 13.688 5.268 -57.578 921 HH2 TRP 107 HH2 TRP 107 15.031 5.460 -59.662 Start of MODEL 22 1 H1 GLY -5 H1 GLY -5 4.521 -49.680 12.850 2 H2 GLY -5 H2 GLY -5 5.854 -50.212 12.063 3 H3 GLY -5 H3 GLY -5 5.988 -49.605 13.578 4 HA2 GLY -5 HA2 GLY -5 4.566 -52.091 12.854 5 HA3 GLY -5 HA3 GLY -5 6.164 -52.008 13.613 6 H SER -4 H SER -4 2.857 -52.273 14.206 7 HA SER -4 HA SER -4 3.287 -52.222 17.107 8 HB2 SER -4 HB2 SER -4 2.731 -49.855 16.658 9 HB3 SER -4 HB3 SER -4 1.223 -50.352 15.872 10 HG SER -4 HG SER -4 0.946 -49.763 18.094 11 H HIS -3 H HIS -3 0.659 -52.303 14.629 12 HA HIS -3 HA HIS -3 -0.090 -55.029 15.458 13 HB2 HIS -3 HB2 HIS -3 -1.415 -53.394 16.876 14 HB3 HIS -3 HB3 HIS -3 -2.145 -52.781 15.393 15 HD2 HIS -3 HD2 HIS -3 -1.765 -56.175 17.307 16 HE1 HIS -3 HE1 HIS -3 -5.520 -56.269 15.285 17 HE2 HIS -3 HE2 HIS -3 -3.984 -57.533 16.874 18 H MET -2 H MET -2 -1.617 -56.035 13.928 19 HA MET -2 HA MET -2 -0.861 -55.214 11.181 20 HB2 MET -2 HB2 MET -2 -0.098 -57.411 12.360 21 HB3 MET -2 HB3 MET -2 -1.723 -57.992 11.986 22 HG2 MET -2 HG2 MET -2 -1.273 -57.588 9.562 23 HG3 MET -2 HG3 MET -2 0.279 -56.875 9.979 24 HE1 MET -2 HE1 MET -2 -1.819 -60.066 9.401 25 HE2 MET -2 HE2 MET -2 -0.813 -61.374 10.058 26 HE3 MET -2 HE3 MET -2 -1.605 -60.229 11.159 27 H ALA -1 H ALA -1 -3.437 -54.379 12.689 28 HA ALA -1 HA ALA -1 -5.105 -54.710 10.280 29 HB1 ALA -1 HB1 ALA -1 -5.967 -55.655 13.044 30 HB2 ALA -1 HB2 ALA -1 -6.942 -55.735 11.556 31 HB3 ALA -1 HB3 ALA -1 -5.459 -56.711 11.711 32 H SER 0 H SER 0 -6.942 -53.509 10.145 33 HA SER 0 HA SER 0 -7.332 -51.123 11.888 34 HB2 SER 0 HB2 SER 0 -6.796 -51.165 8.893 35 HB3 SER 0 HB3 SER 0 -7.491 -49.769 9.753 36 HG SER 0 HG SER 0 -5.202 -49.619 9.502 37 H MET 1 H MET 1 -9.449 -51.060 12.370 38 HA MET 1 HA MET 1 -11.497 -52.219 10.531 39 HB2 MET 1 HB2 MET 1 -11.090 -53.055 13.434 40 HB3 MET 1 HB3 MET 1 -12.409 -53.563 12.368 41 HG2 MET 1 HG2 MET 1 -10.691 -54.572 10.821 42 HG3 MET 1 HG3 MET 1 -9.456 -54.177 12.018 43 HE1 MET 1 HE1 MET 1 -12.263 -56.568 10.904 44 HE2 MET 1 HE2 MET 1 -12.650 -57.498 12.366 45 HE3 MET 1 HE3 MET 1 -13.138 -55.796 12.246 46 H ASP 2 H ASP 2 -11.321 -49.630 10.623 47 HA ASP 2 HA ASP 2 -13.230 -48.575 12.668 48 HB2 ASP 2 HB2 ASP 2 -10.833 -47.256 11.343 49 HB3 ASP 2 HB3 ASP 2 -11.980 -46.429 12.390 50 HA PRO 3 HA PRO 3 -15.861 -47.426 9.363 51 HB2 PRO 3 HB2 PRO 3 -17.344 -45.350 10.390 52 HB3 PRO 3 HB3 PRO 3 -17.469 -47.026 11.006 53 HG2 PRO 3 HG2 PRO 3 -15.748 -44.772 12.108 54 HG3 PRO 3 HG3 PRO 3 -16.904 -45.814 13.004 55 HD2 PRO 3 HD2 PRO 3 -14.269 -46.390 12.975 56 HD3 PRO 3 HD3 PRO 3 -15.473 -47.702 12.825 57 H LEU 4 H LEU 4 -13.627 -45.157 10.412 58 HA LEU 4 HA LEU 4 -14.071 -43.344 8.144 59 HB2 LEU 4 HB2 LEU 4 -12.597 -41.773 9.174 60 HB3 LEU 4 HB3 LEU 4 -13.930 -42.196 10.227 61 HG LEU 4 HG LEU 4 -11.300 -43.668 10.566 62 HD11 LEU 4 HD11 LEU 4 -11.898 -40.865 11.594 63 HD12 LEU 4 HD12 LEU 4 -10.525 -41.882 12.100 64 HD13 LEU 4 HD13 LEU 4 -10.637 -41.322 10.427 65 HD21 LEU 4 HD21 LEU 4 -13.264 -44.314 11.952 66 HD22 LEU 4 HD22 LEU 4 -11.968 -43.633 12.939 67 HD23 LEU 4 HD23 LEU 4 -13.396 -42.651 12.534 68 H ASP 5 H ASP 5 -12.552 -46.146 8.120 69 HA ASP 5 HA ASP 5 -9.912 -45.438 7.311 70 HB2 ASP 5 HB2 ASP 5 -10.797 -47.685 8.181 71 HB3 ASP 5 HB3 ASP 5 -11.453 -47.937 6.551 72 H LYS 6 H LYS 6 -12.632 -44.841 5.638 73 HA LYS 6 HA LYS 6 -11.501 -45.447 2.933 74 HB2 LYS 6 HB2 LYS 6 -14.468 -45.254 3.519 75 HB3 LYS 6 HB3 LYS 6 -13.646 -45.919 2.117 76 HG2 LYS 6 HG2 LYS 6 -14.000 -47.908 3.129 77 HG3 LYS 6 HG3 LYS 6 -12.548 -47.488 4.034 78 HD2 LYS 6 HD2 LYS 6 -14.143 -48.225 5.641 79 HD3 LYS 6 HD3 LYS 6 -14.084 -46.463 5.813 80 HE2 LYS 6 HE2 LYS 6 -16.119 -46.296 4.341 81 HE3 LYS 6 HE3 LYS 6 -16.173 -48.060 4.252 82 HZ1 LYS 6 HZ1 LYS 6 -16.403 -46.472 6.759 83 HZ2 LYS 6 HZ2 LYS 6 -17.656 -47.181 5.975 84 HZ3 LYS 6 HZ3 LYS 6 -16.500 -48.108 6.657 85 H ILE 7 H ILE 7 -13.973 -43.261 4.236 86 HA ILE 7 HA ILE 7 -13.231 -41.229 2.190 87 HB ILE 7 HB ILE 7 -15.441 -40.279 2.502 88 HG12 ILE 7 HG12 ILE 7 -17.230 -41.726 3.584 89 HG13 ILE 7 HG13 ILE 7 -15.962 -42.556 4.472 90 HG21 ILE 7 HG21 ILE 7 -15.517 -43.272 1.940 91 HG22 ILE 7 HG22 ILE 7 -16.633 -42.037 1.331 92 HG23 ILE 7 HG23 ILE 7 -14.944 -42.026 0.811 93 HD11 ILE 7 HD11 ILE 7 -16.485 -39.547 4.608 94 HD12 ILE 7 HD12 ILE 7 -17.175 -40.738 5.725 95 HD13 ILE 7 HD13 ILE 7 -15.431 -40.497 5.686 96 H ILE 8 H ILE 8 -12.932 -41.769 5.502 97 HA ILE 8 HA ILE 8 -12.501 -40.379 7.307 98 HB ILE 8 HB ILE 8 -10.584 -41.410 6.331 99 HG12 ILE 8 HG12 ILE 8 -9.656 -38.806 7.555 100 HG13 ILE 8 HG13 ILE 8 -10.559 -40.014 8.469 101 HG21 ILE 8 HG21 ILE 8 -9.876 -38.776 4.991 102 HG22 ILE 8 HG22 ILE 8 -8.874 -40.237 5.047 103 HG23 ILE 8 HG23 ILE 8 -10.399 -40.259 4.169 104 HD11 ILE 8 HD11 ILE 8 -7.873 -40.459 7.103 105 HD12 ILE 8 HD12 ILE 8 -8.181 -40.313 8.840 106 HD13 ILE 8 HD13 ILE 8 -8.815 -41.711 7.951 107 H ASN 9 H ASN 9 -14.467 -38.883 6.450 108 HA ASN 9 HA ASN 9 -13.424 -36.094 6.656 109 HB2 ASN 9 HB2 ASN 9 -14.729 -37.219 4.390 110 HB3 ASN 9 HB3 ASN 9 -15.909 -36.158 5.145 111 HD21 ASN 9 HD21 ASN 9 -13.756 -33.237 4.759 112 HD22 ASN 9 HD22 ASN 9 -14.931 -33.931 5.884 113 H ASP 10 H ASP 10 -13.674 -36.057 8.837 114 HA ASP 10 HA ASP 10 -16.463 -35.629 9.807 115 HB2 ASP 10 HB2 ASP 10 -14.302 -37.354 11.077 116 HB3 ASP 10 HB3 ASP 10 -15.727 -36.777 11.943 117 H ILE 11 H ILE 11 -15.955 -33.443 9.447 118 HA ILE 11 HA ILE 11 -15.216 -31.384 9.840 119 HB ILE 11 HB ILE 11 -16.913 -31.918 11.577 120 HG12 ILE 11 HG12 ILE 11 -15.104 -29.602 12.345 121 HG13 ILE 11 HG13 ILE 11 -16.129 -29.621 10.908 122 HG21 ILE 11 HG21 ILE 11 -14.571 -31.873 13.524 123 HG22 ILE 11 HG22 ILE 11 -16.290 -31.874 13.959 124 HG23 ILE 11 HG23 ILE 11 -15.604 -33.268 13.146 125 HD11 ILE 11 HD11 ILE 11 -17.079 -29.771 13.796 126 HD12 ILE 11 HD12 ILE 11 -17.260 -28.424 12.664 127 HD13 ILE 11 HD13 ILE 11 -18.133 -29.941 12.369 128 H LYS 12 H LYS 12 -13.069 -33.215 9.562 129 HA LYS 12 HA LYS 12 -10.910 -31.549 10.759 130 HB2 LYS 12 HB2 LYS 12 -11.253 -33.932 11.625 131 HB3 LYS 12 HB3 LYS 12 -10.724 -34.509 10.055 132 HG2 LYS 12 HG2 LYS 12 -8.765 -32.589 11.064 133 HG3 LYS 12 HG3 LYS 12 -9.196 -33.678 12.364 134 HD2 LYS 12 HD2 LYS 12 -7.277 -34.561 11.244 135 HD3 LYS 12 HD3 LYS 12 -8.643 -35.638 10.920 136 HE2 LYS 12 HE2 LYS 12 -8.928 -34.636 8.677 137 HE3 LYS 12 HE3 LYS 12 -7.660 -33.452 9.023 138 HZ1 LYS 12 HZ1 LYS 12 -7.239 -36.393 8.865 139 HZ2 LYS 12 HZ2 LYS 12 -6.784 -35.308 7.731 140 HZ3 LYS 12 HZ3 LYS 12 -6.074 -35.296 9.196 141 H LYS 13 H LYS 13 -12.144 -32.765 7.762 142 HA LYS 13 HA LYS 13 -9.812 -31.676 6.304 143 HB2 LYS 13 HB2 LYS 13 -9.787 -34.190 6.479 144 HB3 LYS 13 HB3 LYS 13 -11.258 -34.228 5.501 145 HG2 LYS 13 HG2 LYS 13 -10.056 -33.109 3.642 146 HG3 LYS 13 HG3 LYS 13 -8.618 -32.929 4.665 147 HD2 LYS 13 HD2 LYS 13 -8.424 -35.405 4.821 148 HD3 LYS 13 HD3 LYS 13 -9.839 -35.574 3.757 149 HE2 LYS 13 HE2 LYS 13 -8.653 -34.352 1.964 150 HE3 LYS 13 HE3 LYS 13 -7.264 -34.099 3.027 151 HZ1 LYS 13 HZ1 LYS 13 -8.233 -36.755 2.105 152 HZ2 LYS 13 HZ2 LYS 13 -6.910 -35.985 1.541 153 HZ3 LYS 13 HZ3 LYS 13 -6.943 -36.514 3.083 154 H GLU 14 H GLU 14 -11.217 -29.791 6.410 155 HA GLU 14 HA GLU 14 -12.865 -29.556 3.963 156 HB2 GLU 14 HB2 GLU 14 -14.286 -30.229 6.010 157 HB3 GLU 14 HB3 GLU 14 -13.958 -28.633 6.657 158 HG2 GLU 14 HG2 GLU 14 -15.263 -29.227 3.957 159 HG3 GLU 14 HG3 GLU 14 -16.156 -28.957 5.446 160 H ALA 15 H ALA 15 -12.453 -27.624 2.951 161 HA ALA 15 HA ALA 15 -11.524 -25.268 4.426 162 HB1 ALA 15 HB1 ALA 15 -9.755 -26.630 2.345 163 HB2 ALA 15 HB2 ALA 15 -9.448 -25.055 3.110 164 HB3 ALA 15 HB3 ALA 15 -9.426 -26.532 4.092 165 H ASN 16 H ASN 16 -11.505 -23.351 3.210 166 HA ASN 16 HA ASN 16 -13.377 -23.326 0.916 167 HB2 ASN 16 HB2 ASN 16 -13.798 -21.988 2.996 168 HB3 ASN 16 HB3 ASN 16 -12.335 -21.061 2.662 169 HD21 ASN 16 HD21 ASN 16 -14.028 -18.945 0.375 170 HD22 ASN 16 HD22 ASN 16 -12.573 -19.243 1.323 171 H ASP 17 H ASP 17 -12.987 -22.065 -0.968 172 HA ASP 17 HA ASP 17 -10.212 -21.999 -1.915 173 HB2 ASP 17 HB2 ASP 17 -12.856 -21.363 -3.271 174 HB3 ASP 17 HB3 ASP 17 -11.285 -21.328 -4.073 175 H SER 18 H SER 18 -10.034 -20.406 0.069 176 HA SER 18 HA SER 18 -10.668 -17.647 -0.522 177 HB2 SER 18 HB2 SER 18 -8.919 -18.829 1.663 178 HB3 SER 18 HB3 SER 18 -9.482 -17.149 1.572 179 HG SER 18 HG SER 18 -10.823 -18.387 2.919 180 H GLY 19 H GLY 19 -9.652 -16.882 -2.306 181 HA2 GLY 19 HA2 GLY 19 -7.982 -15.711 -3.419 182 HA3 GLY 19 HA3 GLY 19 -6.840 -16.118 -2.145 183 H VAL 20 H VAL 20 -8.049 -16.940 -5.279 184 HA VAL 20 HA VAL 20 -5.995 -19.086 -5.622 185 HB VAL 20 HB VAL 20 -8.856 -19.198 -6.653 186 HG11 VAL 20 HG11 VAL 20 -6.528 -21.151 -6.951 187 HG12 VAL 20 HG12 VAL 20 -8.217 -21.500 -7.387 188 HG13 VAL 20 HG13 VAL 20 -7.335 -20.248 -8.251 189 HG21 VAL 20 HG21 VAL 20 -8.799 -19.748 -4.264 190 HG22 VAL 20 HG22 VAL 20 -9.041 -21.218 -5.206 191 HG23 VAL 20 HG23 VAL 20 -7.437 -20.863 -4.526 192 H THR 21 H THR 21 -4.768 -18.888 -7.358 193 HA THR 21 HA THR 21 -3.680 -17.888 -9.086 194 HB THR 21 HB THR 21 -6.204 -17.528 -10.620 195 HG1 THR 21 HG1 THR 21 -6.294 -19.742 -10.976 196 HG21 THR 21 HG21 THR 21 -3.605 -19.008 -11.244 197 HG22 THR 21 HG22 THR 21 -4.888 -18.576 -12.393 198 HG23 THR 21 HG23 THR 21 -3.868 -17.315 -11.684 199 H LEU 22 H LEU 22 -4.699 -15.911 -11.005 200 HA LEU 22 HA LEU 22 -4.415 -13.459 -9.341 201 HB2 LEU 22 HB2 LEU 22 -3.538 -13.963 -12.216 202 HB3 LEU 22 HB3 LEU 22 -3.185 -12.522 -11.268 203 HG LEU 22 HG LEU 22 -2.136 -15.314 -10.625 204 HD11 LEU 22 HD11 LEU 22 -0.756 -12.961 -11.962 205 HD12 LEU 22 HD12 LEU 22 0.013 -14.490 -11.468 206 HD13 LEU 22 HD13 LEU 22 -1.228 -14.497 -12.729 207 HD21 LEU 22 HD21 LEU 22 -2.243 -13.866 -8.628 208 HD22 LEU 22 HD22 LEU 22 -0.568 -14.112 -9.135 209 HD23 LEU 22 HD23 LEU 22 -1.385 -12.576 -9.505 210 H ALA 23 H ALA 23 -6.867 -14.743 -10.014 211 HA ALA 23 HA ALA 23 -8.356 -12.650 -11.495 212 HB1 ALA 23 HB1 ALA 23 -8.078 -15.529 -12.448 213 HB2 ALA 23 HB2 ALA 23 -9.185 -14.313 -13.131 214 HB3 ALA 23 HB3 ALA 23 -7.428 -14.083 -13.241 215 HA PRO 24 HA PRO 24 -11.015 -14.478 -8.194 216 HB2 PRO 24 HB2 PRO 24 -12.302 -12.232 -7.385 217 HB3 PRO 24 HB3 PRO 24 -10.593 -12.549 -6.954 218 HG2 PRO 24 HG2 PRO 24 -11.648 -10.838 -9.235 219 HG3 PRO 24 HG3 PRO 24 -10.427 -10.400 -7.999 220 HD2 PRO 24 HD2 PRO 24 -9.757 -11.336 -10.488 221 HD3 PRO 24 HD3 PRO 24 -8.768 -11.713 -9.042 222 H LEU 25 H LEU 25 -11.734 -12.876 -11.144 223 HA LEU 25 HA LEU 25 -14.317 -14.239 -11.473 224 HB2 LEU 25 HB2 LEU 25 -14.487 -11.724 -10.518 225 HB3 LEU 25 HB3 LEU 25 -14.134 -11.299 -12.181 226 HG LEU 25 HG LEU 25 -16.169 -12.808 -12.807 227 HD11 LEU 25 HD11 LEU 25 -16.717 -12.468 -9.828 228 HD12 LEU 25 HD12 LEU 25 -17.846 -13.116 -11.038 229 HD13 LEU 25 HD13 LEU 25 -16.370 -14.006 -10.644 230 HD21 LEU 25 HD21 LEU 25 -16.242 -10.360 -12.879 231 HD22 LEU 25 HD22 LEU 25 -17.772 -11.020 -12.283 232 HD23 LEU 25 HD23 LEU 25 -16.613 -10.301 -11.140 233 H SER 26 H SER 26 -14.859 -12.859 -13.970 234 HA SER 26 HA SER 26 -13.072 -14.258 -15.759 235 HB2 SER 26 HB2 SER 26 -14.702 -13.426 -17.473 236 HB3 SER 26 HB3 SER 26 -15.439 -14.308 -16.122 237 HG SER 26 HG SER 26 -16.561 -12.351 -16.642 238 H VAL 27 H VAL 27 -11.617 -12.377 -14.390 239 HA VAL 27 HA VAL 27 -10.464 -10.691 -16.475 240 HB VAL 27 HB VAL 27 -12.433 -9.420 -15.635 241 HG11 VAL 27 HG11 VAL 27 -10.912 -9.125 -13.029 242 HG12 VAL 27 HG12 VAL 27 -12.465 -8.381 -13.457 243 HG13 VAL 27 HG13 VAL 27 -12.358 -10.134 -13.243 244 HG21 VAL 27 HG21 VAL 27 -10.538 -8.197 -16.602 245 HG22 VAL 27 HG22 VAL 27 -11.322 -7.268 -15.321 246 HG23 VAL 27 HG23 VAL 27 -9.778 -8.072 -14.992 247 HA PRO 28 HA PRO 28 -7.036 -11.698 -13.761 248 HB2 PRO 28 HB2 PRO 28 -4.961 -10.401 -14.936 249 HB3 PRO 28 HB3 PRO 28 -5.817 -11.761 -15.715 250 HG2 PRO 28 HG2 PRO 28 -6.313 -8.792 -16.142 251 HG3 PRO 28 HG3 PRO 28 -6.026 -10.054 -17.384 252 HD2 PRO 28 HD2 PRO 28 -8.532 -9.274 -16.688 253 HD3 PRO 28 HD3 PRO 28 -8.170 -10.978 -17.081 254 H LYS 29 H LYS 29 -8.401 -10.488 -12.226 255 HA LYS 29 HA LYS 29 -8.728 -9.223 -10.408 256 HB2 LYS 29 HB2 LYS 29 -6.463 -9.899 -9.810 257 HB3 LYS 29 HB3 LYS 29 -5.806 -8.495 -10.644 258 HG2 LYS 29 HG2 LYS 29 -5.791 -7.960 -8.336 259 HG3 LYS 29 HG3 LYS 29 -7.078 -7.017 -9.078 260 HD2 LYS 29 HD2 LYS 29 -8.723 -8.705 -8.196 261 HD3 LYS 29 HD3 LYS 29 -7.374 -9.516 -7.375 262 HE2 LYS 29 HE2 LYS 29 -6.885 -7.417 -6.129 263 HE3 LYS 29 HE3 LYS 29 -8.180 -6.588 -6.999 264 HZ1 LYS 29 HZ1 LYS 29 -8.592 -8.876 -5.142 265 HZ2 LYS 29 HZ2 LYS 29 -8.939 -7.306 -4.826 266 HZ3 LYS 29 HZ3 LYS 29 -9.778 -8.110 -5.965 267 HA PRO 30 HA PRO 30 -9.756 -5.371 -12.528 268 HB2 PRO 30 HB2 PRO 30 -12.079 -4.754 -11.290 269 HB3 PRO 30 HB3 PRO 30 -11.953 -6.138 -12.420 270 HG2 PRO 30 HG2 PRO 30 -11.831 -6.185 -9.390 271 HG3 PRO 30 HG3 PRO 30 -12.791 -7.239 -10.476 272 HD2 PRO 30 HD2 PRO 30 -10.339 -7.923 -9.420 273 HD3 PRO 30 HD3 PRO 30 -10.931 -8.560 -10.972 274 H LYS 31 H LYS 31 -9.795 -3.118 -11.992 275 HA LYS 31 HA LYS 31 -8.026 -2.381 -9.863 276 HB2 LYS 31 HB2 LYS 31 -8.194 -0.162 -10.615 277 HB3 LYS 31 HB3 LYS 31 -8.188 -1.191 -12.041 278 HG2 LYS 31 HG2 LYS 31 -10.628 -0.898 -12.307 279 HG3 LYS 31 HG3 LYS 31 -10.697 0.018 -10.791 280 HD2 LYS 31 HD2 LYS 31 -9.145 1.727 -11.794 281 HD3 LYS 31 HD3 LYS 31 -9.225 0.847 -13.321 282 HE2 LYS 31 HE2 LYS 31 -10.734 2.750 -13.365 283 HE3 LYS 31 HE3 LYS 31 -11.659 1.248 -13.452 284 HZ1 LYS 31 HZ1 LYS 31 -11.241 2.759 -10.909 285 HZ2 LYS 31 HZ2 LYS 31 -12.562 2.942 -11.864 286 HZ3 LYS 31 HZ3 LYS 31 -12.257 1.509 -11.145 287 H LEU 32 H LEU 32 -8.304 -1.065 -8.007 288 HA LEU 32 HA LEU 32 -11.034 -0.561 -7.047 289 HB2 LEU 32 HB2 LEU 32 -10.422 -2.811 -6.186 290 HB3 LEU 32 HB3 LEU 32 -8.910 -2.155 -5.552 291 HG LEU 32 HG LEU 32 -10.253 -0.608 -4.111 292 HD11 LEU 32 HD11 LEU 32 -12.568 -2.378 -5.027 293 HD12 LEU 32 HD12 LEU 32 -12.638 -1.274 -3.641 294 HD13 LEU 32 HD13 LEU 32 -12.426 -0.624 -5.270 295 HD21 LEU 32 HD21 LEU 32 -9.278 -2.646 -3.221 296 HD22 LEU 32 HD22 LEU 32 -10.836 -2.329 -2.442 297 HD23 LEU 32 HD23 LEU 32 -10.710 -3.583 -3.699 298 H GLU 33 H GLU 33 -11.164 1.402 -6.190 299 HA GLU 33 HA GLU 33 -8.745 2.754 -5.058 300 HB2 GLU 33 HB2 GLU 33 -10.984 4.040 -6.693 301 HB3 GLU 33 HB3 GLU 33 -9.700 4.889 -5.839 302 HG2 GLU 33 HG2 GLU 33 -8.923 4.909 -7.996 303 HG3 GLU 33 HG3 GLU 33 -8.031 3.573 -7.283 304 H GLU 34 H GLU 34 -9.557 1.562 -3.165 305 HA GLU 34 HA GLU 34 -11.689 3.062 -1.701 306 HB2 GLU 34 HB2 GLU 34 -12.440 0.883 -2.602 307 HB3 GLU 34 HB3 GLU 34 -11.198 0.064 -1.641 308 HG2 GLU 34 HG2 GLU 34 -12.213 0.977 0.427 309 HG3 GLU 34 HG3 GLU 34 -13.393 1.867 -0.536 310 H LEU 35 H LEU 35 -10.111 4.380 -0.792 311 HA LEU 35 HA LEU 35 -8.738 3.288 1.617 312 HB2 LEU 35 HB2 LEU 35 -7.676 5.201 -0.500 313 HB3 LEU 35 HB3 LEU 35 -6.935 5.015 1.077 314 HG LEU 35 HG LEU 35 -7.298 2.472 -0.478 315 HD11 LEU 35 HD11 LEU 35 -5.156 4.452 -1.281 316 HD12 LEU 35 HD12 LEU 35 -5.422 2.806 -1.902 317 HD13 LEU 35 HD13 LEU 35 -6.606 4.067 -2.237 318 HD21 LEU 35 HD21 LEU 35 -6.194 2.531 1.736 319 HD22 LEU 35 HD22 LEU 35 -5.102 1.981 0.459 320 HD23 LEU 35 HD23 LEU 35 -4.961 3.638 1.084 321 H SER 36 H SER 36 -8.624 4.820 3.357 322 HA SER 36 HA SER 36 -10.711 6.903 3.410 323 HB2 SER 36 HB2 SER 36 -8.593 6.133 5.455 324 HB3 SER 36 HB3 SER 36 -9.899 7.307 5.709 325 HG SER 36 HG SER 36 -10.460 5.226 6.495 326 H GLU 37 H GLU 37 -10.100 9.213 4.108 327 HA GLU 37 HA GLU 37 -8.593 10.389 2.086 328 HB2 GLU 37 HB2 GLU 37 -10.298 11.512 3.451 329 HB3 GLU 37 HB3 GLU 37 -9.197 11.538 4.837 330 HG2 GLU 37 HG2 GLU 37 -7.636 12.995 3.588 331 HG3 GLU 37 HG3 GLU 37 -8.660 12.889 2.154 332 H GLN 38 H GLN 38 -7.352 9.695 5.394 333 HA GLN 38 HA GLN 38 -4.673 10.669 4.669 334 HB2 GLN 38 HB2 GLN 38 -3.976 9.882 6.859 335 HB3 GLN 38 HB3 GLN 38 -5.354 10.970 6.953 336 HG2 GLN 38 HG2 GLN 38 -6.862 9.216 7.548 337 HG3 GLN 38 HG3 GLN 38 -5.745 7.949 7.039 338 HE21 GLN 38 HE21 GLN 38 -3.808 7.986 10.027 339 HE22 GLN 38 HE22 GLN 38 -3.781 7.549 8.325 340 H GLN 39 H GLN 39 -6.288 7.506 4.767 341 HA GLN 39 HA GLN 39 -3.875 5.962 4.492 342 HB2 GLN 39 HB2 GLN 39 -6.777 5.318 3.958 343 HB3 GLN 39 HB3 GLN 39 -5.470 4.173 3.642 344 HG2 GLN 39 HG2 GLN 39 -4.713 4.398 6.019 345 HG3 GLN 39 HG3 GLN 39 -6.124 5.402 6.353 346 HE21 GLN 39 HE21 GLN 39 -6.799 1.745 7.176 347 HE22 GLN 39 HE22 GLN 39 -5.406 2.735 7.552 348 H LYS 40 H LYS 40 -6.088 7.418 2.137 349 HA LYS 40 HA LYS 40 -4.925 6.360 -0.255 350 HB2 LYS 40 HB2 LYS 40 -7.094 7.512 -0.175 351 HB3 LYS 40 HB3 LYS 40 -6.336 9.003 0.377 352 HG2 LYS 40 HG2 LYS 40 -5.163 9.266 -1.756 353 HG3 LYS 40 HG3 LYS 40 -5.811 7.733 -2.347 354 HD2 LYS 40 HD2 LYS 40 -7.536 10.097 -1.466 355 HD3 LYS 40 HD3 LYS 40 -6.976 9.903 -3.122 356 HE2 LYS 40 HE2 LYS 40 -8.659 7.818 -1.656 357 HE3 LYS 40 HE3 LYS 40 -9.337 9.113 -2.643 358 HZ1 LYS 40 HZ1 LYS 40 -7.489 7.023 -3.668 359 HZ2 LYS 40 HZ2 LYS 40 -9.099 7.096 -3.945 360 HZ3 LYS 40 HZ3 LYS 40 -8.115 8.245 -4.555 361 H ILE 41 H ILE 41 -4.066 9.271 1.669 362 HA ILE 41 HA ILE 41 -1.950 10.083 -0.113 363 HB ILE 41 HB ILE 41 -2.337 10.751 2.794 364 HG12 ILE 41 HG12 ILE 41 -3.106 12.516 0.414 365 HG13 ILE 41 HG13 ILE 41 -4.256 11.375 1.077 366 HG21 ILE 41 HG21 ILE 41 -0.667 12.137 0.658 367 HG22 ILE 41 HG22 ILE 41 -0.977 12.795 2.278 368 HG23 ILE 41 HG23 ILE 41 -0.069 11.303 2.108 369 HD11 ILE 41 HD11 ILE 41 -3.028 13.703 2.591 370 HD12 ILE 41 HD12 ILE 41 -4.706 13.509 2.046 371 HD13 ILE 41 HD13 ILE 41 -4.066 12.446 3.310 372 H ILE 42 H ILE 42 -1.906 8.097 2.948 373 HA ILE 42 HA ILE 42 0.957 7.797 2.973 374 HB ILE 42 HB ILE 42 -1.207 5.937 4.009 375 HG12 ILE 42 HG12 ILE 42 0.506 7.776 5.722 376 HG13 ILE 42 HG13 ILE 42 -0.949 8.401 4.965 377 HG21 ILE 42 HG21 ILE 42 1.803 6.009 4.540 378 HG22 ILE 42 HG22 ILE 42 0.653 5.061 5.498 379 HG23 ILE 42 HG23 ILE 42 0.885 4.681 3.796 380 HD11 ILE 42 HD11 ILE 42 -0.856 6.033 6.873 381 HD12 ILE 42 HD12 ILE 42 -1.503 7.655 7.195 382 HD13 ILE 42 HD13 ILE 42 -2.298 6.600 6.005 383 H LEU 43 H LEU 43 -1.616 5.842 1.504 384 HA LEU 43 HA LEU 43 -0.047 3.785 0.377 385 HB2 LEU 43 HB2 LEU 43 -2.492 3.805 0.690 386 HB3 LEU 43 HB3 LEU 43 -2.682 5.032 -0.536 387 HG LEU 43 HG LEU 43 -3.311 2.677 -1.081 388 HD11 LEU 43 HD11 LEU 43 -1.303 3.947 -2.960 389 HD12 LEU 43 HD12 LEU 43 -2.518 2.728 -3.379 390 HD13 LEU 43 HD13 LEU 43 -3.021 4.337 -2.830 391 HD21 LEU 43 HD21 LEU 43 -1.448 1.533 -0.028 392 HD22 LEU 43 HD22 LEU 43 -1.582 1.073 -1.733 393 HD23 LEU 43 HD23 LEU 43 -0.300 2.191 -1.214 394 H ALA 44 H ALA 44 -1.161 6.842 -1.093 395 HA ALA 44 HA ALA 44 0.203 6.629 -3.567 396 HB1 ALA 44 HB1 ALA 44 -0.671 9.045 -1.940 397 HB2 ALA 44 HB2 ALA 44 -0.230 9.076 -3.663 398 HB3 ALA 44 HB3 ALA 44 -1.665 8.167 -3.129 399 H GLU 45 H GLU 45 1.217 8.490 -0.582 400 HA GLU 45 HA GLU 45 3.712 9.342 -1.636 401 HB2 GLU 45 HB2 GLU 45 2.786 8.800 1.210 402 HB3 GLU 45 HB3 GLU 45 4.400 9.410 0.832 403 HG2 GLU 45 HG2 GLU 45 3.345 11.315 -0.424 404 HG3 GLU 45 HG3 GLU 45 1.780 10.819 0.210 405 H TYR 46 H TYR 46 2.884 6.175 -0.207 406 HA TYR 46 HA TYR 46 5.599 5.299 0.091 407 HB2 TYR 46 HB2 TYR 46 3.615 4.341 1.231 408 HB3 TYR 46 HB3 TYR 46 3.041 3.693 -0.298 409 HD1 TYR 46 HD1 TYR 46 2.908 1.659 1.290 410 HD2 TYR 46 HD2 TYR 46 6.635 3.344 -0.105 411 HE1 TYR 46 HE1 TYR 46 4.078 -0.477 1.810 412 HE2 TYR 46 HE2 TYR 46 7.801 1.249 0.492 413 HH TYR 46 HH TYR 46 6.085 -1.574 1.861 414 H ILE 47 H ILE 47 3.192 4.517 -2.482 415 HA ILE 47 HA ILE 47 4.950 3.142 -4.203 416 HB ILE 47 HB ILE 47 2.279 4.527 -4.433 417 HG12 ILE 47 HG12 ILE 47 2.996 1.558 -4.508 418 HG13 ILE 47 HG13 ILE 47 2.611 2.403 -3.014 419 HG21 ILE 47 HG21 ILE 47 3.661 2.901 -6.589 420 HG22 ILE 47 HG22 ILE 47 1.925 3.277 -6.605 421 HG23 ILE 47 HG23 ILE 47 3.091 4.577 -6.714 422 HD11 ILE 47 HD11 ILE 47 0.710 1.902 -5.327 423 HD12 ILE 47 HD12 ILE 47 0.615 1.305 -3.663 424 HD13 ILE 47 HD13 ILE 47 0.379 3.034 -3.995 425 H ALA 48 H ALA 48 4.047 6.620 -3.981 426 HA ALA 48 HA ALA 48 5.286 7.392 -6.471 427 HB1 ALA 48 HB1 ALA 48 4.539 8.998 -3.994 428 HB2 ALA 48 HB2 ALA 48 4.921 9.672 -5.597 429 HB3 ALA 48 HB3 ALA 48 3.479 8.657 -5.381 430 H GLU 49 H GLU 49 6.523 6.932 -3.190 431 HA GLU 49 HA GLU 49 9.126 8.172 -3.814 432 HB2 GLU 49 HB2 GLU 49 8.028 8.338 -1.569 433 HB3 GLU 49 HB3 GLU 49 8.231 6.595 -1.376 434 HG2 GLU 49 HG2 GLU 49 9.978 7.646 -0.165 435 HG3 GLU 49 HG3 GLU 49 10.732 6.940 -1.582 436 H VAL 50 H VAL 50 7.798 4.836 -3.395 437 HA VAL 50 HA VAL 50 10.507 3.789 -4.092 438 HB VAL 50 HB VAL 50 10.212 1.942 -2.872 439 HG11 VAL 50 HG11 VAL 50 8.710 3.986 -1.219 440 HG12 VAL 50 HG12 VAL 50 9.662 2.610 -0.636 441 HG13 VAL 50 HG13 VAL 50 10.469 3.949 -1.471 442 HG21 VAL 50 HG21 VAL 50 7.997 1.160 -3.615 443 HG22 VAL 50 HG22 VAL 50 8.150 1.106 -1.865 444 HG23 VAL 50 HG23 VAL 50 7.211 2.404 -2.628 445 H GLY 51 H GLY 51 7.528 4.142 -5.608 446 HA2 GLY 51 HA2 GLY 51 7.420 4.043 -7.920 447 HA3 GLY 51 HA3 GLY 51 8.876 3.051 -7.971 448 H LEU 52 H LEU 52 6.028 2.185 -6.117 449 HA LEU 52 HA LEU 52 4.791 0.361 -5.970 450 HB2 LEU 52 HB2 LEU 52 4.160 1.553 -8.387 451 HB3 LEU 52 HB3 LEU 52 4.469 -0.082 -8.907 452 HG LEU 52 HG LEU 52 2.384 0.890 -6.918 453 HD11 LEU 52 HD11 LEU 52 2.139 -0.588 -9.567 454 HD12 LEU 52 HD12 LEU 52 0.805 0.033 -8.565 455 HD13 LEU 52 HD13 LEU 52 1.931 1.155 -9.345 456 HD21 LEU 52 HD21 LEU 52 3.195 -1.307 -6.105 457 HD22 LEU 52 HD22 LEU 52 1.529 -1.352 -6.675 458 HD23 LEU 52 HD23 LEU 52 2.828 -2.012 -7.690 459 H GLN 53 H GLN 53 7.762 -0.062 -6.762 460 HA GLN 53 HA GLN 53 7.648 -2.965 -7.509 461 HB2 GLN 53 HB2 GLN 53 9.581 -2.646 -8.864 462 HB3 GLN 53 HB3 GLN 53 8.385 -1.426 -9.283 463 HG2 GLN 53 HG2 GLN 53 9.715 0.134 -7.641 464 HG3 GLN 53 HG3 GLN 53 10.988 -1.087 -7.750 465 HE21 GLN 53 HE21 GLN 53 10.075 1.261 -11.024 466 HE22 GLN 53 HE22 GLN 53 8.871 1.011 -9.752 467 H ASN 54 H ASN 54 8.429 -1.015 -4.964 468 HA ASN 54 HA ASN 54 10.174 -3.134 -3.768 469 HB2 ASN 54 HB2 ASN 54 10.278 -0.150 -3.240 470 HB3 ASN 54 HB3 ASN 54 11.242 -1.356 -2.410 471 HD21 ASN 54 HD21 ASN 54 12.525 0.057 -5.961 472 HD22 ASN 54 HD22 ASN 54 11.014 0.636 -5.271 473 H ILE 55 H ILE 55 7.103 -2.036 -3.693 474 HA ILE 55 HA ILE 55 6.735 -2.009 -0.783 475 HB ILE 55 HB ILE 55 4.432 -1.722 -1.097 476 HG12 ILE 55 HG12 ILE 55 4.757 -2.147 -4.098 477 HG13 ILE 55 HG13 ILE 55 3.985 -3.272 -2.969 478 HG21 ILE 55 HG21 ILE 55 5.631 0.051 -3.245 479 HG22 ILE 55 HG22 ILE 55 4.399 0.434 -2.017 480 HG23 ILE 55 HG23 ILE 55 6.066 0.188 -1.532 481 HD11 ILE 55 HD11 ILE 55 3.036 -0.465 -3.624 482 HD12 ILE 55 HD12 ILE 55 2.260 -1.989 -4.064 483 HD13 ILE 55 HD13 ILE 55 2.332 -1.506 -2.355 484 H THR 56 H THR 56 5.519 -3.540 0.428 485 HA THR 56 HA THR 56 5.125 -6.226 -0.767 486 HB THR 56 HB THR 56 6.019 -6.927 1.679 487 HG1 THR 56 HG1 THR 56 7.826 -5.684 2.215 488 HG21 THR 56 HG21 THR 56 7.940 -6.206 -0.582 489 HG22 THR 56 HG22 THR 56 8.246 -7.368 0.729 490 HG23 THR 56 HG23 THR 56 6.999 -7.710 -0.481 491 H ALA 57 H ALA 57 3.387 -7.378 0.135 492 HA ALA 57 HA ALA 57 1.283 -5.895 1.285 493 HB1 ALA 57 HB1 ALA 57 1.768 -8.911 1.276 494 HB2 ALA 57 HB2 ALA 57 0.213 -8.088 1.535 495 HB3 ALA 57 HB3 ALA 57 1.019 -7.977 -0.040 496 H ILE 58 H ILE 58 3.929 -7.606 2.799 497 HA ILE 58 HA ILE 58 2.932 -7.785 5.505 498 HB ILE 58 HB ILE 58 5.709 -7.735 4.245 499 HG12 ILE 58 HG12 ILE 58 5.803 -10.120 4.996 500 HG13 ILE 58 HG13 ILE 58 4.153 -10.014 5.599 501 HG21 ILE 58 HG21 ILE 58 4.914 -8.121 7.176 502 HG22 ILE 58 HG22 ILE 58 6.518 -8.544 6.526 503 HG23 ILE 58 HG23 ILE 58 5.982 -6.866 6.516 504 HD11 ILE 58 HD11 ILE 58 4.920 -9.681 2.666 505 HD12 ILE 58 HD12 ILE 58 4.434 -11.214 3.414 506 HD13 ILE 58 HD13 ILE 58 3.277 -9.886 3.341 507 H THR 59 H THR 59 5.011 -5.418 3.784 508 HA THR 59 HA THR 59 5.237 -3.674 6.111 509 HB THR 59 HB THR 59 6.045 -3.373 3.205 510 HG1 THR 59 HG1 THR 59 7.997 -4.024 3.935 511 HG21 THR 59 HG21 THR 59 6.832 -1.714 5.645 512 HG22 THR 59 HG22 THR 59 7.602 -1.634 4.039 513 HG23 THR 59 HG23 THR 59 5.912 -1.139 4.235 514 H LEU 60 H LEU 60 3.476 -3.545 2.991 515 HA LEU 60 HA LEU 60 2.114 -1.123 3.442 516 HB2 LEU 60 HB2 LEU 60 2.433 -2.474 1.301 517 HB3 LEU 60 HB3 LEU 60 1.201 -3.573 1.880 518 HG LEU 60 HG LEU 60 -0.420 -1.593 1.866 519 HD11 LEU 60 HD11 LEU 60 1.908 -0.296 0.392 520 HD12 LEU 60 HD12 LEU 60 0.273 0.355 0.525 521 HD13 LEU 60 HD13 LEU 60 1.259 0.219 1.975 522 HD21 LEU 60 HD21 LEU 60 -0.305 -3.234 0.031 523 HD22 LEU 60 HD22 LEU 60 -0.675 -1.610 -0.574 524 HD23 LEU 60 HD23 LEU 60 0.961 -2.283 -0.751 525 H SER 61 H SER 61 1.276 -4.450 4.513 526 HA SER 61 HA SER 61 -1.184 -3.983 5.747 527 HB2 SER 61 HB2 SER 61 -0.308 -6.194 5.606 528 HB3 SER 61 HB3 SER 61 1.080 -5.763 6.617 529 HG SER 61 HG SER 61 -0.441 -6.822 7.862 530 H LYS 62 H LYS 62 1.955 -3.030 6.749 531 HA LYS 62 HA LYS 62 0.953 -2.131 9.382 532 HB2 LYS 62 HB2 LYS 62 3.786 -2.702 8.447 533 HB3 LYS 62 HB3 LYS 62 3.372 -2.036 10.036 534 HG2 LYS 62 HG2 LYS 62 1.913 -4.022 10.476 535 HG3 LYS 62 HG3 LYS 62 2.438 -4.729 8.938 536 HD2 LYS 62 HD2 LYS 62 4.789 -4.702 9.731 537 HD3 LYS 62 HD3 LYS 62 4.251 -3.991 11.271 538 HE2 LYS 62 HE2 LYS 62 2.788 -5.988 11.647 539 HE3 LYS 62 HE3 LYS 62 3.399 -6.701 10.148 540 HZ1 LYS 62 HZ1 LYS 62 5.057 -6.041 12.528 541 HZ2 LYS 62 HZ2 LYS 62 4.602 -7.542 12.084 542 HZ3 LYS 62 HZ3 LYS 62 5.632 -6.694 11.144 543 H LYS 63 H LYS 63 2.213 -0.739 6.406 544 HA LYS 63 HA LYS 63 2.878 1.875 7.376 545 HB2 LYS 63 HB2 LYS 63 1.896 0.721 4.747 546 HB3 LYS 63 HB3 LYS 63 2.243 2.441 4.901 547 HG2 LYS 63 HG2 LYS 63 4.302 0.262 5.473 548 HG3 LYS 63 HG3 LYS 63 4.038 0.986 3.893 549 HD2 LYS 63 HD2 LYS 63 4.520 3.248 4.964 550 HD3 LYS 63 HD3 LYS 63 5.041 2.340 6.410 551 HE2 LYS 63 HE2 LYS 63 6.680 1.095 5.015 552 HE3 LYS 63 HE3 LYS 63 6.156 2.003 3.588 553 HZ1 LYS 63 HZ1 LYS 63 7.416 3.201 6.002 554 HZ2 LYS 63 HZ2 LYS 63 8.158 2.971 4.568 555 HZ3 LYS 63 HZ3 LYS 63 6.931 4.041 4.685 556 H LEU 64 H LEU 64 -0.218 0.425 6.500 557 HA LEU 64 HA LEU 64 -1.629 2.972 7.201 558 HB2 LEU 64 HB2 LEU 64 -2.573 0.752 5.354 559 HB3 LEU 64 HB3 LEU 64 -3.356 2.290 5.663 560 HG LEU 64 HG LEU 64 -0.832 3.122 4.849 561 HD11 LEU 64 HD11 LEU 64 -1.634 0.794 3.050 562 HD12 LEU 64 HD12 LEU 64 -0.288 1.932 2.799 563 HD13 LEU 64 HD13 LEU 64 -0.255 0.787 4.150 564 HD21 LEU 64 HD21 LEU 64 -2.973 4.032 4.141 565 HD22 LEU 64 HD22 LEU 64 -1.865 3.773 2.799 566 HD23 LEU 64 HD23 LEU 64 -3.226 2.645 3.052 567 H ASN 65 H ASN 65 -0.984 0.179 8.712 568 HA ASN 65 HA ASN 65 -1.930 -1.191 10.221 569 HB2 ASN 65 HB2 ASN 65 -3.907 1.026 10.851 570 HB3 ASN 65 HB3 ASN 65 -3.343 -0.251 11.917 571 HD21 ASN 65 HD21 ASN 65 -1.199 3.175 11.538 572 HD22 ASN 65 HD22 ASN 65 -2.662 2.897 10.598 573 H ILE 66 H ILE 66 -2.622 -2.001 7.843 574 HA ILE 66 HA ILE 66 -5.553 -2.625 7.844 575 HB ILE 66 HB ILE 66 -5.171 -3.108 5.394 576 HG12 ILE 66 HG12 ILE 66 -2.512 -1.657 5.839 577 HG13 ILE 66 HG13 ILE 66 -2.858 -3.259 5.214 578 HG21 ILE 66 HG21 ILE 66 -4.980 -0.240 6.321 579 HG22 ILE 66 HG22 ILE 66 -5.621 -0.832 4.764 580 HG23 ILE 66 HG23 ILE 66 -6.445 -1.260 6.255 581 HD11 ILE 66 HD11 ILE 66 -3.587 -0.703 3.771 582 HD12 ILE 66 HD12 ILE 66 -2.230 -1.778 3.415 583 HD13 ILE 66 HD13 ILE 66 -3.892 -2.370 3.215 584 H THR 67 H THR 67 -5.639 -4.794 6.247 585 HA THR 67 HA THR 67 -4.138 -6.863 7.749 586 HB THR 67 HB THR 67 -5.691 -8.395 7.264 587 HG1 THR 67 HG1 THR 67 -6.969 -8.378 5.390 588 HG21 THR 67 HG21 THR 67 -7.505 -6.039 6.582 589 HG22 THR 67 HG22 THR 67 -7.963 -7.609 7.270 590 HG23 THR 67 HG23 THR 67 -7.021 -6.472 8.247 591 H VAL 68 H VAL 68 -2.974 -8.557 6.564 592 HA VAL 68 HA VAL 68 -1.334 -7.678 4.360 593 HB VAL 68 HB VAL 68 -1.985 -10.436 5.460 594 HG11 VAL 68 HG11 VAL 68 0.047 -9.757 3.292 595 HG12 VAL 68 HG12 VAL 68 -0.050 -11.300 4.164 596 HG13 VAL 68 HG13 VAL 68 -1.374 -10.814 3.105 597 HG21 VAL 68 HG21 VAL 68 -0.625 -8.965 6.915 598 HG22 VAL 68 HG22 VAL 68 0.341 -10.309 6.301 599 HG23 VAL 68 HG23 VAL 68 0.523 -8.695 5.584 600 H GLU 69 H GLU 69 -4.616 -9.015 4.410 601 HA GLU 69 HA GLU 69 -4.419 -9.900 1.606 602 HB2 GLU 69 HB2 GLU 69 -5.704 -11.115 3.492 603 HB3 GLU 69 HB3 GLU 69 -6.922 -9.840 3.316 604 HG2 GLU 69 HG2 GLU 69 -7.098 -10.418 0.879 605 HG3 GLU 69 HG3 GLU 69 -5.872 -11.671 1.112 606 H LYS 70 H LYS 70 -5.791 -7.222 3.580 607 HA LYS 70 HA LYS 70 -7.131 -5.930 1.420 608 HB2 LYS 70 HB2 LYS 70 -7.283 -5.589 4.037 609 HB3 LYS 70 HB3 LYS 70 -6.006 -4.401 3.726 610 HG2 LYS 70 HG2 LYS 70 -7.688 -3.696 1.728 611 HG3 LYS 70 HG3 LYS 70 -8.871 -4.511 2.781 612 HD2 LYS 70 HD2 LYS 70 -8.160 -3.020 4.640 613 HD3 LYS 70 HD3 LYS 70 -7.019 -2.235 3.511 614 HE2 LYS 70 HE2 LYS 70 -8.928 -1.605 2.040 615 HE3 LYS 70 HE3 LYS 70 -10.054 -2.331 3.193 616 HZ1 LYS 70 HZ1 LYS 70 -8.276 -0.014 3.748 617 HZ2 LYS 70 HZ2 LYS 70 -9.887 0.061 3.515 618 HZ3 LYS 70 HZ3 LYS 70 -9.302 -0.686 4.841 619 H ALA 71 H ALA 71 -3.936 -5.579 2.877 620 HA ALA 71 HA ALA 71 -2.790 -3.608 1.227 621 HB1 ALA 71 HB1 ALA 71 -1.551 -5.987 2.669 622 HB2 ALA 71 HB2 ALA 71 -0.662 -4.613 2.015 623 HB3 ALA 71 HB3 ALA 71 -1.820 -4.362 3.328 624 H LYS 72 H LYS 72 -2.762 -7.210 0.788 625 HA LYS 72 HA LYS 72 -1.161 -7.102 -1.589 626 HB2 LYS 72 HB2 LYS 72 -1.237 -9.018 -0.020 627 HB3 LYS 72 HB3 LYS 72 -2.946 -9.275 -0.370 628 HG2 LYS 72 HG2 LYS 72 -2.470 -9.964 -2.613 629 HG3 LYS 72 HG3 LYS 72 -0.769 -9.487 -2.487 630 HD2 LYS 72 HD2 LYS 72 -2.005 -11.590 -0.648 631 HD3 LYS 72 HD3 LYS 72 -1.355 -11.999 -2.251 632 HE2 LYS 72 HE2 LYS 72 0.844 -11.016 -1.587 633 HE3 LYS 72 HE3 LYS 72 0.201 -10.704 0.032 634 HZ1 LYS 72 HZ1 LYS 72 0.448 -13.393 -1.219 635 HZ2 LYS 72 HZ2 LYS 72 1.426 -12.807 -0.057 636 HZ3 LYS 72 HZ3 LYS 72 -0.143 -13.112 0.278 637 H ASN 73 H ASN 73 -4.641 -7.029 -1.001 638 HA ASN 73 HA ASN 73 -5.497 -7.499 -3.597 639 HB2 ASN 73 HB2 ASN 73 -7.391 -7.343 -2.401 640 HB3 ASN 73 HB3 ASN 73 -6.612 -6.435 -1.129 641 HD21 ASN 73 HD21 ASN 73 -7.782 -3.288 -2.146 642 HD22 ASN 73 HD22 ASN 73 -6.624 -4.150 -1.139 643 H TYR 74 H TYR 74 -4.091 -4.505 -2.319 644 HA TYR 74 HA TYR 74 -4.629 -2.816 -4.582 645 HB2 TYR 74 HB2 TYR 74 -2.461 -2.564 -2.487 646 HB3 TYR 74 HB3 TYR 74 -2.987 -1.319 -3.600 647 HD1 TYR 74 HD1 TYR 74 -5.732 -0.913 -3.486 648 HD2 TYR 74 HD2 TYR 74 -3.141 -2.275 -0.327 649 HE1 TYR 74 HE1 TYR 74 -7.363 -0.071 -1.800 650 HE2 TYR 74 HE2 TYR 74 -4.786 -1.414 1.369 651 HH TYR 74 HH TYR 74 -7.857 0.158 0.426 652 H ILE 75 H ILE 75 -1.852 -4.765 -3.479 653 HA ILE 75 HA ILE 75 -0.063 -4.112 -5.604 654 HB ILE 75 HB ILE 75 -0.172 -6.551 -3.777 655 HG12 ILE 75 HG12 ILE 75 1.404 -3.952 -3.542 656 HG13 ILE 75 HG13 ILE 75 -0.033 -4.323 -2.604 657 HG21 ILE 75 HG21 ILE 75 2.154 -5.483 -5.442 658 HG22 ILE 75 HG22 ILE 75 2.241 -6.823 -4.278 659 HG23 ILE 75 HG23 ILE 75 1.279 -7.008 -5.727 660 HD11 ILE 75 HD11 ILE 75 2.658 -5.700 -2.385 661 HD12 ILE 75 HD12 ILE 75 1.828 -4.695 -1.192 662 HD13 ILE 75 HD13 ILE 75 1.162 -6.286 -1.609 663 H LYS 76 H LYS 76 -2.631 -6.571 -5.416 664 HA LYS 76 HA LYS 76 -1.766 -7.921 -7.856 665 HB2 LYS 76 HB2 LYS 76 -4.228 -8.209 -6.087 666 HB3 LYS 76 HB3 LYS 76 -3.922 -9.183 -7.546 667 HG2 LYS 76 HG2 LYS 76 -1.623 -9.725 -6.497 668 HG3 LYS 76 HG3 LYS 76 -2.303 -9.114 -4.994 669 HD2 LYS 76 HD2 LYS 76 -3.352 -11.443 -6.660 670 HD3 LYS 76 HD3 LYS 76 -2.445 -11.564 -5.149 671 HE2 LYS 76 HE2 LYS 76 -4.297 -10.391 -3.952 672 HE3 LYS 76 HE3 LYS 76 -5.213 -10.318 -5.465 673 HZ1 LYS 76 HZ1 LYS 76 -4.361 -12.829 -4.113 674 HZ2 LYS 76 HZ2 LYS 76 -5.881 -12.236 -4.121 675 HZ3 LYS 76 HZ3 LYS 76 -5.201 -12.763 -5.511 676 H ASN 77 H ASN 77 -4.142 -5.332 -7.218 677 HA ASN 77 HA ASN 77 -5.046 -5.580 -10.037 678 HB2 ASN 77 HB2 ASN 77 -6.608 -3.974 -9.698 679 HB3 ASN 77 HB3 ASN 77 -6.766 -5.049 -8.299 680 HD21 ASN 77 HD21 ASN 77 -6.026 -2.452 -6.000 681 HD22 ASN 77 HD22 ASN 77 -5.905 -4.201 -6.187 682 H SER 78 H SER 78 -3.203 -3.391 -7.862 683 HA SER 78 HA SER 78 -2.520 -1.812 -10.249 684 HB2 SER 78 HB2 SER 78 -3.595 -0.650 -8.321 685 HB3 SER 78 HB3 SER 78 -2.135 -0.981 -7.363 686 HG SER 78 HG SER 78 -2.138 1.087 -8.452 687 H ASN 79 H ASN 79 -0.744 -2.573 -11.217 688 HA ASN 79 HA ASN 79 1.750 -2.973 -9.681 689 HB2 ASN 79 HB2 ASN 79 0.134 -5.096 -9.846 690 HB3 ASN 79 HB3 ASN 79 0.803 -5.221 -11.470 691 HD21 ASN 79 HD21 ASN 79 3.034 -6.076 -8.155 692 HD22 ASN 79 HD22 ASN 79 1.367 -5.479 -8.075 693 H ARG 80 H ARG 80 3.504 -2.361 -10.861 694 HA ARG 80 HA ARG 80 4.681 -1.185 -12.422 695 HB2 ARG 80 HB2 ARG 80 3.447 -3.353 -14.143 696 HB3 ARG 80 HB3 ARG 80 4.413 -2.099 -14.878 697 HG2 ARG 80 HG2 ARG 80 5.792 -3.975 -14.536 698 HG3 ARG 80 HG3 ARG 80 6.351 -2.670 -13.490 699 HD2 ARG 80 HD2 ARG 80 5.427 -3.778 -11.521 700 HD3 ARG 80 HD3 ARG 80 4.535 -4.912 -12.541 701 HE ARG 80 HE ARG 80 6.370 -6.248 -12.711 702 HH11 ARG 80 HH11 ARG 80 8.435 -6.970 -12.439 703 HH12 ARG 80 HH12 ARG 80 9.671 -5.891 -11.865 704 HH21 ARG 80 HH21 ARG 80 7.620 -3.154 -11.626 705 HH22 ARG 80 HH22 ARG 80 9.236 -3.784 -11.445 706 H LEU 81 H LEU 81 1.502 -0.592 -12.252 707 HA LEU 81 HA LEU 81 1.389 1.248 -14.596 708 HB2 LEU 81 HB2 LEU 81 0.029 -0.874 -14.597 709 HB3 LEU 81 HB3 LEU 81 -0.821 -0.282 -13.175 710 HG LEU 81 HG LEU 81 -1.619 1.692 -14.551 711 HD11 LEU 81 HD11 LEU 81 -0.427 0.070 -16.849 712 HD12 LEU 81 HD12 LEU 81 -1.521 1.459 -17.026 713 HD13 LEU 81 HD13 LEU 81 0.087 1.693 -16.338 714 HD21 LEU 81 HD21 LEU 81 -3.026 -0.288 -14.174 715 HD22 LEU 81 HD22 LEU 81 -3.299 0.384 -15.788 716 HD23 LEU 81 HD23 LEU 81 -2.313 -1.085 -15.594 717 H GLY 82 H GLY 82 0.263 0.998 -11.182 718 HA2 GLY 82 HA2 GLY 82 -0.952 3.622 -11.235 719 HA3 GLY 82 HA3 GLY 82 -0.677 2.616 -9.814 720 H ARG 83 H ARG 83 0.572 5.207 -11.790 721 HA ARG 83 HA ARG 83 3.029 5.493 -10.150 722 HB2 ARG 83 HB2 ARG 83 2.937 5.511 -12.701 723 HB3 ARG 83 HB3 ARG 83 2.438 7.200 -12.537 724 HG2 ARG 83 HG2 ARG 83 4.459 7.549 -11.024 725 HG3 ARG 83 HG3 ARG 83 4.934 5.878 -11.350 726 HD2 ARG 83 HD2 ARG 83 4.668 8.129 -13.363 727 HD3 ARG 83 HD3 ARG 83 6.179 7.458 -12.751 728 HE ARG 83 HE ARG 83 4.466 6.379 -14.854 729 HH11 ARG 83 HH11 ARG 83 5.013 4.544 -15.951 730 HH12 ARG 83 HH12 ARG 83 6.272 3.509 -15.350 731 HH21 ARG 83 HH21 ARG 83 6.959 5.412 -12.582 732 HH22 ARG 83 HH22 ARG 83 7.348 3.981 -13.496 733 H THR 84 H THR 84 0.994 8.091 -11.376 734 HA THR 84 HA THR 84 0.596 9.298 -8.726 735 HB THR 84 HB THR 84 2.965 9.669 -9.127 736 HG1 THR 84 HG1 THR 84 3.015 11.861 -8.815 737 HG21 THR 84 HG21 THR 84 2.168 11.169 -11.644 738 HG22 THR 84 HG22 THR 84 3.784 11.159 -10.903 739 HG23 THR 84 HG23 THR 84 3.103 9.656 -11.535 740 H ASN 85 H ASN 85 -1.122 8.508 -10.977 741 HA ASN 85 HA ASN 85 -2.375 11.135 -11.668 742 HB2 ASN 85 HB2 ASN 85 -1.900 8.802 -13.571 743 HB3 ASN 85 HB3 ASN 85 -2.845 10.241 -13.931 744 HD21 ASN 85 HD21 ASN 85 1.145 10.393 -14.409 745 HD22 ASN 85 HD22 ASN 85 0.311 8.897 -14.025 746 H ASN 86 H ASN 86 -4.440 11.241 -11.122 747 HA ASN 86 HA ASN 86 -6.293 9.006 -11.440 748 HB2 ASN 86 HB2 ASN 86 -5.377 8.529 -9.204 749 HB3 ASN 86 HB3 ASN 86 -5.711 10.195 -8.697 750 HD21 ASN 86 HD21 ASN 86 -9.232 9.631 -8.316 751 HD22 ASN 86 HD22 ASN 86 -8.023 10.871 -8.621 752 H LEU 87 H LEU 87 -8.371 9.699 -11.697 753 HA LEU 87 HA LEU 87 -9.123 12.550 -11.379 754 HB2 LEU 87 HB2 LEU 87 -8.947 10.841 -13.823 755 HB3 LEU 87 HB3 LEU 87 -10.471 11.688 -13.625 756 HG LEU 87 HG LEU 87 -9.184 13.856 -13.379 757 HD11 LEU 87 HD11 LEU 87 -6.886 12.089 -14.324 758 HD12 LEU 87 HD12 LEU 87 -6.887 13.867 -14.410 759 HD13 LEU 87 HD13 LEU 87 -6.960 13.070 -12.845 760 HD21 LEU 87 HD21 LEU 87 -10.315 13.209 -15.461 761 HD22 LEU 87 HD22 LEU 87 -8.815 14.082 -15.800 762 HD23 LEU 87 HD23 LEU 87 -8.872 12.313 -15.983 763 H LYS 88 H LYS 88 -11.514 12.754 -11.571 764 HA LYS 88 HA LYS 88 -12.972 10.524 -10.199 765 HB2 LYS 88 HB2 LYS 88 -14.220 12.334 -9.000 766 HB3 LYS 88 HB3 LYS 88 -12.517 12.198 -8.569 767 HG2 LYS 88 HG2 LYS 88 -11.902 14.147 -9.751 768 HG3 LYS 88 HG3 LYS 88 -13.372 14.150 -10.722 769 HD2 LYS 88 HD2 LYS 88 -13.511 15.948 -9.084 770 HD3 LYS 88 HD3 LYS 88 -14.748 14.733 -8.795 771 HE2 LYS 88 HE2 LYS 88 -13.932 15.354 -6.663 772 HE3 LYS 88 HE3 LYS 88 -13.301 13.739 -6.979 773 HZ1 LYS 88 HZ1 LYS 88 -11.781 16.278 -7.319 774 HZ2 LYS 88 HZ2 LYS 88 -11.595 15.232 -6.084 775 HZ3 LYS 88 HZ3 LYS 88 -11.170 14.786 -7.594 776 H THR 89 H THR 89 -12.809 11.669 -13.132 777 HA THR 89 HA THR 89 -15.483 10.894 -13.718 778 HB THR 89 HB THR 89 -15.890 13.286 -13.454 779 HG1 THR 89 HG1 THR 89 -16.910 13.484 -15.441 780 HG21 THR 89 HG21 THR 89 -14.075 13.705 -15.875 781 HG22 THR 89 HG22 THR 89 -15.017 14.938 -15.008 782 HG23 THR 89 HG23 THR 89 -13.639 14.160 -14.211 783 H ILE 90 H ILE 90 -15.461 9.732 -15.373 784 HA ILE 90 HA ILE 90 -13.397 9.806 -17.492 785 HB ILE 90 HB ILE 90 -13.518 7.111 -17.024 786 HG12 ILE 90 HG12 ILE 90 -13.177 6.580 -14.700 787 HG13 ILE 90 HG13 ILE 90 -13.577 8.223 -14.201 788 HG21 ILE 90 HG21 ILE 90 -11.611 9.031 -15.640 789 HG22 ILE 90 HG22 ILE 90 -11.306 7.325 -16.023 790 HG23 ILE 90 HG23 ILE 90 -11.499 8.497 -17.331 791 HD11 ILE 90 HD11 ILE 90 -15.409 6.232 -15.560 792 HD12 ILE 90 HD12 ILE 90 -15.421 6.638 -13.833 793 HD13 ILE 90 HD13 ILE 90 -15.907 7.862 -15.013 794 H GLY 91 H GLY 91 -16.468 10.212 -17.241 795 HA2 GLY 91 HA2 GLY 91 -18.352 9.760 -18.481 796 HA3 GLY 91 HA3 GLY 91 -17.305 9.035 -19.708 797 H ILE 92 H ILE 92 -16.956 7.532 -16.682 798 HA ILE 92 HA ILE 92 -17.312 5.457 -15.943 799 HB ILE 92 HB ILE 92 -20.236 5.781 -16.612 800 HG12 ILE 92 HG12 ILE 92 -20.150 6.644 -14.073 801 HG13 ILE 92 HG13 ILE 92 -18.526 7.153 -14.504 802 HG21 ILE 92 HG21 ILE 92 -18.755 4.381 -14.325 803 HG22 ILE 92 HG22 ILE 92 -20.519 4.486 -14.510 804 HG23 ILE 92 HG23 ILE 92 -19.585 3.556 -15.656 805 HD11 ILE 92 HD11 ILE 92 -21.080 7.963 -15.978 806 HD12 ILE 92 HD12 ILE 92 -20.305 8.910 -14.693 807 HD13 ILE 92 HD13 ILE 92 -19.459 8.657 -16.218 808 H LEU 93 H LEU 93 -16.341 5.623 -18.523 809 HA LEU 93 HA LEU 93 -15.801 4.439 -20.363 810 HB2 LEU 93 HB2 LEU 93 -16.110 2.309 -18.234 811 HB3 LEU 93 HB3 LEU 93 -15.501 1.935 -19.837 812 HG LEU 93 HG LEU 93 -13.642 3.523 -19.571 813 HD11 LEU 93 HD11 LEU 93 -14.656 3.805 -16.709 814 HD12 LEU 93 HD12 LEU 93 -13.020 4.250 -17.248 815 HD13 LEU 93 HD13 LEU 93 -14.408 5.105 -17.905 816 HD21 LEU 93 HD21 LEU 93 -13.405 1.122 -19.049 817 HD22 LEU 93 HD22 LEU 93 -12.366 2.112 -18.017 818 HD23 LEU 93 HD23 LEU 93 -13.877 1.436 -17.364 819 H GLN 94 H GLN 94 -18.639 5.068 -20.283 820 HA GLN 94 HA GLN 94 -19.711 2.941 -22.089 821 HB2 GLN 94 HB2 GLN 94 -21.857 3.125 -21.030 822 HB3 GLN 94 HB3 GLN 94 -20.622 2.764 -19.826 823 HG2 GLN 94 HG2 GLN 94 -20.599 5.177 -19.159 824 HG3 GLN 94 HG3 GLN 94 -21.896 5.497 -20.316 825 HE21 GLN 94 HE21 GLN 94 -22.710 3.394 -16.850 826 HE22 GLN 94 HE22 GLN 94 -21.056 3.462 -17.460 827 H GLU 95 H GLU 95 -18.546 5.852 -22.455 828 HA GLU 95 HA GLU 95 -20.687 7.207 -23.924 829 HB2 GLU 95 HB2 GLU 95 -17.686 7.711 -23.868 830 HB3 GLU 95 HB3 GLU 95 -18.898 8.743 -24.638 831 HG2 GLU 95 HG2 GLU 95 -20.008 9.010 -22.379 832 HG3 GLU 95 HG3 GLU 95 -18.631 8.168 -21.661 833 H GLU 96 H GLU 96 -20.659 7.647 -26.189 834 HA GLU 96 HA GLU 96 -20.808 6.991 -28.338 835 HB2 GLU 96 HB2 GLU 96 -17.907 6.167 -27.999 836 HB3 GLU 96 HB3 GLU 96 -18.746 6.471 -29.524 837 HG2 GLU 96 HG2 GLU 96 -19.187 8.821 -28.789 838 HG3 GLU 96 HG3 GLU 96 -18.226 8.527 -27.336 839 H VAL 97 H VAL 97 -22.182 5.343 -26.970 840 HA VAL 97 HA VAL 97 -21.922 2.793 -28.488 841 HB VAL 97 HB VAL 97 -22.891 3.034 -25.607 842 HG11 VAL 97 HG11 VAL 97 -22.471 0.568 -27.353 843 HG12 VAL 97 HG12 VAL 97 -22.931 0.568 -25.639 844 HG13 VAL 97 HG13 VAL 97 -24.044 1.221 -26.841 845 HG21 VAL 97 HG21 VAL 97 -20.465 3.261 -25.674 846 HG22 VAL 97 HG22 VAL 97 -20.891 1.669 -25.038 847 HG23 VAL 97 HG23 VAL 97 -20.321 1.836 -26.719 848 H SER 98 H SER 98 -23.740 2.184 -29.575 849 HA SER 98 HA SER 98 -26.375 3.290 -28.696 850 HB2 SER 98 HB2 SER 98 -25.410 4.602 -30.592 851 HB3 SER 98 HB3 SER 98 -25.447 3.130 -31.580 852 HG SER 98 HG SER 98 -27.324 4.450 -31.858 853 H SER 99 H SER 99 -24.777 0.803 -30.761 854 HA SER 99 HA SER 99 -26.677 -1.211 -29.661 855 HB2 SER 99 HB2 SER 99 -27.698 -0.339 -31.758 856 HB3 SER 99 HB3 SER 99 -26.263 -0.871 -32.653 857 HG SER 99 HG SER 99 -27.970 -2.435 -32.665 858 H MET 100 H MET 100 -25.237 -2.434 -28.640 859 HA MET 100 HA MET 100 -23.456 -3.732 -28.141 860 HB2 MET 100 HB2 MET 100 -24.023 -4.710 -30.956 861 HB3 MET 100 HB3 MET 100 -23.005 -5.565 -29.795 862 HG2 MET 100 HG2 MET 100 -25.934 -4.899 -29.348 863 HG3 MET 100 HG3 MET 100 -25.297 -6.452 -29.883 864 HE1 MET 100 HE1 MET 100 -26.554 -7.757 -27.999 865 HE2 MET 100 HE2 MET 100 -26.481 -7.335 -26.274 866 HE3 MET 100 HE3 MET 100 -27.267 -6.231 -27.424 867 H GLU 101 H GLU 101 -22.617 -1.162 -28.996 868 HA GLU 101 HA GLU 101 -20.180 -1.485 -30.572 869 HB2 GLU 101 HB2 GLU 101 -21.747 0.820 -29.517 870 HB3 GLU 101 HB3 GLU 101 -20.068 1.092 -30.011 871 HG2 GLU 101 HG2 GLU 101 -20.426 0.411 -32.224 872 HG3 GLU 101 HG3 GLU 101 -21.921 -0.436 -31.845 873 H ALA 102 H ALA 102 -19.801 -3.127 -28.611 874 HA ALA 102 HA ALA 102 -17.700 -1.906 -26.867 875 HB1 ALA 102 HB1 ALA 102 -19.542 -4.251 -26.242 876 HB2 ALA 102 HB2 ALA 102 -18.243 -3.633 -25.198 877 HB3 ALA 102 HB3 ALA 102 -19.657 -2.619 -25.547 878 H LYS 103 H LYS 103 -15.863 -3.244 -26.425 879 HA LYS 103 HA LYS 103 -15.281 -5.376 -28.459 880 HB2 LYS 103 HB2 LYS 103 -13.349 -3.220 -27.499 881 HB3 LYS 103 HB3 LYS 103 -12.984 -4.572 -28.560 882 HG2 LYS 103 HG2 LYS 103 -13.234 -2.963 -30.131 883 HG3 LYS 103 HG3 LYS 103 -14.895 -3.556 -30.091 884 HD2 LYS 103 HD2 LYS 103 -15.494 -1.635 -28.572 885 HD3 LYS 103 HD3 LYS 103 -13.805 -1.098 -28.626 886 HE2 LYS 103 HE2 LYS 103 -13.981 -0.826 -31.090 887 HE3 LYS 103 HE3 LYS 103 -15.666 -1.362 -31.031 888 HZ1 LYS 103 HZ1 LYS 103 -14.601 1.071 -29.690 889 HZ2 LYS 103 HZ2 LYS 103 -15.509 1.061 -31.045 890 HZ3 LYS 103 HZ3 LYS 103 -16.161 0.578 -29.627 891 H SER 104 H SER 104 -14.916 -7.249 -27.543 892 HA SER 104 HA SER 104 -13.043 -7.561 -25.337 893 HB2 SER 104 HB2 SER 104 -15.057 -7.049 -24.033 894 HB3 SER 104 HB3 SER 104 -15.953 -8.331 -24.859 895 HG SER 104 HG SER 104 -15.070 -8.953 -22.796 896 H MET 105 H MET 105 -15.761 -9.482 -26.697 897 HA MET 105 HA MET 105 -13.956 -11.501 -27.887 898 HB2 MET 105 HB2 MET 105 -15.650 -11.865 -25.413 899 HB3 MET 105 HB3 MET 105 -15.609 -13.191 -26.567 900 HG2 MET 105 HG2 MET 105 -13.227 -13.384 -26.450 901 HG3 MET 105 HG3 MET 105 -13.081 -11.944 -25.447 902 HE1 MET 105 HE1 MET 105 -14.932 -11.957 -23.119 903 HE2 MET 105 HE2 MET 105 -14.070 -12.964 -21.935 904 HE3 MET 105 HE3 MET 105 -13.165 -11.838 -22.970 905 H THR 106 H THR 106 -15.172 -13.168 -29.054 906 HA THR 106 HA THR 106 -17.842 -12.297 -30.075 907 HB THR 106 HB THR 106 -16.051 -12.009 -31.752 908 HG1 THR 106 HG1 THR 106 -17.240 -12.974 -33.364 909 HG21 THR 106 HG21 THR 106 -15.902 -15.058 -31.762 910 HG22 THR 106 HG22 THR 106 -15.107 -13.950 -32.899 911 HG23 THR 106 HG23 THR 106 -14.613 -13.969 -31.200 912 H TRP 107 H TRP 107 -19.030 -14.170 -31.083 913 HA TRP 107 HA TRP 107 -19.144 -16.294 -28.985 914 HB2 TRP 107 HB2 TRP 107 -20.873 -14.306 -29.118 915 HB3 TRP 107 HB3 TRP 107 -21.619 -15.296 -30.361 916 HD1 TRP 107 HD1 TRP 107 -22.994 -17.375 -29.516 917 HE1 TRP 107 HE1 TRP 107 -23.684 -18.269 -27.205 918 HE3 TRP 107 HE3 TRP 107 -19.898 -14.527 -26.596 919 HZ2 TRP 107 HZ2 TRP 107 -22.985 -17.793 -24.438 920 HZ3 TRP 107 HZ3 TRP 107 -19.931 -14.765 -24.122 921 HH2 TRP 107 HH2 TRP 107 -21.467 -16.390 -23.034 Start of MODEL 23 1 H1 GLY -5 H1 GLY -5 -7.724 -66.096 -17.773 2 H2 GLY -5 H2 GLY -5 -8.344 -67.294 -18.704 3 H3 GLY -5 H3 GLY -5 -8.542 -67.336 -17.078 4 HA2 GLY -5 HA2 GLY -5 -10.587 -66.704 -18.109 5 HA3 GLY -5 HA3 GLY -5 -9.934 -65.377 -17.126 6 H SER -4 H SER -4 -11.325 -63.999 -18.482 7 HA SER -4 HA SER -4 -10.917 -63.787 -21.324 8 HB2 SER -4 HB2 SER -4 -13.005 -63.205 -20.115 9 HB3 SER -4 HB3 SER -4 -12.181 -61.811 -19.390 10 HG SER -4 HG SER -4 -13.389 -61.274 -21.286 11 H HIS -3 H HIS -3 -9.678 -61.854 -18.579 12 HA HIS -3 HA HIS -3 -7.401 -60.907 -20.167 13 HB2 HIS -3 HB2 HIS -3 -9.286 -59.258 -20.600 14 HB3 HIS -3 HB3 HIS -3 -9.296 -58.893 -18.877 15 HD2 HIS -3 HD2 HIS -3 -6.925 -58.707 -21.966 16 HE1 HIS -3 HE1 HIS -3 -5.603 -55.744 -19.199 17 HE2 HIS -3 HE2 HIS -3 -5.250 -56.719 -21.522 18 H MET -2 H MET -2 -5.733 -59.901 -18.822 19 HA MET -2 HA MET -2 -6.017 -60.008 -15.898 20 HB2 MET -2 HB2 MET -2 -5.341 -62.340 -16.678 21 HB3 MET -2 HB3 MET -2 -3.831 -61.632 -17.264 22 HG2 MET -2 HG2 MET -2 -3.299 -60.889 -14.958 23 HG3 MET -2 HG3 MET -2 -4.858 -61.513 -14.397 24 HE1 MET -2 HE1 MET -2 -3.897 -62.966 -12.489 25 HE2 MET -2 HE2 MET -2 -2.494 -64.041 -12.664 26 HE3 MET -2 HE3 MET -2 -2.293 -62.284 -12.851 27 H ALA -1 H ALA -1 -4.900 -58.509 -14.891 28 HA ALA -1 HA ALA -1 -2.590 -57.209 -16.120 29 HB1 ALA -1 HB1 ALA -1 -5.165 -55.687 -15.489 30 HB2 ALA -1 HB2 ALA -1 -3.639 -54.956 -16.036 31 HB3 ALA -1 HB3 ALA -1 -4.535 -56.033 -17.114 32 H SER 0 H SER 0 -1.877 -55.292 -14.639 33 HA SER 0 HA SER 0 -2.310 -55.827 -11.742 34 HB2 SER 0 HB2 SER 0 -0.216 -56.965 -12.560 35 HB3 SER 0 HB3 SER 0 0.434 -55.359 -12.954 36 HG SER 0 HG SER 0 1.024 -56.099 -10.838 37 H MET 1 H MET 1 -1.558 -54.023 -10.372 38 HA MET 1 HA MET 1 -1.976 -51.341 -11.634 39 HB2 MET 1 HB2 MET 1 -3.603 -52.548 -9.364 40 HB3 MET 1 HB3 MET 1 -3.670 -50.855 -9.877 41 HG2 MET 1 HG2 MET 1 -4.366 -51.563 -12.141 42 HG3 MET 1 HG3 MET 1 -4.409 -53.244 -11.607 43 HE1 MET 1 HE1 MET 1 -5.755 -53.266 -8.761 44 HE2 MET 1 HE2 MET 1 -7.461 -53.423 -9.223 45 HE3 MET 1 HE3 MET 1 -6.217 -54.324 -10.115 46 H ASP 2 H ASP 2 0.450 -51.569 -11.128 47 HA ASP 2 HA ASP 2 0.955 -50.195 -8.512 48 HB2 ASP 2 HB2 ASP 2 2.549 -52.452 -9.753 49 HB3 ASP 2 HB3 ASP 2 3.227 -51.339 -8.565 50 HA PRO 3 HA PRO 3 2.603 -47.590 -11.961 51 HB2 PRO 3 HB2 PRO 3 1.201 -45.297 -11.576 52 HB3 PRO 3 HB3 PRO 3 0.462 -46.728 -12.362 53 HG2 PRO 3 HG2 PRO 3 0.261 -45.906 -9.441 54 HG3 PRO 3 HG3 PRO 3 -1.072 -46.328 -10.562 55 HD2 PRO 3 HD2 PRO 3 0.026 -48.142 -8.835 56 HD3 PRO 3 HD3 PRO 3 -0.569 -48.612 -10.455 57 H LEU 4 H LEU 4 2.862 -47.600 -8.691 58 HA LEU 4 HA LEU 4 4.743 -45.290 -8.571 59 HB2 LEU 4 HB2 LEU 4 3.166 -46.624 -6.336 60 HB3 LEU 4 HB3 LEU 4 4.302 -45.300 -6.129 61 HG LEU 4 HG LEU 4 1.723 -45.124 -7.721 62 HD11 LEU 4 HD11 LEU 4 2.501 -43.977 -5.011 63 HD12 LEU 4 HD12 LEU 4 0.963 -43.709 -5.864 64 HD13 LEU 4 HD13 LEU 4 1.382 -45.330 -5.289 65 HD21 LEU 4 HD21 LEU 4 3.370 -43.550 -8.632 66 HD22 LEU 4 HD22 LEU 4 2.160 -42.676 -7.692 67 HD23 LEU 4 HD23 LEU 4 3.764 -42.978 -6.991 68 H ASP 5 H ASP 5 5.620 -47.676 -9.728 69 HA ASP 5 HA ASP 5 7.561 -48.714 -7.722 70 HB2 ASP 5 HB2 ASP 5 6.014 -50.240 -9.072 71 HB3 ASP 5 HB3 ASP 5 6.948 -49.764 -10.499 72 H LYS 6 H LYS 6 7.516 -46.358 -9.938 73 HA LYS 6 HA LYS 6 10.216 -46.925 -11.106 74 HB2 LYS 6 HB2 LYS 6 8.180 -45.100 -12.410 75 HB3 LYS 6 HB3 LYS 6 9.596 -45.873 -13.096 76 HG2 LYS 6 HG2 LYS 6 8.124 -47.373 -13.921 77 HG3 LYS 6 HG3 LYS 6 8.222 -48.087 -12.319 78 HD2 LYS 6 HD2 LYS 6 5.890 -47.927 -12.824 79 HD3 LYS 6 HD3 LYS 6 6.227 -46.667 -11.643 80 HE2 LYS 6 HE2 LYS 6 4.766 -45.725 -13.267 81 HE3 LYS 6 HE3 LYS 6 6.344 -44.980 -13.499 82 HZ1 LYS 6 HZ1 LYS 6 5.252 -47.207 -15.147 83 HZ2 LYS 6 HZ2 LYS 6 5.333 -45.648 -15.613 84 HZ3 LYS 6 HZ3 LYS 6 6.706 -46.496 -15.386 85 H ILE 7 H ILE 7 8.217 -44.104 -10.411 86 HA ILE 7 HA ILE 7 10.596 -42.515 -9.568 87 HB ILE 7 HB ILE 7 9.520 -40.544 -10.695 88 HG12 ILE 7 HG12 ILE 7 8.015 -40.969 -12.613 89 HG13 ILE 7 HG13 ILE 7 7.802 -42.640 -12.105 90 HG21 ILE 7 HG21 ILE 7 10.311 -42.824 -12.544 91 HG22 ILE 7 HG22 ILE 7 10.410 -41.085 -12.876 92 HG23 ILE 7 HG23 ILE 7 11.436 -41.800 -11.625 93 HD11 ILE 7 HD11 ILE 7 6.974 -40.216 -10.453 94 HD12 ILE 7 HD12 ILE 7 5.900 -41.138 -11.522 95 HD13 ILE 7 HD13 ILE 7 6.598 -41.925 -10.101 96 H ILE 8 H ILE 8 8.255 -43.960 -8.172 97 HA ILE 8 HA ILE 8 6.550 -42.357 -6.785 98 HB ILE 8 HB ILE 8 6.705 -44.745 -6.482 99 HG12 ILE 8 HG12 ILE 8 6.813 -43.132 -3.896 100 HG13 ILE 8 HG13 ILE 8 5.404 -43.438 -4.911 101 HG21 ILE 8 HG21 ILE 8 9.044 -44.384 -4.580 102 HG22 ILE 8 HG22 ILE 8 8.288 -45.894 -5.122 103 HG23 ILE 8 HG23 ILE 8 9.220 -44.926 -6.262 104 HD11 ILE 8 HD11 ILE 8 6.918 -45.462 -3.207 105 HD12 ILE 8 HD12 ILE 8 5.283 -44.835 -2.956 106 HD13 ILE 8 HD13 ILE 8 5.617 -45.893 -4.338 107 H ASN 9 H ASN 9 6.644 -40.590 -5.565 108 HA ASN 9 HA ASN 9 8.966 -39.995 -3.820 109 HB2 ASN 9 HB2 ASN 9 9.189 -39.120 -6.295 110 HB3 ASN 9 HB3 ASN 9 8.043 -37.884 -5.786 111 HD21 ASN 9 HD21 ASN 9 10.497 -36.390 -3.514 112 HD22 ASN 9 HD22 ASN 9 8.784 -36.843 -3.544 113 H ASP 10 H ASP 10 6.166 -40.692 -3.255 114 HA ASP 10 HA ASP 10 5.250 -38.186 -1.930 115 HB2 ASP 10 HB2 ASP 10 3.734 -40.705 -2.662 116 HB3 ASP 10 HB3 ASP 10 3.039 -39.316 -1.820 117 H ILE 11 H ILE 11 7.231 -40.316 -1.082 118 HA ILE 11 HA ILE 11 6.593 -40.339 1.786 119 HB ILE 11 HB ILE 11 5.411 -42.288 0.794 120 HG12 ILE 11 HG12 ILE 11 7.535 -43.182 2.768 121 HG13 ILE 11 HG13 ILE 11 6.159 -42.157 3.181 122 HG21 ILE 11 HG21 ILE 11 8.146 -43.515 0.276 123 HG22 ILE 11 HG22 ILE 11 6.561 -44.249 -0.016 124 HG23 ILE 11 HG23 ILE 11 7.071 -42.865 -0.978 125 HD11 ILE 11 HD11 ILE 11 6.012 -45.000 2.097 126 HD12 ILE 11 HD12 ILE 11 5.653 -44.457 3.743 127 HD13 ILE 11 HD13 ILE 11 4.607 -43.949 2.404 128 H LYS 12 H LYS 12 8.504 -38.925 0.392 129 HA LYS 12 HA LYS 12 10.974 -40.062 1.583 130 HB2 LYS 12 HB2 LYS 12 10.525 -40.299 -1.122 131 HB3 LYS 12 HB3 LYS 12 11.286 -38.729 -1.091 132 HG2 LYS 12 HG2 LYS 12 13.016 -40.339 -1.461 133 HG3 LYS 12 HG3 LYS 12 13.225 -39.718 0.171 134 HD2 LYS 12 HD2 LYS 12 13.609 -42.123 0.131 135 HD3 LYS 12 HD3 LYS 12 12.181 -41.775 1.099 136 HE2 LYS 12 HE2 LYS 12 10.744 -42.330 -0.906 137 HE3 LYS 12 HE3 LYS 12 12.210 -42.754 -1.797 138 HZ1 LYS 12 HZ1 LYS 12 11.251 -44.088 0.685 139 HZ2 LYS 12 HZ2 LYS 12 11.191 -44.728 -0.817 140 HZ3 LYS 12 HZ3 LYS 12 12.634 -44.476 -0.099 141 H LYS 13 H LYS 13 9.418 -37.124 0.400 142 HA LYS 13 HA LYS 13 10.848 -35.496 2.348 143 HB2 LYS 13 HB2 LYS 13 12.300 -35.533 0.285 144 HB3 LYS 13 HB3 LYS 13 10.956 -34.852 -0.638 145 HG2 LYS 13 HG2 LYS 13 11.038 -32.800 0.767 146 HG3 LYS 13 HG3 LYS 13 12.346 -33.516 1.734 147 HD2 LYS 13 HD2 LYS 13 13.776 -33.605 -0.298 148 HD3 LYS 13 HD3 LYS 13 12.452 -32.905 -1.255 149 HE2 LYS 13 HE2 LYS 13 12.480 -30.890 0.239 150 HE3 LYS 13 HE3 LYS 13 13.844 -31.585 1.124 151 HZ1 LYS 13 HZ1 LYS 13 13.868 -30.865 -1.761 152 HZ2 LYS 13 HZ2 LYS 13 14.600 -30.024 -0.571 153 HZ3 LYS 13 HZ3 LYS 13 15.131 -31.517 -0.952 154 H GLU 14 H GLU 14 9.796 -33.513 2.792 155 HA GLU 14 HA GLU 14 7.282 -32.876 1.364 156 HB2 GLU 14 HB2 GLU 14 6.712 -34.309 3.342 157 HB3 GLU 14 HB3 GLU 14 7.431 -33.090 4.399 158 HG2 GLU 14 HG2 GLU 14 5.771 -31.425 3.631 159 HG3 GLU 14 HG3 GLU 14 5.118 -32.580 2.468 160 H ALA 15 H ALA 15 6.795 -30.699 1.297 161 HA ALA 15 HA ALA 15 8.425 -28.720 2.751 162 HB1 ALA 15 HB1 ALA 15 8.319 -28.873 -0.296 163 HB2 ALA 15 HB2 ALA 15 9.094 -27.592 0.664 164 HB3 ALA 15 HB3 ALA 15 9.737 -29.242 0.714 165 H ASN 16 H ASN 16 7.660 -26.449 2.087 166 HA ASN 16 HA ASN 16 4.737 -26.307 1.552 167 HB2 ASN 16 HB2 ASN 16 5.127 -26.458 4.017 168 HB3 ASN 16 HB3 ASN 16 6.201 -25.062 3.921 169 HD21 ASN 16 HD21 ASN 16 2.133 -24.506 3.589 170 HD22 ASN 16 HD22 ASN 16 2.811 -26.094 3.269 171 H ASP 17 H ASP 17 3.992 -24.288 0.786 172 HA ASP 17 HA ASP 17 6.064 -22.397 -0.261 173 HB2 ASP 17 HB2 ASP 17 3.567 -23.466 -1.632 174 HB3 ASP 17 HB3 ASP 17 4.497 -22.093 -2.212 175 H SER 18 H SER 18 5.782 -20.303 -0.025 176 HA SER 18 HA SER 18 3.505 -19.327 1.566 177 HB2 SER 18 HB2 SER 18 5.831 -18.575 2.028 178 HB3 SER 18 HB3 SER 18 5.865 -17.784 0.438 179 HG SER 18 HG SER 18 5.247 -16.369 2.166 180 H GLY 19 H GLY 19 1.741 -19.348 0.449 181 HA2 GLY 19 HA2 GLY 19 0.142 -18.032 -0.801 182 HA3 GLY 19 HA3 GLY 19 1.408 -17.559 -1.927 183 H VAL 20 H VAL 20 -1.159 -19.566 -1.446 184 HA VAL 20 HA VAL 20 -0.535 -21.251 -3.841 185 HB VAL 20 HB VAL 20 -2.258 -22.037 -1.458 186 HG11 VAL 20 HG11 VAL 20 -1.543 -23.564 -4.004 187 HG12 VAL 20 HG12 VAL 20 -2.369 -24.254 -2.588 188 HG13 VAL 20 HG13 VAL 20 -3.159 -22.995 -3.531 189 HG21 VAL 20 HG21 VAL 20 0.142 -22.210 -0.912 190 HG22 VAL 20 HG22 VAL 20 -0.560 -23.816 -1.114 191 HG23 VAL 20 HG23 VAL 20 0.433 -23.117 -2.412 192 H THR 21 H THR 21 -1.905 -21.115 -5.482 193 HA THR 21 HA THR 21 -3.385 -20.187 -6.902 194 HB THR 21 HB THR 21 -5.646 -20.166 -4.989 195 HG1 THR 21 HG1 THR 21 -5.781 -22.406 -5.052 196 HG21 THR 21 HG21 THR 21 -5.214 -21.573 -7.666 197 HG22 THR 21 HG22 THR 21 -6.765 -21.282 -6.851 198 HG23 THR 21 HG23 THR 21 -5.854 -19.930 -7.551 199 H LEU 22 H LEU 22 -5.684 -18.476 -6.469 200 HA LEU 22 HA LEU 22 -4.258 -15.886 -6.087 201 HB2 LEU 22 HB2 LEU 22 -6.078 -16.769 -8.372 202 HB3 LEU 22 HB3 LEU 22 -5.298 -15.197 -8.249 203 HG LEU 22 HG LEU 22 -3.755 -17.815 -8.496 204 HD11 LEU 22 HD11 LEU 22 -4.530 -15.806 -10.645 205 HD12 LEU 22 HD12 LEU 22 -3.426 -17.184 -10.859 206 HD13 LEU 22 HD13 LEU 22 -5.131 -17.475 -10.487 207 HD21 LEU 22 HD21 LEU 22 -2.441 -15.953 -7.518 208 HD22 LEU 22 HD22 LEU 22 -1.896 -16.345 -9.153 209 HD23 LEU 22 HD23 LEU 22 -2.916 -14.910 -8.886 210 H ALA 23 H ALA 23 -5.991 -17.035 -4.211 211 HA ALA 23 HA ALA 23 -8.648 -15.733 -4.633 212 HB1 ALA 23 HB1 ALA 23 -7.983 -18.478 -3.561 213 HB2 ALA 23 HB2 ALA 23 -9.614 -17.789 -3.777 214 HB3 ALA 23 HB3 ALA 23 -8.579 -18.084 -5.191 215 HA PRO 24 HA PRO 24 -7.299 -14.277 -0.453 216 HB2 PRO 24 HB2 PRO 24 -7.965 -11.642 -0.679 217 HB3 PRO 24 HB3 PRO 24 -6.471 -12.330 -1.384 218 HG2 PRO 24 HG2 PRO 24 -9.114 -11.810 -2.788 219 HG3 PRO 24 HG3 PRO 24 -7.465 -11.336 -3.315 220 HD2 PRO 24 HD2 PRO 24 -8.671 -13.597 -4.243 221 HD3 PRO 24 HD3 PRO 24 -6.915 -13.544 -3.923 222 H LEU 25 H LEU 25 -10.415 -13.880 -2.124 223 HA LEU 25 HA LEU 25 -11.871 -14.224 0.418 224 HB2 LEU 25 HB2 LEU 25 -11.259 -11.691 -0.236 225 HB3 LEU 25 HB3 LEU 25 -12.707 -11.825 -1.214 226 HG LEU 25 HG LEU 25 -12.499 -12.367 1.792 227 HD11 LEU 25 HD11 LEU 25 -13.647 -9.972 0.299 228 HD12 LEU 25 HD12 LEU 25 -13.672 -10.226 2.060 229 HD13 LEU 25 HD13 LEU 25 -12.128 -10.003 1.225 230 HD21 LEU 25 HD21 LEU 25 -14.397 -13.603 0.867 231 HD22 LEU 25 HD22 LEU 25 -14.964 -12.223 1.812 232 HD23 LEU 25 HD23 LEU 25 -14.974 -12.139 0.035 233 H SER 26 H SER 26 -11.826 -16.187 -1.273 234 HA SER 26 HA SER 26 -12.970 -17.591 -2.636 235 HB2 SER 26 HB2 SER 26 -14.523 -17.150 -0.631 236 HB3 SER 26 HB3 SER 26 -15.531 -16.246 -1.770 237 HG SER 26 HG SER 26 -16.140 -18.466 -1.608 238 H VAL 27 H VAL 27 -11.914 -15.520 -4.019 239 HA VAL 27 HA VAL 27 -13.516 -15.325 -6.466 240 HB VAL 27 HB VAL 27 -14.353 -13.527 -4.952 241 HG11 VAL 27 HG11 VAL 27 -11.611 -12.264 -5.248 242 HG12 VAL 27 HG12 VAL 27 -13.029 -11.567 -4.435 243 HG13 VAL 27 HG13 VAL 27 -12.232 -12.990 -3.757 244 HG21 VAL 27 HG21 VAL 27 -14.490 -13.211 -7.388 245 HG22 VAL 27 HG22 VAL 27 -14.264 -11.681 -6.534 246 HG23 VAL 27 HG23 VAL 27 -12.891 -12.415 -7.383 247 HA PRO 28 HA PRO 28 -9.218 -15.394 -7.762 248 HB2 PRO 28 HB2 PRO 28 -9.376 -15.152 -10.461 249 HB3 PRO 28 HB3 PRO 28 -10.061 -16.546 -9.585 250 HG2 PRO 28 HG2 PRO 28 -11.537 -14.040 -10.473 251 HG3 PRO 28 HG3 PRO 28 -11.977 -15.747 -10.799 252 HD2 PRO 28 HD2 PRO 28 -13.057 -14.369 -8.724 253 HD3 PRO 28 HD3 PRO 28 -12.648 -16.098 -8.561 254 H LYS 29 H LYS 29 -9.318 -13.297 -6.424 255 HA LYS 29 HA LYS 29 -8.715 -11.175 -5.924 256 HB2 LYS 29 HB2 LYS 29 -6.621 -11.745 -6.723 257 HB3 LYS 29 HB3 LYS 29 -7.061 -11.602 -8.397 258 HG2 LYS 29 HG2 LYS 29 -7.386 -9.009 -7.017 259 HG3 LYS 29 HG3 LYS 29 -5.791 -9.679 -6.767 260 HD2 LYS 29 HD2 LYS 29 -5.677 -8.307 -8.615 261 HD3 LYS 29 HD3 LYS 29 -5.449 -9.942 -9.206 262 HE2 LYS 29 HE2 LYS 29 -8.084 -8.408 -9.365 263 HE3 LYS 29 HE3 LYS 29 -6.795 -8.220 -10.557 264 HZ1 LYS 29 HZ1 LYS 29 -8.315 -10.704 -10.018 265 HZ2 LYS 29 HZ2 LYS 29 -8.293 -9.849 -11.394 266 HZ3 LYS 29 HZ3 LYS 29 -6.954 -10.681 -10.956 267 HA PRO 30 HA PRO 30 -11.740 -8.761 -8.273 268 HB2 PRO 30 HB2 PRO 30 -12.974 -7.487 -6.260 269 HB3 PRO 30 HB3 PRO 30 -13.140 -9.261 -6.464 270 HG2 PRO 30 HG2 PRO 30 -11.424 -7.752 -4.493 271 HG3 PRO 30 HG3 PRO 30 -12.340 -9.264 -4.256 272 HD2 PRO 30 HD2 PRO 30 -9.571 -9.004 -4.921 273 HD3 PRO 30 HD3 PRO 30 -10.527 -10.499 -4.945 274 H LYS 31 H LYS 31 -11.479 -6.722 -9.234 275 HA LYS 31 HA LYS 31 -9.288 -4.910 -8.469 276 HB2 LYS 31 HB2 LYS 31 -11.509 -4.836 -10.533 277 HB3 LYS 31 HB3 LYS 31 -10.386 -3.504 -10.319 278 HG2 LYS 31 HG2 LYS 31 -9.193 -6.247 -10.697 279 HG3 LYS 31 HG3 LYS 31 -9.996 -5.498 -12.083 280 HD2 LYS 31 HD2 LYS 31 -8.562 -3.469 -11.815 281 HD3 LYS 31 HD3 LYS 31 -7.688 -4.286 -10.503 282 HE2 LYS 31 HE2 LYS 31 -6.956 -6.053 -12.039 283 HE3 LYS 31 HE3 LYS 31 -7.984 -5.407 -13.323 284 HZ1 LYS 31 HZ1 LYS 31 -5.607 -4.018 -12.181 285 HZ2 LYS 31 HZ2 LYS 31 -5.713 -4.704 -13.661 286 HZ3 LYS 31 HZ3 LYS 31 -6.604 -3.387 -13.320 287 H LEU 32 H LEU 32 -9.461 -3.767 -6.661 288 HA LEU 32 HA LEU 32 -11.539 -1.684 -6.608 289 HB2 LEU 32 HB2 LEU 32 -11.997 -1.857 -4.315 290 HB3 LEU 32 HB3 LEU 32 -12.270 -3.437 -5.032 291 HG LEU 32 HG LEU 32 -9.620 -2.889 -3.661 292 HD11 LEU 32 HD11 LEU 32 -12.170 -3.614 -2.196 293 HD12 LEU 32 HD12 LEU 32 -10.514 -3.576 -1.528 294 HD13 LEU 32 HD13 LEU 32 -11.272 -2.077 -2.071 295 HD21 LEU 32 HD21 LEU 32 -9.807 -5.019 -4.741 296 HD22 LEU 32 HD22 LEU 32 -9.960 -5.319 -3.019 297 HD23 LEU 32 HD23 LEU 32 -11.413 -5.335 -4.037 298 H GLU 33 H GLU 33 -11.025 0.163 -5.322 299 HA GLU 33 HA GLU 33 -8.275 0.611 -4.462 300 HB2 GLU 33 HB2 GLU 33 -7.959 2.596 -5.965 301 HB3 GLU 33 HB3 GLU 33 -8.054 1.078 -6.849 302 HG2 GLU 33 HG2 GLU 33 -10.436 1.544 -7.424 303 HG3 GLU 33 HG3 GLU 33 -10.344 3.073 -6.555 304 H GLU 34 H GLU 34 -10.220 0.382 -2.879 305 HA GLU 34 HA GLU 34 -11.464 3.004 -2.246 306 HB2 GLU 34 HB2 GLU 34 -12.867 0.981 -2.522 307 HB3 GLU 34 HB3 GLU 34 -12.094 0.260 -1.103 308 HG2 GLU 34 HG2 GLU 34 -12.886 2.161 0.284 309 HG3 GLU 34 HG3 GLU 34 -13.591 2.917 -1.147 310 H LEU 35 H LEU 35 -9.982 4.230 -1.237 311 HA LEU 35 HA LEU 35 -8.883 3.360 1.409 312 HB2 LEU 35 HB2 LEU 35 -7.745 5.126 -0.786 313 HB3 LEU 35 HB3 LEU 35 -7.035 4.999 0.815 314 HG LEU 35 HG LEU 35 -7.459 2.420 -0.704 315 HD11 LEU 35 HD11 LEU 35 -5.148 4.290 -1.305 316 HD12 LEU 35 HD12 LEU 35 -5.421 2.653 -1.947 317 HD13 LEU 35 HD13 LEU 35 -6.514 3.964 -2.396 318 HD21 LEU 35 HD21 LEU 35 -6.531 2.420 1.593 319 HD22 LEU 35 HD22 LEU 35 -5.359 1.823 0.405 320 HD23 LEU 35 HD23 LEU 35 -5.197 3.466 1.053 321 H SER 36 H SER 36 -8.817 4.962 3.062 322 HA SER 36 HA SER 36 -10.852 7.101 2.930 323 HB2 SER 36 HB2 SER 36 -8.870 6.344 5.114 324 HB3 SER 36 HB3 SER 36 -10.156 7.560 5.252 325 HG SER 36 HG SER 36 -10.815 5.533 6.088 326 H GLU 37 H GLU 37 -10.184 9.418 3.556 327 HA GLU 37 HA GLU 37 -8.490 10.427 1.592 328 HB2 GLU 37 HB2 GLU 37 -10.216 11.700 2.773 329 HB3 GLU 37 HB3 GLU 37 -9.230 11.719 4.245 330 HG2 GLU 37 HG2 GLU 37 -7.492 13.039 3.070 331 HG3 GLU 37 HG3 GLU 37 -8.422 12.948 1.571 332 H GLN 38 H GLN 38 -7.512 9.846 5.012 333 HA GLN 38 HA GLN 38 -4.760 10.682 4.456 334 HB2 GLN 38 HB2 GLN 38 -4.232 9.926 6.690 335 HB3 GLN 38 HB3 GLN 38 -5.600 11.029 6.683 336 HG2 GLN 38 HG2 GLN 38 -7.164 9.286 7.189 337 HG3 GLN 38 HG3 GLN 38 -6.009 8.010 6.798 338 HE21 GLN 38 HE21 GLN 38 -4.266 8.168 9.907 339 HE22 GLN 38 HE22 GLN 38 -4.085 7.729 8.213 340 H GLN 39 H GLN 39 -6.466 7.556 4.516 341 HA GLN 39 HA GLN 39 -4.073 5.957 4.371 342 HB2 GLN 39 HB2 GLN 39 -6.970 5.351 3.757 343 HB3 GLN 39 HB3 GLN 39 -5.670 4.177 3.520 344 HG2 GLN 39 HG2 GLN 39 -4.982 4.524 5.929 345 HG3 GLN 39 HG3 GLN 39 -6.439 5.487 6.162 346 HE21 GLN 39 HE21 GLN 39 -6.984 1.819 7.078 347 HE22 GLN 39 HE22 GLN 39 -5.663 2.895 7.477 348 H LYS 40 H LYS 40 -6.133 7.440 1.909 349 HA LYS 40 HA LYS 40 -4.872 6.288 -0.400 350 HB2 LYS 40 HB2 LYS 40 -7.054 7.452 -0.391 351 HB3 LYS 40 HB3 LYS 40 -6.275 8.976 0.037 352 HG2 LYS 40 HG2 LYS 40 -5.060 9.013 -2.089 353 HG3 LYS 40 HG3 LYS 40 -5.728 7.437 -2.542 354 HD2 LYS 40 HD2 LYS 40 -7.412 9.928 -1.983 355 HD3 LYS 40 HD3 LYS 40 -6.848 9.446 -3.595 356 HE2 LYS 40 HE2 LYS 40 -8.032 7.257 -3.338 357 HE3 LYS 40 HE3 LYS 40 -8.666 7.797 -1.777 358 HZ1 LYS 40 HZ1 LYS 40 -9.203 9.116 -4.388 359 HZ2 LYS 40 HZ2 LYS 40 -10.261 8.185 -3.569 360 HZ3 LYS 40 HZ3 LYS 40 -9.793 9.621 -2.950 361 H ILE 41 H ILE 41 -4.090 9.264 1.479 362 HA ILE 41 HA ILE 41 -1.850 10.005 -0.182 363 HB ILE 41 HB ILE 41 -2.401 10.681 2.697 364 HG12 ILE 41 HG12 ILE 41 -2.895 12.486 0.277 365 HG13 ILE 41 HG13 ILE 41 -4.144 11.393 0.838 366 HG21 ILE 41 HG21 ILE 41 -0.504 11.998 0.712 367 HG22 ILE 41 HG22 ILE 41 -0.913 12.661 2.307 368 HG23 ILE 41 HG23 ILE 41 -0.057 11.134 2.199 369 HD11 ILE 41 HD11 ILE 41 -2.935 13.653 2.469 370 HD12 ILE 41 HD12 ILE 41 -4.568 13.550 1.785 371 HD13 ILE 41 HD13 ILE 41 -4.090 12.447 3.086 372 H ILE 42 H ILE 42 -2.027 8.046 2.886 373 HA ILE 42 HA ILE 42 0.821 7.690 3.100 374 HB ILE 42 HB ILE 42 -1.462 5.926 4.033 375 HG12 ILE 42 HG12 ILE 42 0.242 7.715 5.807 376 HG13 ILE 42 HG13 ILE 42 -1.135 8.393 4.957 377 HG21 ILE 42 HG21 ILE 42 1.507 5.858 4.761 378 HG22 ILE 42 HG22 ILE 42 0.245 4.979 5.638 379 HG23 ILE 42 HG23 ILE 42 0.583 4.569 3.962 380 HD11 ILE 42 HD11 ILE 42 -1.258 6.069 6.917 381 HD12 ILE 42 HD12 ILE 42 -1.862 7.720 7.159 382 HD13 ILE 42 HD13 ILE 42 -2.621 6.663 5.946 383 H LEU 43 H LEU 43 -1.683 5.760 1.501 384 HA LEU 43 HA LEU 43 -0.058 3.670 0.477 385 HB2 LEU 43 HB2 LEU 43 -2.481 3.624 0.673 386 HB3 LEU 43 HB3 LEU 43 -2.664 4.914 -0.497 387 HG LEU 43 HG LEU 43 -3.260 2.612 -1.201 388 HD11 LEU 43 HD11 LEU 43 -1.151 3.895 -2.963 389 HD12 LEU 43 HD12 LEU 43 -2.437 2.786 -3.458 390 HD13 LEU 43 HD13 LEU 43 -2.848 4.394 -2.838 391 HD21 LEU 43 HD21 LEU 43 -1.545 1.315 -0.213 392 HD22 LEU 43 HD22 LEU 43 -1.454 1.085 -1.962 393 HD23 LEU 43 HD23 LEU 43 -0.249 2.108 -1.143 394 H ALA 44 H ALA 44 -1.076 6.752 -1.049 395 HA ALA 44 HA ALA 44 0.362 6.398 -3.475 396 HB1 ALA 44 HB1 ALA 44 -0.642 8.890 -2.043 397 HB2 ALA 44 HB2 ALA 44 -0.139 8.826 -3.750 398 HB3 ALA 44 HB3 ALA 44 -1.560 7.902 -3.204 399 H GLU 45 H GLU 45 1.243 8.424 -0.575 400 HA GLU 45 HA GLU 45 3.708 9.337 -1.660 401 HB2 GLU 45 HB2 GLU 45 2.745 8.977 1.198 402 HB3 GLU 45 HB3 GLU 45 4.288 9.722 0.805 403 HG2 GLU 45 HG2 GLU 45 1.624 10.767 -0.252 404 HG3 GLU 45 HG3 GLU 45 2.397 11.336 1.222 405 H TYR 46 H TYR 46 2.995 6.210 -0.210 406 HA TYR 46 HA TYR 46 5.745 5.449 0.269 407 HB2 TYR 46 HB2 TYR 46 3.807 4.477 1.412 408 HB3 TYR 46 HB3 TYR 46 3.186 3.852 -0.105 409 HD1 TYR 46 HD1 TYR 46 2.961 1.783 1.289 410 HD2 TYR 46 HD2 TYR 46 6.810 3.444 0.236 411 HE1 TYR 46 HE1 TYR 46 4.041 -0.409 1.735 412 HE2 TYR 46 HE2 TYR 46 7.880 1.261 0.728 413 HH TYR 46 HH TYR 46 5.982 -1.572 1.809 414 H ILE 47 H ILE 47 3.438 4.435 -2.315 415 HA ILE 47 HA ILE 47 5.216 3.154 -4.086 416 HB ILE 47 HB ILE 47 2.556 4.532 -4.283 417 HG12 ILE 47 HG12 ILE 47 3.360 1.599 -4.427 418 HG13 ILE 47 HG13 ILE 47 3.000 2.372 -2.905 419 HG21 ILE 47 HG21 ILE 47 3.915 2.923 -6.489 420 HG22 ILE 47 HG22 ILE 47 2.203 3.408 -6.489 421 HG23 ILE 47 HG23 ILE 47 3.447 4.631 -6.574 422 HD11 ILE 47 HD11 ILE 47 0.986 2.060 -5.163 423 HD12 ILE 47 HD12 ILE 47 1.032 1.163 -3.635 424 HD13 ILE 47 HD13 ILE 47 0.711 2.904 -3.636 425 H ALA 48 H ALA 48 4.275 6.613 -3.815 426 HA ALA 48 HA ALA 48 5.561 7.470 -6.237 427 HB1 ALA 48 HB1 ALA 48 4.745 8.971 -3.718 428 HB2 ALA 48 HB2 ALA 48 5.140 9.720 -5.285 429 HB3 ALA 48 HB3 ALA 48 3.714 8.668 -5.133 430 H GLU 49 H GLU 49 6.835 6.808 -3.032 431 HA GLU 49 HA GLU 49 9.374 8.233 -3.591 432 HB2 GLU 49 HB2 GLU 49 8.164 8.406 -1.388 433 HB3 GLU 49 HB3 GLU 49 8.499 6.693 -1.125 434 HG2 GLU 49 HG2 GLU 49 10.106 7.959 0.097 435 HG3 GLU 49 HG3 GLU 49 10.961 7.217 -1.241 436 H VAL 50 H VAL 50 8.129 4.848 -3.422 437 HA VAL 50 HA VAL 50 10.936 3.923 -3.927 438 HB VAL 50 HB VAL 50 10.575 1.966 -2.737 439 HG11 VAL 50 HG11 VAL 50 9.293 4.135 -1.036 440 HG12 VAL 50 HG12 VAL 50 10.199 2.716 -0.481 441 HG13 VAL 50 HG13 VAL 50 11.036 3.999 -1.371 442 HG21 VAL 50 HG21 VAL 50 8.311 1.318 -3.307 443 HG22 VAL 50 HG22 VAL 50 8.487 1.374 -1.564 444 HG23 VAL 50 HG23 VAL 50 7.628 2.676 -2.409 445 H GLY 51 H GLY 51 7.739 3.920 -5.265 446 HA2 GLY 51 HA2 GLY 51 7.078 3.123 -7.362 447 HA3 GLY 51 HA3 GLY 51 8.568 2.199 -7.525 448 H LEU 52 H LEU 52 5.631 1.495 -7.789 449 HA LEU 52 HA LEU 52 4.812 -0.013 -5.582 450 HB2 LEU 52 HB2 LEU 52 3.641 0.995 -7.774 451 HB3 LEU 52 HB3 LEU 52 3.759 -0.645 -8.360 452 HG LEU 52 HG LEU 52 2.496 0.005 -5.666 453 HD11 LEU 52 HD11 LEU 52 1.160 0.002 -8.387 454 HD12 LEU 52 HD12 LEU 52 0.335 0.193 -6.821 455 HD13 LEU 52 HD13 LEU 52 1.465 1.432 -7.377 456 HD21 LEU 52 HD21 LEU 52 2.724 -2.357 -5.899 457 HD22 LEU 52 HD22 LEU 52 1.052 -1.994 -6.278 458 HD23 LEU 52 HD23 LEU 52 2.204 -2.320 -7.593 459 H GLN 53 H GLN 53 7.127 -0.806 -7.704 460 HA GLN 53 HA GLN 53 6.947 -3.760 -7.604 461 HB2 GLN 53 HB2 GLN 53 8.839 -3.774 -9.086 462 HB3 GLN 53 HB3 GLN 53 7.640 -2.623 -9.666 463 HG2 GLN 53 HG2 GLN 53 9.087 -0.812 -8.427 464 HG3 GLN 53 HG3 GLN 53 10.325 -2.068 -8.351 465 HE21 GLN 53 HE21 GLN 53 9.323 -0.362 -11.979 466 HE22 GLN 53 HE22 GLN 53 8.192 -0.270 -10.639 467 H ASN 54 H ASN 54 8.217 -1.313 -5.576 468 HA ASN 54 HA ASN 54 10.126 -3.220 -4.290 469 HB2 ASN 54 HB2 ASN 54 10.142 -0.181 -4.287 470 HB3 ASN 54 HB3 ASN 54 11.324 -1.214 -3.491 471 HD21 ASN 54 HD21 ASN 54 11.994 -0.199 -7.257 472 HD22 ASN 54 HD22 ASN 54 10.892 0.632 -6.150 473 H ILE 55 H ILE 55 7.155 -1.799 -3.787 474 HA ILE 55 HA ILE 55 7.229 -1.805 -0.856 475 HB ILE 55 HB ILE 55 4.873 -1.528 -0.865 476 HG12 ILE 55 HG12 ILE 55 4.865 -1.980 -3.867 477 HG13 ILE 55 HG13 ILE 55 4.215 -3.096 -2.662 478 HG21 ILE 55 HG21 ILE 55 5.835 0.226 -3.142 479 HG22 ILE 55 HG22 ILE 55 4.720 0.607 -1.796 480 HG23 ILE 55 HG23 ILE 55 6.432 0.377 -1.484 481 HD11 ILE 55 HD11 ILE 55 3.197 -0.306 -3.266 482 HD12 ILE 55 HD12 ILE 55 2.401 -1.832 -3.628 483 HD13 ILE 55 HD13 ILE 55 2.608 -1.337 -1.934 484 H THR 56 H THR 56 6.040 -3.277 0.493 485 HA THR 56 HA THR 56 5.557 -6.001 -0.622 486 HB THR 56 HB THR 56 6.250 -6.668 1.857 487 HG1 THR 56 HG1 THR 56 8.199 -5.384 2.308 488 HG21 THR 56 HG21 THR 56 8.347 -5.960 -0.248 489 HG22 THR 56 HG22 THR 56 8.548 -7.125 1.085 490 HG23 THR 56 HG23 THR 56 7.394 -7.460 -0.215 491 H ALA 57 H ALA 57 3.735 -7.063 0.181 492 HA ALA 57 HA ALA 57 1.601 -5.516 1.256 493 HB1 ALA 57 HB1 ALA 57 2.006 -8.540 1.132 494 HB2 ALA 57 HB2 ALA 57 0.468 -7.692 1.405 495 HB3 ALA 57 HB3 ALA 57 1.301 -7.531 -0.154 496 H ILE 58 H ILE 58 4.161 -7.355 2.783 497 HA ILE 58 HA ILE 58 3.112 -7.584 5.461 498 HB ILE 58 HB ILE 58 5.922 -7.453 4.275 499 HG12 ILE 58 HG12 ILE 58 6.056 -9.832 5.047 500 HG13 ILE 58 HG13 ILE 58 4.379 -9.763 5.578 501 HG21 ILE 58 HG21 ILE 58 5.101 -7.856 7.193 502 HG22 ILE 58 HG22 ILE 58 6.723 -8.220 6.555 503 HG23 ILE 58 HG23 ILE 58 6.127 -6.564 6.540 504 HD11 ILE 58 HD11 ILE 58 5.270 -9.405 2.679 505 HD12 ILE 58 HD12 ILE 58 4.776 -10.948 3.401 506 HD13 ILE 58 HD13 ILE 58 3.602 -9.637 3.277 507 H THR 59 H THR 59 5.195 -5.156 3.836 508 HA THR 59 HA THR 59 5.292 -3.396 6.135 509 HB THR 59 HB THR 59 6.047 -3.012 3.225 510 HG1 THR 59 HG1 THR 59 7.623 -4.175 3.782 511 HG21 THR 59 HG21 THR 59 6.751 -1.363 5.695 512 HG22 THR 59 HG22 THR 59 7.545 -1.226 4.105 513 HG23 THR 59 HG23 THR 59 5.831 -0.812 4.271 514 H LEU 60 H LEU 60 3.478 -3.350 3.014 515 HA LEU 60 HA LEU 60 2.078 -0.957 3.520 516 HB2 LEU 60 HB2 LEU 60 2.373 -2.245 1.328 517 HB3 LEU 60 HB3 LEU 60 1.145 -3.354 1.892 518 HG LEU 60 HG LEU 60 -0.442 -1.348 2.048 519 HD11 LEU 60 HD11 LEU 60 1.801 -0.032 0.451 520 HD12 LEU 60 HD12 LEU 60 0.217 0.665 0.797 521 HD13 LEU 60 HD13 LEU 60 1.335 0.419 2.115 522 HD21 LEU 60 HD21 LEU 60 -0.498 -2.891 0.121 523 HD22 LEU 60 HD22 LEU 60 -0.790 -1.225 -0.404 524 HD23 LEU 60 HD23 LEU 60 0.794 -1.976 -0.666 525 H SER 61 H SER 61 1.283 -4.311 4.506 526 HA SER 61 HA SER 61 -1.164 -3.872 5.790 527 HB2 SER 61 HB2 SER 61 -0.210 -6.074 5.504 528 HB3 SER 61 HB3 SER 61 1.112 -5.671 6.614 529 HG SER 61 HG SER 61 -0.440 -6.816 7.728 530 H LYS 62 H LYS 62 1.955 -2.887 6.718 531 HA LYS 62 HA LYS 62 1.079 -2.114 9.429 532 HB2 LYS 62 HB2 LYS 62 3.869 -2.524 8.304 533 HB3 LYS 62 HB3 LYS 62 3.534 -1.951 9.943 534 HG2 LYS 62 HG2 LYS 62 2.256 -4.000 10.443 535 HG3 LYS 62 HG3 LYS 62 2.538 -4.603 8.803 536 HD2 LYS 62 HD2 LYS 62 5.009 -4.451 9.230 537 HD3 LYS 62 HD3 LYS 62 4.653 -4.055 10.918 538 HE2 LYS 62 HE2 LYS 62 3.793 -6.602 9.454 539 HE3 LYS 62 HE3 LYS 62 5.210 -6.475 10.499 540 HZ1 LYS 62 HZ1 LYS 62 2.403 -6.094 11.395 541 HZ2 LYS 62 HZ2 LYS 62 3.341 -7.388 11.718 542 HZ3 LYS 62 HZ3 LYS 62 3.719 -5.936 12.355 543 H LYS 63 H LYS 63 2.125 -0.600 6.419 544 HA LYS 63 HA LYS 63 2.672 2.039 7.431 545 HB2 LYS 63 HB2 LYS 63 1.697 0.899 4.788 546 HB3 LYS 63 HB3 LYS 63 2.019 2.619 4.987 547 HG2 LYS 63 HG2 LYS 63 4.142 0.492 5.493 548 HG3 LYS 63 HG3 LYS 63 3.831 1.191 3.912 549 HD2 LYS 63 HD2 LYS 63 4.308 3.468 4.893 550 HD3 LYS 63 HD3 LYS 63 4.771 2.647 6.408 551 HE2 LYS 63 HE2 LYS 63 6.485 1.345 5.169 552 HE3 LYS 63 HE3 LYS 63 6.015 2.154 3.665 553 HZ1 LYS 63 HZ1 LYS 63 7.149 3.523 6.052 554 HZ2 LYS 63 HZ2 LYS 63 7.960 3.207 4.673 555 HZ3 LYS 63 HZ3 LYS 63 6.719 4.266 4.660 556 H LEU 64 H LEU 64 -0.300 0.406 6.462 557 HA LEU 64 HA LEU 64 -1.922 2.824 7.149 558 HB2 LEU 64 HB2 LEU 64 -2.503 0.479 5.315 559 HB3 LEU 64 HB3 LEU 64 -3.576 1.843 5.597 560 HG LEU 64 HG LEU 64 -1.052 2.982 4.868 561 HD11 LEU 64 HD11 LEU 64 -1.900 0.815 2.907 562 HD12 LEU 64 HD12 LEU 64 -0.634 2.044 2.664 563 HD13 LEU 64 HD13 LEU 64 -0.434 0.792 3.899 564 HD21 LEU 64 HD21 LEU 64 -3.241 3.920 4.401 565 HD22 LEU 64 HD22 LEU 64 -2.227 3.816 2.959 566 HD23 LEU 64 HD23 LEU 64 -3.552 2.646 3.191 567 H ASN 65 H ASN 65 -1.103 0.079 8.699 568 HA ASN 65 HA ASN 65 -1.970 -1.294 10.262 569 HB2 ASN 65 HB2 ASN 65 -4.038 0.847 10.844 570 HB3 ASN 65 HB3 ASN 65 -3.397 -0.361 11.946 571 HD21 ASN 65 HD21 ASN 65 -1.437 3.154 11.428 572 HD22 ASN 65 HD22 ASN 65 -2.904 2.778 10.529 573 H ILE 66 H ILE 66 -2.647 -2.188 7.933 574 HA ILE 66 HA ILE 66 -5.544 -2.956 7.979 575 HB ILE 66 HB ILE 66 -5.267 -3.412 5.553 576 HG12 ILE 66 HG12 ILE 66 -2.538 -2.092 5.906 577 HG13 ILE 66 HG13 ILE 66 -3.001 -3.636 5.187 578 HG21 ILE 66 HG21 ILE 66 -4.921 -0.530 6.358 579 HG22 ILE 66 HG22 ILE 66 -5.719 -1.174 4.900 580 HG23 ILE 66 HG23 ILE 66 -6.420 -1.491 6.482 581 HD11 ILE 66 HD11 ILE 66 -3.622 -0.921 3.984 582 HD12 ILE 66 HD12 ILE 66 -2.326 -2.012 3.500 583 HD13 ILE 66 HD13 ILE 66 -4.027 -2.503 3.278 584 H THR 67 H THR 67 -5.438 -5.141 6.276 585 HA THR 67 HA THR 67 -3.790 -7.119 7.761 586 HB THR 67 HB THR 67 -5.202 -8.794 7.242 587 HG1 THR 67 HG1 THR 67 -6.618 -8.752 5.457 588 HG21 THR 67 HG21 THR 67 -7.250 -6.565 6.858 589 HG22 THR 67 HG22 THR 67 -7.528 -8.207 7.470 590 HG23 THR 67 HG23 THR 67 -6.608 -7.054 8.452 591 H VAL 68 H VAL 68 -2.580 -8.730 6.500 592 HA VAL 68 HA VAL 68 -1.051 -7.647 4.312 593 HB VAL 68 HB VAL 68 -1.467 -10.537 5.170 594 HG11 VAL 68 HG11 VAL 68 0.673 -9.325 3.361 595 HG12 VAL 68 HG12 VAL 68 0.693 -10.979 4.009 596 HG13 VAL 68 HG13 VAL 68 -0.564 -10.506 2.868 597 HG21 VAL 68 HG21 VAL 68 -0.439 -9.159 6.946 598 HG22 VAL 68 HG22 VAL 68 0.753 -10.259 6.255 599 HG23 VAL 68 HG23 VAL 68 0.765 -8.544 5.789 600 H GLU 69 H GLU 69 -4.207 -9.242 4.356 601 HA GLU 69 HA GLU 69 -4.030 -9.945 1.481 602 HB2 GLU 69 HB2 GLU 69 -6.260 -10.327 3.516 603 HB3 GLU 69 HB3 GLU 69 -6.295 -10.861 1.827 604 HG2 GLU 69 HG2 GLU 69 -4.250 -12.247 2.251 605 HG3 GLU 69 HG3 GLU 69 -4.321 -11.803 3.957 606 H LYS 70 H LYS 70 -5.471 -7.482 3.642 607 HA LYS 70 HA LYS 70 -7.028 -6.250 1.577 608 HB2 LYS 70 HB2 LYS 70 -7.228 -6.087 4.187 609 HB3 LYS 70 HB3 LYS 70 -6.024 -4.803 4.008 610 HG2 LYS 70 HG2 LYS 70 -7.861 -4.220 1.978 611 HG3 LYS 70 HG3 LYS 70 -8.893 -4.926 3.241 612 HD2 LYS 70 HD2 LYS 70 -7.968 -3.267 4.851 613 HD3 LYS 70 HD3 LYS 70 -6.973 -2.600 3.523 614 HE2 LYS 70 HE2 LYS 70 -9.003 -2.033 2.247 615 HE3 LYS 70 HE3 LYS 70 -10.022 -2.764 3.494 616 HZ1 LYS 70 HZ1 LYS 70 -8.302 -0.367 3.877 617 HZ2 LYS 70 HZ2 LYS 70 -9.920 -0.353 3.718 618 HZ3 LYS 70 HZ3 LYS 70 -9.247 -1.037 5.038 619 H ALA 71 H ALA 71 -3.826 -5.698 2.941 620 HA ALA 71 HA ALA 71 -2.928 -3.545 1.311 621 HB1 ALA 71 HB1 ALA 71 -1.435 -5.884 2.605 622 HB2 ALA 71 HB2 ALA 71 -0.683 -4.429 1.960 623 HB3 ALA 71 HB3 ALA 71 -1.769 -4.315 3.351 624 H LYS 72 H LYS 72 -2.707 -7.117 0.784 625 HA LYS 72 HA LYS 72 -1.122 -6.839 -1.589 626 HB2 LYS 72 HB2 LYS 72 -0.972 -8.750 -0.046 627 HB3 LYS 72 HB3 LYS 72 -2.641 -9.213 -0.395 628 HG2 LYS 72 HG2 LYS 72 -2.082 -9.805 -2.649 629 HG3 LYS 72 HG3 LYS 72 -0.455 -9.113 -2.510 630 HD2 LYS 72 HD2 LYS 72 -1.438 -11.417 -0.758 631 HD3 LYS 72 HD3 LYS 72 -0.652 -11.661 -2.333 632 HE2 LYS 72 HE2 LYS 72 1.335 -10.381 -1.510 633 HE3 LYS 72 HE3 LYS 72 0.575 -10.253 0.083 634 HZ1 LYS 72 HZ1 LYS 72 1.308 -12.799 -1.266 635 HZ2 LYS 72 HZ2 LYS 72 2.108 -12.134 -0.013 636 HZ3 LYS 72 HZ3 LYS 72 0.592 -12.700 0.200 637 H ASN 73 H ASN 73 -4.615 -7.070 -1.010 638 HA ASN 73 HA ASN 73 -5.459 -7.673 -3.558 639 HB2 ASN 73 HB2 ASN 73 -7.510 -7.081 -2.838 640 HB3 ASN 73 HB3 ASN 73 -6.758 -6.753 -1.294 641 HD21 ASN 73 HD21 ASN 73 -7.564 -3.313 -1.542 642 HD22 ASN 73 HD22 ASN 73 -6.948 -4.595 -0.535 643 H TYR 74 H TYR 74 -4.365 -4.488 -2.396 644 HA TYR 74 HA TYR 74 -4.921 -3.014 -4.727 645 HB2 TYR 74 HB2 TYR 74 -2.684 -2.577 -2.714 646 HB3 TYR 74 HB3 TYR 74 -3.389 -1.354 -3.765 647 HD1 TYR 74 HD1 TYR 74 -3.042 -1.917 -0.571 648 HD2 TYR 74 HD2 TYR 74 -6.361 -1.773 -3.354 649 HE1 TYR 74 HE1 TYR 74 -4.531 -1.073 1.237 650 HE2 TYR 74 HE2 TYR 74 -7.838 -0.940 -1.520 651 HH TYR 74 HH TYR 74 -6.624 -0.414 1.805 652 H ILE 75 H ILE 75 -1.958 -4.725 -3.677 653 HA ILE 75 HA ILE 75 -0.281 -3.929 -5.857 654 HB ILE 75 HB ILE 75 -0.044 -6.361 -4.028 655 HG12 ILE 75 HG12 ILE 75 0.976 -3.515 -3.616 656 HG13 ILE 75 HG13 ILE 75 -0.324 -4.266 -2.711 657 HG21 ILE 75 HG21 ILE 75 2.097 -4.808 -5.562 658 HG22 ILE 75 HG22 ILE 75 2.389 -6.189 -4.483 659 HG23 ILE 75 HG23 ILE 75 1.506 -6.433 -5.973 660 HD11 ILE 75 HD11 ILE 75 2.596 -5.028 -2.567 661 HD12 ILE 75 HD12 ILE 75 1.564 -4.333 -1.308 662 HD13 ILE 75 HD13 ILE 75 1.270 -5.992 -1.868 663 H LYS 76 H LYS 76 -2.603 -6.577 -5.506 664 HA LYS 76 HA LYS 76 -1.869 -7.975 -7.992 665 HB2 LYS 76 HB2 LYS 76 -4.189 -8.238 -6.116 666 HB3 LYS 76 HB3 LYS 76 -3.751 -9.344 -7.445 667 HG2 LYS 76 HG2 LYS 76 -1.929 -8.804 -5.082 668 HG3 LYS 76 HG3 LYS 76 -3.122 -10.080 -5.095 669 HD2 LYS 76 HD2 LYS 76 -0.928 -9.883 -7.208 670 HD3 LYS 76 HD3 LYS 76 -0.668 -10.625 -5.627 671 HE2 LYS 76 HE2 LYS 76 -2.581 -12.169 -6.043 672 HE3 LYS 76 HE3 LYS 76 -2.736 -11.504 -7.678 673 HZ1 LYS 76 HZ1 LYS 76 -0.293 -12.841 -6.608 674 HZ2 LYS 76 HZ2 LYS 76 -1.354 -13.537 -7.629 675 HZ3 LYS 76 HZ3 LYS 76 -0.458 -12.268 -8.128 676 H ASN 77 H ASN 77 -3.884 -5.241 -7.194 677 HA ASN 77 HA ASN 77 -5.526 -5.490 -9.650 678 HB2 ASN 77 HB2 ASN 77 -5.660 -3.852 -7.061 679 HB3 ASN 77 HB3 ASN 77 -6.737 -3.564 -8.420 680 HD21 ASN 77 HD21 ASN 77 -8.356 -5.918 -6.051 681 HD22 ASN 77 HD22 ASN 77 -7.346 -4.539 -5.620 682 H SER 78 H SER 78 -3.984 -2.930 -7.821 683 HA SER 78 HA SER 78 -3.357 -1.371 -10.265 684 HB2 SER 78 HB2 SER 78 -3.296 -0.618 -7.319 685 HB3 SER 78 HB3 SER 78 -2.894 0.472 -8.663 686 HG SER 78 HG SER 78 -5.087 0.694 -8.001 687 H ASN 79 H ASN 79 -1.477 -2.140 -11.131 688 HA ASN 79 HA ASN 79 0.980 -1.980 -9.463 689 HB2 ASN 79 HB2 ASN 79 1.723 -4.191 -10.515 690 HB3 ASN 79 HB3 ASN 79 0.593 -4.184 -9.172 691 HD21 ASN 79 HD21 ASN 79 -1.522 -6.341 -10.910 692 HD22 ASN 79 HD22 ASN 79 -0.624 -5.956 -9.437 693 H ARG 80 H ARG 80 0.432 -2.995 -12.880 694 HA ARG 80 HA ARG 80 2.695 -1.429 -13.807 695 HB2 ARG 80 HB2 ARG 80 0.385 -2.815 -15.234 696 HB3 ARG 80 HB3 ARG 80 1.546 -1.827 -16.099 697 HG2 ARG 80 HG2 ARG 80 2.309 -4.032 -16.336 698 HG3 ARG 80 HG3 ARG 80 3.420 -3.219 -15.246 699 HD2 ARG 80 HD2 ARG 80 3.030 -5.486 -14.476 700 HD3 ARG 80 HD3 ARG 80 2.363 -4.358 -13.308 701 HE ARG 80 HE ARG 80 0.231 -5.161 -13.726 702 HH11 ARG 80 HH11 ARG 80 -1.323 -6.453 -14.546 703 HH12 ARG 80 HH12 ARG 80 -0.991 -7.491 -15.903 704 HH21 ARG 80 HH21 ARG 80 2.264 -6.462 -16.280 705 HH22 ARG 80 HH22 ARG 80 0.991 -7.495 -16.869 706 H LEU 81 H LEU 81 -0.646 -0.619 -13.369 707 HA LEU 81 HA LEU 81 -0.407 2.012 -14.685 708 HB2 LEU 81 HB2 LEU 81 -2.359 0.352 -14.885 709 HB3 LEU 81 HB3 LEU 81 -2.761 0.766 -13.232 710 HG LEU 81 HG LEU 81 -2.511 3.266 -14.649 711 HD11 LEU 81 HD11 LEU 81 -4.202 1.265 -16.188 712 HD12 LEU 81 HD12 LEU 81 -4.100 3.018 -16.472 713 HD13 LEU 81 HD13 LEU 81 -2.679 1.995 -16.747 714 HD21 LEU 81 HD21 LEU 81 -4.066 2.780 -12.785 715 HD22 LEU 81 HD22 LEU 81 -4.920 3.443 -14.191 716 HD23 LEU 81 HD23 LEU 81 -5.000 1.698 -13.843 717 H GLY 82 H GLY 82 0.594 0.957 -11.708 718 HA2 GLY 82 HA2 GLY 82 -0.679 2.814 -9.922 719 HA3 GLY 82 HA3 GLY 82 0.763 1.844 -9.606 720 H ARG 83 H ARG 83 1.962 3.239 -12.086 721 HA ARG 83 HA ARG 83 2.232 6.057 -11.323 722 HB2 ARG 83 HB2 ARG 83 4.114 4.509 -10.198 723 HB3 ARG 83 HB3 ARG 83 4.838 4.619 -11.817 724 HG2 ARG 83 HG2 ARG 83 5.028 6.995 -11.665 725 HG3 ARG 83 HG3 ARG 83 4.021 7.069 -10.208 726 HD2 ARG 83 HD2 ARG 83 5.722 6.070 -8.854 727 HD3 ARG 83 HD3 ARG 83 6.590 5.462 -10.263 728 HE ARG 83 HE ARG 83 7.748 7.406 -10.421 729 HH11 ARG 83 HH11 ARG 83 8.445 9.434 -9.939 730 HH12 ARG 83 HH12 ARG 83 7.469 10.485 -8.957 731 HH21 ARG 83 HH21 ARG 83 4.901 8.253 -8.549 732 HH22 ARG 83 HH22 ARG 83 5.514 9.849 -8.206 733 H THR 84 H THR 84 3.392 7.245 -13.046 734 HA THR 84 HA THR 84 2.324 6.927 -15.578 735 HB THR 84 HB THR 84 3.202 8.975 -14.751 736 HG1 THR 84 HG1 THR 84 4.216 9.645 -16.638 737 HG21 THR 84 HG21 THR 84 6.066 8.131 -15.270 738 HG22 THR 84 HG22 THR 84 5.448 9.563 -14.427 739 HG23 THR 84 HG23 THR 84 5.337 7.966 -13.665 740 H ASN 85 H ASN 85 2.442 5.241 -16.864 741 HA ASN 85 HA ASN 85 5.007 4.341 -18.006 742 HB2 ASN 85 HB2 ASN 85 3.064 2.507 -16.520 743 HB3 ASN 85 HB3 ASN 85 4.220 1.916 -17.704 744 HD21 ASN 85 HD21 ASN 85 5.520 2.775 -13.967 745 HD22 ASN 85 HD22 ASN 85 3.861 3.146 -14.450 746 H ASN 86 H ASN 86 4.781 3.864 -20.141 747 HA ASN 86 HA ASN 86 2.295 2.788 -21.239 748 HB2 ASN 86 HB2 ASN 86 1.887 5.253 -21.322 749 HB3 ASN 86 HB3 ASN 86 3.352 5.463 -22.278 750 HD21 ASN 86 HD21 ASN 86 1.857 4.082 -25.267 751 HD22 ASN 86 HD22 ASN 86 3.393 4.270 -24.422 752 H LEU 87 H LEU 87 3.619 0.959 -21.595 753 HA LEU 87 HA LEU 87 5.387 1.135 -23.949 754 HB2 LEU 87 HB2 LEU 87 6.492 1.306 -21.441 755 HB3 LEU 87 HB3 LEU 87 6.447 -0.427 -21.585 756 HG LEU 87 HG LEU 87 8.611 0.565 -22.129 757 HD11 LEU 87 HD11 LEU 87 7.407 -0.634 -24.641 758 HD12 LEU 87 HD12 LEU 87 9.129 -0.521 -24.235 759 HD13 LEU 87 HD13 LEU 87 8.054 -1.539 -23.260 760 HD21 LEU 87 HD21 LEU 87 7.788 2.723 -23.051 761 HD22 LEU 87 HD22 LEU 87 9.035 1.950 -24.046 762 HD23 LEU 87 HD23 LEU 87 7.338 1.886 -24.552 763 H LYS 88 H LYS 88 2.772 0.133 -23.575 764 HA LYS 88 HA LYS 88 3.010 -2.805 -24.040 765 HB2 LYS 88 HB2 LYS 88 1.329 -1.952 -22.440 766 HB3 LYS 88 HB3 LYS 88 0.574 -0.989 -23.720 767 HG2 LYS 88 HG2 LYS 88 -0.066 -2.984 -24.933 768 HG3 LYS 88 HG3 LYS 88 0.894 -4.012 -23.839 769 HD2 LYS 88 HD2 LYS 88 -0.603 -3.368 -21.954 770 HD3 LYS 88 HD3 LYS 88 -1.578 -2.390 -23.075 771 HE2 LYS 88 HE2 LYS 88 -2.059 -4.417 -24.424 772 HE3 LYS 88 HE3 LYS 88 -1.066 -5.391 -23.333 773 HZ1 LYS 88 HZ1 LYS 88 -3.548 -3.954 -22.548 774 HZ2 LYS 88 HZ2 LYS 88 -3.419 -5.564 -22.770 775 HZ3 LYS 88 HZ3 LYS 88 -2.627 -4.849 -21.538 776 H THR 89 H THR 89 2.668 0.203 -25.719 777 HA THR 89 HA THR 89 2.886 -1.019 -28.301 778 HB THR 89 HB THR 89 0.467 -1.227 -28.048 779 HG1 THR 89 HG1 THR 89 -0.063 -0.088 -29.904 780 HG21 THR 89 HG21 THR 89 0.328 1.804 -27.791 781 HG22 THR 89 HG22 THR 89 -1.022 0.643 -27.769 782 HG23 THR 89 HG23 THR 89 0.133 0.684 -26.422 783 H ILE 90 H ILE 90 4.227 0.222 -29.333 784 HA ILE 90 HA ILE 90 4.187 3.169 -29.105 785 HB ILE 90 HB ILE 90 6.763 2.949 -29.102 786 HG12 ILE 90 HG12 ILE 90 6.868 0.474 -29.427 787 HG13 ILE 90 HG13 ILE 90 7.918 1.212 -28.237 788 HG21 ILE 90 HG21 ILE 90 5.255 2.393 -26.536 789 HG22 ILE 90 HG22 ILE 90 6.889 3.073 -26.686 790 HG23 ILE 90 HG23 ILE 90 5.497 3.970 -27.306 791 HD11 ILE 90 HD11 ILE 90 5.470 -0.488 -27.623 792 HD12 ILE 90 HD12 ILE 90 7.168 -0.874 -27.364 793 HD13 ILE 90 HD13 ILE 90 6.408 0.402 -26.407 794 H GLY 91 H GLY 91 3.828 0.814 -31.281 795 HA2 GLY 91 HA2 GLY 91 4.160 0.618 -33.556 796 HA3 GLY 91 HA3 GLY 91 4.793 2.266 -33.588 797 H ILE 92 H ILE 92 6.513 0.339 -31.391 798 HA ILE 92 HA ILE 92 8.621 -0.473 -31.299 799 HB ILE 92 HB ILE 92 7.892 -1.955 -33.842 800 HG12 ILE 92 HG12 ILE 92 7.271 -3.745 -31.941 801 HG13 ILE 92 HG13 ILE 92 6.976 -2.319 -30.966 802 HG21 ILE 92 HG21 ILE 92 9.710 -2.685 -31.491 803 HG22 ILE 92 HG22 ILE 92 9.285 -3.762 -32.842 804 HG23 ILE 92 HG23 ILE 92 10.243 -2.342 -33.147 805 HD11 ILE 92 HD11 ILE 92 5.657 -2.925 -33.659 806 HD12 ILE 92 HD12 ILE 92 4.964 -3.315 -32.074 807 HD13 ILE 92 HD13 ILE 92 5.191 -1.629 -32.530 808 H LEU 93 H LEU 93 8.610 2.052 -32.202 809 HA LEU 93 HA LEU 93 9.678 3.703 -33.252 810 HB2 LEU 93 HB2 LEU 93 11.348 2.599 -31.670 811 HB3 LEU 93 HB3 LEU 93 12.118 1.916 -33.096 812 HG LEU 93 HG LEU 93 12.647 4.231 -33.896 813 HD11 LEU 93 HD11 LEU 93 11.376 5.103 -31.264 814 HD12 LEU 93 HD12 LEU 93 12.372 6.132 -32.317 815 HD13 LEU 93 HD13 LEU 93 10.822 5.532 -32.901 816 HD21 LEU 93 HD21 LEU 93 14.235 2.992 -32.477 817 HD22 LEU 93 HD22 LEU 93 14.324 4.737 -32.197 818 HD23 LEU 93 HD23 LEU 93 13.489 3.694 -31.024 819 H GLN 94 H GLN 94 8.454 1.789 -35.080 820 HA GLN 94 HA GLN 94 10.063 2.168 -37.574 821 HB2 GLN 94 HB2 GLN 94 8.342 -0.081 -36.534 822 HB3 GLN 94 HB3 GLN 94 8.507 0.172 -38.286 823 HG2 GLN 94 HG2 GLN 94 10.902 -0.049 -38.200 824 HG3 GLN 94 HG3 GLN 94 10.914 -0.012 -36.438 825 HE21 GLN 94 HE21 GLN 94 10.172 -3.454 -36.058 826 HE22 GLN 94 HE22 GLN 94 10.353 -1.888 -35.256 827 H GLU 95 H GLU 95 9.391 4.192 -37.947 828 HA GLU 95 HA GLU 95 6.678 4.529 -39.118 829 HB2 GLU 95 HB2 GLU 95 6.742 5.535 -36.839 830 HB3 GLU 95 HB3 GLU 95 8.116 6.534 -37.321 831 HG2 GLU 95 HG2 GLU 95 6.725 7.696 -38.983 832 HG3 GLU 95 HG3 GLU 95 5.372 6.611 -38.648 833 H GLU 96 H GLU 96 6.624 5.961 -40.932 834 HA GLU 96 HA GLU 96 9.235 6.814 -42.073 835 HB2 GLU 96 HB2 GLU 96 8.664 4.551 -42.926 836 HB3 GLU 96 HB3 GLU 96 7.127 5.177 -43.537 837 HG2 GLU 96 HG2 GLU 96 8.332 6.716 -45.042 838 HG3 GLU 96 HG3 GLU 96 9.879 6.202 -44.361 839 H VAL 97 H VAL 97 9.210 8.791 -42.574 840 HA VAL 97 HA VAL 97 6.774 10.101 -43.667 841 HB VAL 97 HB VAL 97 8.638 11.307 -41.578 842 HG11 VAL 97 HG11 VAL 97 6.206 12.475 -42.999 843 HG12 VAL 97 HG12 VAL 97 7.037 13.216 -41.612 844 HG13 VAL 97 HG13 VAL 97 7.886 13.027 -43.146 845 HG21 VAL 97 HG21 VAL 97 7.117 9.752 -40.496 846 HG22 VAL 97 HG22 VAL 97 6.603 11.402 -40.146 847 HG23 VAL 97 HG23 VAL 97 5.730 10.442 -41.362 848 H SER 98 H SER 98 7.328 10.491 -45.719 849 HA SER 98 HA SER 98 9.245 12.545 -46.236 850 HB2 SER 98 HB2 SER 98 10.876 10.705 -46.168 851 HB3 SER 98 HB3 SER 98 9.992 9.850 -47.437 852 HG SER 98 HG SER 98 11.764 11.110 -48.242 853 H SER 99 H SER 99 8.322 9.964 -48.542 854 HA SER 99 HA SER 99 7.142 12.003 -50.297 855 HB2 SER 99 HB2 SER 99 7.670 9.051 -50.767 856 HB3 SER 99 HB3 SER 99 7.221 10.252 -51.993 857 HG SER 99 HG SER 99 9.487 9.884 -51.909 858 H MET 100 H MET 100 5.942 9.333 -48.353 859 HA MET 100 HA MET 100 3.139 9.938 -49.171 860 HB2 MET 100 HB2 MET 100 4.361 7.150 -48.990 861 HB3 MET 100 HB3 MET 100 2.637 7.510 -49.158 862 HG2 MET 100 HG2 MET 100 3.096 8.647 -51.320 863 HG3 MET 100 HG3 MET 100 4.806 8.225 -51.166 864 HE1 MET 100 HE1 MET 100 4.901 7.140 -53.518 865 HE2 MET 100 HE2 MET 100 3.737 5.937 -54.112 866 HE3 MET 100 HE3 MET 100 3.201 7.597 -53.772 867 H GLU 101 H GLU 101 2.301 10.734 -47.359 868 HA GLU 101 HA GLU 101 2.433 9.172 -44.845 869 HB2 GLU 101 HB2 GLU 101 4.286 10.944 -44.939 870 HB3 GLU 101 HB3 GLU 101 3.027 12.159 -44.820 871 HG2 GLU 101 HG2 GLU 101 3.580 9.902 -42.832 872 HG3 GLU 101 HG3 GLU 101 4.107 11.568 -42.659 873 H ALA 102 H ALA 102 0.274 8.614 -45.336 874 HA ALA 102 HA ALA 102 -1.759 10.591 -44.594 875 HB1 ALA 102 HB1 ALA 102 -1.789 9.235 -47.335 876 HB2 ALA 102 HB2 ALA 102 -3.087 10.244 -46.660 877 HB3 ALA 102 HB3 ALA 102 -1.515 10.965 -47.035 878 H LYS 103 H LYS 103 -3.868 9.649 -44.295 879 HA LYS 103 HA LYS 103 -3.960 6.674 -43.865 880 HB2 LYS 103 HB2 LYS 103 -4.956 8.963 -42.153 881 HB3 LYS 103 HB3 LYS 103 -5.795 7.420 -42.108 882 HG2 LYS 103 HG2 LYS 103 -2.792 7.611 -41.636 883 HG3 LYS 103 HG3 LYS 103 -3.984 7.831 -40.346 884 HD2 LYS 103 HD2 LYS 103 -4.939 5.584 -40.834 885 HD3 LYS 103 HD3 LYS 103 -3.691 5.332 -42.074 886 HE2 LYS 103 HE2 LYS 103 -1.918 5.529 -40.405 887 HE3 LYS 103 HE3 LYS 103 -3.092 5.918 -39.140 888 HZ1 LYS 103 HZ1 LYS 103 -2.969 3.338 -40.610 889 HZ2 LYS 103 HZ2 LYS 103 -2.465 3.576 -39.076 890 HZ3 LYS 103 HZ3 LYS 103 -4.052 3.699 -39.436 891 H SER 104 H SER 104 -6.281 9.367 -44.120 892 HA SER 104 HA SER 104 -7.705 8.019 -46.358 893 HB2 SER 104 HB2 SER 104 -9.041 8.950 -43.782 894 HB3 SER 104 HB3 SER 104 -9.876 8.385 -45.241 895 HG SER 104 HG SER 104 -9.654 6.730 -43.660 896 H MET 105 H MET 105 -8.816 9.432 -47.717 897 HA MET 105 HA MET 105 -9.100 12.278 -47.073 898 HB2 MET 105 HB2 MET 105 -6.683 11.780 -47.972 899 HB3 MET 105 HB3 MET 105 -7.474 11.567 -49.539 900 HG2 MET 105 HG2 MET 105 -8.294 13.837 -49.502 901 HG3 MET 105 HG3 MET 105 -7.811 14.058 -47.819 902 HE1 MET 105 HE1 MET 105 -4.849 13.048 -47.528 903 HE2 MET 105 HE2 MET 105 -3.990 14.544 -47.935 904 HE3 MET 105 HE3 MET 105 -5.479 14.614 -46.968 905 H THR 106 H THR 106 -10.429 13.411 -48.543 906 HA THR 106 HA THR 106 -12.079 11.744 -50.394 907 HB THR 106 HB THR 106 -12.682 14.527 -49.401 908 HG1 THR 106 HG1 THR 106 -13.994 13.549 -47.863 909 HG21 THR 106 HG21 THR 106 -14.442 12.332 -50.581 910 HG22 THR 106 HG22 THR 106 -15.045 13.858 -49.893 911 HG23 THR 106 HG23 THR 106 -14.033 13.891 -51.336 912 H TRP 107 H TRP 107 -12.398 12.259 -52.428 913 HA TRP 107 HA TRP 107 -10.601 14.240 -53.710 914 HB2 TRP 107 HB2 TRP 107 -10.331 12.723 -55.575 915 HB3 TRP 107 HB3 TRP 107 -9.736 12.051 -54.068 916 HD1 TRP 107 HD1 TRP 107 -12.385 11.573 -56.705 917 HE1 TRP 107 HE1 TRP 107 -13.523 9.264 -56.437 918 HE3 TRP 107 HE3 TRP 107 -10.407 10.264 -52.199 919 HZ2 TRP 107 HZ2 TRP 107 -13.564 7.139 -54.465 920 HZ3 TRP 107 HZ3 TRP 107 -11.026 8.108 -51.113 921 HH2 TRP 107 HH2 TRP 107 -12.597 6.541 -52.238 Start of MODEL 24 1 H1 GLY -5 H1 GLY -5 -17.404 -52.225 -29.938 2 H2 GLY -5 H2 GLY -5 -18.592 -51.113 -29.753 3 H3 GLY -5 H3 GLY -5 -18.959 -52.624 -30.271 4 HA2 GLY -5 HA2 GLY -5 -19.598 -52.388 -27.970 5 HA3 GLY -5 HA3 GLY -5 -18.296 -53.577 -28.163 6 H SER -4 H SER -4 -17.659 -53.253 -25.974 7 HA SER -4 HA SER -4 -15.772 -51.017 -25.600 8 HB2 SER -4 HB2 SER -4 -17.957 -50.218 -24.671 9 HB3 SER -4 HB3 SER -4 -17.949 -51.597 -23.553 10 HG SER -4 HG SER -4 -17.062 -49.667 -22.630 11 H HIS -3 H HIS -3 -14.129 -51.470 -24.154 12 HA HIS -3 HA HIS -3 -13.994 -54.094 -22.778 13 HB2 HIS -3 HB2 HIS -3 -12.001 -53.148 -24.882 14 HB3 HIS -3 HB3 HIS -3 -11.712 -54.477 -23.762 15 HD2 HIS -3 HD2 HIS -3 -13.269 -56.719 -24.036 16 HE1 HIS -3 HE1 HIS -3 -14.483 -55.895 -28.042 17 HE2 HIS -3 HE2 HIS -3 -14.380 -57.677 -26.225 18 H MET -2 H MET -2 -12.454 -54.210 -21.129 19 HA MET -2 HA MET -2 -10.869 -51.836 -20.377 20 HB2 MET -2 HB2 MET -2 -13.082 -51.383 -19.401 21 HB3 MET -2 HB3 MET -2 -13.116 -52.986 -18.660 22 HG2 MET -2 HG2 MET -2 -11.217 -52.400 -17.230 23 HG3 MET -2 HG3 MET -2 -11.080 -50.818 -18.010 24 HE1 MET -2 HE1 MET -2 -10.973 -49.926 -15.462 25 HE2 MET -2 HE2 MET -2 -12.272 -50.202 -14.279 26 HE3 MET -2 HE3 MET -2 -11.276 -51.563 -14.840 27 H ALA -1 H ALA -1 -9.072 -52.300 -19.261 28 HA ALA -1 HA ALA -1 -8.377 -55.118 -18.876 29 HB1 ALA -1 HB1 ALA -1 -6.727 -52.580 -18.551 30 HB2 ALA -1 HB2 ALA -1 -6.106 -54.243 -18.503 31 HB3 ALA -1 HB3 ALA -1 -6.803 -53.605 -20.004 32 H SER 0 H SER 0 -7.577 -55.997 -16.914 33 HA SER 0 HA SER 0 -8.018 -54.525 -14.365 34 HB2 SER 0 HB2 SER 0 -10.122 -55.733 -14.879 35 HB3 SER 0 HB3 SER 0 -9.222 -57.257 -14.955 36 HG SER 0 HG SER 0 -10.174 -56.894 -12.890 37 H MET 1 H MET 1 -5.854 -54.448 -13.983 38 HA MET 1 HA MET 1 -4.442 -56.942 -13.304 39 HB2 MET 1 HB2 MET 1 -4.176 -56.369 -15.816 40 HB3 MET 1 HB3 MET 1 -3.147 -55.039 -15.291 41 HG2 MET 1 HG2 MET 1 -1.616 -56.635 -14.215 42 HG3 MET 1 HG3 MET 1 -2.717 -57.969 -14.544 43 HE1 MET 1 HE1 MET 1 -3.609 -57.833 -17.516 44 HE2 MET 1 HE2 MET 1 -2.277 -58.707 -18.297 45 HE3 MET 1 HE3 MET 1 -2.899 -59.262 -16.729 46 H ASP 2 H ASP 2 -5.436 -54.585 -11.811 47 HA ASP 2 HA ASP 2 -2.887 -53.610 -10.594 48 HB2 ASP 2 HB2 ASP 2 -5.410 -52.054 -11.267 49 HB3 ASP 2 HB3 ASP 2 -4.201 -51.470 -10.141 50 HA PRO 3 HA PRO 3 -4.663 -54.972 -6.782 51 HB2 PRO 3 HB2 PRO 3 -3.367 -53.480 -4.891 52 HB3 PRO 3 HB3 PRO 3 -2.516 -54.663 -5.931 53 HG2 PRO 3 HG2 PRO 3 -2.774 -51.665 -6.360 54 HG3 PRO 3 HG3 PRO 3 -1.280 -52.657 -6.380 55 HD2 PRO 3 HD2 PRO 3 -2.591 -51.996 -8.668 56 HD3 PRO 3 HD3 PRO 3 -1.820 -53.596 -8.474 57 H LEU 4 H LEU 4 -5.626 -52.125 -8.057 58 HA LEU 4 HA LEU 4 -7.480 -51.481 -5.823 59 HB2 LEU 4 HB2 LEU 4 -6.217 -49.607 -7.855 60 HB3 LEU 4 HB3 LEU 4 -7.411 -49.131 -6.652 61 HG LEU 4 HG LEU 4 -4.640 -50.195 -5.994 62 HD11 LEU 4 HD11 LEU 4 -5.797 -47.382 -5.843 63 HD12 LEU 4 HD12 LEU 4 -4.173 -47.883 -5.321 64 HD13 LEU 4 HD13 LEU 4 -4.611 -47.961 -7.034 65 HD21 LEU 4 HD21 LEU 4 -6.216 -50.709 -4.176 66 HD22 LEU 4 HD22 LEU 4 -5.154 -49.385 -3.699 67 HD23 LEU 4 HD23 LEU 4 -6.822 -49.035 -4.202 68 H ASP 5 H ASP 5 -8.055 -53.445 -7.821 69 HA ASP 5 HA ASP 5 -10.419 -52.200 -9.156 70 HB2 ASP 5 HB2 ASP 5 -8.899 -54.790 -9.583 71 HB3 ASP 5 HB3 ASP 5 -10.480 -54.521 -10.303 72 H LYS 6 H LYS 6 -9.924 -53.388 -6.246 73 HA LYS 6 HA LYS 6 -12.342 -55.178 -6.157 74 HB2 LYS 6 HB2 LYS 6 -10.053 -55.427 -4.193 75 HB3 LYS 6 HB3 LYS 6 -11.304 -56.576 -4.622 76 HG2 LYS 6 HG2 LYS 6 -9.687 -57.541 -5.866 77 HG3 LYS 6 HG3 LYS 6 -10.105 -56.308 -7.047 78 HD2 LYS 6 HD2 LYS 6 -7.727 -56.255 -6.895 79 HD3 LYS 6 HD3 LYS 6 -8.293 -54.836 -6.020 80 HE2 LYS 6 HE2 LYS 6 -6.534 -55.775 -4.731 81 HE3 LYS 6 HE3 LYS 6 -8.029 -56.098 -3.857 82 HZ1 LYS 6 HZ1 LYS 6 -6.601 -58.064 -5.580 83 HZ2 LYS 6 HZ2 LYS 6 -6.580 -58.055 -3.950 84 HZ3 LYS 6 HZ3 LYS 6 -7.968 -58.379 -4.738 85 H ILE 7 H ILE 7 -10.425 -53.197 -3.971 86 HA ILE 7 HA ILE 7 -12.866 -52.362 -2.463 87 HB ILE 7 HB ILE 7 -11.535 -52.613 -0.353 88 HG12 ILE 7 HG12 ILE 7 -9.695 -54.273 -0.320 89 HG13 ILE 7 HG13 ILE 7 -9.631 -54.265 -2.080 90 HG21 ILE 7 HG21 ILE 7 -12.004 -55.193 -1.892 91 HG22 ILE 7 HG22 ILE 7 -11.994 -54.971 -0.134 92 HG23 ILE 7 HG23 ILE 7 -13.264 -54.218 -1.105 93 HD11 ILE 7 HD11 ILE 7 -9.079 -51.837 -0.320 94 HD12 ILE 7 HD12 ILE 7 -7.841 -52.922 -0.982 95 HD13 ILE 7 HD13 ILE 7 -8.829 -51.956 -2.084 96 H ILE 8 H ILE 8 -10.947 -51.093 -4.458 97 HA ILE 8 HA ILE 8 -9.374 -49.092 -3.559 98 HB ILE 8 HB ILE 8 -9.806 -49.563 -5.891 99 HG12 ILE 8 HG12 ILE 8 -10.210 -46.613 -5.234 100 HG13 ILE 8 HG13 ILE 8 -8.671 -47.473 -5.275 101 HG21 ILE 8 HG21 ILE 8 -12.379 -47.943 -5.749 102 HG22 ILE 8 HG22 ILE 8 -11.706 -48.799 -7.144 103 HG23 ILE 8 HG23 ILE 8 -12.325 -49.720 -5.784 104 HD11 ILE 8 HD11 ILE 8 -10.502 -46.864 -7.632 105 HD12 ILE 8 HD12 ILE 8 -8.912 -46.171 -7.286 106 HD13 ILE 8 HD13 ILE 8 -9.046 -47.877 -7.741 107 H ASN 9 H ASN 9 -12.867 -48.804 -3.389 108 HA ASN 9 HA ASN 9 -12.590 -46.325 -1.726 109 HB2 ASN 9 HB2 ASN 9 -14.595 -46.997 -3.918 110 HB3 ASN 9 HB3 ASN 9 -14.970 -45.835 -2.646 111 HD21 ASN 9 HD21 ASN 9 -12.561 -43.421 -3.702 112 HD22 ASN 9 HD22 ASN 9 -13.279 -44.134 -2.253 113 H ASP 10 H ASP 10 -12.919 -46.875 0.359 114 HA ASP 10 HA ASP 10 -15.190 -48.414 1.201 115 HB2 ASP 10 HB2 ASP 10 -13.690 -50.167 0.204 116 HB3 ASP 10 HB3 ASP 10 -12.410 -49.641 1.297 117 H ILE 11 H ILE 11 -15.093 -46.224 2.140 118 HA ILE 11 HA ILE 11 -14.484 -44.575 3.497 119 HB ILE 11 HB ILE 11 -14.246 -46.807 5.498 120 HG12 ILE 11 HG12 ILE 11 -16.784 -45.370 4.612 121 HG13 ILE 11 HG13 ILE 11 -16.362 -47.034 4.207 122 HG21 ILE 11 HG21 ILE 11 -15.142 -43.891 5.766 123 HG22 ILE 11 HG22 ILE 11 -14.982 -45.048 7.117 124 HG23 ILE 11 HG23 ILE 11 -13.555 -44.486 6.263 125 HD11 ILE 11 HD11 ILE 11 -17.008 -45.996 6.980 126 HD12 ILE 11 HD12 ILE 11 -17.937 -47.122 5.982 127 HD13 ILE 11 HD13 ILE 11 -16.363 -47.622 6.631 128 H LYS 12 H LYS 12 -12.622 -44.591 2.011 129 HA LYS 12 HA LYS 12 -10.170 -44.156 3.561 130 HB2 LYS 12 HB2 LYS 12 -10.314 -46.620 2.621 131 HB3 LYS 12 HB3 LYS 12 -9.846 -45.905 1.093 132 HG2 LYS 12 HG2 LYS 12 -8.320 -45.555 3.721 133 HG3 LYS 12 HG3 LYS 12 -8.022 -46.886 2.616 134 HD2 LYS 12 HD2 LYS 12 -7.656 -43.959 1.863 135 HD3 LYS 12 HD3 LYS 12 -6.376 -45.016 2.447 136 HE2 LYS 12 HE2 LYS 12 -6.597 -46.509 0.556 137 HE3 LYS 12 HE3 LYS 12 -8.042 -45.663 -0.019 138 HZ1 LYS 12 HZ1 LYS 12 -5.364 -44.397 0.161 139 HZ2 LYS 12 HZ2 LYS 12 -6.033 -44.971 -1.219 140 HZ3 LYS 12 HZ3 LYS 12 -6.743 -43.721 -0.436 141 H LYS 13 H LYS 13 -11.481 -44.215 0.254 142 HA LYS 13 HA LYS 13 -11.243 -42.838 -1.579 143 HB2 LYS 13 HB2 LYS 13 -11.225 -40.711 0.600 144 HB3 LYS 13 HB3 LYS 13 -11.241 -40.327 -1.114 145 HG2 LYS 13 HG2 LYS 13 -13.332 -41.625 -1.410 146 HG3 LYS 13 HG3 LYS 13 -13.382 -41.915 0.343 147 HD2 LYS 13 HD2 LYS 13 -13.544 -39.496 0.771 148 HD3 LYS 13 HD3 LYS 13 -13.271 -39.144 -0.936 149 HE2 LYS 13 HE2 LYS 13 -15.590 -38.844 -0.553 150 HE3 LYS 13 HE3 LYS 13 -15.396 -40.302 -1.526 151 HZ1 LYS 13 HZ1 LYS 13 -15.867 -40.256 1.414 152 HZ2 LYS 13 HZ2 LYS 13 -16.992 -40.609 0.288 153 HZ3 LYS 13 HZ3 LYS 13 -15.728 -41.615 0.509 154 H GLU 14 H GLU 14 -9.923 -40.936 -2.594 155 HA GLU 14 HA GLU 14 -7.048 -41.084 -1.914 156 HB2 GLU 14 HB2 GLU 14 -7.608 -42.989 -3.479 157 HB3 GLU 14 HB3 GLU 14 -8.013 -41.797 -4.715 158 HG2 GLU 14 HG2 GLU 14 -5.684 -40.893 -4.567 159 HG3 GLU 14 HG3 GLU 14 -5.328 -42.033 -3.271 160 H ALA 15 H ALA 15 -7.796 -38.945 -1.204 161 HA ALA 15 HA ALA 15 -7.299 -36.919 -3.307 162 HB1 ALA 15 HB1 ALA 15 -9.583 -36.764 -1.296 163 HB2 ALA 15 HB2 ALA 15 -9.092 -35.492 -2.437 164 HB3 ALA 15 HB3 ALA 15 -9.754 -37.021 -3.053 165 H ASN 16 H ASN 16 -6.731 -34.796 -2.378 166 HA ASN 16 HA ASN 16 -5.587 -34.759 0.340 167 HB2 ASN 16 HB2 ASN 16 -3.949 -36.073 -0.941 168 HB3 ASN 16 HB3 ASN 16 -3.869 -34.832 -2.185 169 HD21 ASN 16 HD21 ASN 16 -1.870 -34.281 1.354 170 HD22 ASN 16 HD22 ASN 16 -3.077 -35.553 1.221 171 H ASP 17 H ASP 17 -5.323 -33.086 -2.837 172 HA ASP 17 HA ASP 17 -5.297 -30.907 -3.429 173 HB2 ASP 17 HB2 ASP 17 -7.587 -30.748 -1.446 174 HB3 ASP 17 HB3 ASP 17 -7.262 -29.603 -2.746 175 H SER 18 H SER 18 -3.231 -31.320 -1.611 176 HA SER 18 HA SER 18 -3.111 -29.107 0.208 177 HB2 SER 18 HB2 SER 18 -1.702 -31.103 0.460 178 HB3 SER 18 HB3 SER 18 -0.825 -30.683 -1.026 179 HG SER 18 HG SER 18 0.248 -29.947 0.878 180 H GLY 19 H GLY 19 -3.256 -27.085 -0.397 181 HA2 GLY 19 HA2 GLY 19 -2.690 -25.033 -1.294 182 HA3 GLY 19 HA3 GLY 19 -1.420 -25.785 -2.249 183 H VAL 20 H VAL 20 -4.580 -24.482 -2.266 184 HA VAL 20 HA VAL 20 -4.651 -24.664 -5.214 185 HB VAL 20 HB VAL 20 -6.094 -26.472 -4.428 186 HG11 VAL 20 HG11 VAL 20 -7.856 -24.355 -3.128 187 HG12 VAL 20 HG12 VAL 20 -8.195 -26.090 -3.273 188 HG13 VAL 20 HG13 VAL 20 -6.853 -25.541 -2.258 189 HG21 VAL 20 HG21 VAL 20 -6.618 -25.283 -6.538 190 HG22 VAL 20 HG22 VAL 20 -8.050 -25.965 -5.749 191 HG23 VAL 20 HG23 VAL 20 -7.737 -24.224 -5.649 192 H THR 21 H THR 21 -5.391 -22.897 -6.229 193 HA THR 21 HA THR 21 -5.849 -20.756 -6.672 194 HB THR 21 HB THR 21 -7.603 -20.802 -4.238 195 HG1 THR 21 HG1 THR 21 -9.161 -21.453 -5.714 196 HG21 THR 21 HG21 THR 21 -7.589 -19.034 -6.717 197 HG22 THR 21 HG22 THR 21 -8.999 -19.210 -5.642 198 HG23 THR 21 HG23 THR 21 -7.505 -18.527 -5.010 199 H LEU 22 H LEU 22 -5.539 -18.503 -6.252 200 HA LEU 22 HA LEU 22 -3.646 -17.864 -4.077 201 HB2 LEU 22 HB2 LEU 22 -2.070 -16.935 -5.563 202 HB3 LEU 22 HB3 LEU 22 -2.382 -18.594 -6.049 203 HG LEU 22 HG LEU 22 -3.707 -16.255 -7.483 204 HD11 LEU 22 HD11 LEU 22 -1.017 -17.554 -8.111 205 HD12 LEU 22 HD12 LEU 22 -1.857 -16.356 -9.121 206 HD13 LEU 22 HD13 LEU 22 -1.258 -15.895 -7.523 207 HD21 LEU 22 HD21 LEU 22 -4.661 -18.426 -8.057 208 HD22 LEU 22 HD22 LEU 22 -3.687 -17.847 -9.403 209 HD23 LEU 22 HD23 LEU 22 -3.037 -19.104 -8.327 210 H ALA 23 H ALA 23 -6.325 -17.159 -4.166 211 HA ALA 23 HA ALA 23 -6.561 -14.338 -4.942 212 HB1 ALA 23 HB1 ALA 23 -8.489 -16.264 -3.579 213 HB2 ALA 23 HB2 ALA 23 -8.894 -14.643 -4.173 214 HB3 ALA 23 HB3 ALA 23 -8.406 -15.908 -5.319 215 HA PRO 24 HA PRO 24 -5.579 -12.750 -0.874 216 HB2 PRO 24 HB2 PRO 24 -6.849 -10.327 -0.835 217 HB3 PRO 24 HB3 PRO 24 -5.413 -10.674 -1.844 218 HG2 PRO 24 HG2 PRO 24 -8.328 -10.693 -2.675 219 HG3 PRO 24 HG3 PRO 24 -6.935 -9.959 -3.525 220 HD2 PRO 24 HD2 PRO 24 -7.948 -12.424 -4.187 221 HD3 PRO 24 HD3 PRO 24 -6.209 -12.038 -4.335 222 H LEU 25 H LEU 25 -9.068 -12.474 -1.714 223 HA LEU 25 HA LEU 25 -9.857 -14.051 0.580 224 HB2 LEU 25 HB2 LEU 25 -9.602 -11.758 1.602 225 HB3 LEU 25 HB3 LEU 25 -10.782 -11.152 0.441 226 HG LEU 25 HG LEU 25 -12.511 -12.671 1.439 227 HD11 LEU 25 HD11 LEU 25 -10.330 -13.281 3.479 228 HD12 LEU 25 HD12 LEU 25 -12.052 -13.686 3.659 229 HD13 LEU 25 HD13 LEU 25 -11.105 -14.448 2.381 230 HD21 LEU 25 HD21 LEU 25 -12.272 -10.337 2.190 231 HD22 LEU 25 HD22 LEU 25 -12.794 -11.394 3.511 232 HD23 LEU 25 HD23 LEU 25 -11.102 -10.849 3.428 233 H SER 26 H SER 26 -10.496 -15.308 -1.241 234 HA SER 26 HA SER 26 -11.841 -16.136 -2.849 235 HB2 SER 26 HB2 SER 26 -13.959 -16.306 -2.263 236 HB3 SER 26 HB3 SER 26 -13.514 -15.299 -0.876 237 HG SER 26 HG SER 26 -15.367 -14.508 -1.930 238 H VAL 27 H VAL 27 -13.492 -15.487 -4.710 239 HA VAL 27 HA VAL 27 -13.578 -14.775 -6.844 240 HB VAL 27 HB VAL 27 -12.873 -12.189 -5.468 241 HG11 VAL 27 HG11 VAL 27 -13.734 -12.277 -8.373 242 HG12 VAL 27 HG12 VAL 27 -13.462 -10.864 -7.359 243 HG13 VAL 27 HG13 VAL 27 -12.090 -11.868 -7.811 244 HG21 VAL 27 HG21 VAL 27 -15.076 -13.185 -5.023 245 HG22 VAL 27 HG22 VAL 27 -15.222 -11.668 -5.913 246 HG23 VAL 27 HG23 VAL 27 -15.422 -13.215 -6.765 247 HA PRO 28 HA PRO 28 -9.459 -15.172 -8.656 248 HB2 PRO 28 HB2 PRO 28 -9.927 -14.635 -11.301 249 HB3 PRO 28 HB3 PRO 28 -10.463 -16.127 -10.486 250 HG2 PRO 28 HG2 PRO 28 -12.093 -13.597 -10.930 251 HG3 PRO 28 HG3 PRO 28 -12.530 -15.283 -11.371 252 HD2 PRO 28 HD2 PRO 28 -13.421 -14.230 -9.070 253 HD3 PRO 28 HD3 PRO 28 -12.812 -15.899 -9.095 254 H LYS 29 H LYS 29 -9.233 -13.259 -7.156 255 HA LYS 29 HA LYS 29 -8.416 -11.254 -6.522 256 HB2 LYS 29 HB2 LYS 29 -6.499 -11.899 -7.724 257 HB3 LYS 29 HB3 LYS 29 -7.187 -11.438 -9.255 258 HG2 LYS 29 HG2 LYS 29 -7.139 -9.017 -7.670 259 HG3 LYS 29 HG3 LYS 29 -5.650 -9.845 -7.351 260 HD2 LYS 29 HD2 LYS 29 -5.143 -8.550 -9.144 261 HD3 LYS 29 HD3 LYS 29 -5.354 -10.107 -9.910 262 HE2 LYS 29 HE2 LYS 29 -7.500 -7.958 -9.715 263 HE3 LYS 29 HE3 LYS 29 -6.277 -7.975 -10.997 264 HZ1 LYS 29 HZ1 LYS 29 -8.376 -10.024 -10.536 265 HZ2 LYS 29 HZ2 LYS 29 -8.199 -9.095 -11.857 266 HZ3 LYS 29 HZ3 LYS 29 -7.113 -10.274 -11.568 267 HA PRO 30 HA PRO 30 -11.754 -8.588 -8.091 268 HB2 PRO 30 HB2 PRO 30 -12.238 -7.172 -5.807 269 HB3 PRO 30 HB3 PRO 30 -12.833 -8.839 -6.058 270 HG2 PRO 30 HG2 PRO 30 -10.329 -7.967 -4.579 271 HG3 PRO 30 HG3 PRO 30 -11.607 -9.096 -4.021 272 HD2 PRO 30 HD2 PRO 30 -9.287 -9.960 -5.140 273 HD3 PRO 30 HD3 PRO 30 -10.830 -10.815 -5.442 274 H LYS 31 H LYS 31 -11.937 -6.271 -8.365 275 HA LYS 31 HA LYS 31 -9.323 -4.756 -8.359 276 HB2 LYS 31 HB2 LYS 31 -11.633 -4.604 -10.341 277 HB3 LYS 31 HB3 LYS 31 -10.169 -3.620 -10.369 278 HG2 LYS 31 HG2 LYS 31 -8.801 -5.652 -10.774 279 HG3 LYS 31 HG3 LYS 31 -10.270 -6.649 -10.733 280 HD2 LYS 31 HD2 LYS 31 -11.202 -5.329 -12.639 281 HD3 LYS 31 HD3 LYS 31 -9.687 -4.403 -12.717 282 HE2 LYS 31 HE2 LYS 31 -8.431 -6.493 -13.164 283 HE3 LYS 31 HE3 LYS 31 -9.934 -7.427 -13.045 284 HZ1 LYS 31 HZ1 LYS 31 -9.382 -5.348 -15.095 285 HZ2 LYS 31 HZ2 LYS 31 -9.378 -6.961 -15.351 286 HZ3 LYS 31 HZ3 LYS 31 -10.772 -6.202 -14.975 287 H LEU 32 H LEU 32 -9.429 -3.326 -6.719 288 HA LEU 32 HA LEU 32 -11.674 -1.425 -6.542 289 HB2 LEU 32 HB2 LEU 32 -11.888 -1.793 -4.152 290 HB3 LEU 32 HB3 LEU 32 -12.313 -3.222 -5.082 291 HG LEU 32 HG LEU 32 -9.514 -3.058 -3.980 292 HD11 LEU 32 HD11 LEU 32 -11.930 -3.780 -2.294 293 HD12 LEU 32 HD12 LEU 32 -10.217 -3.978 -1.839 294 HD13 LEU 32 HD13 LEU 32 -10.875 -2.359 -2.082 295 HD21 LEU 32 HD21 LEU 32 -10.025 -5.046 -5.282 296 HD22 LEU 32 HD22 LEU 32 -9.999 -5.529 -3.597 297 HD23 LEU 32 HD23 LEU 32 -11.557 -5.295 -4.400 298 H GLU 33 H GLU 33 -11.265 0.452 -5.306 299 HA GLU 33 HA GLU 33 -8.562 1.072 -4.399 300 HB2 GLU 33 HB2 GLU 33 -8.303 3.016 -5.973 301 HB3 GLU 33 HB3 GLU 33 -8.257 1.456 -6.779 302 HG2 GLU 33 HG2 GLU 33 -10.591 1.718 -7.536 303 HG3 GLU 33 HG3 GLU 33 -10.723 3.252 -6.683 304 H GLU 34 H GLU 34 -10.490 0.836 -2.831 305 HA GLU 34 HA GLU 34 -11.701 3.521 -2.246 306 HB2 GLU 34 HB2 GLU 34 -12.688 0.743 -1.552 307 HB3 GLU 34 HB3 GLU 34 -13.371 2.250 -0.912 308 HG2 GLU 34 HG2 GLU 34 -13.729 3.045 -3.269 309 HG3 GLU 34 HG3 GLU 34 -13.220 1.459 -3.849 310 H LEU 35 H LEU 35 -9.866 4.318 -1.326 311 HA LEU 35 HA LEU 35 -9.176 3.447 1.455 312 HB2 LEU 35 HB2 LEU 35 -7.774 5.176 -0.612 313 HB3 LEU 35 HB3 LEU 35 -7.219 5.039 1.045 314 HG LEU 35 HG LEU 35 -7.626 2.435 -0.411 315 HD11 LEU 35 HD11 LEU 35 -5.249 4.229 -1.011 316 HD12 LEU 35 HD12 LEU 35 -5.512 2.558 -1.565 317 HD13 LEU 35 HD13 LEU 35 -6.567 3.851 -2.144 318 HD21 LEU 35 HD21 LEU 35 -6.764 2.526 1.916 319 HD22 LEU 35 HD22 LEU 35 -5.579 1.836 0.794 320 HD23 LEU 35 HD23 LEU 35 -5.382 3.504 1.357 321 H SER 36 H SER 36 -9.001 5.091 3.095 322 HA SER 36 HA SER 36 -10.966 7.301 2.929 323 HB2 SER 36 HB2 SER 36 -10.611 5.990 5.026 324 HB3 SER 36 HB3 SER 36 -8.973 6.667 5.131 325 HG SER 36 HG SER 36 -10.587 7.846 6.342 326 H GLU 37 H GLU 37 -10.119 9.602 3.550 327 HA GLU 37 HA GLU 37 -8.430 10.431 1.438 328 HB2 GLU 37 HB2 GLU 37 -10.220 11.750 2.704 329 HB3 GLU 37 HB3 GLU 37 -9.031 11.975 3.986 330 HG2 GLU 37 HG2 GLU 37 -8.917 13.934 2.731 331 HG3 GLU 37 HG3 GLU 37 -7.509 13.031 2.194 332 H GLN 38 H GLN 38 -7.591 10.017 4.907 333 HA GLN 38 HA GLN 38 -4.809 10.810 4.521 334 HB2 GLN 38 HB2 GLN 38 -6.114 10.963 6.694 335 HB3 GLN 38 HB3 GLN 38 -6.036 9.200 6.792 336 HG2 GLN 38 HG2 GLN 38 -3.444 9.503 6.612 337 HG3 GLN 38 HG3 GLN 38 -3.750 11.214 6.904 338 HE21 GLN 38 HE21 GLN 38 -4.274 8.454 9.932 339 HE22 GLN 38 HE22 GLN 38 -4.216 7.916 8.258 340 H GLN 39 H GLN 39 -6.537 7.685 4.697 341 HA GLN 39 HA GLN 39 -4.304 5.918 4.567 342 HB2 GLN 39 HB2 GLN 39 -7.143 5.674 3.575 343 HB3 GLN 39 HB3 GLN 39 -6.002 4.342 3.529 344 HG2 GLN 39 HG2 GLN 39 -6.519 5.732 6.172 345 HG3 GLN 39 HG3 GLN 39 -7.724 4.631 5.523 346 HE21 GLN 39 HE21 GLN 39 -4.713 2.944 7.473 347 HE22 GLN 39 HE22 GLN 39 -5.079 4.667 7.582 348 H LYS 40 H LYS 40 -6.191 7.472 1.951 349 HA LYS 40 HA LYS 40 -4.832 6.334 -0.287 350 HB2 LYS 40 HB2 LYS 40 -7.014 7.527 -0.317 351 HB3 LYS 40 HB3 LYS 40 -6.199 9.044 0.075 352 HG2 LYS 40 HG2 LYS 40 -4.899 8.834 -2.080 353 HG3 LYS 40 HG3 LYS 40 -5.874 7.412 -2.482 354 HD2 LYS 40 HD2 LYS 40 -6.936 10.223 -1.929 355 HD3 LYS 40 HD3 LYS 40 -6.679 9.532 -3.539 356 HE2 LYS 40 HE2 LYS 40 -8.353 7.770 -3.072 357 HE3 LYS 40 HE3 LYS 40 -8.599 8.416 -1.442 358 HZ1 LYS 40 HZ1 LYS 40 -9.166 9.900 -3.952 359 HZ2 LYS 40 HZ2 LYS 40 -10.290 9.239 -2.971 360 HZ3 LYS 40 HZ3 LYS 40 -9.380 10.490 -2.441 361 H ILE 41 H ILE 41 -4.086 9.328 1.585 362 HA ILE 41 HA ILE 41 -1.830 10.042 -0.066 363 HB ILE 41 HB ILE 41 -2.433 10.780 2.786 364 HG12 ILE 41 HG12 ILE 41 -2.831 12.548 0.322 365 HG13 ILE 41 HG13 ILE 41 -4.103 11.464 0.837 366 HG21 ILE 41 HG21 ILE 41 -0.466 12.035 0.832 367 HG22 ILE 41 HG22 ILE 41 -0.926 12.747 2.391 368 HG23 ILE 41 HG23 ILE 41 -0.076 11.213 2.359 369 HD11 ILE 41 HD11 ILE 41 -2.960 13.738 2.498 370 HD12 ILE 41 HD12 ILE 41 -4.560 13.637 1.742 371 HD13 ILE 41 HD13 ILE 41 -4.150 12.547 3.077 372 H ILE 42 H ILE 42 -2.051 8.073 2.982 373 HA ILE 42 HA ILE 42 0.803 7.729 3.240 374 HB ILE 42 HB ILE 42 -1.461 5.921 4.136 375 HG12 ILE 42 HG12 ILE 42 0.145 7.765 5.944 376 HG13 ILE 42 HG13 ILE 42 -1.245 8.394 5.076 377 HG21 ILE 42 HG21 ILE 42 1.499 5.965 4.909 378 HG22 ILE 42 HG22 ILE 42 0.259 5.034 5.763 379 HG23 ILE 42 HG23 ILE 42 0.639 4.645 4.092 380 HD11 ILE 42 HD11 ILE 42 -1.331 6.025 6.986 381 HD12 ILE 42 HD12 ILE 42 -1.932 7.665 7.291 382 HD13 ILE 42 HD13 ILE 42 -2.697 6.655 6.040 383 H LEU 43 H LEU 43 -1.691 5.812 1.604 384 HA LEU 43 HA LEU 43 -0.042 3.738 0.572 385 HB2 LEU 43 HB2 LEU 43 -2.493 3.710 0.744 386 HB3 LEU 43 HB3 LEU 43 -2.642 4.986 -0.438 387 HG LEU 43 HG LEU 43 -3.241 2.685 -1.156 388 HD11 LEU 43 HD11 LEU 43 -1.028 3.887 -2.857 389 HD12 LEU 43 HD12 LEU 43 -2.344 2.830 -3.382 390 HD13 LEU 43 HD13 LEU 43 -2.705 4.462 -2.796 391 HD21 LEU 43 HD21 LEU 43 -1.561 1.390 -0.085 392 HD22 LEU 43 HD22 LEU 43 -1.450 1.120 -1.828 393 HD23 LEU 43 HD23 LEU 43 -0.243 2.146 -1.018 394 H ALA 44 H ALA 44 -1.071 6.830 -0.940 395 HA ALA 44 HA ALA 44 0.404 6.529 -3.342 396 HB1 ALA 44 HB1 ALA 44 -0.583 9.000 -1.862 397 HB2 ALA 44 HB2 ALA 44 -0.074 8.969 -3.567 398 HB3 ALA 44 HB3 ALA 44 -1.509 8.053 -3.049 399 H GLU 45 H GLU 45 1.279 8.475 -0.382 400 HA GLU 45 HA GLU 45 3.765 9.397 -1.395 401 HB2 GLU 45 HB2 GLU 45 2.756 8.913 1.428 402 HB3 GLU 45 HB3 GLU 45 4.331 9.627 1.106 403 HG2 GLU 45 HG2 GLU 45 1.745 10.820 0.022 404 HG3 GLU 45 HG3 GLU 45 2.456 11.263 1.569 405 H TYR 46 H TYR 46 3.010 6.201 -0.106 406 HA TYR 46 HA TYR 46 5.771 5.446 0.370 407 HB2 TYR 46 HB2 TYR 46 3.866 4.460 1.538 408 HB3 TYR 46 HB3 TYR 46 3.214 3.849 0.028 409 HD1 TYR 46 HD1 TYR 46 3.017 1.751 1.306 410 HD2 TYR 46 HD2 TYR 46 6.862 3.466 0.349 411 HE1 TYR 46 HE1 TYR 46 4.109 -0.458 1.691 412 HE2 TYR 46 HE2 TYR 46 7.941 1.268 0.760 413 HH TYR 46 HH TYR 46 6.066 -1.603 1.770 414 H ILE 47 H ILE 47 3.447 4.486 -2.240 415 HA ILE 47 HA ILE 47 5.277 3.244 -4.009 416 HB ILE 47 HB ILE 47 2.600 4.567 -4.189 417 HG12 ILE 47 HG12 ILE 47 3.270 1.662 -4.733 418 HG13 ILE 47 HG13 ILE 47 3.272 2.212 -3.071 419 HG21 ILE 47 HG21 ILE 47 4.080 3.235 -6.492 420 HG22 ILE 47 HG22 ILE 47 2.320 3.489 -6.472 421 HG23 ILE 47 HG23 ILE 47 3.403 4.877 -6.445 422 HD11 ILE 47 HD11 ILE 47 0.847 2.594 -4.873 423 HD12 ILE 47 HD12 ILE 47 1.098 1.192 -3.805 424 HD13 ILE 47 HD13 ILE 47 0.965 2.816 -3.124 425 H ALA 48 H ALA 48 4.329 6.701 -3.639 426 HA ALA 48 HA ALA 48 5.731 7.657 -5.957 427 HB1 ALA 48 HB1 ALA 48 4.893 9.037 -3.377 428 HB2 ALA 48 HB2 ALA 48 5.359 9.857 -4.887 429 HB3 ALA 48 HB3 ALA 48 3.894 8.851 -4.836 430 H GLU 49 H GLU 49 6.886 6.745 -2.765 431 HA GLU 49 HA GLU 49 9.465 8.158 -3.124 432 HB2 GLU 49 HB2 GLU 49 8.213 8.188 -0.953 433 HB3 GLU 49 HB3 GLU 49 8.474 6.447 -0.820 434 HG2 GLU 49 HG2 GLU 49 10.081 7.543 0.552 435 HG3 GLU 49 HG3 GLU 49 10.958 6.879 -0.812 436 H VAL 50 H VAL 50 8.174 4.786 -3.243 437 HA VAL 50 HA VAL 50 10.977 3.877 -3.813 438 HB VAL 50 HB VAL 50 10.578 1.816 -2.781 439 HG11 VAL 50 HG11 VAL 50 9.503 3.935 -0.884 440 HG12 VAL 50 HG12 VAL 50 10.342 2.431 -0.462 441 HG13 VAL 50 HG13 VAL 50 11.217 3.718 -1.310 442 HG21 VAL 50 HG21 VAL 50 8.216 1.388 -3.302 443 HG22 VAL 50 HG22 VAL 50 8.549 1.192 -1.589 444 HG23 VAL 50 HG23 VAL 50 7.712 2.644 -2.168 445 H GLY 51 H GLY 51 7.785 3.990 -5.145 446 HA2 GLY 51 HA2 GLY 51 7.122 3.334 -7.283 447 HA3 GLY 51 HA3 GLY 51 8.597 2.396 -7.500 448 H LEU 52 H LEU 52 5.648 1.731 -7.825 449 HA LEU 52 HA LEU 52 4.775 0.177 -5.680 450 HB2 LEU 52 HB2 LEU 52 3.445 1.239 -7.546 451 HB3 LEU 52 HB3 LEU 52 3.947 -0.052 -8.616 452 HG LEU 52 HG LEU 52 2.735 -1.045 -6.083 453 HD11 LEU 52 HD11 LEU 52 0.961 0.499 -7.991 454 HD12 LEU 52 HD12 LEU 52 0.472 -0.385 -6.532 455 HD13 LEU 52 HD13 LEU 52 1.484 1.066 -6.394 456 HD21 LEU 52 HD21 LEU 52 3.127 -2.481 -8.094 457 HD22 LEU 52 HD22 LEU 52 1.417 -2.422 -7.629 458 HD23 LEU 52 HD23 LEU 52 1.999 -1.467 -9.013 459 H GLN 53 H GLN 53 7.122 -0.656 -7.770 460 HA GLN 53 HA GLN 53 6.841 -3.604 -7.771 461 HB2 GLN 53 HB2 GLN 53 9.080 -1.749 -8.675 462 HB3 GLN 53 HB3 GLN 53 9.109 -3.510 -8.857 463 HG2 GLN 53 HG2 GLN 53 7.174 -3.477 -10.322 464 HG3 GLN 53 HG3 GLN 53 6.959 -1.734 -10.086 465 HE21 GLN 53 HE21 GLN 53 9.740 -0.822 -12.180 466 HE22 GLN 53 HE22 GLN 53 8.818 -0.304 -10.774 467 H ASN 54 H ASN 54 8.223 -1.180 -5.685 468 HA ASN 54 HA ASN 54 10.012 -3.175 -4.369 469 HB2 ASN 54 HB2 ASN 54 10.124 -0.144 -4.332 470 HB3 ASN 54 HB3 ASN 54 11.309 -1.231 -3.612 471 HD21 ASN 54 HD21 ASN 54 11.805 -0.174 -7.408 472 HD22 ASN 54 HD22 ASN 54 10.792 0.674 -6.232 473 H ILE 55 H ILE 55 7.078 -1.728 -3.827 474 HA ILE 55 HA ILE 55 7.170 -1.771 -0.895 475 HB ILE 55 HB ILE 55 4.809 -1.495 -0.899 476 HG12 ILE 55 HG12 ILE 55 4.854 -1.990 -3.892 477 HG13 ILE 55 HG13 ILE 55 4.129 -3.038 -2.669 478 HG21 ILE 55 HG21 ILE 55 5.778 0.291 -3.158 479 HG22 ILE 55 HG22 ILE 55 4.649 0.662 -1.826 480 HG23 ILE 55 HG23 ILE 55 6.356 0.438 -1.490 481 HD11 ILE 55 HD11 ILE 55 3.211 -0.250 -3.422 482 HD12 ILE 55 HD12 ILE 55 2.391 -1.773 -3.753 483 HD13 ILE 55 HD13 ILE 55 2.544 -1.209 -2.070 484 H THR 56 H THR 56 5.984 -3.280 0.424 485 HA THR 56 HA THR 56 5.467 -5.967 -0.748 486 HB THR 56 HB THR 56 6.197 -6.680 1.719 487 HG1 THR 56 HG1 THR 56 8.000 -5.459 2.372 488 HG21 THR 56 HG21 THR 56 8.269 -5.954 -0.404 489 HG22 THR 56 HG22 THR 56 8.487 -7.127 0.917 490 HG23 THR 56 HG23 THR 56 7.316 -7.454 -0.371 491 H ALA 57 H ALA 57 3.654 -7.048 0.084 492 HA ALA 57 HA ALA 57 1.535 -5.504 1.176 493 HB1 ALA 57 HB1 ALA 57 1.958 -8.528 1.087 494 HB2 ALA 57 HB2 ALA 57 0.418 -7.686 1.365 495 HB3 ALA 57 HB3 ALA 57 1.233 -7.544 -0.205 496 H ILE 58 H ILE 58 4.086 -7.372 2.684 497 HA ILE 58 HA ILE 58 3.061 -7.601 5.367 498 HB ILE 58 HB ILE 58 5.862 -7.504 4.158 499 HG12 ILE 58 HG12 ILE 58 5.957 -9.901 4.883 500 HG13 ILE 58 HG13 ILE 58 4.288 -9.812 5.433 501 HG21 ILE 58 HG21 ILE 58 5.058 -7.975 7.073 502 HG22 ILE 58 HG22 ILE 58 6.673 -8.322 6.408 503 HG23 ILE 58 HG23 ILE 58 6.085 -6.664 6.450 504 HD11 ILE 58 HD11 ILE 58 5.156 -9.420 2.534 505 HD12 ILE 58 HD12 ILE 58 4.643 -10.966 3.234 506 HD13 ILE 58 HD13 ILE 58 3.489 -9.637 3.144 507 H THR 59 H THR 59 5.244 -5.203 3.795 508 HA THR 59 HA THR 59 5.307 -3.471 6.107 509 HB THR 59 HB THR 59 6.148 -3.124 3.220 510 HG1 THR 59 HG1 THR 59 8.081 -3.740 3.959 511 HG21 THR 59 HG21 THR 59 6.802 -1.416 5.664 512 HG22 THR 59 HG22 THR 59 7.623 -1.322 4.083 513 HG23 THR 59 HG23 THR 59 5.911 -0.895 4.212 514 H LEU 60 H LEU 60 3.538 -3.344 2.965 515 HA LEU 60 HA LEU 60 2.171 -0.938 3.471 516 HB2 LEU 60 HB2 LEU 60 2.396 -2.266 1.286 517 HB3 LEU 60 HB3 LEU 60 1.151 -3.336 1.896 518 HG LEU 60 HG LEU 60 -0.407 -1.332 1.999 519 HD11 LEU 60 HD11 LEU 60 1.858 -0.022 0.438 520 HD12 LEU 60 HD12 LEU 60 0.268 0.674 0.766 521 HD13 LEU 60 HD13 LEU 60 1.366 0.427 2.097 522 HD21 LEU 60 HD21 LEU 60 -0.447 -2.874 0.075 523 HD22 LEU 60 HD22 LEU 60 -0.732 -1.206 -0.447 524 HD23 LEU 60 HD23 LEU 60 0.854 -1.960 -0.700 525 H SER 61 H SER 61 1.350 -4.275 4.491 526 HA SER 61 HA SER 61 -1.092 -3.773 5.755 527 HB2 SER 61 HB2 SER 61 -0.249 -6.012 5.451 528 HB3 SER 61 HB3 SER 61 1.085 -5.690 6.564 529 HG SER 61 HG SER 61 -0.532 -6.755 7.672 530 H LYS 62 H LYS 62 2.050 -2.920 6.762 531 HA LYS 62 HA LYS 62 1.071 -2.047 9.413 532 HB2 LYS 62 HB2 LYS 62 3.757 -2.980 8.439 533 HB3 LYS 62 HB3 LYS 62 3.742 -1.736 9.681 534 HG2 LYS 62 HG2 LYS 62 3.805 -3.682 10.935 535 HG3 LYS 62 HG3 LYS 62 2.136 -3.160 11.023 536 HD2 LYS 62 HD2 LYS 62 2.000 -5.494 10.741 537 HD3 LYS 62 HD3 LYS 62 1.630 -4.850 9.153 538 HE2 LYS 62 HE2 LYS 62 3.105 -6.649 8.751 539 HE3 LYS 62 HE3 LYS 62 4.090 -5.201 8.546 540 HZ1 LYS 62 HZ1 LYS 62 4.023 -6.893 10.996 541 HZ2 LYS 62 HZ2 LYS 62 5.226 -6.882 9.895 542 HZ3 LYS 62 HZ3 LYS 62 4.953 -5.562 10.811 543 H LYS 63 H LYS 63 2.230 -0.632 6.421 544 HA LYS 63 HA LYS 63 2.821 2.009 7.409 545 HB2 LYS 63 HB2 LYS 63 1.813 0.849 4.786 546 HB3 LYS 63 HB3 LYS 63 2.114 2.575 4.959 547 HG2 LYS 63 HG2 LYS 63 4.252 0.446 5.409 548 HG3 LYS 63 HG3 LYS 63 3.930 1.223 3.869 549 HD2 LYS 63 HD2 LYS 63 4.375 3.458 5.007 550 HD3 LYS 63 HD3 LYS 63 4.930 2.524 6.421 551 HE2 LYS 63 HE2 LYS 63 6.583 1.353 4.966 552 HE3 LYS 63 HE3 LYS 63 6.037 2.314 3.584 553 HZ1 LYS 63 HZ1 LYS 63 7.283 3.425 6.047 554 HZ2 LYS 63 HZ2 LYS 63 8.025 3.273 4.602 555 HZ3 LYS 63 HZ3 LYS 63 6.779 4.314 4.771 556 H LEU 64 H LEU 64 -0.174 0.429 6.449 557 HA LEU 64 HA LEU 64 -1.770 2.859 7.131 558 HB2 LEU 64 HB2 LEU 64 -2.303 0.474 5.329 559 HB3 LEU 64 HB3 LEU 64 -3.459 1.757 5.643 560 HG LEU 64 HG LEU 64 -1.032 3.072 4.888 561 HD11 LEU 64 HD11 LEU 64 -1.787 0.891 2.907 562 HD12 LEU 64 HD12 LEU 64 -0.594 2.195 2.670 563 HD13 LEU 64 HD13 LEU 64 -0.307 0.932 3.880 564 HD21 LEU 64 HD21 LEU 64 -3.306 3.875 4.488 565 HD22 LEU 64 HD22 LEU 64 -2.312 3.859 3.024 566 HD23 LEU 64 HD23 LEU 64 -3.552 2.599 3.268 567 H ASN 65 H ASN 65 -0.960 0.092 8.707 568 HA ASN 65 HA ASN 65 -1.861 -1.315 10.223 569 HB2 ASN 65 HB2 ASN 65 -3.686 1.016 10.906 570 HB3 ASN 65 HB3 ASN 65 -3.348 -0.378 11.923 571 HD21 ASN 65 HD21 ASN 65 -0.712 2.694 11.856 572 HD22 ASN 65 HD22 ASN 65 -2.176 2.728 10.884 573 H ILE 66 H ILE 66 -2.591 -2.107 7.896 574 HA ILE 66 HA ILE 66 -5.506 -2.804 7.941 575 HB ILE 66 HB ILE 66 -5.210 -3.280 5.525 576 HG12 ILE 66 HG12 ILE 66 -2.433 -2.052 5.879 577 HG13 ILE 66 HG13 ILE 66 -2.943 -3.597 5.192 578 HG21 ILE 66 HG21 ILE 66 -4.740 -0.392 6.247 579 HG22 ILE 66 HG22 ILE 66 -5.588 -1.061 4.830 580 HG23 ILE 66 HG23 ILE 66 -6.276 -1.280 6.433 581 HD11 ILE 66 HD11 ILE 66 -3.450 -0.888 3.915 582 HD12 ILE 66 HD12 ILE 66 -2.217 -2.054 3.449 583 HD13 ILE 66 HD13 ILE 66 -3.939 -2.466 3.254 584 H THR 67 H THR 67 -5.313 -5.005 6.188 585 HA THR 67 HA THR 67 -3.714 -6.981 7.736 586 HB THR 67 HB THR 67 -5.156 -8.657 7.275 587 HG1 THR 67 HG1 THR 67 -6.615 -8.616 5.518 588 HG21 THR 67 HG21 THR 67 -7.181 -6.405 6.891 589 HG22 THR 67 HG22 THR 67 -7.475 -8.034 7.529 590 HG23 THR 67 HG23 THR 67 -6.521 -6.883 8.481 591 H VAL 68 H VAL 68 -2.540 -8.621 6.485 592 HA VAL 68 HA VAL 68 -1.067 -7.597 4.232 593 HB VAL 68 HB VAL 68 -1.451 -10.465 5.170 594 HG11 VAL 68 HG11 VAL 68 0.675 -9.268 3.330 595 HG12 VAL 68 HG12 VAL 68 0.707 -10.912 3.998 596 HG13 VAL 68 HG13 VAL 68 -0.561 -10.460 2.859 597 HG21 VAL 68 HG21 VAL 68 -0.422 -9.059 6.916 598 HG22 VAL 68 HG22 VAL 68 0.783 -10.143 6.225 599 HG23 VAL 68 HG23 VAL 68 0.758 -8.434 5.739 600 H GLU 69 H GLU 69 -4.221 -9.162 4.396 601 HA GLU 69 HA GLU 69 -4.162 -10.029 1.566 602 HB2 GLU 69 HB2 GLU 69 -6.338 -10.089 3.696 603 HB3 GLU 69 HB3 GLU 69 -6.484 -10.761 2.066 604 HG2 GLU 69 HG2 GLU 69 -4.638 -12.328 2.506 605 HG3 GLU 69 HG3 GLU 69 -4.409 -11.663 4.121 606 H LYS 70 H LYS 70 -5.432 -7.390 3.632 607 HA LYS 70 HA LYS 70 -7.040 -6.168 1.608 608 HB2 LYS 70 HB2 LYS 70 -7.030 -5.944 4.243 609 HB3 LYS 70 HB3 LYS 70 -5.862 -4.660 3.899 610 HG2 LYS 70 HG2 LYS 70 -7.742 -3.962 2.090 611 HG3 LYS 70 HG3 LYS 70 -8.780 -4.935 3.170 612 HD2 LYS 70 HD2 LYS 70 -7.932 -3.527 5.087 613 HD3 LYS 70 HD3 LYS 70 -7.026 -2.586 3.888 614 HE2 LYS 70 HE2 LYS 70 -8.961 -1.305 4.374 615 HE3 LYS 70 HE3 LYS 70 -9.189 -1.987 2.761 616 HZ1 LYS 70 HZ1 LYS 70 -10.388 -3.059 5.270 617 HZ2 LYS 70 HZ2 LYS 70 -11.186 -2.200 4.139 618 HZ3 LYS 70 HZ3 LYS 70 -10.629 -3.689 3.777 619 H ALA 71 H ALA 71 -3.781 -5.643 2.868 620 HA ALA 71 HA ALA 71 -2.869 -3.560 1.180 621 HB1 ALA 71 HB1 ALA 71 -1.414 -5.911 2.494 622 HB2 ALA 71 HB2 ALA 71 -0.638 -4.476 1.829 623 HB3 ALA 71 HB3 ALA 71 -1.716 -4.329 3.229 624 H LYS 72 H LYS 72 -2.719 -7.140 0.713 625 HA LYS 72 HA LYS 72 -1.122 -6.908 -1.665 626 HB2 LYS 72 HB2 LYS 72 -0.991 -8.770 -0.026 627 HB3 LYS 72 HB3 LYS 72 -2.640 -9.262 -0.417 628 HG2 LYS 72 HG2 LYS 72 -1.969 -9.896 -2.653 629 HG3 LYS 72 HG3 LYS 72 -0.342 -9.232 -2.416 630 HD2 LYS 72 HD2 LYS 72 -1.510 -11.481 -0.707 631 HD3 LYS 72 HD3 LYS 72 -0.574 -11.765 -2.191 632 HE2 LYS 72 HE2 LYS 72 1.336 -10.483 -1.189 633 HE3 LYS 72 HE3 LYS 72 0.417 -10.340 0.317 634 HZ1 LYS 72 HZ1 LYS 72 1.266 -12.904 -0.931 635 HZ2 LYS 72 HZ2 LYS 72 1.940 -12.232 0.390 636 HZ3 LYS 72 HZ3 LYS 72 0.406 -12.783 0.454 637 H ASN 73 H ASN 73 -4.595 -7.081 -1.073 638 HA ASN 73 HA ASN 73 -5.405 -7.735 -3.655 639 HB2 ASN 73 HB2 ASN 73 -7.453 -7.247 -2.885 640 HB3 ASN 73 HB3 ASN 73 -6.710 -6.811 -1.361 641 HD21 ASN 73 HD21 ASN 73 -7.556 -3.391 -1.766 642 HD22 ASN 73 HD22 ASN 73 -6.864 -4.606 -0.720 643 H TYR 74 H TYR 74 -4.453 -4.493 -2.442 644 HA TYR 74 HA TYR 74 -4.922 -3.026 -4.780 645 HB2 TYR 74 HB2 TYR 74 -2.700 -2.580 -2.743 646 HB3 TYR 74 HB3 TYR 74 -3.412 -1.364 -3.788 647 HD1 TYR 74 HD1 TYR 74 -3.070 -1.973 -0.584 648 HD2 TYR 74 HD2 TYR 74 -6.346 -1.751 -3.409 649 HE1 TYR 74 HE1 TYR 74 -4.565 -1.072 1.202 650 HE2 TYR 74 HE2 TYR 74 -7.845 -0.915 -1.588 651 HH TYR 74 HH TYR 74 -6.696 -0.432 1.762 652 H ILE 75 H ILE 75 -2.015 -4.772 -3.678 653 HA ILE 75 HA ILE 75 -0.274 -3.919 -5.799 654 HB ILE 75 HB ILE 75 -0.114 -6.358 -3.982 655 HG12 ILE 75 HG12 ILE 75 1.143 -3.588 -3.713 656 HG13 ILE 75 HG13 ILE 75 -0.230 -4.147 -2.775 657 HG21 ILE 75 HG21 ILE 75 2.058 -4.980 -5.637 658 HG22 ILE 75 HG22 ILE 75 2.309 -6.341 -4.522 659 HG23 ILE 75 HG23 ILE 75 1.360 -6.580 -5.975 660 HD11 ILE 75 HD11 ILE 75 2.596 -5.214 -2.588 661 HD12 ILE 75 HD12 ILE 75 1.665 -4.332 -1.368 662 HD13 ILE 75 HD13 ILE 75 1.176 -5.974 -1.825 663 H LYS 76 H LYS 76 -2.562 -6.711 -5.503 664 HA LYS 76 HA LYS 76 -1.600 -8.057 -7.862 665 HB2 LYS 76 HB2 LYS 76 -2.854 -8.833 -5.671 666 HB3 LYS 76 HB3 LYS 76 -4.283 -8.479 -6.654 667 HG2 LYS 76 HG2 LYS 76 -3.578 -10.110 -8.303 668 HG3 LYS 76 HG3 LYS 76 -1.950 -10.206 -7.657 669 HD2 LYS 76 HD2 LYS 76 -4.313 -11.074 -5.955 670 HD3 LYS 76 HD3 LYS 76 -3.598 -12.155 -7.164 671 HE2 LYS 76 HE2 LYS 76 -1.399 -11.970 -6.125 672 HE3 LYS 76 HE3 LYS 76 -1.999 -10.799 -4.947 673 HZ1 LYS 76 HZ1 LYS 76 -3.036 -13.594 -5.153 674 HZ2 LYS 76 HZ2 LYS 76 -1.881 -13.131 -4.101 675 HZ3 LYS 76 HZ3 LYS 76 -3.390 -12.512 -3.986 676 H ASN 77 H ASN 77 -4.220 -5.695 -7.309 677 HA ASN 77 HA ASN 77 -5.077 -6.025 -10.134 678 HB2 ASN 77 HB2 ASN 77 -6.987 -4.584 -9.479 679 HB3 ASN 77 HB3 ASN 77 -6.885 -6.128 -8.646 680 HD21 ASN 77 HD21 ASN 77 -7.354 -4.573 -5.579 681 HD22 ASN 77 HD22 ASN 77 -7.829 -5.822 -6.728 682 H SER 78 H SER 78 -3.899 -3.428 -7.949 683 HA SER 78 HA SER 78 -3.655 -1.727 -10.252 684 HB2 SER 78 HB2 SER 78 -4.488 -1.066 -7.895 685 HB3 SER 78 HB3 SER 78 -2.767 -0.872 -7.506 686 HG SER 78 HG SER 78 -3.762 1.070 -8.284 687 H ASN 79 H ASN 79 -2.096 -3.628 -10.903 688 HA ASN 79 HA ASN 79 0.575 -3.228 -9.868 689 HB2 ASN 79 HB2 ASN 79 -0.702 -5.427 -10.368 690 HB3 ASN 79 HB3 ASN 79 -0.194 -5.189 -12.050 691 HD21 ASN 79 HD21 ASN 79 2.527 -5.876 -9.028 692 HD22 ASN 79 HD22 ASN 79 0.867 -5.303 -8.736 693 H ARG 80 H ARG 80 -0.861 -2.691 -13.078 694 HA ARG 80 HA ARG 80 1.702 -1.396 -13.954 695 HB2 ARG 80 HB2 ARG 80 -0.480 -2.679 -15.638 696 HB3 ARG 80 HB3 ARG 80 0.781 -1.631 -16.280 697 HG2 ARG 80 HG2 ARG 80 1.791 -3.641 -16.628 698 HG3 ARG 80 HG3 ARG 80 2.462 -3.216 -15.060 699 HD2 ARG 80 HD2 ARG 80 0.183 -4.622 -14.337 700 HD3 ARG 80 HD3 ARG 80 0.595 -5.415 -15.844 701 HE ARG 80 HE ARG 80 1.975 -5.597 -13.292 702 HH11 ARG 80 HH11 ARG 80 3.644 -6.866 -12.978 703 HH12 ARG 80 HH12 ARG 80 4.618 -7.436 -14.313 704 HH21 ARG 80 HH21 ARG 80 2.685 -5.896 -16.718 705 HH22 ARG 80 HH22 ARG 80 4.083 -6.888 -16.405 706 H LEU 81 H LEU 81 -1.307 -0.561 -12.799 707 HA LEU 81 HA LEU 81 -1.566 1.995 -14.189 708 HB2 LEU 81 HB2 LEU 81 -3.430 0.689 -13.214 709 HB3 LEU 81 HB3 LEU 81 -2.817 0.990 -11.594 710 HG LEU 81 HG LEU 81 -3.466 3.315 -13.446 711 HD11 LEU 81 HD11 LEU 81 -5.459 1.786 -11.722 712 HD12 LEU 81 HD12 LEU 81 -5.774 3.318 -12.569 713 HD13 LEU 81 HD13 LEU 81 -5.440 1.852 -13.499 714 HD21 LEU 81 HD21 LEU 81 -2.412 3.888 -11.265 715 HD22 LEU 81 HD22 LEU 81 -4.083 4.437 -11.316 716 HD23 LEU 81 HD23 LEU 81 -3.666 2.965 -10.415 717 H GLY 82 H GLY 82 -0.044 0.871 -11.169 718 HA2 GLY 82 HA2 GLY 82 0.723 3.542 -10.323 719 HA3 GLY 82 HA3 GLY 82 1.216 2.019 -9.586 720 H ARG 83 H ARG 83 1.734 3.325 -12.884 721 HA ARG 83 HA ARG 83 4.713 3.075 -12.572 722 HB2 ARG 83 HB2 ARG 83 3.123 2.217 -15.020 723 HB3 ARG 83 HB3 ARG 83 4.861 2.047 -14.772 724 HG2 ARG 83 HG2 ARG 83 2.714 0.559 -13.210 725 HG3 ARG 83 HG3 ARG 83 3.629 -0.069 -14.581 726 HD2 ARG 83 HD2 ARG 83 5.736 0.195 -13.264 727 HD3 ARG 83 HD3 ARG 83 4.778 0.725 -11.879 728 HE ARG 83 HE ARG 83 3.627 -1.452 -11.873 729 HH11 ARG 83 HH11 ARG 83 3.772 -3.580 -11.894 730 HH12 ARG 83 HH12 ARG 83 5.128 -4.391 -12.646 731 HH21 ARG 83 HH21 ARG 83 6.584 -1.487 -13.770 732 HH22 ARG 83 HH22 ARG 83 6.681 -3.222 -13.710 733 H THR 84 H THR 84 5.717 3.881 -14.717 734 HA THR 84 HA THR 84 4.762 6.656 -15.320 735 HB THR 84 HB THR 84 6.580 6.398 -13.614 736 HG1 THR 84 HG1 THR 84 7.826 8.034 -14.459 737 HG21 THR 84 HG21 THR 84 8.310 5.547 -15.971 738 HG22 THR 84 HG22 THR 84 8.836 5.853 -14.302 739 HG23 THR 84 HG23 THR 84 7.769 4.482 -14.653 740 H ASN 85 H ASN 85 4.919 3.858 -16.869 741 HA ASN 85 HA ASN 85 6.708 4.571 -19.051 742 HB2 ASN 85 HB2 ASN 85 5.058 2.063 -18.550 743 HB3 ASN 85 HB3 ASN 85 6.252 2.251 -19.832 744 HD21 ASN 85 HD21 ASN 85 7.583 1.067 -16.290 745 HD22 ASN 85 HD22 ASN 85 5.904 0.950 -16.806 746 H ASN 86 H ASN 86 5.054 6.472 -19.248 747 HA ASN 86 HA ASN 86 3.225 5.934 -21.552 748 HB2 ASN 86 HB2 ASN 86 1.517 7.318 -20.481 749 HB3 ASN 86 HB3 ASN 86 1.948 5.964 -19.447 750 HD21 ASN 86 HD21 ASN 86 2.844 9.790 -18.234 751 HD22 ASN 86 HD22 ASN 86 2.537 9.462 -19.941 752 H LEU 87 H LEU 87 6.000 7.202 -21.321 753 HA LEU 87 HA LEU 87 5.441 9.759 -22.691 754 HB2 LEU 87 HB2 LEU 87 5.639 9.816 -20.009 755 HB3 LEU 87 HB3 LEU 87 7.349 9.725 -20.310 756 HG LEU 87 HG LEU 87 6.490 11.974 -19.830 757 HD11 LEU 87 HD11 LEU 87 7.533 11.860 -22.673 758 HD12 LEU 87 HD12 LEU 87 7.555 13.261 -21.585 759 HD13 LEU 87 HD13 LEU 87 8.519 11.824 -21.198 760 HD21 LEU 87 HD21 LEU 87 4.257 11.714 -20.910 761 HD22 LEU 87 HD22 LEU 87 5.086 13.227 -21.316 762 HD23 LEU 87 HD23 LEU 87 5.039 11.906 -22.495 763 H LYS 88 H LYS 88 6.224 7.588 -23.923 764 HA LYS 88 HA LYS 88 9.157 7.800 -24.478 765 HB2 LYS 88 HB2 LYS 88 8.229 5.604 -23.847 766 HB3 LYS 88 HB3 LYS 88 7.114 5.657 -25.221 767 HG2 LYS 88 HG2 LYS 88 8.949 5.595 -26.798 768 HG3 LYS 88 HG3 LYS 88 10.143 5.792 -25.489 769 HD2 LYS 88 HD2 LYS 88 9.412 3.608 -24.532 770 HD3 LYS 88 HD3 LYS 88 8.306 3.381 -25.893 771 HE2 LYS 88 HE2 LYS 88 11.337 3.726 -26.119 772 HE3 LYS 88 HE3 LYS 88 10.514 2.165 -26.073 773 HZ1 LYS 88 HZ1 LYS 88 10.132 4.219 -28.184 774 HZ2 LYS 88 HZ2 LYS 88 10.957 2.825 -28.348 775 HZ3 LYS 88 HZ3 LYS 88 9.344 2.786 -28.119 776 H THR 89 H THR 89 6.038 8.507 -25.839 777 HA THR 89 HA THR 89 7.184 9.904 -28.089 778 HB THR 89 HB THR 89 7.150 7.649 -29.026 779 HG1 THR 89 HG1 THR 89 5.912 8.167 -30.827 780 HG21 THR 89 HG21 THR 89 4.126 7.629 -28.716 781 HG22 THR 89 HG22 THR 89 5.180 6.336 -29.336 782 HG23 THR 89 HG23 THR 89 5.218 6.764 -27.614 783 H ILE 90 H ILE 90 6.092 11.736 -28.022 784 HA ILE 90 HA ILE 90 3.158 11.756 -27.740 785 HB ILE 90 HB ILE 90 3.515 13.734 -26.157 786 HG12 ILE 90 HG12 ILE 90 5.896 14.120 -26.391 787 HG13 ILE 90 HG13 ILE 90 5.326 13.972 -24.747 788 HG21 ILE 90 HG21 ILE 90 4.132 11.006 -25.010 789 HG22 ILE 90 HG22 ILE 90 3.424 12.401 -24.174 790 HG23 ILE 90 HG23 ILE 90 2.531 11.603 -25.474 791 HD11 ILE 90 HD11 ILE 90 7.069 11.987 -26.243 792 HD12 ILE 90 HD12 ILE 90 7.446 12.945 -24.821 793 HD13 ILE 90 HD13 ILE 90 6.286 11.615 -24.688 794 H GLY 91 H GLY 91 5.478 12.643 -29.790 795 HA2 GLY 91 HA2 GLY 91 5.745 14.303 -31.373 796 HA3 GLY 91 HA3 GLY 91 4.154 14.940 -30.936 797 H ILE 92 H ILE 92 6.110 14.783 -28.212 798 HA ILE 92 HA ILE 92 7.096 16.266 -26.840 799 HB ILE 92 HB ILE 92 8.506 17.223 -29.349 800 HG12 ILE 92 HG12 ILE 92 8.561 14.766 -29.326 801 HG13 ILE 92 HG13 ILE 92 10.139 15.445 -29.027 802 HG21 ILE 92 HG21 ILE 92 9.339 17.248 -26.423 803 HG22 ILE 92 HG22 ILE 92 10.512 17.351 -27.754 804 HG23 ILE 92 HG23 ILE 92 9.299 18.599 -27.577 805 HD11 ILE 92 HD11 ILE 92 8.306 14.295 -26.877 806 HD12 ILE 92 HD12 ILE 92 9.703 13.488 -27.606 807 HD13 ILE 92 HD13 ILE 92 9.944 14.931 -26.610 808 H LEU 93 H LEU 93 4.567 17.080 -27.888 809 HA LEU 93 HA LEU 93 3.125 18.759 -28.139 810 HB2 LEU 93 HB2 LEU 93 3.985 18.925 -25.681 811 HB3 LEU 93 HB3 LEU 93 4.783 20.397 -26.211 812 HG LEU 93 HG LEU 93 2.495 21.314 -26.858 813 HD11 LEU 93 HD11 LEU 93 1.520 18.799 -25.428 814 HD12 LEU 93 HD12 LEU 93 0.512 20.197 -25.866 815 HD13 LEU 93 HD13 LEU 93 1.238 19.210 -27.137 816 HD21 LEU 93 HD21 LEU 93 3.563 21.851 -24.705 817 HD22 LEU 93 HD22 LEU 93 1.804 21.738 -24.541 818 HD23 LEU 93 HD23 LEU 93 2.835 20.404 -23.972 819 H GLN 94 H GLN 94 5.447 18.782 -29.955 820 HA GLN 94 HA GLN 94 5.596 21.634 -30.824 821 HB2 GLN 94 HB2 GLN 94 7.179 19.129 -31.498 822 HB3 GLN 94 HB3 GLN 94 7.326 20.610 -32.436 823 HG2 GLN 94 HG2 GLN 94 7.819 20.487 -29.430 824 HG3 GLN 94 HG3 GLN 94 9.075 20.286 -30.645 825 HE21 GLN 94 HE21 GLN 94 9.143 23.767 -31.557 826 HE22 GLN 94 HE22 GLN 94 9.489 22.149 -32.155 827 H GLU 95 H GLU 95 4.349 18.486 -31.881 828 HA GLU 95 HA GLU 95 2.786 19.833 -34.025 829 HB2 GLU 95 HB2 GLU 95 4.441 17.301 -34.404 830 HB3 GLU 95 HB3 GLU 95 3.218 17.897 -35.531 831 HG2 GLU 95 HG2 GLU 95 4.525 20.011 -35.806 832 HG3 GLU 95 HG3 GLU 95 5.791 19.341 -34.772 833 H GLU 96 H GLU 96 0.774 18.955 -34.408 834 HA GLU 96 HA GLU 96 -0.056 16.425 -33.127 835 HB2 GLU 96 HB2 GLU 96 -0.460 18.197 -31.420 836 HB3 GLU 96 HB3 GLU 96 -1.479 19.064 -32.573 837 HG2 GLU 96 HG2 GLU 96 -3.023 17.109 -32.663 838 HG3 GLU 96 HG3 GLU 96 -1.969 16.225 -31.558 839 H VAL 97 H VAL 97 -0.738 15.314 -34.769 840 HA VAL 97 HA VAL 97 -2.826 16.399 -36.553 841 HB VAL 97 HB VAL 97 -0.340 14.942 -37.564 842 HG11 VAL 97 HG11 VAL 97 -2.764 15.988 -39.087 843 HG12 VAL 97 HG12 VAL 97 -1.291 15.315 -39.815 844 HG13 VAL 97 HG13 VAL 97 -2.337 14.277 -38.850 845 HG21 VAL 97 HG21 VAL 97 0.188 17.299 -37.164 846 HG22 VAL 97 HG22 VAL 97 0.070 17.003 -38.897 847 HG23 VAL 97 HG23 VAL 97 -1.271 17.804 -38.047 848 H SER 98 H SER 98 -4.421 14.921 -36.949 849 HA SER 98 HA SER 98 -4.001 12.072 -36.935 850 HB2 SER 98 HB2 SER 98 -3.946 12.358 -34.506 851 HB3 SER 98 HB3 SER 98 -5.507 13.188 -34.538 852 HG SER 98 HG SER 98 -5.665 10.928 -34.023 853 H SER 99 H SER 99 -6.868 14.010 -35.907 854 HA SER 99 HA SER 99 -8.555 12.635 -37.849 855 HB2 SER 99 HB2 SER 99 -10.362 13.918 -36.726 856 HB3 SER 99 HB3 SER 99 -9.358 12.976 -35.608 857 HG SER 99 HG SER 99 -9.729 15.123 -34.853 858 H MET 100 H MET 100 -6.925 15.686 -37.761 859 HA MET 100 HA MET 100 -8.241 16.546 -40.312 860 HB2 MET 100 HB2 MET 100 -7.228 18.276 -38.017 861 HB3 MET 100 HB3 MET 100 -7.730 18.876 -39.604 862 HG2 MET 100 HG2 MET 100 -10.006 18.015 -39.244 863 HG3 MET 100 HG3 MET 100 -9.519 17.309 -37.706 864 HE1 MET 100 HE1 MET 100 -10.374 20.583 -39.664 865 HE2 MET 100 HE2 MET 100 -10.054 21.856 -38.467 866 HE3 MET 100 HE3 MET 100 -8.700 20.973 -39.198 867 H GLU 101 H GLU 101 -6.853 16.191 -41.902 868 HA GLU 101 HA GLU 101 -3.999 16.975 -41.656 869 HB2 GLU 101 HB2 GLU 101 -4.203 14.561 -41.055 870 HB3 GLU 101 HB3 GLU 101 -4.897 14.238 -42.643 871 HG2 GLU 101 HG2 GLU 101 -2.762 15.131 -43.682 872 HG3 GLU 101 HG3 GLU 101 -2.118 15.374 -42.067 873 H ALA 102 H ALA 102 -4.979 18.774 -42.901 874 HA ALA 102 HA ALA 102 -4.833 18.290 -45.810 875 HB1 ALA 102 HB1 ALA 102 -7.245 19.594 -44.465 876 HB2 ALA 102 HB2 ALA 102 -6.958 19.491 -46.216 877 HB3 ALA 102 HB3 ALA 102 -7.230 18.012 -45.277 878 H LYS 103 H LYS 103 -4.268 20.079 -47.017 879 HA LYS 103 HA LYS 103 -3.774 22.701 -45.704 880 HB2 LYS 103 HB2 LYS 103 -1.665 21.192 -47.300 881 HB3 LYS 103 HB3 LYS 103 -1.547 22.862 -46.732 882 HG2 LYS 103 HG2 LYS 103 -1.773 22.006 -44.354 883 HG3 LYS 103 HG3 LYS 103 -1.740 20.362 -44.997 884 HD2 LYS 103 HD2 LYS 103 0.463 20.790 -44.274 885 HD3 LYS 103 HD3 LYS 103 0.486 20.841 -46.033 886 HE2 LYS 103 HE2 LYS 103 1.866 22.628 -45.272 887 HE3 LYS 103 HE3 LYS 103 0.399 23.366 -45.913 888 HZ1 LYS 103 HZ1 LYS 103 0.960 22.884 -43.028 889 HZ2 LYS 103 HZ2 LYS 103 1.053 24.331 -43.770 890 HZ3 LYS 103 HZ3 LYS 103 -0.394 23.598 -43.604 891 H SER 104 H SER 104 -3.991 24.437 -47.039 892 HA SER 104 HA SER 104 -4.780 24.022 -49.898 893 HB2 SER 104 HB2 SER 104 -6.426 25.473 -47.791 894 HB3 SER 104 HB3 SER 104 -6.782 25.400 -49.528 895 HG SER 104 HG SER 104 -7.958 23.831 -48.335 896 H MET 105 H MET 105 -2.522 24.931 -49.999 897 HA MET 105 HA MET 105 -2.628 27.900 -50.222 898 HB2 MET 105 HB2 MET 105 -0.642 26.245 -48.662 899 HB3 MET 105 HB3 MET 105 -0.062 27.688 -49.491 900 HG2 MET 105 HG2 MET 105 -2.413 27.690 -47.577 901 HG3 MET 105 HG3 MET 105 -0.751 28.090 -47.129 902 HE1 MET 105 HE1 MET 105 -1.746 30.334 -46.063 903 HE2 MET 105 HE2 MET 105 -2.692 31.523 -46.986 904 HE3 MET 105 HE3 MET 105 -3.375 29.918 -46.646 905 H THR 106 H THR 106 -0.792 28.788 -51.395 906 HA THR 106 HA THR 106 0.228 27.177 -53.654 907 HB THR 106 HB THR 106 -1.944 28.038 -54.386 908 HG1 THR 106 HG1 THR 106 -1.212 29.034 -56.239 909 HG21 THR 106 HG21 THR 106 -0.805 30.828 -53.904 910 HG22 THR 106 HG22 THR 106 -2.353 30.440 -54.689 911 HG23 THR 106 HG23 THR 106 -2.117 30.070 -52.975 912 H TRP 107 H TRP 107 1.743 28.361 -54.956 913 HA TRP 107 HA TRP 107 3.559 29.960 -53.210 914 HB2 TRP 107 HB2 TRP 107 4.099 27.506 -53.573 915 HB3 TRP 107 HB3 TRP 107 4.451 27.908 -55.248 916 HD1 TRP 107 HD1 TRP 107 6.832 28.834 -55.715 917 HE1 TRP 107 HE1 TRP 107 8.884 29.447 -54.288 918 HE3 TRP 107 HE3 TRP 107 4.679 28.587 -51.081 919 HZ2 TRP 107 HZ2 TRP 107 9.503 29.788 -51.483 920 HZ3 TRP 107 HZ3 TRP 107 6.024 29.064 -49.039 921 HH2 TRP 107 HH2 TRP 107 8.430 29.662 -49.229 Start of MODEL 25 1 H1 GLY -5 H1 GLY -5 -32.271 -19.199 28.827 2 H2 GLY -5 H2 GLY -5 -32.173 -19.431 30.447 3 H3 GLY -5 H3 GLY -5 -33.633 -19.218 29.733 4 HA2 GLY -5 HA2 GLY -5 -31.842 -21.517 29.290 5 HA3 GLY -5 HA3 GLY -5 -33.305 -21.541 30.294 6 H SER -4 H SER -4 -33.036 -23.342 28.250 7 HA SER -4 HA SER -4 -34.657 -22.335 25.946 8 HB2 SER -4 HB2 SER -4 -32.911 -24.805 26.204 9 HB3 SER -4 HB3 SER -4 -33.821 -24.312 24.762 10 HG SER -4 HG SER -4 -31.606 -23.635 24.718 11 H HIS -3 H HIS -3 -36.754 -22.730 26.054 12 HA HIS -3 HA HIS -3 -37.759 -25.408 26.933 13 HB2 HIS -3 HB2 HIS -3 -38.778 -22.732 27.964 14 HB3 HIS -3 HB3 HIS -3 -39.636 -24.260 28.132 15 HD2 HIS -3 HD2 HIS -3 -36.893 -22.215 29.732 16 HE1 HIS -3 HE1 HIS -3 -36.907 -25.943 31.811 17 HE2 HIS -3 HE2 HIS -3 -36.000 -23.565 31.819 18 H MET -2 H MET -2 -38.964 -22.266 25.624 19 HA MET -2 HA MET -2 -40.262 -23.675 23.378 20 HB2 MET -2 HB2 MET -2 -41.804 -23.692 25.431 21 HB3 MET -2 HB3 MET -2 -41.878 -21.938 25.297 22 HG2 MET -2 HG2 MET -2 -43.819 -22.932 24.262 23 HG3 MET -2 HG3 MET -2 -42.842 -22.196 22.998 24 HE1 MET -2 HE1 MET -2 -44.303 -23.489 21.195 25 HE2 MET -2 HE2 MET -2 -44.576 -25.245 21.223 26 HE3 MET -2 HE3 MET -2 -45.253 -24.223 22.508 27 H ALA -1 H ALA -1 -38.220 -22.356 22.768 28 HA ALA -1 HA ALA -1 -39.210 -20.002 21.326 29 HB1 ALA -1 HB1 ALA -1 -36.870 -19.848 23.284 30 HB2 ALA -1 HB2 ALA -1 -37.380 -18.548 22.178 31 HB3 ALA -1 HB3 ALA -1 -38.453 -19.072 23.493 32 H SER 0 H SER 0 -38.039 -19.457 19.510 33 HA SER 0 HA SER 0 -35.458 -20.676 18.869 34 HB2 SER 0 HB2 SER 0 -37.067 -22.469 18.249 35 HB3 SER 0 HB3 SER 0 -37.904 -21.334 17.177 36 HG SER 0 HG SER 0 -36.336 -22.625 16.068 37 H MET 1 H MET 1 -34.337 -19.112 17.904 38 HA MET 1 HA MET 1 -35.587 -17.275 15.937 39 HB2 MET 1 HB2 MET 1 -34.283 -16.521 18.565 40 HB3 MET 1 HB3 MET 1 -34.102 -15.431 17.200 41 HG2 MET 1 HG2 MET 1 -36.785 -16.346 18.274 42 HG3 MET 1 HG3 MET 1 -35.979 -14.830 18.663 43 HE1 MET 1 HE1 MET 1 -38.058 -13.395 17.995 44 HE2 MET 1 HE2 MET 1 -38.916 -13.544 16.446 45 HE3 MET 1 HE3 MET 1 -38.957 -14.884 17.614 46 H ASP 2 H ASP 2 -33.340 -19.509 16.149 47 HA ASP 2 HA ASP 2 -31.604 -18.220 14.138 48 HB2 ASP 2 HB2 ASP 2 -30.616 -17.696 16.367 49 HB3 ASP 2 HB3 ASP 2 -30.369 -19.419 16.634 50 HA PRO 3 HA PRO 3 -32.033 -22.616 12.986 51 HB2 PRO 3 HB2 PRO 3 -32.173 -22.361 10.289 52 HB3 PRO 3 HB3 PRO 3 -33.521 -21.837 11.343 53 HG2 PRO 3 HG2 PRO 3 -31.316 -20.122 10.154 54 HG3 PRO 3 HG3 PRO 3 -33.080 -19.822 10.134 55 HD2 PRO 3 HD2 PRO 3 -31.369 -18.725 11.996 56 HD3 PRO 3 HD3 PRO 3 -33.078 -19.108 12.360 57 H LEU 4 H LEU 4 -29.421 -20.621 12.828 58 HA LEU 4 HA LEU 4 -27.642 -22.690 11.607 59 HB2 LEU 4 HB2 LEU 4 -27.447 -19.660 11.446 60 HB3 LEU 4 HB3 LEU 4 -26.222 -20.777 10.858 61 HG LEU 4 HG LEU 4 -29.049 -20.627 9.764 62 HD11 LEU 4 HD11 LEU 4 -26.413 -19.624 8.622 63 HD12 LEU 4 HD12 LEU 4 -27.996 -19.582 7.810 64 HD13 LEU 4 HD13 LEU 4 -27.725 -18.612 9.266 65 HD21 LEU 4 HD21 LEU 4 -28.091 -22.870 9.439 66 HD22 LEU 4 HD22 LEU 4 -28.128 -21.993 7.909 67 HD23 LEU 4 HD23 LEU 4 -26.595 -22.156 8.791 68 H ASP 5 H ASP 5 -28.388 -22.630 14.345 69 HA ASP 5 HA ASP 5 -25.820 -21.925 15.670 70 HB2 ASP 5 HB2 ASP 5 -28.088 -21.104 16.529 71 HB3 ASP 5 HB3 ASP 5 -28.452 -22.790 16.911 72 H LYS 6 H LYS 6 -27.009 -24.532 14.192 73 HA LYS 6 HA LYS 6 -26.277 -26.527 16.302 74 HB2 LYS 6 HB2 LYS 6 -28.167 -27.105 14.003 75 HB3 LYS 6 HB3 LYS 6 -27.948 -27.964 15.516 76 HG2 LYS 6 HG2 LYS 6 -29.780 -26.843 16.202 77 HG3 LYS 6 HG3 LYS 6 -28.671 -25.512 16.478 78 HD2 LYS 6 HD2 LYS 6 -30.479 -24.565 15.251 79 HD3 LYS 6 HD3 LYS 6 -29.163 -24.729 14.092 80 HE2 LYS 6 HE2 LYS 6 -31.150 -25.412 12.979 81 HE3 LYS 6 HE3 LYS 6 -30.197 -26.867 13.261 82 HZ1 LYS 6 HZ1 LYS 6 -32.510 -25.996 14.922 83 HZ2 LYS 6 HZ2 LYS 6 -32.546 -27.194 13.817 84 HZ3 LYS 6 HZ3 LYS 6 -31.649 -27.364 15.165 85 H ILE 7 H ILE 7 -26.409 -26.381 12.779 86 HA ILE 7 HA ILE 7 -23.964 -28.076 12.539 87 HB ILE 7 HB ILE 7 -25.068 -29.151 10.553 88 HG12 ILE 7 HG12 ILE 7 -27.527 -29.247 10.470 89 HG13 ILE 7 HG13 ILE 7 -27.653 -27.978 11.681 90 HG21 ILE 7 HG21 ILE 7 -26.453 -29.610 13.220 91 HG22 ILE 7 HG22 ILE 7 -26.285 -30.761 11.882 92 HG23 ILE 7 HG23 ILE 7 -24.849 -30.227 12.767 93 HD11 ILE 7 HD11 ILE 7 -26.385 -27.619 8.931 94 HD12 ILE 7 HD12 ILE 7 -28.063 -27.212 9.344 95 HD13 ILE 7 HD13 ILE 7 -26.740 -26.334 10.119 96 H ILE 8 H ILE 8 -24.706 -25.081 12.211 97 HA ILE 8 HA ILE 8 -24.559 -24.091 9.700 98 HB ILE 8 HB ILE 8 -24.771 -22.729 11.626 99 HG12 ILE 8 HG12 ILE 8 -22.498 -21.898 9.778 100 HG13 ILE 8 HG13 ILE 8 -24.227 -21.639 9.558 101 HG21 ILE 8 HG21 ILE 8 -21.798 -22.845 12.216 102 HG22 ILE 8 HG22 ILE 8 -23.078 -22.048 13.140 103 HG23 ILE 8 HG23 ILE 8 -23.008 -23.805 13.091 104 HD11 ILE 8 HD11 ILE 8 -22.406 -20.302 11.602 105 HD12 ILE 8 HD12 ILE 8 -23.187 -19.565 10.197 106 HD13 ILE 8 HD13 ILE 8 -24.170 -20.099 11.570 107 H ASN 9 H ASN 9 -23.404 -24.933 8.026 108 HA ASN 9 HA ASN 9 -20.495 -24.481 7.986 109 HB2 ASN 9 HB2 ASN 9 -21.145 -26.889 8.854 110 HB3 ASN 9 HB3 ASN 9 -21.497 -27.220 7.165 111 HD21 ASN 9 HD21 ASN 9 -18.024 -27.444 6.337 112 HD22 ASN 9 HD22 ASN 9 -19.657 -27.365 5.701 113 H ASP 10 H ASP 10 -23.097 -23.618 6.459 114 HA ASP 10 HA ASP 10 -22.537 -24.649 3.842 115 HB2 ASP 10 HB2 ASP 10 -24.821 -24.283 4.839 116 HB3 ASP 10 HB3 ASP 10 -24.559 -22.546 4.717 117 H ILE 11 H ILE 11 -20.850 -22.495 5.254 118 HA ILE 11 HA ILE 11 -20.024 -21.029 2.843 119 HB ILE 11 HB ILE 11 -21.960 -19.804 3.900 120 HG12 ILE 11 HG12 ILE 11 -19.482 -18.060 3.857 121 HG13 ILE 11 HG13 ILE 11 -20.250 -18.719 2.409 122 HG21 ILE 11 HG21 ILE 11 -20.034 -19.093 6.147 123 HG22 ILE 11 HG22 ILE 11 -21.711 -18.556 5.955 124 HG23 ILE 11 HG23 ILE 11 -21.373 -20.254 6.280 125 HD11 ILE 11 HD11 ILE 11 -21.544 -16.844 4.433 126 HD12 ILE 11 HD12 ILE 11 -21.019 -16.452 2.789 127 HD13 ILE 11 HD13 ILE 11 -22.374 -17.571 3.035 128 H LYS 12 H LYS 12 -18.776 -23.005 4.493 129 HA LYS 12 HA LYS 12 -16.269 -21.468 5.090 130 HB2 LYS 12 HB2 LYS 12 -17.448 -23.832 6.582 131 HB3 LYS 12 HB3 LYS 12 -15.744 -23.380 6.717 132 HG2 LYS 12 HG2 LYS 12 -16.292 -21.163 7.526 133 HG3 LYS 12 HG3 LYS 12 -18.022 -21.441 7.319 134 HD2 LYS 12 HD2 LYS 12 -16.272 -23.097 9.194 135 HD3 LYS 12 HD3 LYS 12 -17.156 -21.641 9.689 136 HE2 LYS 12 HE2 LYS 12 -19.286 -22.652 8.957 137 HE3 LYS 12 HE3 LYS 12 -18.431 -24.123 8.466 138 HZ1 LYS 12 HZ1 LYS 12 -18.495 -23.108 11.253 139 HZ2 LYS 12 HZ2 LYS 12 -19.482 -24.277 10.673 140 HZ3 LYS 12 HZ3 LYS 12 -17.864 -24.536 10.752 141 H LYS 13 H LYS 13 -17.431 -24.658 3.997 142 HA LYS 13 HA LYS 13 -15.385 -24.952 2.012 143 HB2 LYS 13 HB2 LYS 13 -14.105 -26.823 3.035 144 HB3 LYS 13 HB3 LYS 13 -13.879 -25.298 3.861 145 HG2 LYS 13 HG2 LYS 13 -15.711 -26.153 5.544 146 HG3 LYS 13 HG3 LYS 13 -15.459 -27.723 4.780 147 HD2 LYS 13 HD2 LYS 13 -14.110 -27.659 6.739 148 HD3 LYS 13 HD3 LYS 13 -12.998 -27.524 5.366 149 HE2 LYS 13 HE2 LYS 13 -12.882 -25.063 5.703 150 HE3 LYS 13 HE3 LYS 13 -14.068 -25.174 7.008 151 HZ1 LYS 13 HZ1 LYS 13 -11.372 -26.422 7.059 152 HZ2 LYS 13 HZ2 LYS 13 -11.802 -25.076 7.874 153 HZ3 LYS 13 HZ3 LYS 13 -12.468 -26.511 8.267 154 H GLU 14 H GLU 14 -15.936 -26.422 0.520 155 HA GLU 14 HA GLU 14 -17.449 -28.839 1.182 156 HB2 GLU 14 HB2 GLU 14 -19.073 -26.750 0.820 157 HB3 GLU 14 HB3 GLU 14 -18.774 -27.072 -0.883 158 HG2 GLU 14 HG2 GLU 14 -19.578 -29.453 -0.492 159 HG3 GLU 14 HG3 GLU 14 -19.847 -29.043 1.197 160 H ALA 15 H ALA 15 -14.837 -27.956 -0.249 161 HA ALA 15 HA ALA 15 -15.170 -29.512 -2.769 162 HB1 ALA 15 HB1 ALA 15 -14.033 -26.698 -2.557 163 HB2 ALA 15 HB2 ALA 15 -14.058 -27.699 -4.026 164 HB3 ALA 15 HB3 ALA 15 -15.582 -27.147 -3.307 165 H ASN 16 H ASN 16 -13.208 -30.158 -3.799 166 HA ASN 16 HA ASN 16 -11.265 -31.097 -1.829 167 HB2 ASN 16 HB2 ASN 16 -12.428 -32.486 -3.617 168 HB3 ASN 16 HB3 ASN 16 -11.411 -31.682 -4.814 169 HD21 ASN 16 HD21 ASN 16 -9.798 -34.476 -2.256 170 HD22 ASN 16 HD22 ASN 16 -11.343 -33.737 -1.871 171 H ASP 17 H ASP 17 -11.160 -28.898 -4.633 172 HA ASP 17 HA ASP 17 -8.693 -27.661 -3.598 173 HB2 ASP 17 HB2 ASP 17 -8.898 -28.924 -6.357 174 HB3 ASP 17 HB3 ASP 17 -7.846 -27.550 -6.048 175 H SER 18 H SER 18 -9.063 -25.555 -3.519 176 HA SER 18 HA SER 18 -10.552 -24.113 -5.645 177 HB2 SER 18 HB2 SER 18 -11.307 -24.000 -2.695 178 HB3 SER 18 HB3 SER 18 -11.953 -22.945 -3.966 179 HG SER 18 HG SER 18 -13.375 -24.637 -3.585 180 H GLY 19 H GLY 19 -7.824 -24.039 -5.331 181 HA2 GLY 19 HA2 GLY 19 -7.417 -21.187 -4.774 182 HA3 GLY 19 HA3 GLY 19 -6.551 -22.290 -3.687 183 H VAL 20 H VAL 20 -7.213 -21.997 -7.172 184 HA VAL 20 HA VAL 20 -4.324 -22.171 -7.852 185 HB VAL 20 HB VAL 20 -5.325 -24.423 -7.649 186 HG11 VAL 20 HG11 VAL 20 -7.058 -23.656 -10.022 187 HG12 VAL 20 HG12 VAL 20 -6.907 -25.273 -9.298 188 HG13 VAL 20 HG13 VAL 20 -7.611 -23.949 -8.357 189 HG21 VAL 20 HG21 VAL 20 -3.393 -24.027 -9.154 190 HG22 VAL 20 HG22 VAL 20 -4.395 -25.430 -9.560 191 HG23 VAL 20 HG23 VAL 20 -4.526 -23.954 -10.525 192 H THR 21 H THR 21 -6.537 -20.098 -8.038 193 HA THR 21 HA THR 21 -6.299 -19.399 -10.931 194 HB THR 21 HB THR 21 -8.920 -18.967 -9.573 195 HG1 THR 21 HG1 THR 21 -9.643 -20.968 -10.278 196 HG21 THR 21 HG21 THR 21 -8.122 -19.677 -12.434 197 HG22 THR 21 HG22 THR 21 -9.768 -19.297 -11.878 198 HG23 THR 21 HG23 THR 21 -8.521 -18.046 -11.853 199 H LEU 22 H LEU 22 -6.517 -17.189 -11.450 200 HA LEU 22 HA LEU 22 -5.719 -15.411 -9.214 201 HB2 LEU 22 HB2 LEU 22 -5.173 -15.030 -12.185 202 HB3 LEU 22 HB3 LEU 22 -4.458 -14.173 -10.827 203 HG LEU 22 HG LEU 22 -3.837 -16.775 -10.184 204 HD11 LEU 22 HD11 LEU 22 -3.541 -16.553 -13.212 205 HD12 LEU 22 HD12 LEU 22 -2.919 -17.864 -12.186 206 HD13 LEU 22 HD13 LEU 22 -4.662 -17.641 -12.370 207 HD21 LEU 22 HD21 LEU 22 -2.270 -14.875 -10.141 208 HD22 LEU 22 HD22 LEU 22 -1.549 -16.262 -10.971 209 HD23 LEU 22 HD23 LEU 22 -2.178 -14.892 -11.917 210 H ALA 23 H ALA 23 -8.431 -15.842 -9.602 211 HA ALA 23 HA ALA 23 -9.543 -13.299 -10.706 212 HB1 ALA 23 HB1 ALA 23 -10.038 -16.124 -11.723 213 HB2 ALA 23 HB2 ALA 23 -10.855 -14.646 -12.301 214 HB3 ALA 23 HB3 ALA 23 -9.101 -14.865 -12.540 215 HA PRO 24 HA PRO 24 -11.694 -14.849 -6.951 216 HB2 PRO 24 HB2 PRO 24 -12.151 -12.492 -5.648 217 HB3 PRO 24 HB3 PRO 24 -10.546 -13.280 -5.717 218 HG2 PRO 24 HG2 PRO 24 -11.591 -11.038 -7.479 219 HG3 PRO 24 HG3 PRO 24 -10.030 -11.125 -6.602 220 HD2 PRO 24 HD2 PRO 24 -10.246 -11.789 -9.241 221 HD3 PRO 24 HD3 PRO 24 -9.139 -12.672 -8.145 222 H LEU 25 H LEU 25 -12.940 -12.312 -9.102 223 HA LEU 25 HA LEU 25 -15.640 -13.476 -8.943 224 HB2 LEU 25 HB2 LEU 25 -15.253 -11.530 -7.191 225 HB3 LEU 25 HB3 LEU 25 -15.439 -10.473 -8.579 226 HG LEU 25 HG LEU 25 -17.447 -12.556 -7.584 227 HD11 LEU 25 HD11 LEU 25 -17.499 -9.514 -7.425 228 HD12 LEU 25 HD12 LEU 25 -18.777 -10.616 -6.862 229 HD13 LEU 25 HD13 LEU 25 -17.194 -10.627 -6.072 230 HD21 LEU 25 HD21 LEU 25 -17.789 -12.229 -9.990 231 HD22 LEU 25 HD22 LEU 25 -19.090 -11.458 -9.082 232 HD23 LEU 25 HD23 LEU 25 -17.789 -10.463 -9.770 233 H SER 26 H SER 26 -14.381 -14.092 -10.949 234 HA SER 26 HA SER 26 -13.838 -14.002 -13.148 235 HB2 SER 26 HB2 SER 26 -15.897 -11.782 -13.345 236 HB3 SER 26 HB3 SER 26 -15.138 -12.608 -14.713 237 HG SER 26 HG SER 26 -17.178 -13.522 -14.143 238 H VAL 27 H VAL 27 -12.923 -12.646 -14.931 239 HA VAL 27 HA VAL 27 -11.221 -11.454 -15.750 240 HB VAL 27 HB VAL 27 -12.226 -9.469 -13.725 241 HG11 VAL 27 HG11 VAL 27 -10.300 -8.776 -15.973 242 HG12 VAL 27 HG12 VAL 27 -11.107 -7.660 -14.877 243 HG13 VAL 27 HG13 VAL 27 -9.898 -8.765 -14.234 244 HG21 VAL 27 HG21 VAL 27 -13.782 -10.055 -15.529 245 HG22 VAL 27 HG22 VAL 27 -13.225 -8.389 -15.691 246 HG23 VAL 27 HG23 VAL 27 -12.545 -9.652 -16.741 247 HA PRO 28 HA PRO 28 -7.471 -12.151 -13.315 248 HB2 PRO 28 HB2 PRO 28 -5.618 -10.819 -14.837 249 HB3 PRO 28 HB3 PRO 28 -6.310 -12.403 -15.282 250 HG2 PRO 28 HG2 PRO 28 -7.235 -9.663 -16.224 251 HG3 PRO 28 HG3 PRO 28 -6.832 -11.098 -17.225 252 HD2 PRO 28 HD2 PRO 28 -9.385 -10.583 -16.579 253 HD3 PRO 28 HD3 PRO 28 -8.779 -12.253 -16.511 254 H LYS 29 H LYS 29 -8.650 -10.920 -11.765 255 HA LYS 29 HA LYS 29 -9.009 -9.347 -10.189 256 HB2 LYS 29 HB2 LYS 29 -6.840 -10.345 -9.614 257 HB3 LYS 29 HB3 LYS 29 -6.003 -9.046 -10.456 258 HG2 LYS 29 HG2 LYS 29 -5.990 -8.681 -8.031 259 HG3 LYS 29 HG3 LYS 29 -6.860 -7.402 -8.843 260 HD2 LYS 29 HD2 LYS 29 -9.012 -8.341 -8.156 261 HD3 LYS 29 HD3 LYS 29 -8.204 -9.791 -7.506 262 HE2 LYS 29 HE2 LYS 29 -7.041 -8.422 -5.826 263 HE3 LYS 29 HE3 LYS 29 -7.725 -6.945 -6.517 264 HZ1 LYS 29 HZ1 LYS 29 -9.284 -9.105 -5.198 265 HZ2 LYS 29 HZ2 LYS 29 -9.009 -7.610 -4.599 266 HZ3 LYS 29 HZ3 LYS 29 -9.951 -7.791 -5.914 267 HA PRO 30 HA PRO 30 -9.363 -5.635 -12.825 268 HB2 PRO 30 HB2 PRO 30 -11.857 -4.807 -12.007 269 HB3 PRO 30 HB3 PRO 30 -11.583 -6.094 -13.216 270 HG2 PRO 30 HG2 PRO 30 -12.111 -6.405 -10.246 271 HG3 PRO 30 HG3 PRO 30 -12.893 -7.274 -11.606 272 HD2 PRO 30 HD2 PRO 30 -10.852 -8.353 -10.187 273 HD3 PRO 30 HD3 PRO 30 -10.989 -8.634 -11.947 274 H LYS 31 H LYS 31 -9.399 -3.359 -12.401 275 HA LYS 31 HA LYS 31 -7.838 -2.592 -10.161 276 HB2 LYS 31 HB2 LYS 31 -7.927 -0.370 -10.972 277 HB3 LYS 31 HB3 LYS 31 -7.737 -1.469 -12.333 278 HG2 LYS 31 HG2 LYS 31 -10.094 -1.176 -12.963 279 HG3 LYS 31 HG3 LYS 31 -10.400 -0.214 -11.505 280 HD2 LYS 31 HD2 LYS 31 -8.774 1.492 -12.274 281 HD3 LYS 31 HD3 LYS 31 -8.526 0.571 -13.775 282 HE2 LYS 31 HE2 LYS 31 -10.889 0.839 -14.374 283 HE3 LYS 31 HE3 LYS 31 -11.235 1.606 -12.820 284 HZ1 LYS 31 HZ1 LYS 31 -9.437 2.745 -14.894 285 HZ2 LYS 31 HZ2 LYS 31 -10.955 3.255 -14.581 286 HZ3 LYS 31 HZ3 LYS 31 -9.790 3.447 -13.458 287 H LEU 32 H LEU 32 -8.165 -1.202 -8.396 288 HA LEU 32 HA LEU 32 -10.914 -0.603 -7.523 289 HB2 LEU 32 HB2 LEU 32 -10.084 -2.853 -6.640 290 HB3 LEU 32 HB3 LEU 32 -8.730 -1.985 -5.913 291 HG LEU 32 HG LEU 32 -10.346 -0.640 -4.605 292 HD11 LEU 32 HD11 LEU 32 -12.348 -2.696 -5.657 293 HD12 LEU 32 HD12 LEU 32 -12.658 -1.587 -4.309 294 HD13 LEU 32 HD13 LEU 32 -12.411 -0.942 -5.933 295 HD21 LEU 32 HD21 LEU 32 -9.195 -2.553 -3.609 296 HD22 LEU 32 HD22 LEU 32 -10.840 -2.426 -2.963 297 HD23 LEU 32 HD23 LEU 32 -10.462 -3.651 -4.197 298 H GLU 33 H GLU 33 -11.010 1.187 -6.063 299 HA GLU 33 HA GLU 33 -8.551 2.619 -5.363 300 HB2 GLU 33 HB2 GLU 33 -9.297 4.751 -6.425 301 HB3 GLU 33 HB3 GLU 33 -8.881 3.495 -7.579 302 HG2 GLU 33 HG2 GLU 33 -11.272 2.996 -7.967 303 HG3 GLU 33 HG3 GLU 33 -11.737 4.215 -6.785 304 H GLU 34 H GLU 34 -9.796 1.405 -3.625 305 HA GLU 34 HA GLU 34 -11.594 3.308 -2.147 306 HB2 GLU 34 HB2 GLU 34 -11.560 0.278 -2.160 307 HB3 GLU 34 HB3 GLU 34 -12.393 1.262 -0.940 308 HG2 GLU 34 HG2 GLU 34 -13.526 2.457 -2.947 309 HG3 GLU 34 HG3 GLU 34 -12.974 1.088 -3.911 310 H LEU 35 H LEU 35 -9.970 4.483 -1.269 311 HA LEU 35 HA LEU 35 -8.893 3.398 1.289 312 HB2 LEU 35 HB2 LEU 35 -7.539 5.243 -0.719 313 HB3 LEU 35 HB3 LEU 35 -6.976 5.033 0.926 314 HG LEU 35 HG LEU 35 -7.276 2.484 -0.607 315 HD11 LEU 35 HD11 LEU 35 -5.054 4.404 -1.340 316 HD12 LEU 35 HD12 LEU 35 -5.300 2.739 -1.924 317 HD13 LEU 35 HD13 LEU 35 -6.446 4.003 -2.371 318 HD21 LEU 35 HD21 LEU 35 -6.292 2.568 1.657 319 HD22 LEU 35 HD22 LEU 35 -5.133 1.981 0.456 320 HD23 LEU 35 HD23 LEU 35 -5.008 3.647 1.056 321 H SER 36 H SER 36 -8.893 5.001 2.985 322 HA SER 36 HA SER 36 -10.894 7.161 2.766 323 HB2 SER 36 HB2 SER 36 -8.931 6.458 4.984 324 HB3 SER 36 HB3 SER 36 -10.200 7.695 5.082 325 HG SER 36 HG SER 36 -10.890 5.698 5.973 326 H GLU 37 H GLU 37 -10.234 9.503 3.320 327 HA GLU 37 HA GLU 37 -8.463 10.446 1.368 328 HB2 GLU 37 HB2 GLU 37 -10.248 11.748 2.448 329 HB3 GLU 37 HB3 GLU 37 -9.305 11.834 3.942 330 HG2 GLU 37 HG2 GLU 37 -7.543 13.117 2.776 331 HG3 GLU 37 HG3 GLU 37 -8.402 12.940 1.244 332 H GLN 38 H GLN 38 -7.665 9.955 4.834 333 HA GLN 38 HA GLN 38 -4.895 10.813 4.529 334 HB2 GLN 38 HB2 GLN 38 -6.238 10.848 6.682 335 HB3 GLN 38 HB3 GLN 38 -6.171 9.083 6.690 336 HG2 GLN 38 HG2 GLN 38 -3.577 9.372 6.620 337 HG3 GLN 38 HG3 GLN 38 -3.880 11.068 6.989 338 HE21 GLN 38 HE21 GLN 38 -4.508 8.169 9.861 339 HE22 GLN 38 HE22 GLN 38 -4.355 7.702 8.173 340 H GLN 39 H GLN 39 -6.557 7.636 4.504 341 HA GLN 39 HA GLN 39 -4.177 6.042 4.371 342 HB2 GLN 39 HB2 GLN 39 -7.025 5.476 3.536 343 HB3 GLN 39 HB3 GLN 39 -5.717 4.294 3.425 344 HG2 GLN 39 HG2 GLN 39 -5.262 4.600 5.872 345 HG3 GLN 39 HG3 GLN 39 -6.693 5.626 5.987 346 HE21 GLN 39 HE21 GLN 39 -7.434 1.946 6.771 347 HE22 GLN 39 HE22 GLN 39 -6.087 2.958 7.266 348 H LYS 40 H LYS 40 -6.162 7.533 1.810 349 HA LYS 40 HA LYS 40 -4.783 6.399 -0.428 350 HB2 LYS 40 HB2 LYS 40 -6.968 7.546 -0.551 351 HB3 LYS 40 HB3 LYS 40 -6.226 9.079 -0.081 352 HG2 LYS 40 HG2 LYS 40 -4.879 9.113 -2.128 353 HG3 LYS 40 HG3 LYS 40 -5.502 7.530 -2.612 354 HD2 LYS 40 HD2 LYS 40 -7.249 9.995 -2.178 355 HD3 LYS 40 HD3 LYS 40 -6.548 9.543 -3.742 356 HE2 LYS 40 HE2 LYS 40 -7.710 7.326 -3.594 357 HE3 LYS 40 HE3 LYS 40 -8.491 7.858 -2.098 358 HZ1 LYS 40 HZ1 LYS 40 -8.803 9.172 -4.749 359 HZ2 LYS 40 HZ2 LYS 40 -9.921 8.225 -4.031 360 HZ3 LYS 40 HZ3 LYS 40 -9.529 9.666 -3.372 361 H ILE 41 H ILE 41 -4.113 9.371 1.502 362 HA ILE 41 HA ILE 41 -1.831 10.167 -0.059 363 HB ILE 41 HB ILE 41 -2.483 10.774 2.808 364 HG12 ILE 41 HG12 ILE 41 -2.850 12.643 0.415 365 HG13 ILE 41 HG13 ILE 41 -4.125 11.533 0.863 366 HG21 ILE 41 HG21 ILE 41 -0.485 12.115 0.947 367 HG22 ILE 41 HG22 ILE 41 -0.981 12.766 2.523 368 HG23 ILE 41 HG23 ILE 41 -0.125 11.236 2.449 369 HD11 ILE 41 HD11 ILE 41 -3.022 13.739 2.638 370 HD12 ILE 41 HD12 ILE 41 -4.608 13.666 1.846 371 HD13 ILE 41 HD13 ILE 41 -4.219 12.521 3.141 372 H ILE 42 H ILE 42 -2.054 8.132 2.961 373 HA ILE 42 HA ILE 42 0.802 7.831 3.204 374 HB ILE 42 HB ILE 42 -1.441 5.995 4.104 375 HG12 ILE 42 HG12 ILE 42 0.143 7.849 5.914 376 HG13 ILE 42 HG13 ILE 42 -1.260 8.458 5.048 377 HG21 ILE 42 HG21 ILE 42 1.514 6.050 4.883 378 HG22 ILE 42 HG22 ILE 42 0.278 5.112 5.731 379 HG23 ILE 42 HG23 ILE 42 0.660 4.727 4.061 380 HD11 ILE 42 HD11 ILE 42 -1.306 6.085 6.956 381 HD12 ILE 42 HD12 ILE 42 -1.928 7.713 7.266 382 HD13 ILE 42 HD13 ILE 42 -2.684 6.697 6.015 383 H LEU 43 H LEU 43 -1.659 5.828 1.588 384 HA LEU 43 HA LEU 43 -0.000 3.782 0.557 385 HB2 LEU 43 HB2 LEU 43 -2.433 3.733 0.753 386 HB3 LEU 43 HB3 LEU 43 -2.613 5.016 -0.424 387 HG LEU 43 HG LEU 43 -3.180 2.677 -1.105 388 HD11 LEU 43 HD11 LEU 43 -1.123 4.016 -2.897 389 HD12 LEU 43 HD12 LEU 43 -2.379 2.865 -3.373 390 HD13 LEU 43 HD13 LEU 43 -2.834 4.466 -2.764 391 HD21 LEU 43 HD21 LEU 43 -1.219 1.563 -0.074 392 HD22 LEU 43 HD22 LEU 43 -1.431 1.140 -1.784 393 HD23 LEU 43 HD23 LEU 43 -0.161 2.282 -1.301 394 H ALA 44 H ALA 44 -1.053 6.863 -0.963 395 HA ALA 44 HA ALA 44 0.465 6.599 -3.349 396 HB1 ALA 44 HB1 ALA 44 -0.531 9.044 -1.835 397 HB2 ALA 44 HB2 ALA 44 0.039 9.049 -3.521 398 HB3 ALA 44 HB3 ALA 44 -1.427 8.140 -3.080 399 H GLU 45 H GLU 45 1.291 8.483 -0.332 400 HA GLU 45 HA GLU 45 3.831 9.351 -1.239 401 HB2 GLU 45 HB2 GLU 45 2.721 8.834 1.543 402 HB3 GLU 45 HB3 GLU 45 4.326 9.500 1.289 403 HG2 GLU 45 HG2 GLU 45 1.835 10.816 0.130 404 HG3 GLU 45 HG3 GLU 45 2.470 11.177 1.732 405 H TYR 46 H TYR 46 2.972 6.126 -0.080 406 HA TYR 46 HA TYR 46 5.702 5.295 0.387 407 HB2 TYR 46 HB2 TYR 46 3.713 4.265 1.422 408 HB3 TYR 46 HB3 TYR 46 3.175 3.698 -0.148 409 HD1 TYR 46 HD1 TYR 46 2.990 1.554 1.231 410 HD2 TYR 46 HD2 TYR 46 6.783 3.378 0.233 411 HE1 TYR 46 HE1 TYR 46 4.146 -0.626 1.559 412 HE2 TYR 46 HE2 TYR 46 7.913 1.186 0.553 413 HH TYR 46 HH TYR 46 6.122 -1.737 1.522 414 H ILE 47 H ILE 47 3.437 4.413 -2.308 415 HA ILE 47 HA ILE 47 5.289 3.279 -4.098 416 HB ILE 47 HB ILE 47 2.620 4.620 -4.319 417 HG12 ILE 47 HG12 ILE 47 3.297 1.686 -4.727 418 HG13 ILE 47 HG13 ILE 47 3.170 2.303 -3.093 419 HG21 ILE 47 HG21 ILE 47 4.185 3.224 -6.519 420 HG22 ILE 47 HG22 ILE 47 2.421 3.443 -6.584 421 HG23 ILE 47 HG23 ILE 47 3.479 4.851 -6.556 422 HD11 ILE 47 HD11 ILE 47 0.919 2.466 -5.145 423 HD12 ILE 47 HD12 ILE 47 1.036 1.325 -3.787 424 HD13 ILE 47 HD13 ILE 47 0.868 3.060 -3.481 425 H ALA 48 H ALA 48 4.283 6.712 -3.660 426 HA ALA 48 HA ALA 48 5.624 7.720 -6.002 427 HB1 ALA 48 HB1 ALA 48 4.702 9.074 -3.436 428 HB2 ALA 48 HB2 ALA 48 5.110 9.901 -4.960 429 HB3 ALA 48 HB3 ALA 48 3.710 8.805 -4.886 430 H GLU 49 H GLU 49 6.782 6.928 -2.773 431 HA GLU 49 HA GLU 49 9.322 8.407 -3.159 432 HB2 GLU 49 HB2 GLU 49 8.200 8.516 -1.000 433 HB3 GLU 49 HB3 GLU 49 8.296 6.753 -0.825 434 HG2 GLU 49 HG2 GLU 49 10.715 6.836 -0.713 435 HG3 GLU 49 HG3 GLU 49 10.733 8.546 -1.166 436 H VAL 50 H VAL 50 8.131 5.003 -3.122 437 HA VAL 50 HA VAL 50 10.962 4.161 -3.724 438 HB VAL 50 HB VAL 50 10.530 2.024 -2.858 439 HG11 VAL 50 HG11 VAL 50 9.538 4.099 -0.869 440 HG12 VAL 50 HG12 VAL 50 10.305 2.542 -0.502 441 HG13 VAL 50 HG13 VAL 50 11.238 3.815 -1.308 442 HG21 VAL 50 HG21 VAL 50 8.073 1.786 -3.391 443 HG22 VAL 50 HG22 VAL 50 8.531 1.296 -1.767 444 HG23 VAL 50 HG23 VAL 50 7.716 2.844 -2.028 445 H GLY 51 H GLY 51 7.815 4.146 -5.183 446 HA2 GLY 51 HA2 GLY 51 7.225 3.444 -7.329 447 HA3 GLY 51 HA3 GLY 51 8.750 2.582 -7.515 448 H LEU 52 H LEU 52 5.788 1.826 -7.794 449 HA LEU 52 HA LEU 52 5.060 0.113 -5.695 450 HB2 LEU 52 HB2 LEU 52 3.545 1.194 -7.319 451 HB3 LEU 52 HB3 LEU 52 4.138 0.188 -8.616 452 HG LEU 52 HG LEU 52 3.116 -1.379 -6.295 453 HD11 LEU 52 HD11 LEU 52 1.196 0.395 -7.833 454 HD12 LEU 52 HD12 LEU 52 0.758 -0.908 -6.696 455 HD13 LEU 52 HD13 LEU 52 1.628 0.521 -6.114 456 HD21 LEU 52 HD21 LEU 52 3.615 -2.365 -8.527 457 HD22 LEU 52 HD22 LEU 52 1.911 -2.565 -8.083 458 HD23 LEU 52 HD23 LEU 52 2.398 -1.301 -9.251 459 H GLN 53 H GLN 53 7.442 -0.414 -7.813 460 HA GLN 53 HA GLN 53 7.249 -3.258 -8.445 461 HB2 GLN 53 HB2 GLN 53 9.518 -1.239 -8.637 462 HB3 GLN 53 HB3 GLN 53 9.621 -2.895 -9.245 463 HG2 GLN 53 HG2 GLN 53 7.886 -2.528 -10.875 464 HG3 GLN 53 HG3 GLN 53 7.467 -0.954 -10.195 465 HE21 GLN 53 HE21 GLN 53 10.270 0.761 -11.640 466 HE22 GLN 53 HE22 GLN 53 9.166 0.784 -10.271 467 H ASN 54 H ASN 54 8.429 -1.508 -5.665 468 HA ASN 54 HA ASN 54 9.603 -4.037 -4.586 469 HB2 ASN 54 HB2 ASN 54 11.456 -2.734 -3.592 470 HB3 ASN 54 HB3 ASN 54 11.453 -2.644 -5.354 471 HD21 ASN 54 HD21 ASN 54 10.983 0.855 -5.376 472 HD22 ASN 54 HD22 ASN 54 11.251 -0.612 -6.307 473 H ILE 55 H ILE 55 7.141 -1.955 -3.993 474 HA ILE 55 HA ILE 55 7.162 -2.026 -1.099 475 HB ILE 55 HB ILE 55 4.778 -1.677 -1.186 476 HG12 ILE 55 HG12 ILE 55 4.958 -2.046 -4.198 477 HG13 ILE 55 HG13 ILE 55 4.173 -3.153 -3.071 478 HG21 ILE 55 HG21 ILE 55 5.963 0.112 -3.333 479 HG22 ILE 55 HG22 ILE 55 4.792 0.504 -2.042 480 HG23 ILE 55 HG23 ILE 55 6.471 0.172 -1.637 481 HD11 ILE 55 HD11 ILE 55 3.316 -0.305 -3.664 482 HD12 ILE 55 HD12 ILE 55 2.491 -1.800 -4.133 483 HD13 ILE 55 HD13 ILE 55 2.595 -1.361 -2.423 484 H THR 56 H THR 56 5.955 -3.426 0.295 485 HA THR 56 HA THR 56 5.263 -6.106 -0.780 486 HB THR 56 HB THR 56 6.032 -6.762 1.706 487 HG1 THR 56 HG1 THR 56 8.081 -5.587 2.008 488 HG21 THR 56 HG21 THR 56 8.053 -6.270 -0.529 489 HG22 THR 56 HG22 THR 56 8.248 -7.400 0.834 490 HG23 THR 56 HG23 THR 56 7.005 -7.699 -0.390 491 H ALA 57 H ALA 57 3.467 -7.098 0.117 492 HA ALA 57 HA ALA 57 1.426 -5.493 1.261 493 HB1 ALA 57 HB1 ALA 57 1.779 -8.528 1.207 494 HB2 ALA 57 HB2 ALA 57 0.267 -7.647 1.510 495 HB3 ALA 57 HB3 ALA 57 1.045 -7.546 -0.082 496 H ILE 58 H ILE 58 4.006 -7.366 2.729 497 HA ILE 58 HA ILE 58 3.033 -7.500 5.447 498 HB ILE 58 HB ILE 58 5.783 -7.575 4.128 499 HG12 ILE 58 HG12 ILE 58 5.797 -9.941 4.971 500 HG13 ILE 58 HG13 ILE 58 4.162 -9.738 5.590 501 HG21 ILE 58 HG21 ILE 58 5.087 -7.790 7.092 502 HG22 ILE 58 HG22 ILE 58 6.641 -8.342 6.406 503 HG23 ILE 58 HG23 ILE 58 6.193 -6.638 6.323 504 HD11 ILE 58 HD11 ILE 58 4.915 -9.532 2.640 505 HD12 ILE 58 HD12 ILE 58 4.346 -11.011 3.437 506 HD13 ILE 58 HD13 ILE 58 3.268 -9.618 3.330 507 H THR 59 H THR 59 4.959 -5.132 3.610 508 HA THR 59 HA THR 59 5.364 -3.386 5.936 509 HB THR 59 HB THR 59 5.946 -3.039 2.981 510 HG1 THR 59 HG1 THR 59 7.472 -4.302 3.454 511 HG21 THR 59 HG21 THR 59 6.833 -1.420 5.408 512 HG22 THR 59 HG22 THR 59 7.550 -1.299 3.783 513 HG23 THR 59 HG23 THR 59 5.855 -0.835 4.034 514 H LEU 60 H LEU 60 3.423 -3.328 2.920 515 HA LEU 60 HA LEU 60 2.108 -0.882 3.472 516 HB2 LEU 60 HB2 LEU 60 2.466 -2.186 1.308 517 HB3 LEU 60 HB3 LEU 60 1.060 -3.134 1.718 518 HG LEU 60 HG LEU 60 0.801 -0.119 1.789 519 HD11 LEU 60 HD11 LEU 60 0.975 -1.758 -0.765 520 HD12 LEU 60 HD12 LEU 60 0.441 -0.072 -0.656 521 HD13 LEU 60 HD13 LEU 60 2.102 -0.479 -0.233 522 HD21 LEU 60 HD21 LEU 60 -1.127 -1.664 2.277 523 HD22 LEU 60 HD22 LEU 60 -1.419 -0.581 0.909 524 HD23 LEU 60 HD23 LEU 60 -0.999 -2.284 0.617 525 H SER 61 H SER 61 1.210 -4.245 4.468 526 HA SER 61 HA SER 61 -1.257 -3.587 5.647 527 HB2 SER 61 HB2 SER 61 -1.137 -5.576 6.899 528 HB3 SER 61 HB3 SER 61 -0.491 -5.893 5.297 529 HG SER 61 HG SER 61 0.772 -6.757 7.071 530 H LYS 62 H LYS 62 1.913 -2.904 6.639 531 HA LYS 62 HA LYS 62 1.116 -2.167 9.389 532 HB2 LYS 62 HB2 LYS 62 3.858 -2.453 8.128 533 HB3 LYS 62 HB3 LYS 62 3.586 -1.880 9.779 534 HG2 LYS 62 HG2 LYS 62 2.455 -3.980 10.379 535 HG3 LYS 62 HG3 LYS 62 2.634 -4.581 8.724 536 HD2 LYS 62 HD2 LYS 62 5.129 -4.342 8.964 537 HD3 LYS 62 HD3 LYS 62 4.869 -3.906 10.670 538 HE2 LYS 62 HE2 LYS 62 3.714 -6.097 11.019 539 HE3 LYS 62 HE3 LYS 62 4.004 -6.510 9.324 540 HZ1 LYS 62 HZ1 LYS 62 6.126 -6.031 11.352 541 HZ2 LYS 62 HZ2 LYS 62 5.694 -7.489 10.768 542 HZ3 LYS 62 HZ3 LYS 62 6.404 -6.398 9.784 543 H LYS 63 H LYS 63 2.241 -0.595 6.417 544 HA LYS 63 HA LYS 63 2.710 2.045 7.402 545 HB2 LYS 63 HB2 LYS 63 1.709 0.912 4.758 546 HB3 LYS 63 HB3 LYS 63 2.095 2.618 4.962 547 HG2 LYS 63 HG2 LYS 63 4.293 0.863 5.883 548 HG3 LYS 63 HG3 LYS 63 3.848 0.557 4.200 549 HD2 LYS 63 HD2 LYS 63 4.194 2.828 3.575 550 HD3 LYS 63 HD3 LYS 63 4.445 3.348 5.249 551 HE2 LYS 63 HE2 LYS 63 6.224 1.339 3.802 552 HE3 LYS 63 HE3 LYS 63 6.521 3.077 3.786 553 HZ1 LYS 63 HZ1 LYS 63 6.447 1.418 6.255 554 HZ2 LYS 63 HZ2 LYS 63 7.793 2.015 5.551 555 HZ3 LYS 63 HZ3 LYS 63 6.706 3.031 6.210 556 H LEU 64 H LEU 64 -0.251 0.406 6.468 557 HA LEU 64 HA LEU 64 -1.908 2.814 7.103 558 HB2 LEU 64 HB2 LEU 64 -2.189 0.518 5.160 559 HB3 LEU 64 HB3 LEU 64 -3.479 1.676 5.441 560 HG LEU 64 HG LEU 64 -0.965 3.061 4.853 561 HD11 LEU 64 HD11 LEU 64 -1.935 1.116 2.722 562 HD12 LEU 64 HD12 LEU 64 -0.677 2.361 2.528 563 HD13 LEU 64 HD13 LEU 64 -0.405 0.987 3.611 564 HD21 LEU 64 HD21 LEU 64 -3.200 4.023 4.633 565 HD22 LEU 64 HD22 LEU 64 -2.302 4.065 3.103 566 HD23 LEU 64 HD23 LEU 64 -3.589 2.864 3.333 567 H ASN 65 H ASN 65 -1.065 0.246 8.797 568 HA ASN 65 HA ASN 65 -1.941 -1.268 10.205 569 HB2 ASN 65 HB2 ASN 65 -3.361 -0.349 11.967 570 HB3 ASN 65 HB3 ASN 65 -1.973 0.641 11.575 571 HD21 ASN 65 HD21 ASN 65 -3.893 3.480 10.688 572 HD22 ASN 65 HD22 ASN 65 -2.301 2.739 10.622 573 H ILE 66 H ILE 66 -2.601 -2.404 8.234 574 HA ILE 66 HA ILE 66 -5.482 -3.185 8.249 575 HB ILE 66 HB ILE 66 -4.868 -3.494 5.635 576 HG12 ILE 66 HG12 ILE 66 -3.554 -0.842 6.152 577 HG13 ILE 66 HG13 ILE 66 -2.540 -2.244 6.119 578 HG21 ILE 66 HG21 ILE 66 -5.867 -0.959 6.988 579 HG22 ILE 66 HG22 ILE 66 -6.083 -1.333 5.273 580 HG23 ILE 66 HG23 ILE 66 -6.835 -2.369 6.499 581 HD11 ILE 66 HD11 ILE 66 -4.268 -1.183 3.844 582 HD12 ILE 66 HD12 ILE 66 -2.507 -1.317 3.929 583 HD13 ILE 66 HD13 ILE 66 -3.490 -2.783 3.805 584 H THR 67 H THR 67 -5.655 -5.268 6.716 585 HA THR 67 HA THR 67 -3.850 -7.286 7.872 586 HB THR 67 HB THR 67 -5.263 -8.920 7.220 587 HG1 THR 67 HG1 THR 67 -6.771 -8.674 5.513 588 HG21 THR 67 HG21 THR 67 -7.273 -6.630 7.181 589 HG22 THR 67 HG22 THR 67 -7.559 -8.325 7.620 590 HG23 THR 67 HG23 THR 67 -6.555 -7.306 8.666 591 H VAL 68 H VAL 68 -2.689 -8.869 6.559 592 HA VAL 68 HA VAL 68 -1.147 -7.738 4.385 593 HB VAL 68 HB VAL 68 -1.484 -10.625 5.279 594 HG11 VAL 68 HG11 VAL 68 0.586 -9.396 3.403 595 HG12 VAL 68 HG12 VAL 68 0.670 -11.033 4.086 596 HG13 VAL 68 HG13 VAL 68 -0.626 -10.623 2.964 597 HG21 VAL 68 HG21 VAL 68 -0.454 -9.146 6.998 598 HG22 VAL 68 HG22 VAL 68 0.721 -10.288 6.341 599 HG23 VAL 68 HG23 VAL 68 0.738 -8.598 5.796 600 H GLU 69 H GLU 69 -4.283 -9.368 4.434 601 HA GLU 69 HA GLU 69 -4.108 -10.207 1.602 602 HB2 GLU 69 HB2 GLU 69 -6.396 -10.234 3.616 603 HB3 GLU 69 HB3 GLU 69 -6.486 -10.850 1.961 604 HG2 GLU 69 HG2 GLU 69 -4.686 -12.483 2.459 605 HG3 GLU 69 HG3 GLU 69 -4.595 -11.892 4.119 606 H LYS 70 H LYS 70 -5.585 -7.692 3.612 607 HA LYS 70 HA LYS 70 -7.005 -6.330 1.577 608 HB2 LYS 70 HB2 LYS 70 -7.244 -6.265 4.108 609 HB3 LYS 70 HB3 LYS 70 -5.843 -5.210 4.174 610 HG2 LYS 70 HG2 LYS 70 -8.464 -4.641 2.739 611 HG3 LYS 70 HG3 LYS 70 -8.038 -4.121 4.376 612 HD2 LYS 70 HD2 LYS 70 -6.055 -2.885 3.318 613 HD3 LYS 70 HD3 LYS 70 -6.866 -3.121 1.760 614 HE2 LYS 70 HE2 LYS 70 -8.191 -1.869 4.207 615 HE3 LYS 70 HE3 LYS 70 -7.333 -0.921 2.984 616 HZ1 LYS 70 HZ1 LYS 70 -9.697 -2.626 2.403 617 HZ2 LYS 70 HZ2 LYS 70 -9.713 -0.997 2.538 618 HZ3 LYS 70 HZ3 LYS 70 -8.882 -1.688 1.323 619 H ALA 71 H ALA 71 -3.853 -5.744 3.031 620 HA ALA 71 HA ALA 71 -2.870 -3.663 1.401 621 HB1 ALA 71 HB1 ALA 71 -1.386 -5.935 2.794 622 HB2 ALA 71 HB2 ALA 71 -0.668 -4.418 2.236 623 HB3 ALA 71 HB3 ALA 71 -1.874 -4.398 3.531 624 H LYS 72 H LYS 72 -2.619 -7.232 0.874 625 HA LYS 72 HA LYS 72 -0.968 -7.006 -1.479 626 HB2 LYS 72 HB2 LYS 72 -0.979 -8.950 0.065 627 HB3 LYS 72 HB3 LYS 72 -2.655 -9.299 -0.347 628 HG2 LYS 72 HG2 LYS 72 -2.077 -9.929 -2.570 629 HG3 LYS 72 HG3 LYS 72 -0.432 -9.284 -2.421 630 HD2 LYS 72 HD2 LYS 72 -1.470 -11.551 -0.658 631 HD3 LYS 72 HD3 LYS 72 -0.721 -11.837 -2.241 632 HE2 LYS 72 HE2 LYS 72 1.322 -10.611 -1.462 633 HE3 LYS 72 HE3 LYS 72 0.585 -10.438 0.136 634 HZ1 LYS 72 HZ1 LYS 72 1.212 -13.031 -1.179 635 HZ2 LYS 72 HZ2 LYS 72 2.061 -12.368 0.043 636 HZ3 LYS 72 HZ3 LYS 72 0.530 -12.876 0.297 637 H ASN 73 H ASN 73 -4.443 -7.031 -0.921 638 HA ASN 73 HA ASN 73 -5.269 -7.640 -3.500 639 HB2 ASN 73 HB2 ASN 73 -7.224 -7.463 -2.440 640 HB3 ASN 73 HB3 ASN 73 -6.476 -6.658 -1.084 641 HD21 ASN 73 HD21 ASN 73 -7.650 -3.442 -1.946 642 HD22 ASN 73 HD22 ASN 73 -6.566 -4.374 -0.915 643 H TYR 74 H TYR 74 -4.236 -4.432 -2.265 644 HA TYR 74 HA TYR 74 -4.647 -2.907 -4.620 645 HB2 TYR 74 HB2 TYR 74 -2.504 -2.626 -2.477 646 HB3 TYR 74 HB3 TYR 74 -2.947 -1.393 -3.646 647 HD1 TYR 74 HD1 TYR 74 -5.573 -0.769 -3.670 648 HD2 TYR 74 HD2 TYR 74 -3.364 -2.398 -0.343 649 HE1 TYR 74 HE1 TYR 74 -7.265 0.164 -2.097 650 HE2 TYR 74 HE2 TYR 74 -5.056 -1.441 1.234 651 HH TYR 74 HH TYR 74 -7.930 0.371 0.079 652 H ILE 75 H ILE 75 -1.844 -4.825 -3.523 653 HA ILE 75 HA ILE 75 -0.146 -4.134 -5.740 654 HB ILE 75 HB ILE 75 0.003 -6.455 -3.774 655 HG12 ILE 75 HG12 ILE 75 1.251 -3.667 -3.677 656 HG13 ILE 75 HG13 ILE 75 -0.085 -4.201 -2.671 657 HG21 ILE 75 HG21 ILE 75 2.181 -5.212 -5.520 658 HG22 ILE 75 HG22 ILE 75 2.423 -6.492 -4.312 659 HG23 ILE 75 HG23 ILE 75 1.472 -6.826 -5.741 660 HD11 ILE 75 HD11 ILE 75 2.768 -5.196 -2.511 661 HD12 ILE 75 HD12 ILE 75 1.842 -4.275 -1.317 662 HD13 ILE 75 HD13 ILE 75 1.388 -5.952 -1.676 663 H LYS 76 H LYS 76 -2.762 -6.447 -5.457 664 HA LYS 76 HA LYS 76 -1.972 -7.939 -7.882 665 HB2 LYS 76 HB2 LYS 76 -4.257 -8.203 -5.892 666 HB3 LYS 76 HB3 LYS 76 -4.039 -9.258 -7.291 667 HG2 LYS 76 HG2 LYS 76 -1.808 -8.944 -5.268 668 HG3 LYS 76 HG3 LYS 76 -3.154 -10.047 -4.988 669 HD2 LYS 76 HD2 LYS 76 -2.679 -11.335 -6.933 670 HD3 LYS 76 HD3 LYS 76 -1.528 -10.160 -7.568 671 HE2 LYS 76 HE2 LYS 76 -1.095 -11.605 -4.918 672 HE3 LYS 76 HE3 LYS 76 -0.603 -12.296 -6.465 673 HZ1 LYS 76 HZ1 LYS 76 0.378 -9.698 -5.407 674 HZ2 LYS 76 HZ2 LYS 76 1.236 -11.089 -5.485 675 HZ3 LYS 76 HZ3 LYS 76 0.787 -10.342 -6.854 676 H ASN 77 H ASN 77 -4.123 -5.264 -7.071 677 HA ASN 77 HA ASN 77 -5.370 -5.511 -9.772 678 HB2 ASN 77 HB2 ASN 77 -7.125 -4.210 -9.052 679 HB3 ASN 77 HB3 ASN 77 -6.900 -5.433 -7.822 680 HD21 ASN 77 HD21 ASN 77 -6.812 -3.045 -5.274 681 HD22 ASN 77 HD22 ASN 77 -6.773 -4.739 -5.691 682 H SER 78 H SER 78 -3.461 -3.231 -7.771 683 HA SER 78 HA SER 78 -3.794 -1.177 -9.752 684 HB2 SER 78 HB2 SER 78 -3.639 -0.900 -7.234 685 HB3 SER 78 HB3 SER 78 -1.885 -1.104 -7.399 686 HG SER 78 HG SER 78 -2.581 1.112 -7.444 687 H ASN 79 H ASN 79 -1.547 -3.709 -9.583 688 HA ASN 79 HA ASN 79 0.876 -2.471 -10.236 689 HB2 ASN 79 HB2 ASN 79 1.689 -4.736 -10.690 690 HB3 ASN 79 HB3 ASN 79 0.672 -4.695 -9.257 691 HD21 ASN 79 HD21 ASN 79 -1.528 -7.116 -10.522 692 HD22 ASN 79 HD22 ASN 79 -0.755 -6.328 -9.138 693 H ARG 80 H ARG 80 -1.683 -2.723 -12.414 694 HA ARG 80 HA ARG 80 -0.015 -2.874 -14.852 695 HB2 ARG 80 HB2 ARG 80 -3.026 -2.478 -14.555 696 HB3 ARG 80 HB3 ARG 80 -2.140 -2.741 -16.055 697 HG2 ARG 80 HG2 ARG 80 -2.786 -4.895 -15.708 698 HG3 ARG 80 HG3 ARG 80 -1.262 -4.929 -14.835 699 HD2 ARG 80 HD2 ARG 80 -2.758 -5.997 -13.392 700 HD3 ARG 80 HD3 ARG 80 -2.676 -4.392 -12.706 701 HE ARG 80 HE ARG 80 -4.838 -3.856 -13.639 702 HH11 ARG 80 HH11 ARG 80 -6.929 -4.525 -14.107 703 HH12 ARG 80 HH12 ARG 80 -7.265 -6.236 -14.213 704 HH21 ARG 80 HH21 ARG 80 -4.055 -7.264 -13.818 705 HH22 ARG 80 HH22 ARG 80 -5.732 -7.730 -13.921 706 H LEU 81 H LEU 81 -0.871 -0.385 -12.748 707 HA LEU 81 HA LEU 81 -1.184 1.703 -14.765 708 HB2 LEU 81 HB2 LEU 81 -2.286 1.382 -12.413 709 HB3 LEU 81 HB3 LEU 81 -0.835 2.153 -11.788 710 HG LEU 81 HG LEU 81 -2.730 3.344 -13.875 711 HD11 LEU 81 HD11 LEU 81 -2.495 3.908 -10.891 712 HD12 LEU 81 HD12 LEU 81 -3.579 4.735 -12.037 713 HD13 LEU 81 HD13 LEU 81 -3.814 3.017 -11.679 714 HD21 LEU 81 HD21 LEU 81 -0.575 4.436 -14.063 715 HD22 LEU 81 HD22 LEU 81 -1.664 5.520 -13.201 716 HD23 LEU 81 HD23 LEU 81 -0.444 4.600 -12.295 717 H GLY 82 H GLY 82 1.386 0.881 -12.365 718 HA2 GLY 82 HA2 GLY 82 3.668 1.230 -12.484 719 HA3 GLY 82 HA3 GLY 82 3.476 1.750 -14.158 720 H ARG 83 H ARG 83 3.292 3.928 -14.623 721 HA ARG 83 HA ARG 83 3.763 5.920 -12.416 722 HB2 ARG 83 HB2 ARG 83 4.434 6.191 -15.377 723 HB3 ARG 83 HB3 ARG 83 4.585 7.440 -14.152 724 HG2 ARG 83 HG2 ARG 83 6.737 6.656 -14.475 725 HG3 ARG 83 HG3 ARG 83 6.250 5.953 -12.933 726 HD2 ARG 83 HD2 ARG 83 6.071 3.777 -13.853 727 HD3 ARG 83 HD3 ARG 83 5.911 4.369 -15.505 728 HE ARG 83 HE ARG 83 8.395 3.949 -13.988 729 HH11 ARG 83 HH11 ARG 83 10.341 4.100 -15.054 730 HH12 ARG 83 HH12 ARG 83 10.411 4.796 -16.647 731 HH21 ARG 83 HH21 ARG 83 7.057 5.456 -16.866 732 HH22 ARG 83 HH22 ARG 83 8.610 5.541 -17.649 733 H THR 84 H THR 84 2.366 6.059 -15.664 734 HA THR 84 HA THR 84 -0.316 6.725 -14.780 735 HB THR 84 HB THR 84 0.500 8.843 -14.306 736 HG1 THR 84 HG1 THR 84 -0.583 10.094 -15.813 737 HG21 THR 84 HG21 THR 84 1.911 9.025 -16.995 738 HG22 THR 84 HG22 THR 84 1.751 10.319 -15.793 739 HG23 THR 84 HG23 THR 84 2.690 8.876 -15.402 740 H ASN 85 H ASN 85 -1.410 5.500 -16.156 741 HA ASN 85 HA ASN 85 -0.926 5.609 -19.071 742 HB2 ASN 85 HB2 ASN 85 -0.707 3.069 -17.384 743 HB3 ASN 85 HB3 ASN 85 -0.931 3.069 -19.129 744 HD21 ASN 85 HD21 ASN 85 2.778 3.696 -17.659 745 HD22 ASN 85 HD22 ASN 85 1.412 3.405 -16.576 746 H ASN 86 H ASN 86 -2.759 5.329 -20.244 747 HA ASN 86 HA ASN 86 -5.189 4.136 -19.086 748 HB2 ASN 86 HB2 ASN 86 -4.900 7.077 -19.836 749 HB3 ASN 86 HB3 ASN 86 -6.446 6.255 -19.992 750 HD21 ASN 86 HD21 ASN 86 -6.918 5.797 -16.471 751 HD22 ASN 86 HD22 ASN 86 -7.202 5.006 -18.015 752 H LEU 87 H LEU 87 -6.860 3.725 -20.629 753 HA LEU 87 HA LEU 87 -5.705 2.956 -23.190 754 HB2 LEU 87 HB2 LEU 87 -8.156 2.123 -21.663 755 HB3 LEU 87 HB3 LEU 87 -8.026 1.792 -23.386 756 HG LEU 87 HG LEU 87 -5.950 0.527 -23.058 757 HD11 LEU 87 HD11 LEU 87 -6.435 0.977 -20.080 758 HD12 LEU 87 HD12 LEU 87 -5.323 -0.231 -20.763 759 HD13 LEU 87 HD13 LEU 87 -5.008 1.482 -21.023 760 HD21 LEU 87 HD21 LEU 87 -8.148 -0.596 -23.042 761 HD22 LEU 87 HD22 LEU 87 -6.993 -1.424 -21.988 762 HD23 LEU 87 HD23 LEU 87 -8.250 -0.384 -21.278 763 H LYS 88 H LYS 88 -8.749 4.329 -22.371 764 HA LYS 88 HA LYS 88 -8.763 6.198 -24.701 765 HB2 LYS 88 HB2 LYS 88 -10.995 5.418 -25.407 766 HB3 LYS 88 HB3 LYS 88 -9.744 4.204 -25.620 767 HG2 LYS 88 HG2 LYS 88 -10.533 2.860 -23.846 768 HG3 LYS 88 HG3 LYS 88 -11.480 4.171 -23.121 769 HD2 LYS 88 HD2 LYS 88 -13.053 4.178 -24.933 770 HD3 LYS 88 HD3 LYS 88 -12.101 3.036 -25.885 771 HE2 LYS 88 HE2 LYS 88 -13.259 2.343 -23.150 772 HE3 LYS 88 HE3 LYS 88 -14.178 2.149 -24.642 773 HZ1 LYS 88 HZ1 LYS 88 -11.588 0.800 -24.089 774 HZ2 LYS 88 HZ2 LYS 88 -13.053 0.087 -24.056 775 HZ3 LYS 88 HZ3 LYS 88 -12.458 0.646 -25.465 776 H THR 89 H THR 89 -8.568 6.685 -21.856 777 HA THR 89 HA THR 89 -10.835 8.504 -21.445 778 HB THR 89 HB THR 89 -11.664 6.392 -20.560 779 HG1 THR 89 HG1 THR 89 -12.220 7.261 -18.557 780 HG21 THR 89 HG21 THR 89 -9.490 6.529 -18.433 781 HG22 THR 89 HG22 THR 89 -10.759 5.299 -18.622 782 HG23 THR 89 HG23 THR 89 -9.448 5.399 -19.811 783 H ILE 90 H ILE 90 -9.850 10.311 -21.085 784 HA ILE 90 HA ILE 90 -7.755 10.487 -19.002 785 HB ILE 90 HB ILE 90 -6.728 12.281 -20.508 786 HG12 ILE 90 HG12 ILE 90 -8.671 12.344 -22.148 787 HG13 ILE 90 HG13 ILE 90 -7.027 12.491 -22.729 788 HG21 ILE 90 HG21 ILE 90 -6.441 9.391 -21.369 789 HG22 ILE 90 HG22 ILE 90 -5.284 10.704 -21.669 790 HG23 ILE 90 HG23 ILE 90 -5.622 10.181 -20.011 791 HD11 ILE 90 HD11 ILE 90 -8.690 9.946 -22.968 792 HD12 ILE 90 HD12 ILE 90 -8.374 11.129 -24.239 793 HD13 ILE 90 HD13 ILE 90 -7.037 10.189 -23.572 794 H GLY 91 H GLY 91 -10.777 11.297 -19.409 795 HA2 GLY 91 HA2 GLY 91 -12.156 12.923 -18.524 796 HA3 GLY 91 HA3 GLY 91 -10.737 13.758 -17.890 797 H ILE 92 H ILE 92 -9.885 13.611 -20.968 798 HA ILE 92 HA ILE 92 -9.741 15.045 -22.695 799 HB ILE 92 HB ILE 92 -12.667 15.664 -22.217 800 HG12 ILE 92 HG12 ILE 92 -12.344 13.243 -22.484 801 HG13 ILE 92 HG13 ILE 92 -13.169 13.944 -23.855 802 HG21 ILE 92 HG21 ILE 92 -10.881 16.136 -24.625 803 HG22 ILE 92 HG22 ILE 92 -12.661 16.091 -24.717 804 HG23 ILE 92 HG23 ILE 92 -11.876 17.312 -23.744 805 HD11 ILE 92 HD11 ILE 92 -10.218 13.162 -23.816 806 HD12 ILE 92 HD12 ILE 92 -11.537 12.243 -24.552 807 HD13 ILE 92 HD13 ILE 92 -11.099 13.826 -25.210 808 H LEU 93 H LEU 93 -8.616 15.820 -20.448 809 HA LEU 93 HA LEU 93 -7.635 17.549 -19.373 810 HB2 LEU 93 HB2 LEU 93 -6.972 17.330 -21.958 811 HB3 LEU 93 HB3 LEU 93 -7.503 18.998 -22.004 812 HG LEU 93 HG LEU 93 -5.353 17.778 -20.205 813 HD11 LEU 93 HD11 LEU 93 -5.139 19.719 -22.543 814 HD12 LEU 93 HD12 LEU 93 -3.790 19.099 -21.562 815 HD13 LEU 93 HD13 LEU 93 -4.722 17.990 -22.581 816 HD21 LEU 93 HD21 LEU 93 -6.345 19.672 -19.000 817 HD22 LEU 93 HD22 LEU 93 -4.732 20.087 -19.579 818 HD23 LEU 93 HD23 LEU 93 -6.160 20.706 -20.436 819 H GLN 94 H GLN 94 -10.031 17.884 -18.512 820 HA GLN 94 HA GLN 94 -10.682 20.802 -18.642 821 HB2 GLN 94 HB2 GLN 94 -12.326 18.431 -19.441 822 HB3 GLN 94 HB3 GLN 94 -13.172 19.676 -18.507 823 HG2 GLN 94 HG2 GLN 94 -12.570 21.392 -20.118 824 HG3 GLN 94 HG3 GLN 94 -11.524 20.273 -20.995 825 HE21 GLN 94 HE21 GLN 94 -14.184 18.511 -22.620 826 HE22 GLN 94 HE22 GLN 94 -12.543 18.330 -21.985 827 H GLU 95 H GLU 95 -9.385 18.855 -16.655 828 HA GLU 95 HA GLU 95 -11.185 19.000 -14.317 829 HB2 GLU 95 HB2 GLU 95 -8.675 17.409 -14.956 830 HB3 GLU 95 HB3 GLU 95 -9.444 17.402 -13.371 831 HG2 GLU 95 HG2 GLU 95 -10.127 15.455 -14.605 832 HG3 GLU 95 HG3 GLU 95 -11.491 16.497 -14.229 833 H GLU 96 H GLU 96 -10.264 21.509 -14.945 834 HA GLU 96 HA GLU 96 -8.348 22.147 -12.739 835 HB2 GLU 96 HB2 GLU 96 -7.390 22.160 -15.116 836 HB3 GLU 96 HB3 GLU 96 -8.369 23.600 -15.400 837 HG2 GLU 96 HG2 GLU 96 -7.167 24.757 -13.542 838 HG3 GLU 96 HG3 GLU 96 -6.303 23.268 -13.167 839 H VAL 97 H VAL 97 -10.939 22.070 -12.193 840 HA VAL 97 HA VAL 97 -11.514 24.901 -11.546 841 HB VAL 97 HB VAL 97 -13.694 23.055 -12.592 842 HG11 VAL 97 HG11 VAL 97 -13.669 26.060 -12.045 843 HG12 VAL 97 HG12 VAL 97 -15.048 25.120 -12.658 844 HG13 VAL 97 HG13 VAL 97 -14.454 24.844 -11.020 845 HG21 VAL 97 HG21 VAL 97 -12.291 23.609 -14.509 846 HG22 VAL 97 HG22 VAL 97 -13.810 24.501 -14.597 847 HG23 VAL 97 HG23 VAL 97 -12.328 25.334 -14.072 848 H SER 98 H SER 98 -10.461 23.910 -9.633 849 HA SER 98 HA SER 98 -12.522 23.686 -7.646 850 HB2 SER 98 HB2 SER 98 -12.529 21.333 -8.283 851 HB3 SER 98 HB3 SER 98 -10.792 21.208 -7.963 852 HG SER 98 HG SER 98 -12.087 20.492 -6.184 853 H SER 99 H SER 99 -9.138 22.460 -7.565 854 HA SER 99 HA SER 99 -8.634 24.073 -5.168 855 HB2 SER 99 HB2 SER 99 -6.834 22.103 -6.618 856 HB3 SER 99 HB3 SER 99 -6.552 22.808 -5.015 857 HG SER 99 HG SER 99 -7.511 20.738 -4.858 858 H MET 100 H MET 100 -7.805 24.337 -8.534 859 HA MET 100 HA MET 100 -6.471 26.906 -8.026 860 HB2 MET 100 HB2 MET 100 -4.728 24.959 -8.251 861 HB3 MET 100 HB3 MET 100 -5.193 24.928 -9.952 862 HG2 MET 100 HG2 MET 100 -3.228 26.279 -9.694 863 HG3 MET 100 HG3 MET 100 -4.555 27.367 -10.100 864 HE1 MET 100 HE1 MET 100 -2.709 29.303 -9.302 865 HE2 MET 100 HE2 MET 100 -1.995 29.313 -7.672 866 HE3 MET 100 HE3 MET 100 -1.586 28.011 -8.812 867 H GLU 101 H GLU 101 -7.068 28.403 -9.529 868 HA GLU 101 HA GLU 101 -8.405 27.597 -12.055 869 HB2 GLU 101 HB2 GLU 101 -9.986 27.678 -9.946 870 HB3 GLU 101 HB3 GLU 101 -9.860 29.424 -10.127 871 HG2 GLU 101 HG2 GLU 101 -10.637 29.063 -12.570 872 HG3 GLU 101 HG3 GLU 101 -10.929 27.384 -12.132 873 H ALA 102 H ALA 102 -5.908 28.985 -11.503 874 HA ALA 102 HA ALA 102 -6.451 31.756 -12.487 875 HB1 ALA 102 HB1 ALA 102 -4.355 30.833 -10.482 876 HB2 ALA 102 HB2 ALA 102 -4.579 32.491 -11.079 877 HB3 ALA 102 HB3 ALA 102 -5.847 31.726 -10.102 878 H LYS 103 H LYS 103 -4.942 32.726 -13.813 879 HA LYS 103 HA LYS 103 -3.319 30.906 -15.525 880 HB2 LYS 103 HB2 LYS 103 -4.339 33.748 -15.887 881 HB3 LYS 103 HB3 LYS 103 -3.240 32.956 -17.021 882 HG2 LYS 103 HG2 LYS 103 -4.835 31.209 -17.512 883 HG3 LYS 103 HG3 LYS 103 -5.955 31.776 -16.273 884 HD2 LYS 103 HD2 LYS 103 -5.152 33.430 -18.706 885 HD3 LYS 103 HD3 LYS 103 -6.577 32.380 -18.630 886 HE2 LYS 103 HE2 LYS 103 -7.401 33.661 -16.646 887 HE3 LYS 103 HE3 LYS 103 -6.031 34.768 -16.808 888 HZ1 LYS 103 HZ1 LYS 103 -8.126 34.336 -18.872 889 HZ2 LYS 103 HZ2 LYS 103 -8.016 35.640 -17.902 890 HZ3 LYS 103 HZ3 LYS 103 -6.864 35.363 -19.023 891 H SER 104 H SER 104 -1.170 30.992 -15.694 892 HA SER 104 HA SER 104 0.397 33.274 -14.684 893 HB2 SER 104 HB2 SER 104 0.129 31.786 -12.704 894 HB3 SER 104 HB3 SER 104 0.876 30.462 -13.619 895 HG SER 104 HG SER 104 2.386 31.636 -12.307 896 H MET 105 H MET 105 1.947 33.692 -16.086 897 HA MET 105 HA MET 105 3.213 31.647 -17.818 898 HB2 MET 105 HB2 MET 105 1.471 33.953 -18.785 899 HB3 MET 105 HB3 MET 105 2.710 33.228 -19.807 900 HG2 MET 105 HG2 MET 105 1.670 31.048 -19.679 901 HG3 MET 105 HG3 MET 105 0.440 31.636 -18.563 902 HE1 MET 105 HE1 MET 105 -0.875 34.125 -19.427 903 HE2 MET 105 HE2 MET 105 -2.069 33.576 -20.624 904 HE3 MET 105 HE3 MET 105 -1.768 32.607 -19.166 905 H THR 106 H THR 106 4.966 32.600 -19.128 906 HA THR 106 HA THR 106 6.181 35.074 -17.985 907 HB THR 106 HB THR 106 7.312 33.060 -17.112 908 HG1 THR 106 HG1 THR 106 9.344 33.866 -17.529 909 HG21 THR 106 HG21 THR 106 8.268 32.642 -19.980 910 HG22 THR 106 HG22 THR 106 8.819 31.767 -18.536 911 HG23 THR 106 HG23 THR 106 7.155 31.569 -19.102 912 H TRP 107 H TRP 107 7.863 35.975 -19.396 913 HA TRP 107 HA TRP 107 6.619 36.370 -22.072 914 HB2 TRP 107 HB2 TRP 107 6.691 38.211 -20.339 915 HB3 TRP 107 HB3 TRP 107 8.430 38.281 -20.575 916 HD1 TRP 107 HD1 TRP 107 9.286 39.481 -22.760 917 HE1 TRP 107 HE1 TRP 107 8.165 40.921 -24.573 918 HE3 TRP 107 HE3 TRP 107 4.388 38.422 -21.708 919 HZ2 TRP 107 HZ2 TRP 107 5.479 41.534 -25.449 920 HZ3 TRP 107 HZ3 TRP 107 2.562 39.452 -23.051 921 HH2 TRP 107 HH2 TRP 107 3.095 41.004 -24.917 Start of MODEL 26 1 H1 GLY -5 H1 GLY -5 19.400 -26.602 22.521 2 H2 GLY -5 H2 GLY -5 19.266 -25.298 23.505 3 H3 GLY -5 H3 GLY -5 20.220 -25.229 22.173 4 HA2 GLY -5 HA2 GLY -5 17.288 -25.518 22.158 5 HA3 GLY -5 HA3 GLY -5 18.168 -24.022 21.795 6 H SER -4 H SER -4 16.321 -25.385 20.071 7 HA SER -4 HA SER -4 18.047 -26.481 17.883 8 HB2 SER -4 HB2 SER -4 15.122 -27.027 18.464 9 HB3 SER -4 HB3 SER -4 16.114 -27.788 17.207 10 HG SER -4 HG SER -4 15.954 -29.087 19.097 11 H HIS -3 H HIS -3 16.700 -23.578 18.479 12 HA HIS -3 HA HIS -3 15.169 -23.113 16.050 13 HB2 HIS -3 HB2 HIS -3 14.940 -21.915 18.291 14 HB3 HIS -3 HB3 HIS -3 16.402 -21.023 17.876 15 HD2 HIS -3 HD2 HIS -3 16.189 -19.402 15.586 16 HE1 HIS -3 HE1 HIS -3 11.927 -19.190 15.702 17 HE2 HIS -3 HE2 HIS -3 14.032 -18.178 14.687 18 H MET -2 H MET -2 15.850 -22.431 14.073 19 HA MET -2 HA MET -2 18.529 -21.299 13.642 20 HB2 MET -2 HB2 MET -2 18.555 -23.957 13.670 21 HB3 MET -2 HB3 MET -2 17.744 -23.800 12.120 22 HG2 MET -2 HG2 MET -2 19.898 -23.997 11.450 23 HG3 MET -2 HG3 MET -2 19.817 -22.249 11.513 24 HE1 MET -2 HE1 MET -2 20.434 -21.349 14.563 25 HE2 MET -2 HE2 MET -2 22.200 -21.374 14.488 26 HE3 MET -2 HE3 MET -2 21.276 -20.771 13.098 27 H ALA -1 H ALA -1 18.822 -20.316 11.617 28 HA ALA -1 HA ALA -1 16.339 -19.371 10.407 29 HB1 ALA -1 HB1 ALA -1 19.248 -18.622 9.886 30 HB2 ALA -1 HB2 ALA -1 17.819 -17.752 9.287 31 HB3 ALA -1 HB3 ALA -1 18.149 -17.811 11.029 32 H SER 0 H SER 0 15.905 -19.257 8.206 33 HA SER 0 HA SER 0 17.087 -21.260 6.350 34 HB2 SER 0 HB2 SER 0 14.200 -21.120 7.293 35 HB3 SER 0 HB3 SER 0 14.699 -21.967 5.809 36 HG SER 0 HG SER 0 14.577 -23.370 7.631 37 H MET 1 H MET 1 16.907 -20.688 4.203 38 HA MET 1 HA MET 1 15.471 -18.162 3.492 39 HB2 MET 1 HB2 MET 1 18.360 -18.817 2.790 40 HB3 MET 1 HB3 MET 1 17.456 -17.387 2.285 41 HG2 MET 1 HG2 MET 1 17.177 -16.775 4.715 42 HG3 MET 1 HG3 MET 1 18.246 -18.119 5.120 43 HE1 MET 1 HE1 MET 1 17.903 -14.491 3.851 44 HE2 MET 1 HE2 MET 1 19.480 -14.136 3.116 45 HE3 MET 1 HE3 MET 1 18.352 -15.238 2.299 46 H ASP 2 H ASP 2 15.126 -21.188 2.829 47 HA ASP 2 HA ASP 2 15.569 -21.245 -0.075 48 HB2 ASP 2 HB2 ASP 2 16.086 -23.133 1.491 49 HB3 ASP 2 HB3 ASP 2 14.350 -23.377 1.688 50 HA PRO 3 HA PRO 3 11.218 -20.075 -0.605 51 HB2 PRO 3 HB2 PRO 3 11.242 -19.236 -3.175 52 HB3 PRO 3 HB3 PRO 3 12.162 -18.367 -1.909 53 HG2 PRO 3 HG2 PRO 3 13.197 -20.439 -3.869 54 HG3 PRO 3 HG3 PRO 3 13.894 -18.835 -3.491 55 HD2 PRO 3 HD2 PRO 3 14.741 -21.184 -2.300 56 HD3 PRO 3 HD3 PRO 3 14.805 -19.593 -1.488 57 H LEU 4 H LEU 4 12.514 -22.915 -1.650 58 HA LEU 4 HA LEU 4 10.142 -23.650 -3.285 59 HB2 LEU 4 HB2 LEU 4 12.904 -24.907 -3.273 60 HB3 LEU 4 HB3 LEU 4 11.567 -25.354 -4.324 61 HG LEU 4 HG LEU 4 13.025 -22.688 -4.367 62 HD11 LEU 4 HD11 LEU 4 12.986 -25.006 -6.340 63 HD12 LEU 4 HD12 LEU 4 13.848 -23.462 -6.543 64 HD13 LEU 4 HD13 LEU 4 14.328 -24.577 -5.255 65 HD21 LEU 4 HD21 LEU 4 10.682 -22.352 -5.045 66 HD22 LEU 4 HD22 LEU 4 11.739 -22.275 -6.456 67 HD23 LEU 4 HD23 LEU 4 10.783 -23.743 -6.151 68 H ASP 5 H ASP 5 10.194 -23.770 -0.311 69 HA ASP 5 HA ASP 5 9.742 -26.684 0.062 70 HB2 ASP 5 HB2 ASP 5 10.157 -24.343 1.927 71 HB3 ASP 5 HB3 ASP 5 9.371 -25.789 2.531 72 H LYS 6 H LYS 6 7.839 -24.233 -0.884 73 HA LYS 6 HA LYS 6 5.401 -25.432 0.375 74 HB2 LYS 6 HB2 LYS 6 4.488 -23.383 0.982 75 HB3 LYS 6 HB3 LYS 6 6.119 -23.446 1.608 76 HG2 LYS 6 HG2 LYS 6 5.186 -21.823 -0.798 77 HG3 LYS 6 HG3 LYS 6 5.447 -21.229 0.832 78 HD2 LYS 6 HD2 LYS 6 7.901 -21.873 0.607 79 HD3 LYS 6 HD3 LYS 6 7.567 -22.257 -1.089 80 HE2 LYS 6 HE2 LYS 6 8.445 -20.073 -1.119 81 HE3 LYS 6 HE3 LYS 6 6.715 -19.908 -1.413 82 HZ1 LYS 6 HZ1 LYS 6 8.058 -19.458 1.209 83 HZ2 LYS 6 HZ2 LYS 6 7.529 -18.282 0.210 84 HZ3 LYS 6 HZ3 LYS 6 6.455 -19.269 0.936 85 H ILE 7 H ILE 7 6.510 -23.858 -2.562 86 HA ILE 7 HA ILE 7 4.007 -24.728 -3.924 87 HB ILE 7 HB ILE 7 4.027 -22.589 -5.245 88 HG12 ILE 7 HG12 ILE 7 4.998 -20.577 -4.081 89 HG13 ILE 7 HG13 ILE 7 5.959 -21.662 -3.077 90 HG21 ILE 7 HG21 ILE 7 3.495 -22.269 -2.277 91 HG22 ILE 7 HG22 ILE 7 2.777 -21.350 -3.611 92 HG23 ILE 7 HG23 ILE 7 2.426 -23.073 -3.443 93 HD11 ILE 7 HD11 ILE 7 6.135 -21.522 -6.114 94 HD12 ILE 7 HD12 ILE 7 7.203 -20.660 -4.990 95 HD13 ILE 7 HD13 ILE 7 7.217 -22.427 -5.021 96 H ILE 8 H ILE 8 6.869 -25.693 -3.822 97 HA ILE 8 HA ILE 8 8.266 -25.259 -6.159 98 HB ILE 8 HB ILE 8 9.015 -26.520 -4.139 99 HG12 ILE 8 HG12 ILE 8 9.571 -27.834 -6.837 100 HG13 ILE 8 HG13 ILE 8 10.345 -26.376 -6.212 101 HG21 ILE 8 HG21 ILE 8 7.756 -28.965 -5.435 102 HG22 ILE 8 HG22 ILE 8 8.611 -28.873 -3.878 103 HG23 ILE 8 HG23 ILE 8 7.033 -28.098 -4.068 104 HD11 ILE 8 HD11 ILE 8 10.604 -29.197 -5.095 105 HD12 ILE 8 HD12 ILE 8 11.842 -28.239 -5.922 106 HD13 ILE 8 HD13 ILE 8 11.278 -27.747 -4.314 107 H ASN 9 H ASN 9 8.279 -25.889 -8.177 108 HA ASN 9 HA ASN 9 6.554 -28.007 -9.275 109 HB2 ASN 9 HB2 ASN 9 5.750 -25.200 -9.106 110 HB3 ASN 9 HB3 ASN 9 5.953 -25.641 -10.800 111 HD21 ASN 9 HD21 ASN 9 3.293 -28.081 -10.667 112 HD22 ASN 9 HD22 ASN 9 4.824 -27.743 -11.489 113 H ASP 10 H ASP 10 7.677 -28.992 -10.950 114 HA ASP 10 HA ASP 10 9.205 -27.541 -12.839 115 HB2 ASP 10 HB2 ASP 10 11.402 -28.391 -12.413 116 HB3 ASP 10 HB3 ASP 10 10.891 -27.386 -11.071 117 H ILE 11 H ILE 11 7.408 -28.730 -13.725 118 HA ILE 11 HA ILE 11 6.321 -30.409 -14.672 119 HB ILE 11 HB ILE 11 9.096 -31.163 -15.553 120 HG12 ILE 11 HG12 ILE 11 7.148 -29.267 -16.937 121 HG13 ILE 11 HG13 ILE 11 8.495 -28.723 -15.942 122 HG21 ILE 11 HG21 ILE 11 6.329 -31.629 -16.765 123 HG22 ILE 11 HG22 ILE 11 7.853 -32.033 -17.599 124 HG23 ILE 11 HG23 ILE 11 7.403 -32.887 -16.138 125 HD11 ILE 11 HD11 ILE 11 8.758 -30.259 -18.544 126 HD12 ILE 11 HD12 ILE 11 9.168 -28.571 -18.223 127 HD13 ILE 11 HD13 ILE 11 10.103 -29.861 -17.446 128 H LYS 12 H LYS 12 5.958 -30.927 -12.377 129 HA LYS 12 HA LYS 12 6.160 -33.812 -11.974 130 HB2 LYS 12 HB2 LYS 12 8.334 -32.798 -11.102 131 HB3 LYS 12 HB3 LYS 12 7.411 -32.014 -9.839 132 HG2 LYS 12 HG2 LYS 12 7.123 -35.007 -10.243 133 HG3 LYS 12 HG3 LYS 12 8.638 -34.417 -9.601 134 HD2 LYS 12 HD2 LYS 12 5.917 -33.904 -8.339 135 HD3 LYS 12 HD3 LYS 12 7.040 -35.158 -7.843 136 HE2 LYS 12 HE2 LYS 12 7.644 -32.162 -7.762 137 HE3 LYS 12 HE3 LYS 12 7.076 -33.116 -6.394 138 HZ1 LYS 12 HZ1 LYS 12 9.650 -33.554 -7.810 139 HZ2 LYS 12 HZ2 LYS 12 9.471 -32.917 -6.322 140 HZ3 LYS 12 HZ3 LYS 12 9.096 -34.482 -6.581 141 H LYS 13 H LYS 13 5.150 -30.720 -10.501 142 HA LYS 13 HA LYS 13 2.878 -32.081 -9.161 143 HB2 LYS 13 HB2 LYS 13 4.260 -29.448 -8.563 144 HB3 LYS 13 HB3 LYS 13 2.827 -30.012 -7.721 145 HG2 LYS 13 HG2 LYS 13 5.495 -31.470 -7.785 146 HG3 LYS 13 HG3 LYS 13 4.986 -30.385 -6.506 147 HD2 LYS 13 HD2 LYS 13 3.546 -32.981 -7.226 148 HD3 LYS 13 HD3 LYS 13 4.720 -32.781 -5.922 149 HE2 LYS 13 HE2 LYS 13 3.275 -31.037 -4.882 150 HE3 LYS 13 HE3 LYS 13 2.064 -31.298 -6.143 151 HZ1 LYS 13 HZ1 LYS 13 2.976 -33.365 -4.210 152 HZ2 LYS 13 HZ2 LYS 13 1.554 -32.572 -4.139 153 HZ3 LYS 13 HZ3 LYS 13 1.849 -33.601 -5.370 154 H GLU 14 H GLU 14 1.903 -32.138 -11.389 155 HA GLU 14 HA GLU 14 0.192 -29.721 -11.755 156 HB2 GLU 14 HB2 GLU 14 0.669 -29.606 -14.130 157 HB3 GLU 14 HB3 GLU 14 2.143 -29.424 -13.189 158 HG2 GLU 14 HG2 GLU 14 2.767 -31.777 -13.654 159 HG3 GLU 14 HG3 GLU 14 1.267 -32.010 -14.555 160 H ALA 15 H ALA 15 -0.198 -32.739 -11.002 161 HA ALA 15 HA ALA 15 -1.867 -33.736 -13.168 162 HB1 ALA 15 HB1 ALA 15 -1.383 -34.806 -10.359 163 HB2 ALA 15 HB2 ALA 15 -2.152 -35.680 -11.698 164 HB3 ALA 15 HB3 ALA 15 -0.446 -35.212 -11.817 165 H ASN 16 H ASN 16 -2.575 -32.347 -9.951 166 HA ASN 16 HA ASN 16 -5.422 -31.942 -10.667 167 HB2 ASN 16 HB2 ASN 16 -4.467 -33.647 -8.317 168 HB3 ASN 16 HB3 ASN 16 -6.079 -32.949 -8.419 169 HD21 ASN 16 HD21 ASN 16 -7.225 -35.223 -10.930 170 HD22 ASN 16 HD22 ASN 16 -7.475 -33.609 -10.284 171 H ASP 17 H ASP 17 -4.967 -29.744 -10.670 172 HA ASP 17 HA ASP 17 -4.504 -28.426 -8.014 173 HB2 ASP 17 HB2 ASP 17 -3.077 -27.833 -10.638 174 HB3 ASP 17 HB3 ASP 17 -3.040 -26.802 -9.207 175 H SER 18 H SER 18 -6.535 -27.845 -7.709 176 HA SER 18 HA SER 18 -7.490 -25.535 -9.274 177 HB2 SER 18 HB2 SER 18 -8.624 -27.506 -10.278 178 HB3 SER 18 HB3 SER 18 -9.289 -27.918 -8.686 179 HG SER 18 HG SER 18 -10.740 -26.655 -9.974 180 H GLY 19 H GLY 19 -7.658 -24.027 -7.836 181 HA2 GLY 19 HA2 GLY 19 -9.252 -23.208 -6.034 182 HA3 GLY 19 HA3 GLY 19 -8.662 -24.554 -5.053 183 H VAL 20 H VAL 20 -5.892 -23.957 -6.312 184 HA VAL 20 HA VAL 20 -5.130 -21.575 -4.672 185 HB VAL 20 HB VAL 20 -4.290 -23.428 -3.523 186 HG11 VAL 20 HG11 VAL 20 -3.035 -24.513 -6.077 187 HG12 VAL 20 HG12 VAL 20 -2.806 -25.147 -4.437 188 HG13 VAL 20 HG13 VAL 20 -4.404 -25.217 -5.187 189 HG21 VAL 20 HG21 VAL 20 -2.758 -21.497 -3.805 190 HG22 VAL 20 HG22 VAL 20 -1.905 -23.028 -3.540 191 HG23 VAL 20 HG23 VAL 20 -1.978 -22.331 -5.170 192 H THR 21 H THR 21 -5.115 -20.010 -6.148 193 HA THR 21 HA THR 21 -3.076 -20.103 -8.233 194 HB THR 21 HB THR 21 -5.443 -19.124 -9.592 195 HG1 THR 21 HG1 THR 21 -6.540 -21.047 -9.853 196 HG21 THR 21 HG21 THR 21 -3.626 -21.526 -10.055 197 HG22 THR 21 HG22 THR 21 -4.679 -20.756 -11.274 198 HG23 THR 21 HG23 THR 21 -3.296 -19.865 -10.609 199 H LEU 22 H LEU 22 -3.109 -18.097 -9.593 200 HA LEU 22 HA LEU 22 -2.670 -15.966 -7.682 201 HB2 LEU 22 HB2 LEU 22 -2.029 -16.267 -10.653 202 HB3 LEU 22 HB3 LEU 22 -1.320 -15.037 -9.620 203 HG LEU 22 HG LEU 22 -0.940 -17.994 -9.006 204 HD11 LEU 22 HD11 LEU 22 0.731 -16.282 -10.862 205 HD12 LEU 22 HD12 LEU 22 1.181 -17.887 -10.233 206 HD13 LEU 22 HD13 LEU 22 -0.237 -17.725 -11.279 207 HD21 LEU 22 HD21 LEU 22 -0.344 -16.361 -7.236 208 HD22 LEU 22 HD22 LEU 22 1.077 -17.197 -7.875 209 HD23 LEU 22 HD23 LEU 22 0.737 -15.528 -8.379 210 H ALA 23 H ALA 23 -5.367 -16.511 -8.566 211 HA ALA 23 HA ALA 23 -6.376 -13.907 -9.510 212 HB1 ALA 23 HB1 ALA 23 -6.510 -16.492 -11.137 213 HB2 ALA 23 HB2 ALA 23 -7.419 -15.009 -11.521 214 HB3 ALA 23 HB3 ALA 23 -5.642 -15.009 -11.574 215 HA PRO 24 HA PRO 24 -9.659 -15.612 -6.969 216 HB2 PRO 24 HB2 PRO 24 -11.465 -13.600 -6.980 217 HB3 PRO 24 HB3 PRO 24 -9.823 -13.386 -6.298 218 HG2 PRO 24 HG2 PRO 24 -10.801 -12.607 -9.070 219 HG3 PRO 24 HG3 PRO 24 -9.912 -11.603 -7.885 220 HD2 PRO 24 HD2 PRO 24 -8.653 -12.964 -9.926 221 HD3 PRO 24 HD3 PRO 24 -7.878 -12.698 -8.338 222 H LEU 25 H LEU 25 -10.332 -14.813 -10.310 223 HA LEU 25 HA LEU 25 -12.439 -16.818 -10.595 224 HB2 LEU 25 HB2 LEU 25 -13.376 -14.418 -9.772 225 HB3 LEU 25 HB3 LEU 25 -13.126 -13.992 -11.451 226 HG LEU 25 HG LEU 25 -14.608 -16.061 -12.014 227 HD11 LEU 25 HD11 LEU 25 -15.293 -15.774 -9.060 228 HD12 LEU 25 HD12 LEU 25 -16.156 -16.777 -10.247 229 HD13 LEU 25 HD13 LEU 25 -14.492 -17.173 -9.802 230 HD21 LEU 25 HD21 LEU 25 -15.405 -13.752 -12.203 231 HD22 LEU 25 HD22 LEU 25 -16.681 -14.814 -11.592 232 HD23 LEU 25 HD23 LEU 25 -15.816 -13.734 -10.471 233 H SER 26 H SER 26 -13.319 -15.811 -13.132 234 HA SER 26 HA SER 26 -11.168 -16.607 -14.893 235 HB2 SER 26 HB2 SER 26 -12.981 -16.374 -16.615 236 HB3 SER 26 HB3 SER 26 -13.372 -17.438 -15.252 237 HG SER 26 HG SER 26 -15.090 -15.976 -15.789 238 H VAL 27 H VAL 27 -10.270 -14.392 -13.634 239 HA VAL 27 HA VAL 27 -9.999 -12.341 -15.729 240 HB VAL 27 HB VAL 27 -12.060 -11.825 -14.447 241 HG11 VAL 27 HG11 VAL 27 -10.263 -11.238 -12.066 242 HG12 VAL 27 HG12 VAL 27 -12.017 -10.995 -12.181 243 HG13 VAL 27 HG13 VAL 27 -11.350 -12.634 -12.195 244 HG21 VAL 27 HG21 VAL 27 -10.829 -10.001 -15.536 245 HG22 VAL 27 HG22 VAL 27 -11.609 -9.454 -14.049 246 HG23 VAL 27 HG23 VAL 27 -9.861 -9.751 -14.059 247 HA PRO 28 HA PRO 28 -5.991 -12.297 -13.639 248 HB2 PRO 28 HB2 PRO 28 -4.653 -10.403 -15.042 249 HB3 PRO 28 HB3 PRO 28 -5.178 -11.941 -15.780 250 HG2 PRO 28 HG2 PRO 28 -6.625 -9.269 -15.883 251 HG3 PRO 28 HG3 PRO 28 -6.180 -10.335 -17.255 252 HD2 PRO 28 HD2 PRO 28 -8.647 -10.409 -16.107 253 HD3 PRO 28 HD3 PRO 28 -7.858 -11.892 -16.715 254 H LYS 29 H LYS 29 -7.599 -11.529 -11.933 255 HA LYS 29 HA LYS 29 -8.212 -10.378 -10.139 256 HB2 LYS 29 HB2 LYS 29 -5.711 -10.171 -9.822 257 HB3 LYS 29 HB3 LYS 29 -5.834 -8.545 -10.490 258 HG2 LYS 29 HG2 LYS 29 -5.881 -8.162 -8.184 259 HG3 LYS 29 HG3 LYS 29 -7.583 -8.101 -8.621 260 HD2 LYS 29 HD2 LYS 29 -7.855 -10.448 -7.858 261 HD3 LYS 29 HD3 LYS 29 -6.126 -10.542 -7.530 262 HE2 LYS 29 HE2 LYS 29 -7.298 -10.275 -5.447 263 HE3 LYS 29 HE3 LYS 29 -6.339 -8.827 -5.772 264 HZ1 LYS 29 HZ1 LYS 29 -9.261 -9.028 -6.308 265 HZ2 LYS 29 HZ2 LYS 29 -8.607 -8.320 -4.994 266 HZ3 LYS 29 HZ3 LYS 29 -8.311 -7.681 -6.470 267 HA PRO 30 HA PRO 30 -10.569 -6.952 -11.909 268 HB2 PRO 30 HB2 PRO 30 -12.494 -6.671 -10.024 269 HB3 PRO 30 HB3 PRO 30 -12.444 -8.090 -11.118 270 HG2 PRO 30 HG2 PRO 30 -11.386 -7.891 -8.279 271 HG3 PRO 30 HG3 PRO 30 -12.435 -9.165 -8.979 272 HD2 PRO 30 HD2 PRO 30 -9.713 -9.411 -8.777 273 HD3 PRO 30 HD3 PRO 30 -10.641 -10.151 -10.112 274 H LYS 31 H LYS 31 -10.781 -4.696 -11.478 275 HA LYS 31 HA LYS 31 -8.731 -3.614 -9.669 276 HB2 LYS 31 HB2 LYS 31 -10.609 -2.298 -11.670 277 HB3 LYS 31 HB3 LYS 31 -9.393 -1.425 -10.727 278 HG2 LYS 31 HG2 LYS 31 -7.584 -2.743 -11.702 279 HG3 LYS 31 HG3 LYS 31 -8.722 -3.732 -12.620 280 HD2 LYS 31 HD2 LYS 31 -8.367 -0.726 -12.984 281 HD3 LYS 31 HD3 LYS 31 -7.587 -1.974 -13.969 282 HE2 LYS 31 HE2 LYS 31 -9.841 -2.860 -14.604 283 HE3 LYS 31 HE3 LYS 31 -10.597 -1.540 -13.701 284 HZ1 LYS 31 HZ1 LYS 31 -8.791 -1.195 -16.038 285 HZ2 LYS 31 HZ2 LYS 31 -10.409 -1.000 -16.057 286 HZ3 LYS 31 HZ3 LYS 31 -9.480 0.030 -15.200 287 H LEU 32 H LEU 32 -8.994 -2.289 -7.934 288 HA LEU 32 HA LEU 32 -11.621 -1.577 -6.813 289 HB2 LEU 32 HB2 LEU 32 -11.253 -3.880 -6.023 290 HB3 LEU 32 HB3 LEU 32 -9.595 -3.495 -5.639 291 HG LEU 32 HG LEU 32 -10.634 -1.747 -3.966 292 HD11 LEU 32 HD11 LEU 32 -12.844 -3.836 -4.177 293 HD12 LEU 32 HD12 LEU 32 -12.739 -2.530 -2.978 294 HD13 LEU 32 HD13 LEU 32 -12.989 -2.140 -4.689 295 HD21 LEU 32 HD21 LEU 32 -9.211 -3.583 -3.299 296 HD22 LEU 32 HD22 LEU 32 -10.600 -3.476 -2.205 297 HD23 LEU 32 HD23 LEU 32 -10.561 -4.741 -3.459 298 H GLU 33 H GLU 33 -11.421 0.345 -5.736 299 HA GLU 33 HA GLU 33 -8.823 1.429 -4.819 300 HB2 GLU 33 HB2 GLU 33 -10.379 2.416 -7.215 301 HB3 GLU 33 HB3 GLU 33 -9.659 3.618 -6.159 302 HG2 GLU 33 HG2 GLU 33 -8.065 1.384 -7.453 303 HG3 GLU 33 HG3 GLU 33 -8.256 2.999 -8.117 304 H GLU 34 H GLU 34 -9.941 0.976 -2.834 305 HA GLU 34 HA GLU 34 -11.898 3.093 -2.039 306 HB2 GLU 34 HB2 GLU 34 -12.186 0.090 -1.755 307 HB3 GLU 34 HB3 GLU 34 -13.018 1.230 -0.668 308 HG2 GLU 34 HG2 GLU 34 -13.934 2.385 -2.730 309 HG3 GLU 34 HG3 GLU 34 -13.311 1.037 -3.685 310 H LEU 35 H LEU 35 -9.980 4.094 -1.331 311 HA LEU 35 HA LEU 35 -9.080 3.267 1.401 312 HB2 LEU 35 HB2 LEU 35 -7.856 5.042 -0.740 313 HB3 LEU 35 HB3 LEU 35 -7.225 4.938 0.892 314 HG LEU 35 HG LEU 35 -7.560 2.303 -0.513 315 HD11 LEU 35 HD11 LEU 35 -5.355 4.227 -1.327 316 HD12 LEU 35 HD12 LEU 35 -5.538 2.528 -1.817 317 HD13 LEU 35 HD13 LEU 35 -6.725 3.723 -2.345 318 HD21 LEU 35 HD21 LEU 35 -6.549 2.467 1.732 319 HD22 LEU 35 HD22 LEU 35 -5.382 1.868 0.544 320 HD23 LEU 35 HD23 LEU 35 -5.283 3.548 1.091 321 H SER 36 H SER 36 -9.051 4.891 3.037 322 HA SER 36 HA SER 36 -11.045 7.064 2.845 323 HB2 SER 36 HB2 SER 36 -10.693 5.763 4.943 324 HB3 SER 36 HB3 SER 36 -9.059 6.447 5.061 325 HG SER 36 HG SER 36 -10.704 7.603 6.266 326 H GLU 37 H GLU 37 -10.255 9.358 3.505 327 HA GLU 37 HA GLU 37 -8.573 10.306 1.428 328 HB2 GLU 37 HB2 GLU 37 -10.317 11.620 2.562 329 HB3 GLU 37 HB3 GLU 37 -9.334 11.682 4.035 330 HG2 GLU 37 HG2 GLU 37 -7.583 12.946 2.824 331 HG3 GLU 37 HG3 GLU 37 -8.501 12.805 1.322 332 H GLN 38 H GLN 38 -7.709 9.778 4.883 333 HA GLN 38 HA GLN 38 -4.936 10.597 4.431 334 HB2 GLN 38 HB2 GLN 38 -4.507 9.843 6.690 335 HB3 GLN 38 HB3 GLN 38 -5.859 10.964 6.616 336 HG2 GLN 38 HG2 GLN 38 -7.467 9.254 7.070 337 HG3 GLN 38 HG3 GLN 38 -6.325 7.955 6.724 338 HE21 GLN 38 HE21 GLN 38 -4.664 8.118 9.885 339 HE22 GLN 38 HE22 GLN 38 -4.404 7.720 8.191 340 H GLN 39 H GLN 39 -6.666 7.504 4.446 341 HA GLN 39 HA GLN 39 -4.356 5.787 4.417 342 HB2 GLN 39 HB2 GLN 39 -7.182 5.418 3.422 343 HB3 GLN 39 HB3 GLN 39 -5.991 4.131 3.419 344 HG2 GLN 39 HG2 GLN 39 -6.590 5.552 6.028 345 HG3 GLN 39 HG3 GLN 39 -7.748 4.400 5.387 346 HE21 GLN 39 HE21 GLN 39 -4.697 2.858 7.405 347 HE22 GLN 39 HE22 GLN 39 -5.099 4.572 7.461 348 H LYS 40 H LYS 40 -6.273 7.336 1.824 349 HA LYS 40 HA LYS 40 -4.886 6.217 -0.418 350 HB2 LYS 40 HB2 LYS 40 -7.030 7.328 -0.650 351 HB3 LYS 40 HB3 LYS 40 -6.383 8.849 -0.031 352 HG2 LYS 40 HG2 LYS 40 -4.981 9.154 -1.976 353 HG3 LYS 40 HG3 LYS 40 -5.376 7.550 -2.600 354 HD2 LYS 40 HD2 LYS 40 -7.475 9.710 -2.123 355 HD3 LYS 40 HD3 LYS 40 -6.570 9.619 -3.628 356 HE2 LYS 40 HE2 LYS 40 -8.249 7.317 -2.531 357 HE3 LYS 40 HE3 LYS 40 -8.857 8.533 -3.654 358 HZ1 LYS 40 HZ1 LYS 40 -6.596 6.690 -4.243 359 HZ2 LYS 40 HZ2 LYS 40 -8.096 6.573 -4.856 360 HZ3 LYS 40 HZ3 LYS 40 -7.161 7.843 -5.255 361 H ILE 41 H ILE 41 -4.188 9.195 1.493 362 HA ILE 41 HA ILE 41 -1.912 9.941 -0.111 363 HB ILE 41 HB ILE 41 -2.538 10.643 2.745 364 HG12 ILE 41 HG12 ILE 41 -2.995 12.416 0.292 365 HG13 ILE 41 HG13 ILE 41 -4.243 11.314 0.827 366 HG21 ILE 41 HG21 ILE 41 -0.616 11.957 0.785 367 HG22 ILE 41 HG22 ILE 41 -1.071 12.640 2.360 368 HG23 ILE 41 HG23 ILE 41 -0.197 11.121 2.298 369 HD11 ILE 41 HD11 ILE 41 -3.107 13.603 2.471 370 HD12 ILE 41 HD12 ILE 41 -4.718 13.478 1.742 371 HD13 ILE 41 HD13 ILE 41 -4.267 12.392 3.068 372 H ILE 42 H ILE 42 -2.116 7.987 2.972 373 HA ILE 42 HA ILE 42 0.732 7.677 3.196 374 HB ILE 42 HB ILE 42 -1.470 5.808 4.119 375 HG12 ILE 42 HG12 ILE 42 0.043 7.719 5.934 376 HG13 ILE 42 HG13 ILE 42 -1.335 8.318 5.030 377 HG21 ILE 42 HG21 ILE 42 1.486 6.010 4.876 378 HG22 ILE 42 HG22 ILE 42 0.299 5.047 5.774 379 HG23 ILE 42 HG23 ILE 42 0.680 4.629 4.106 380 HD11 ILE 42 HD11 ILE 42 -1.407 5.972 6.968 381 HD12 ILE 42 HD12 ILE 42 -2.094 7.592 7.210 382 HD13 ILE 42 HD13 ILE 42 -2.766 6.518 5.961 383 H LEU 43 H LEU 43 -1.729 5.718 1.549 384 HA LEU 43 HA LEU 43 -0.050 3.669 0.514 385 HB2 LEU 43 HB2 LEU 43 -2.467 3.558 0.642 386 HB3 LEU 43 HB3 LEU 43 -2.660 4.904 -0.454 387 HG LEU 43 HG LEU 43 -3.204 2.642 -1.321 388 HD11 LEU 43 HD11 LEU 43 -1.089 4.067 -2.958 389 HD12 LEU 43 HD12 LEU 43 -2.355 2.979 -3.540 390 HD13 LEU 43 HD13 LEU 43 -2.791 4.538 -2.823 391 HD21 LEU 43 HD21 LEU 43 -1.506 1.279 -0.411 392 HD22 LEU 43 HD22 LEU 43 -1.336 1.214 -2.165 393 HD23 LEU 43 HD23 LEU 43 -0.189 2.178 -1.203 394 H ALA 44 H ALA 44 -1.018 6.811 -0.918 395 HA ALA 44 HA ALA 44 0.465 6.551 -3.331 396 HB1 ALA 44 HB1 ALA 44 -0.535 8.988 -1.818 397 HB2 ALA 44 HB2 ALA 44 -0.005 8.979 -3.516 398 HB3 ALA 44 HB3 ALA 44 -1.447 8.054 -3.029 399 H GLU 45 H GLU 45 1.310 8.425 -0.318 400 HA GLU 45 HA GLU 45 3.812 9.375 -1.270 401 HB2 GLU 45 HB2 GLU 45 2.802 8.814 1.542 402 HB3 GLU 45 HB3 GLU 45 4.380 9.538 1.205 403 HG2 GLU 45 HG2 GLU 45 3.209 11.326 -0.142 404 HG3 GLU 45 HG3 GLU 45 1.679 10.725 0.486 405 H TYR 46 H TYR 46 3.030 6.167 -0.031 406 HA TYR 46 HA TYR 46 5.786 5.388 0.450 407 HB2 TYR 46 HB2 TYR 46 3.910 4.427 1.647 408 HB3 TYR 46 HB3 TYR 46 3.196 3.853 0.148 409 HD1 TYR 46 HD1 TYR 46 6.863 3.370 0.483 410 HD2 TYR 46 HD2 TYR 46 2.948 1.745 1.277 411 HE1 TYR 46 HE1 TYR 46 7.867 1.127 0.797 412 HE2 TYR 46 HE2 TYR 46 3.976 -0.536 1.559 413 HH TYR 46 HH TYR 46 7.490 -1.082 1.253 414 H ILE 47 H ILE 47 3.455 4.493 -2.202 415 HA ILE 47 HA ILE 47 5.297 3.266 -3.959 416 HB ILE 47 HB ILE 47 2.695 4.746 -4.257 417 HG12 ILE 47 HG12 ILE 47 3.329 1.801 -4.685 418 HG13 ILE 47 HG13 ILE 47 3.019 2.420 -3.077 419 HG21 ILE 47 HG21 ILE 47 4.220 3.320 -6.475 420 HG22 ILE 47 HG22 ILE 47 2.503 3.751 -6.577 421 HG23 ILE 47 HG23 ILE 47 3.710 5.020 -6.449 422 HD11 ILE 47 HD11 ILE 47 1.022 2.594 -5.372 423 HD12 ILE 47 HD12 ILE 47 0.975 1.456 -4.009 424 HD13 ILE 47 HD13 ILE 47 0.792 3.195 -3.726 425 H ALA 48 H ALA 48 4.460 6.741 -3.494 426 HA ALA 48 HA ALA 48 5.987 7.744 -5.700 427 HB1 ALA 48 HB1 ALA 48 5.150 9.031 -3.074 428 HB2 ALA 48 HB2 ALA 48 5.678 9.900 -4.533 429 HB3 ALA 48 HB3 ALA 48 4.172 8.957 -4.556 430 H GLU 49 H GLU 49 7.018 6.590 -2.552 431 HA GLU 49 HA GLU 49 9.678 7.881 -2.769 432 HB2 GLU 49 HB2 GLU 49 8.423 7.948 -0.653 433 HB3 GLU 49 HB3 GLU 49 8.465 6.181 -0.560 434 HG2 GLU 49 HG2 GLU 49 10.900 6.211 -0.361 435 HG3 GLU 49 HG3 GLU 49 10.946 7.947 -0.685 436 H VAL 50 H VAL 50 8.217 4.615 -3.169 437 HA VAL 50 HA VAL 50 10.982 3.571 -3.684 438 HB VAL 50 HB VAL 50 10.455 1.508 -2.712 439 HG11 VAL 50 HG11 VAL 50 9.406 3.600 -0.774 440 HG12 VAL 50 HG12 VAL 50 10.172 2.049 -0.386 441 HG13 VAL 50 HG13 VAL 50 11.124 3.332 -1.154 442 HG21 VAL 50 HG21 VAL 50 8.108 1.191 -3.326 443 HG22 VAL 50 HG22 VAL 50 8.356 0.953 -1.605 444 HG23 VAL 50 HG23 VAL 50 7.608 2.450 -2.193 445 H GLY 51 H GLY 51 7.789 3.844 -5.017 446 HA2 GLY 51 HA2 GLY 51 7.150 3.334 -7.200 447 HA3 GLY 51 HA3 GLY 51 8.545 2.287 -7.414 448 H LEU 52 H LEU 52 5.596 1.923 -7.868 449 HA LEU 52 HA LEU 52 4.364 0.351 -6.003 450 HB2 LEU 52 HB2 LEU 52 3.325 1.512 -7.953 451 HB3 LEU 52 HB3 LEU 52 4.109 0.381 -9.051 452 HG LEU 52 HG LEU 52 2.676 -1.463 -8.182 453 HD11 LEU 52 HD11 LEU 52 1.247 0.758 -6.662 454 HD12 LEU 52 HD12 LEU 52 0.754 -0.946 -6.757 455 HD13 LEU 52 HD13 LEU 52 2.239 -0.498 -5.902 456 HD21 LEU 52 HD21 LEU 52 2.010 -0.147 -10.150 457 HD22 LEU 52 HD22 LEU 52 0.599 -0.668 -9.206 458 HD23 LEU 52 HD23 LEU 52 1.168 1.005 -9.084 459 H GLN 53 H GLN 53 6.839 -0.645 -7.952 460 HA GLN 53 HA GLN 53 6.277 -3.561 -7.772 461 HB2 GLN 53 HB2 GLN 53 8.204 -3.931 -9.160 462 HB3 GLN 53 HB3 GLN 53 7.080 -2.826 -9.914 463 HG2 GLN 53 HG2 GLN 53 9.356 -1.610 -8.341 464 HG3 GLN 53 HG3 GLN 53 9.781 -2.459 -9.813 465 HE21 GLN 53 HE21 GLN 53 8.834 1.258 -10.367 466 HE22 GLN 53 HE22 GLN 53 9.608 0.576 -8.946 467 H ASN 54 H ASN 54 7.906 -1.253 -5.835 468 HA ASN 54 HA ASN 54 9.672 -3.341 -4.631 469 HB2 ASN 54 HB2 ASN 54 9.908 -0.320 -4.550 470 HB3 ASN 54 HB3 ASN 54 11.059 -1.455 -3.857 471 HD21 ASN 54 HD21 ASN 54 11.798 -0.271 -7.492 472 HD22 ASN 54 HD22 ASN 54 10.833 0.585 -6.276 473 H ILE 55 H ILE 55 6.895 -1.595 -3.974 474 HA ILE 55 HA ILE 55 6.998 -1.688 -1.072 475 HB ILE 55 HB ILE 55 4.597 -1.461 -1.074 476 HG12 ILE 55 HG12 ILE 55 4.687 -1.729 -4.100 477 HG13 ILE 55 HG13 ILE 55 4.000 -2.911 -2.979 478 HG21 ILE 55 HG21 ILE 55 5.655 0.432 -3.203 479 HG22 ILE 55 HG22 ILE 55 4.436 0.736 -1.933 480 HG23 ILE 55 HG23 ILE 55 6.110 0.510 -1.488 481 HD11 ILE 55 HD11 ILE 55 2.988 -0.103 -3.493 482 HD12 ILE 55 HD12 ILE 55 2.198 -1.628 -3.894 483 HD13 ILE 55 HD13 ILE 55 2.388 -1.166 -2.186 484 H THR 56 H THR 56 5.930 -3.187 0.320 485 HA THR 56 HA THR 56 5.317 -5.868 -0.837 486 HB THR 56 HB THR 56 6.045 -6.482 1.719 487 HG1 THR 56 HG1 THR 56 8.032 -5.432 2.111 488 HG21 THR 56 HG21 THR 56 7.951 -6.250 -0.643 489 HG22 THR 56 HG22 THR 56 8.203 -7.259 0.811 490 HG23 THR 56 HG23 THR 56 6.865 -7.620 -0.287 491 H ALA 57 H ALA 57 3.525 -6.935 -0.020 492 HA ALA 57 HA ALA 57 1.430 -5.460 1.192 493 HB1 ALA 57 HB1 ALA 57 1.919 -8.471 1.064 494 HB2 ALA 57 HB2 ALA 57 0.375 -7.661 1.409 495 HB3 ALA 57 HB3 ALA 57 1.125 -7.491 -0.190 496 H ILE 58 H ILE 58 4.118 -7.241 2.587 497 HA ILE 58 HA ILE 58 3.185 -7.497 5.296 498 HB ILE 58 HB ILE 58 6.034 -7.119 4.265 499 HG12 ILE 58 HG12 ILE 58 5.264 -8.980 3.037 500 HG13 ILE 58 HG13 ILE 58 6.249 -9.596 4.348 501 HG21 ILE 58 HG21 ILE 58 4.915 -8.278 6.851 502 HG22 ILE 58 HG22 ILE 58 6.630 -8.344 6.365 503 HG23 ILE 58 HG23 ILE 58 5.848 -6.784 6.659 504 HD11 ILE 58 HD11 ILE 58 3.203 -9.640 4.209 505 HD12 ILE 58 HD12 ILE 58 4.304 -11.008 4.008 506 HD13 ILE 58 HD13 ILE 58 4.165 -10.220 5.594 507 H THR 59 H THR 59 5.298 -5.063 3.709 508 HA THR 59 HA THR 59 5.425 -3.337 6.019 509 HB THR 59 HB THR 59 6.112 -2.948 3.090 510 HG1 THR 59 HG1 THR 59 8.057 -3.612 3.669 511 HG21 THR 59 HG21 THR 59 6.844 -1.275 5.548 512 HG22 THR 59 HG22 THR 59 7.629 -1.134 3.954 513 HG23 THR 59 HG23 THR 59 5.914 -0.736 4.127 514 H LEU 60 H LEU 60 3.536 -3.309 2.984 515 HA LEU 60 HA LEU 60 2.166 -0.881 3.468 516 HB2 LEU 60 HB2 LEU 60 2.411 -2.177 1.290 517 HB3 LEU 60 HB3 LEU 60 1.217 -3.306 1.891 518 HG LEU 60 HG LEU 60 -0.438 -1.381 1.983 519 HD11 LEU 60 HD11 LEU 60 1.716 0.075 0.401 520 HD12 LEU 60 HD12 LEU 60 0.108 0.676 0.833 521 HD13 LEU 60 HD13 LEU 60 1.294 0.454 2.095 522 HD21 LEU 60 HD21 LEU 60 -0.360 -2.906 0.054 523 HD22 LEU 60 HD22 LEU 60 -0.725 -1.252 -0.471 524 HD23 LEU 60 HD23 LEU 60 0.900 -1.926 -0.696 525 H SER 61 H SER 61 1.331 -4.229 4.459 526 HA SER 61 HA SER 61 -1.074 -3.746 5.805 527 HB2 SER 61 HB2 SER 61 -0.192 -5.970 5.457 528 HB3 SER 61 HB3 SER 61 1.156 -5.631 6.557 529 HG SER 61 HG SER 61 -0.418 -6.738 7.677 530 H LYS 62 H LYS 62 2.091 -2.864 6.700 531 HA LYS 62 HA LYS 62 1.233 -2.077 9.420 532 HB2 LYS 62 HB2 LYS 62 4.005 -2.580 8.294 533 HB3 LYS 62 HB3 LYS 62 3.696 -1.948 9.920 534 HG2 LYS 62 HG2 LYS 62 2.301 -3.941 10.439 535 HG3 LYS 62 HG3 LYS 62 2.680 -4.620 8.847 536 HD2 LYS 62 HD2 LYS 62 5.097 -4.574 9.409 537 HD3 LYS 62 HD3 LYS 62 4.714 -3.953 11.021 538 HE2 LYS 62 HE2 LYS 62 3.740 -6.618 9.881 539 HE3 LYS 62 HE3 LYS 62 5.161 -6.433 10.911 540 HZ1 LYS 62 HZ1 LYS 62 2.378 -5.787 11.730 541 HZ2 LYS 62 HZ2 LYS 62 3.246 -7.073 12.227 542 HZ3 LYS 62 HZ3 LYS 62 3.702 -5.572 12.668 543 H LYS 63 H LYS 63 2.313 -0.563 6.439 544 HA LYS 63 HA LYS 63 2.873 2.072 7.471 545 HB2 LYS 63 HB2 LYS 63 1.909 0.938 4.818 546 HB3 LYS 63 HB3 LYS 63 2.185 2.666 5.025 547 HG2 LYS 63 HG2 LYS 63 4.346 0.555 5.456 548 HG3 LYS 63 HG3 LYS 63 4.028 1.354 3.921 549 HD2 LYS 63 HD2 LYS 63 4.446 3.571 5.090 550 HD3 LYS 63 HD3 LYS 63 4.981 2.628 6.507 551 HE2 LYS 63 HE2 LYS 63 6.666 1.478 5.071 552 HE3 LYS 63 HE3 LYS 63 6.140 2.448 3.688 553 HZ1 LYS 63 HZ1 LYS 63 7.343 3.539 6.183 554 HZ2 LYS 63 HZ2 LYS 63 8.105 3.411 4.746 555 HZ3 LYS 63 HZ3 LYS 63 6.851 4.443 4.911 556 H LEU 64 H LEU 64 -0.102 0.463 6.472 557 HA LEU 64 HA LEU 64 -1.727 2.871 7.160 558 HB2 LEU 64 HB2 LEU 64 -2.211 0.472 5.374 559 HB3 LEU 64 HB3 LEU 64 -3.413 1.710 5.693 560 HG LEU 64 HG LEU 64 -1.094 3.148 4.913 561 HD11 LEU 64 HD11 LEU 64 -1.639 0.868 2.972 562 HD12 LEU 64 HD12 LEU 64 -0.530 2.244 2.733 563 HD13 LEU 64 HD13 LEU 64 -0.191 1.029 3.977 564 HD21 LEU 64 HD21 LEU 64 -3.396 3.774 4.426 565 HD22 LEU 64 HD22 LEU 64 -2.392 3.754 2.970 566 HD23 LEU 64 HD23 LEU 64 -3.543 2.427 3.270 567 H ASN 65 H ASN 65 -0.885 0.106 8.743 568 HA ASN 65 HA ASN 65 -1.766 -1.272 10.296 569 HB2 ASN 65 HB2 ASN 65 -3.628 1.042 10.945 570 HB3 ASN 65 HB3 ASN 65 -3.223 -0.307 11.995 571 HD21 ASN 65 HD21 ASN 65 -0.706 2.856 11.785 572 HD22 ASN 65 HD22 ASN 65 -2.195 2.808 10.851 573 H ILE 66 H ILE 66 -2.499 -2.150 8.015 574 HA ILE 66 HA ILE 66 -5.414 -2.843 8.091 575 HB ILE 66 HB ILE 66 -5.158 -3.263 5.642 576 HG12 ILE 66 HG12 ILE 66 -2.409 -1.991 6.001 577 HG13 ILE 66 HG13 ILE 66 -2.919 -3.500 5.247 578 HG21 ILE 66 HG21 ILE 66 -4.776 -0.394 6.501 579 HG22 ILE 66 HG22 ILE 66 -5.594 -1.002 5.040 580 HG23 ILE 66 HG23 ILE 66 -6.286 -1.334 6.622 581 HD11 ILE 66 HD11 ILE 66 -3.523 -0.755 4.096 582 HD12 ILE 66 HD12 ILE 66 -2.212 -1.826 3.604 583 HD13 ILE 66 HD13 ILE 66 -3.901 -2.326 3.370 584 H THR 67 H THR 67 -5.265 -5.000 6.289 585 HA THR 67 HA THR 67 -3.650 -7.017 7.771 586 HB THR 67 HB THR 67 -5.085 -8.688 7.260 587 HG1 THR 67 HG1 THR 67 -6.623 -8.554 5.577 588 HG21 THR 67 HG21 THR 67 -7.112 -6.414 7.153 589 HG22 THR 67 HG22 THR 67 -7.377 -8.086 7.687 590 HG23 THR 67 HG23 THR 67 -6.355 -7.007 8.654 591 H VAL 68 H VAL 68 -2.570 -8.686 6.449 592 HA VAL 68 HA VAL 68 -1.063 -7.593 4.254 593 HB VAL 68 HB VAL 68 -1.494 -10.493 5.066 594 HG11 VAL 68 HG11 VAL 68 0.632 -9.274 3.248 595 HG12 VAL 68 HG12 VAL 68 0.626 -10.943 3.851 596 HG13 VAL 68 HG13 VAL 68 -0.640 -10.413 2.745 597 HG21 VAL 68 HG21 VAL 68 -0.416 -9.149 6.843 598 HG22 VAL 68 HG22 VAL 68 0.755 -10.243 6.107 599 HG23 VAL 68 HG23 VAL 68 0.763 -8.521 5.669 600 H GLU 69 H GLU 69 -4.268 -9.080 4.312 601 HA GLU 69 HA GLU 69 -4.191 -9.673 1.394 602 HB2 GLU 69 HB2 GLU 69 -6.384 -9.975 3.486 603 HB3 GLU 69 HB3 GLU 69 -6.550 -10.373 1.772 604 HG2 GLU 69 HG2 GLU 69 -4.689 -12.016 1.973 605 HG3 GLU 69 HG3 GLU 69 -4.570 -11.666 3.699 606 H LYS 70 H LYS 70 -5.446 -7.295 3.699 607 HA LYS 70 HA LYS 70 -6.989 -5.831 1.751 608 HB2 LYS 70 HB2 LYS 70 -7.461 -6.222 4.266 609 HB3 LYS 70 HB3 LYS 70 -6.248 -4.970 4.547 610 HG2 LYS 70 HG2 LYS 70 -7.967 -3.986 2.506 611 HG3 LYS 70 HG3 LYS 70 -9.033 -4.803 3.666 612 HD2 LYS 70 HD2 LYS 70 -7.858 -3.428 5.496 613 HD3 LYS 70 HD3 LYS 70 -7.033 -2.588 4.170 614 HE2 LYS 70 HE2 LYS 70 -8.833 -1.184 4.820 615 HE3 LYS 70 HE3 LYS 70 -9.275 -1.899 3.265 616 HZ1 LYS 70 HZ1 LYS 70 -10.245 -2.830 5.925 617 HZ2 LYS 70 HZ2 LYS 70 -11.119 -1.961 4.860 618 HZ3 LYS 70 HZ3 LYS 70 -10.682 -3.486 4.491 619 H ALA 71 H ALA 71 -3.870 -6.008 2.483 620 HA ALA 71 HA ALA 71 -2.999 -3.428 1.272 621 HB1 ALA 71 HB1 ALA 71 -1.410 -5.690 2.585 622 HB2 ALA 71 HB2 ALA 71 -0.760 -4.150 2.014 623 HB3 ALA 71 HB3 ALA 71 -1.889 -4.182 3.371 624 H LYS 72 H LYS 72 -2.660 -7.001 0.774 625 HA LYS 72 HA LYS 72 -1.005 -6.766 -1.559 626 HB2 LYS 72 HB2 LYS 72 -0.978 -8.727 -0.044 627 HB3 LYS 72 HB3 LYS 72 -2.665 -9.075 -0.418 628 HG2 LYS 72 HG2 LYS 72 -2.124 -9.665 -2.679 629 HG3 LYS 72 HG3 LYS 72 -0.456 -9.092 -2.509 630 HD2 LYS 72 HD2 LYS 72 -1.631 -11.351 -0.822 631 HD3 LYS 72 HD3 LYS 72 -0.843 -11.621 -2.390 632 HE2 LYS 72 HE2 LYS 72 1.219 -10.489 -1.508 633 HE3 LYS 72 HE3 LYS 72 0.442 -10.366 0.078 634 HZ1 LYS 72 HZ1 LYS 72 1.028 -12.909 -1.350 635 HZ2 LYS 72 HZ2 LYS 72 1.855 -12.339 -0.067 636 HZ3 LYS 72 HZ3 LYS 72 0.302 -12.810 0.112 637 H ASN 73 H ASN 73 -4.472 -6.852 -1.024 638 HA ASN 73 HA ASN 73 -5.401 -7.454 -3.564 639 HB2 ASN 73 HB2 ASN 73 -7.343 -5.995 -3.006 640 HB3 ASN 73 HB3 ASN 73 -6.913 -7.099 -1.713 641 HD21 ASN 73 HD21 ASN 73 -7.576 -3.803 -0.158 642 HD22 ASN 73 HD22 ASN 73 -8.535 -4.981 -1.052 643 H TYR 74 H TYR 74 -4.382 -4.174 -2.468 644 HA TYR 74 HA TYR 74 -4.683 -2.772 -4.820 645 HB2 TYR 74 HB2 TYR 74 -2.471 -2.473 -2.753 646 HB3 TYR 74 HB3 TYR 74 -3.016 -1.213 -3.858 647 HD1 TYR 74 HD1 TYR 74 -2.969 -1.888 -0.589 648 HD2 TYR 74 HD2 TYR 74 -5.937 -1.207 -3.658 649 HE1 TYR 74 HE1 TYR 74 -4.586 -1.110 1.136 650 HE2 TYR 74 HE2 TYR 74 -7.571 -0.510 -1.915 651 HH TYR 74 HH TYR 74 -6.745 -0.496 1.566 652 H ILE 75 H ILE 75 -1.866 -4.675 -3.768 653 HA ILE 75 HA ILE 75 -0.126 -3.975 -5.946 654 HB ILE 75 HB ILE 75 -0.005 -6.356 -4.044 655 HG12 ILE 75 HG12 ILE 75 1.156 -3.553 -3.734 656 HG13 ILE 75 HG13 ILE 75 -0.188 -4.197 -2.804 657 HG21 ILE 75 HG21 ILE 75 2.196 -4.966 -5.642 658 HG22 ILE 75 HG22 ILE 75 2.435 -6.300 -4.492 659 HG23 ILE 75 HG23 ILE 75 1.538 -6.587 -5.965 660 HD11 ILE 75 HD11 ILE 75 2.694 -5.082 -2.614 661 HD12 ILE 75 HD12 ILE 75 1.684 -4.299 -1.389 662 HD13 ILE 75 HD13 ILE 75 1.325 -5.963 -1.888 663 H LYS 76 H LYS 76 -2.638 -6.415 -5.590 664 HA LYS 76 HA LYS 76 -1.908 -7.907 -8.038 665 HB2 LYS 76 HB2 LYS 76 -4.233 -8.036 -6.062 666 HB3 LYS 76 HB3 LYS 76 -4.040 -9.126 -7.425 667 HG2 LYS 76 HG2 LYS 76 -2.049 -8.872 -5.146 668 HG3 LYS 76 HG3 LYS 76 -3.363 -10.035 -5.198 669 HD2 LYS 76 HD2 LYS 76 -1.046 -9.871 -7.188 670 HD3 LYS 76 HD3 LYS 76 -1.196 -11.031 -5.863 671 HE2 LYS 76 HE2 LYS 76 -3.276 -11.939 -6.867 672 HE3 LYS 76 HE3 LYS 76 -3.145 -10.787 -8.203 673 HZ1 LYS 76 HZ1 LYS 76 -1.166 -12.910 -7.603 674 HZ2 LYS 76 HZ2 LYS 76 -2.272 -12.929 -8.822 675 HZ3 LYS 76 HZ3 LYS 76 -1.049 -11.836 -8.835 676 H ASN 77 H ASN 77 -4.206 -5.437 -6.993 677 HA ASN 77 HA ASN 77 -5.982 -5.655 -9.273 678 HB2 ASN 77 HB2 ASN 77 -5.640 -3.476 -7.143 679 HB3 ASN 77 HB3 ASN 77 -6.994 -3.607 -8.251 680 HD21 ASN 77 HD21 ASN 77 -7.764 -5.076 -4.864 681 HD22 ASN 77 HD22 ASN 77 -7.103 -3.520 -5.363 682 H SER 78 H SER 78 -3.452 -3.433 -8.062 683 HA SER 78 HA SER 78 -3.000 -2.467 -10.833 684 HB2 SER 78 HB2 SER 78 -2.780 -0.871 -8.253 685 HB3 SER 78 HB3 SER 78 -2.256 -0.291 -9.847 686 HG SER 78 HG SER 78 -4.399 0.392 -9.292 687 H ASN 79 H ASN 79 -1.119 -2.791 -11.681 688 HA ASN 79 HA ASN 79 1.302 -3.181 -9.982 689 HB2 ASN 79 HB2 ASN 79 -0.164 -5.307 -10.248 690 HB3 ASN 79 HB3 ASN 79 0.360 -5.324 -11.930 691 HD21 ASN 79 HD21 ASN 79 2.874 -6.362 -8.881 692 HD22 ASN 79 HD22 ASN 79 1.231 -5.746 -8.614 693 H ARG 80 H ARG 80 0.119 -3.427 -13.376 694 HA ARG 80 HA ARG 80 2.757 -2.493 -14.404 695 HB2 ARG 80 HB2 ARG 80 0.385 -3.690 -15.873 696 HB3 ARG 80 HB3 ARG 80 1.971 -3.352 -16.554 697 HG2 ARG 80 HG2 ARG 80 1.315 -5.423 -14.420 698 HG3 ARG 80 HG3 ARG 80 1.742 -5.726 -16.095 699 HD2 ARG 80 HD2 ARG 80 3.579 -4.531 -13.972 700 HD3 ARG 80 HD3 ARG 80 3.617 -6.186 -14.543 701 HE ARG 80 HE ARG 80 4.649 -3.803 -15.922 702 HH11 ARG 80 HH11 ARG 80 5.831 -4.034 -17.781 703 HH12 ARG 80 HH12 ARG 80 5.877 -5.567 -18.599 704 HH21 ARG 80 HH21 ARG 80 3.809 -7.177 -16.390 705 HH22 ARG 80 HH22 ARG 80 4.766 -7.301 -17.841 706 H LEU 81 H LEU 81 0.289 -0.864 -13.322 707 HA LEU 81 HA LEU 81 0.128 1.152 -15.530 708 HB2 LEU 81 HB2 LEU 81 -1.872 -0.247 -15.146 709 HB3 LEU 81 HB3 LEU 81 -1.899 0.238 -13.453 710 HG LEU 81 HG LEU 81 -2.371 2.591 -14.138 711 HD11 LEU 81 HD11 LEU 81 -2.554 1.395 -16.942 712 HD12 LEU 81 HD12 LEU 81 -3.108 3.018 -16.475 713 HD13 LEU 81 HD13 LEU 81 -1.388 2.625 -16.398 714 HD21 LEU 81 HD21 LEU 81 -4.178 0.999 -13.586 715 HD22 LEU 81 HD22 LEU 81 -4.690 2.164 -14.820 716 HD23 LEU 81 HD23 LEU 81 -4.266 0.501 -15.289 717 H GLY 82 H GLY 82 0.270 0.841 -11.949 718 HA2 GLY 82 HA2 GLY 82 -0.160 3.689 -11.590 719 HA3 GLY 82 HA3 GLY 82 0.080 2.496 -10.330 720 H ARG 83 H ARG 83 1.935 4.179 -12.896 721 HA ARG 83 HA ARG 83 4.257 4.538 -10.995 722 HB2 ARG 83 HB2 ARG 83 4.255 3.999 -13.957 723 HB3 ARG 83 HB3 ARG 83 5.647 4.723 -13.117 724 HG2 ARG 83 HG2 ARG 83 5.863 2.857 -11.616 725 HG3 ARG 83 HG3 ARG 83 4.311 2.188 -12.113 726 HD2 ARG 83 HD2 ARG 83 5.287 1.852 -14.435 727 HD3 ARG 83 HD3 ARG 83 6.850 2.335 -13.765 728 HE ARG 83 HE ARG 83 7.038 0.254 -12.713 729 HH11 ARG 83 HH11 ARG 83 6.433 -1.639 -11.870 730 HH12 ARG 83 HH12 ARG 83 4.754 -2.189 -11.983 731 HH21 ARG 83 HH21 ARG 83 3.646 0.580 -13.608 732 HH22 ARG 83 HH22 ARG 83 3.271 -0.936 -12.782 733 H THR 84 H THR 84 3.490 6.249 -14.012 734 HA THR 84 HA THR 84 2.754 8.670 -12.567 735 HB THR 84 HB THR 84 5.042 8.966 -12.205 736 HG1 THR 84 HG1 THR 84 5.435 10.820 -13.415 737 HG21 THR 84 HG21 THR 84 5.601 8.448 -15.150 738 HG22 THR 84 HG22 THR 84 6.778 8.995 -13.937 739 HG23 THR 84 HG23 THR 84 6.042 7.392 -13.783 740 H ASN 85 H ASN 85 1.257 9.597 -13.668 741 HA ASN 85 HA ASN 85 1.290 9.738 -16.645 742 HB2 ASN 85 HB2 ASN 85 -0.998 8.662 -14.931 743 HB3 ASN 85 HB3 ASN 85 -1.105 9.003 -16.654 744 HD21 ASN 85 HD21 ASN 85 0.491 5.484 -15.451 745 HD22 ASN 85 HD22 ASN 85 -0.004 6.690 -14.275 746 H ASN 86 H ASN 86 1.405 11.590 -14.062 747 HA ASN 86 HA ASN 86 -0.650 13.588 -14.900 748 HB2 ASN 86 HB2 ASN 86 -1.222 11.920 -12.950 749 HB3 ASN 86 HB3 ASN 86 -0.115 12.895 -11.993 750 HD21 ASN 86 HD21 ASN 86 -2.376 15.753 -12.031 751 HD22 ASN 86 HD22 ASN 86 -0.653 15.383 -12.218 752 H LEU 87 H LEU 87 2.376 13.436 -15.210 753 HA LEU 87 HA LEU 87 3.146 15.993 -13.894 754 HB2 LEU 87 HB2 LEU 87 4.565 13.329 -13.913 755 HB3 LEU 87 HB3 LEU 87 5.513 14.803 -14.034 756 HG LEU 87 HG LEU 87 4.347 15.610 -11.898 757 HD11 LEU 87 HD11 LEU 87 3.694 12.631 -11.710 758 HD12 LEU 87 HD12 LEU 87 3.643 13.776 -10.350 759 HD13 LEU 87 HD13 LEU 87 2.530 13.976 -11.696 760 HD21 LEU 87 HD21 LEU 87 6.693 14.869 -12.013 761 HD22 LEU 87 HD22 LEU 87 5.942 14.368 -10.493 762 HD23 LEU 87 HD23 LEU 87 6.181 13.180 -11.795 763 H LYS 88 H LYS 88 4.876 17.076 -14.990 764 HA LYS 88 HA LYS 88 4.781 16.796 -17.968 765 HB2 LYS 88 HB2 LYS 88 4.733 19.284 -18.037 766 HB3 LYS 88 HB3 LYS 88 3.290 18.554 -17.335 767 HG2 LYS 88 HG2 LYS 88 3.958 19.109 -15.093 768 HG3 LYS 88 HG3 LYS 88 5.582 19.598 -15.623 769 HD2 LYS 88 HD2 LYS 88 4.580 21.457 -16.950 770 HD3 LYS 88 HD3 LYS 88 2.969 20.999 -16.353 771 HE2 LYS 88 HE2 LYS 88 3.704 21.409 -14.026 772 HE3 LYS 88 HE3 LYS 88 5.335 21.794 -14.590 773 HZ1 LYS 88 HZ1 LYS 88 2.894 23.344 -15.278 774 HZ2 LYS 88 HZ2 LYS 88 4.037 23.809 -14.212 775 HZ3 LYS 88 HZ3 LYS 88 4.404 23.695 -15.797 776 H THR 89 H THR 89 6.862 16.214 -15.673 777 HA THR 89 HA THR 89 9.069 16.680 -17.449 778 HB THR 89 HB THR 89 9.189 18.725 -16.084 779 HG1 THR 89 HG1 THR 89 11.382 18.448 -15.680 780 HG21 THR 89 HG21 THR 89 9.968 16.936 -13.743 781 HG22 THR 89 HG22 THR 89 9.891 18.710 -13.782 782 HG23 THR 89 HG23 THR 89 8.397 17.760 -13.877 783 H ILE 90 H ILE 90 9.922 14.810 -17.659 784 HA ILE 90 HA ILE 90 10.366 12.979 -15.372 785 HB ILE 90 HB ILE 90 9.732 11.143 -17.079 786 HG12 ILE 90 HG12 ILE 90 9.490 12.771 -19.035 787 HG13 ILE 90 HG13 ILE 90 8.398 11.416 -18.857 788 HG21 ILE 90 HG21 ILE 90 7.531 12.790 -15.806 789 HG22 ILE 90 HG22 ILE 90 7.413 11.097 -16.335 790 HG23 ILE 90 HG23 ILE 90 8.514 11.541 -15.022 791 HD11 ILE 90 HD11 ILE 90 7.661 14.285 -18.145 792 HD12 ILE 90 HD12 ILE 90 7.219 13.414 -19.617 793 HD13 ILE 90 HD13 ILE 90 6.596 12.866 -18.057 794 H GLY 91 H GLY 91 12.031 14.727 -17.481 795 HA2 GLY 91 HA2 GLY 91 14.059 14.565 -18.556 796 HA3 GLY 91 HA3 GLY 91 14.341 13.035 -17.715 797 H ILE 92 H ILE 92 11.474 12.926 -19.492 798 HA ILE 92 HA ILE 92 10.769 11.636 -21.179 799 HB ILE 92 HB ILE 92 12.850 12.971 -22.922 800 HG12 ILE 92 HG12 ILE 92 10.830 14.642 -23.275 801 HG13 ILE 92 HG13 ILE 92 10.326 14.139 -21.670 802 HG21 ILE 92 HG21 ILE 92 9.952 12.111 -23.424 803 HG22 ILE 92 HG22 ILE 92 11.048 12.852 -24.609 804 HG23 ILE 92 HG23 ILE 92 11.378 11.241 -24.011 805 HD11 ILE 92 HD11 ILE 92 13.058 15.332 -22.354 806 HD12 ILE 92 HD12 ILE 92 11.656 16.274 -21.811 807 HD13 ILE 92 HD13 ILE 92 12.382 15.095 -20.722 808 H LEU 93 H LEU 93 12.342 10.220 -19.526 809 HA LEU 93 HA LEU 93 13.528 8.367 -19.191 810 HB2 LEU 93 HB2 LEU 93 11.464 7.717 -20.676 811 HB3 LEU 93 HB3 LEU 93 12.659 7.410 -21.924 812 HG LEU 93 HG LEU 93 13.748 5.723 -20.332 813 HD11 LEU 93 HD11 LEU 93 11.193 6.218 -18.736 814 HD12 LEU 93 HD12 LEU 93 12.336 4.882 -18.476 815 HD13 LEU 93 HD13 LEU 93 12.851 6.544 -18.179 816 HD21 LEU 93 HD21 LEU 93 12.213 5.044 -22.136 817 HD22 LEU 93 HD22 LEU 93 12.022 4.013 -20.709 818 HD23 LEU 93 HD23 LEU 93 10.822 5.281 -21.056 819 H GLN 94 H GLN 94 15.016 10.514 -20.556 820 HA GLN 94 HA GLN 94 17.305 9.002 -21.757 821 HB2 GLN 94 HB2 GLN 94 15.703 11.321 -22.889 822 HB3 GLN 94 HB3 GLN 94 17.350 10.967 -23.433 823 HG2 GLN 94 HG2 GLN 94 16.752 8.794 -24.246 824 HG3 GLN 94 HG3 GLN 94 15.149 8.873 -23.519 825 HE21 GLN 94 HE21 GLN 94 13.740 10.978 -26.038 826 HE22 GLN 94 HE22 GLN 94 13.605 10.469 -24.345 827 H GLU 95 H GLU 95 17.930 9.369 -19.421 828 HA GLU 95 HA GLU 95 19.143 12.051 -18.930 829 HB2 GLU 95 HB2 GLU 95 18.703 9.705 -17.054 830 HB3 GLU 95 HB3 GLU 95 19.474 11.238 -16.627 831 HG2 GLU 95 HG2 GLU 95 17.378 12.449 -17.257 832 HG3 GLU 95 HG3 GLU 95 16.590 10.902 -17.571 833 H GLU 96 H GLU 96 21.330 12.260 -18.259 834 HA GLU 96 HA GLU 96 23.224 10.097 -18.999 835 HB2 GLU 96 HB2 GLU 96 24.411 11.596 -20.564 836 HB3 GLU 96 HB3 GLU 96 22.784 11.209 -21.100 837 HG2 GLU 96 HG2 GLU 96 21.947 13.393 -20.474 838 HG3 GLU 96 HG3 GLU 96 23.437 13.790 -19.619 839 H VAL 97 H VAL 97 22.741 10.878 -16.417 840 HA VAL 97 HA VAL 97 24.932 12.566 -15.631 841 HB VAL 97 HB VAL 97 24.123 12.114 -13.360 842 HG11 VAL 97 HG11 VAL 97 21.851 12.868 -15.235 843 HG12 VAL 97 HG12 VAL 97 21.978 13.272 -13.515 844 HG13 VAL 97 HG13 VAL 97 23.137 13.958 -14.667 845 HG21 VAL 97 HG21 VAL 97 23.315 9.808 -13.590 846 HG22 VAL 97 HG22 VAL 97 22.059 10.862 -12.930 847 HG23 VAL 97 HG23 VAL 97 21.985 10.363 -14.630 848 H SER 98 H SER 98 26.626 11.969 -14.344 849 HA SER 98 HA SER 98 27.067 9.346 -13.319 850 HB2 SER 98 HB2 SER 98 27.593 8.695 -15.586 851 HB3 SER 98 HB3 SER 98 28.756 10.018 -15.755 852 HG SER 98 HG SER 98 29.747 7.983 -15.239 853 H SER 99 H SER 99 29.525 11.647 -14.610 854 HA SER 99 HA SER 99 30.951 11.683 -12.096 855 HB2 SER 99 HB2 SER 99 31.982 11.883 -14.359 856 HB3 SER 99 HB3 SER 99 31.284 13.508 -14.504 857 HG SER 99 HG SER 99 33.471 13.497 -13.725 858 H MET 100 H MET 100 28.606 13.837 -13.576 859 HA MET 100 HA MET 100 28.313 15.293 -11.003 860 HB2 MET 100 HB2 MET 100 28.264 16.538 -13.783 861 HB3 MET 100 HB3 MET 100 27.641 17.323 -12.325 862 HG2 MET 100 HG2 MET 100 29.872 17.140 -11.265 863 HG3 MET 100 HG3 MET 100 30.514 16.430 -12.751 864 HE1 MET 100 HE1 MET 100 32.448 18.270 -12.603 865 HE2 MET 100 HE2 MET 100 32.141 20.021 -12.557 866 HE3 MET 100 HE3 MET 100 31.689 19.005 -11.171 867 H GLU 101 H GLU 101 26.234 15.855 -10.467 868 HA GLU 101 HA GLU 101 23.961 14.786 -12.067 869 HB2 GLU 101 HB2 GLU 101 25.005 13.140 -10.344 870 HB3 GLU 101 HB3 GLU 101 24.286 14.174 -9.110 871 HG2 GLU 101 HG2 GLU 101 22.024 13.724 -10.156 872 HG3 GLU 101 HG3 GLU 101 22.818 12.713 -11.356 873 H ALA 102 H ALA 102 25.022 17.535 -11.287 874 HA ALA 102 HA ALA 102 22.722 18.597 -9.690 875 HB1 ALA 102 HB1 ALA 102 25.632 19.479 -9.736 876 HB2 ALA 102 HB2 ALA 102 24.322 20.232 -8.801 877 HB3 ALA 102 HB3 ALA 102 24.821 18.568 -8.441 878 H LYS 103 H LYS 103 21.365 19.402 -11.153 879 HA LYS 103 HA LYS 103 22.293 21.700 -12.838 880 HB2 LYS 103 HB2 LYS 103 20.255 19.574 -13.622 881 HB3 LYS 103 HB3 LYS 103 20.546 21.078 -14.508 882 HG2 LYS 103 HG2 LYS 103 22.952 20.415 -14.787 883 HG3 LYS 103 HG3 LYS 103 22.562 18.838 -14.071 884 HD2 LYS 103 HD2 LYS 103 20.928 18.410 -15.880 885 HD3 LYS 103 HD3 LYS 103 21.282 20.006 -16.582 886 HE2 LYS 103 HE2 LYS 103 23.677 19.333 -16.842 887 HE3 LYS 103 HE3 LYS 103 23.283 17.728 -16.213 888 HZ1 LYS 103 HZ1 LYS 103 22.153 18.919 -18.694 889 HZ2 LYS 103 HZ2 LYS 103 23.290 17.752 -18.642 890 HZ3 LYS 103 HZ3 LYS 103 21.776 17.436 -18.117 891 H SER 104 H SER 104 20.809 21.216 -10.098 892 HA SER 104 HA SER 104 18.376 22.813 -10.392 893 HB2 SER 104 HB2 SER 104 18.342 22.651 -7.901 894 HB3 SER 104 HB3 SER 104 18.381 21.089 -8.733 895 HG SER 104 HG SER 104 19.865 21.192 -6.969 896 H MET 105 H MET 105 18.041 24.791 -9.148 897 HA MET 105 HA MET 105 20.385 26.504 -8.620 898 HB2 MET 105 HB2 MET 105 18.547 26.790 -10.960 899 HB3 MET 105 HB3 MET 105 18.773 28.264 -10.030 900 HG2 MET 105 HG2 MET 105 21.051 26.594 -11.149 901 HG3 MET 105 HG3 MET 105 20.364 28.030 -11.901 902 HE1 MET 105 HE1 MET 105 23.448 27.042 -10.488 903 HE2 MET 105 HE2 MET 105 23.777 27.957 -9.002 904 HE3 MET 105 HE3 MET 105 22.597 26.630 -8.983 905 H THR 106 H THR 106 19.840 28.541 -7.652 906 HA THR 106 HA THR 106 17.350 28.498 -5.996 907 HB THR 106 HB THR 106 19.432 28.227 -4.709 908 HG1 THR 106 HG1 THR 106 18.845 29.742 -3.191 909 HG21 THR 106 HG21 THR 106 20.041 31.106 -5.521 910 HG22 THR 106 HG22 THR 106 20.918 30.129 -4.326 911 HG23 THR 106 HG23 THR 106 20.965 29.676 -6.035 912 H TRP 107 H TRP 107 16.711 30.727 -5.294 913 HA TRP 107 HA TRP 107 16.181 32.228 -7.799 914 HB2 TRP 107 HB2 TRP 107 14.393 31.144 -6.283 915 HB3 TRP 107 HB3 TRP 107 14.646 32.512 -5.215 916 HD1 TRP 107 HD1 TRP 107 14.318 35.003 -6.600 917 HE1 TRP 107 HE1 TRP 107 12.442 35.659 -8.232 918 HE3 TRP 107 HE3 TRP 107 12.756 30.316 -7.957 919 HZ2 TRP 107 HZ2 TRP 107 10.504 34.316 -9.900 920 HZ3 TRP 107 HZ3 TRP 107 10.882 30.035 -9.566 921 HH2 TRP 107 HH2 TRP 107 9.752 32.021 -10.542 Start of MODEL 27 1 H1 GLY -5 H1 GLY -5 -5.455 -42.872 21.450 2 H2 GLY -5 H2 GLY -5 -4.725 -42.110 22.703 3 H3 GLY -5 H3 GLY -5 -4.881 -43.741 22.715 4 HA2 GLY -5 HA2 GLY -5 -3.237 -42.203 20.808 5 HA3 GLY -5 HA3 GLY -5 -2.611 -43.104 22.199 6 H SER -4 H SER -4 -2.913 -43.281 18.948 7 HA SER -4 HA SER -4 -2.637 -46.225 18.913 8 HB2 SER -4 HB2 SER -4 -5.083 -45.626 18.558 9 HB3 SER -4 HB3 SER -4 -4.600 -44.880 17.027 10 HG SER -4 HG SER -4 -5.238 -47.087 16.788 11 H HIS -3 H HIS -3 -0.511 -44.835 18.762 12 HA HIS -3 HA HIS -3 0.349 -44.839 15.903 13 HB2 HIS -3 HB2 HIS -3 -0.171 -42.507 16.574 14 HB3 HIS -3 HB3 HIS -3 0.978 -42.631 17.903 15 HD2 HIS -3 HD2 HIS -3 0.965 -42.980 14.001 16 HE1 HIS -3 HE1 HIS -3 4.752 -41.368 15.127 17 HE2 HIS -3 HE2 HIS -3 3.282 -42.044 13.160 18 H MET -2 H MET -2 1.334 -46.796 16.175 19 HA MET -2 HA MET -2 3.807 -46.905 17.790 20 HB2 MET -2 HB2 MET -2 3.117 -48.971 18.934 21 HB3 MET -2 HB3 MET -2 2.060 -47.625 19.335 22 HG2 MET -2 HG2 MET -2 0.372 -48.444 17.718 23 HG3 MET -2 HG3 MET -2 1.421 -49.810 17.314 24 HE1 MET -2 HE1 MET -2 -0.744 -51.340 17.757 25 HE2 MET -2 HE2 MET -2 -1.632 -51.363 19.296 26 HE3 MET -2 HE3 MET -2 -1.688 -49.920 18.262 27 H ALA -1 H ALA -1 3.209 -46.927 14.880 28 HA ALA -1 HA ALA -1 5.133 -49.031 14.256 29 HB1 ALA -1 HB1 ALA -1 2.306 -49.060 13.102 30 HB2 ALA -1 HB2 ALA -1 3.639 -50.141 12.606 31 HB3 ALA -1 HB3 ALA -1 2.972 -50.229 14.257 32 H SER 0 H SER 0 6.403 -48.542 12.651 33 HA SER 0 HA SER 0 5.826 -46.426 10.640 34 HB2 SER 0 HB2 SER 0 7.945 -46.319 12.821 35 HB3 SER 0 HB3 SER 0 8.027 -45.337 11.340 36 HG SER 0 HG SER 0 7.061 -44.214 13.101 37 H MET 1 H MET 1 6.195 -47.778 8.897 38 HA MET 1 HA MET 1 8.978 -48.671 8.463 39 HB2 MET 1 HB2 MET 1 7.421 -50.532 9.538 40 HB3 MET 1 HB3 MET 1 6.783 -50.672 7.900 41 HG2 MET 1 HG2 MET 1 9.231 -50.983 7.141 42 HG3 MET 1 HG3 MET 1 9.662 -50.993 8.846 43 HE1 MET 1 HE1 MET 1 8.290 -52.912 5.812 44 HE2 MET 1 HE2 MET 1 7.445 -54.310 6.509 45 HE3 MET 1 HE3 MET 1 6.746 -52.685 6.665 46 H ASP 2 H ASP 2 7.206 -46.571 7.295 47 HA ASP 2 HA ASP 2 6.975 -47.515 4.468 48 HB2 ASP 2 HB2 ASP 2 5.219 -45.603 6.023 49 HB3 ASP 2 HB3 ASP 2 5.128 -45.854 4.280 50 HA PRO 3 HA PRO 3 9.845 -44.161 3.824 51 HB2 PRO 3 HB2 PRO 3 10.356 -44.414 1.156 52 HB3 PRO 3 HB3 PRO 3 10.853 -45.663 2.341 53 HG2 PRO 3 HG2 PRO 3 8.353 -45.634 0.613 54 HG3 PRO 3 HG3 PRO 3 9.536 -46.963 0.820 55 HD2 PRO 3 HD2 PRO 3 7.206 -46.839 2.249 56 HD3 PRO 3 HD3 PRO 3 8.716 -47.487 2.957 57 H LEU 4 H LEU 4 6.774 -44.141 2.495 58 HA LEU 4 HA LEU 4 6.997 -41.300 1.592 59 HB2 LEU 4 HB2 LEU 4 5.216 -43.535 0.549 60 HB3 LEU 4 HB3 LEU 4 5.122 -41.856 0.029 61 HG LEU 4 HG LEU 4 7.551 -43.634 -0.374 62 HD11 LEU 4 HD11 LEU 4 5.430 -42.666 -2.332 63 HD12 LEU 4 HD12 LEU 4 6.878 -43.619 -2.734 64 HD13 LEU 4 HD13 LEU 4 5.609 -44.327 -1.722 65 HD21 LEU 4 HD21 LEU 4 8.219 -41.275 -0.247 66 HD22 LEU 4 HD22 LEU 4 8.288 -41.833 -1.919 67 HD23 LEU 4 HD23 LEU 4 6.925 -40.826 -1.386 68 H ASP 5 H ASP 5 6.593 -41.893 4.280 69 HA ASP 5 HA ASP 5 3.779 -40.995 4.712 70 HB2 ASP 5 HB2 ASP 5 5.223 -43.127 5.853 71 HB3 ASP 5 HB3 ASP 5 5.247 -41.889 7.094 72 H LYS 6 H LYS 6 6.602 -39.562 4.378 73 HA LYS 6 HA LYS 6 6.325 -37.672 6.697 74 HB2 LYS 6 HB2 LYS 6 8.983 -38.067 5.334 75 HB3 LYS 6 HB3 LYS 6 8.604 -37.500 6.940 76 HG2 LYS 6 HG2 LYS 6 9.300 -39.545 7.575 77 HG3 LYS 6 HG3 LYS 6 7.657 -40.029 7.171 78 HD2 LYS 6 HD2 LYS 6 9.157 -41.632 6.203 79 HD3 LYS 6 HD3 LYS 6 8.497 -40.684 4.863 80 HE2 LYS 6 HE2 LYS 6 10.567 -39.302 4.818 81 HE3 LYS 6 HE3 LYS 6 11.212 -40.214 6.187 82 HZ1 LYS 6 HZ1 LYS 6 10.526 -41.418 3.550 83 HZ2 LYS 6 HZ2 LYS 6 12.044 -41.010 4.019 84 HZ3 LYS 6 HZ3 LYS 6 11.243 -42.189 4.810 85 H ILE 7 H ILE 7 7.701 -37.769 3.451 86 HA ILE 7 HA ILE 7 6.930 -34.932 2.945 87 HB ILE 7 HB ILE 7 9.117 -34.682 1.740 88 HG12 ILE 7 HG12 ILE 7 11.013 -36.112 2.436 89 HG13 ILE 7 HG13 ILE 7 9.906 -37.249 3.197 90 HG21 ILE 7 HG21 ILE 7 9.345 -35.267 4.716 91 HG22 ILE 7 HG22 ILE 7 10.370 -34.195 3.745 92 HG23 ILE 7 HG23 ILE 7 8.670 -33.786 4.003 93 HD11 ILE 7 HD11 ILE 7 9.932 -36.594 0.219 94 HD12 ILE 7 HD12 ILE 7 10.755 -37.975 0.967 95 HD13 ILE 7 HD13 ILE 7 8.992 -37.883 1.020 96 H ILE 8 H ILE 8 5.911 -37.718 2.083 97 HA ILE 8 HA ILE 8 6.133 -38.213 -0.603 98 HB ILE 8 HB ILE 8 4.825 -39.555 0.890 99 HG12 ILE 8 HG12 ILE 8 3.324 -38.617 -1.589 100 HG13 ILE 8 HG13 ILE 8 4.548 -39.883 -1.482 101 HG21 ILE 8 HG21 ILE 8 2.528 -37.571 0.729 102 HG22 ILE 8 HG22 ILE 8 2.620 -39.067 1.678 103 HG23 ILE 8 HG23 ILE 8 3.626 -37.689 2.118 104 HD11 ILE 8 HD11 ILE 8 1.717 -39.950 -0.360 105 HD12 ILE 8 HD12 ILE 8 2.382 -40.904 -1.692 106 HD13 ILE 8 HD13 ILE 8 2.935 -41.202 -0.035 107 H ASN 9 H ASN 9 5.884 -37.099 -2.419 108 HA ASN 9 HA ASN 9 3.756 -35.051 -2.738 109 HB2 ASN 9 HB2 ASN 9 6.110 -34.203 -1.815 110 HB3 ASN 9 HB3 ASN 9 6.594 -34.326 -3.502 111 HD21 ASN 9 HD21 ASN 9 4.405 -31.560 -4.444 112 HD22 ASN 9 HD22 ASN 9 4.885 -33.156 -5.038 113 H ASP 10 H ASP 10 4.640 -37.794 -3.997 114 HA ASP 10 HA ASP 10 5.116 -36.929 -6.732 115 HB2 ASP 10 HB2 ASP 10 6.385 -38.780 -5.560 116 HB3 ASP 10 HB3 ASP 10 4.917 -39.752 -5.615 117 H ILE 11 H ILE 11 2.433 -36.889 -5.265 118 HA ILE 11 HA ILE 11 0.709 -37.566 -7.549 119 HB ILE 11 HB ILE 11 1.095 -39.655 -6.203 120 HG12 ILE 11 HG12 ILE 11 -1.843 -38.904 -6.242 121 HG13 ILE 11 HG13 ILE 11 -0.894 -39.292 -7.681 122 HG21 ILE 11 HG21 ILE 11 -0.607 -38.362 -4.037 123 HG22 ILE 11 HG22 ILE 11 0.086 -39.993 -4.035 124 HG23 ILE 11 HG23 ILE 11 1.152 -38.595 -3.947 125 HD11 ILE 11 HD11 ILE 11 -1.429 -41.149 -5.324 126 HD12 ILE 11 HD12 ILE 11 -2.110 -41.255 -6.953 127 HD13 ILE 11 HD13 ILE 11 -0.375 -41.533 -6.708 128 H LYS 12 H LYS 12 1.428 -35.114 -6.377 129 HA LYS 12 HA LYS 12 -1.313 -34.111 -5.731 130 HB2 LYS 12 HB2 LYS 12 0.011 -34.340 -3.648 131 HB3 LYS 12 HB3 LYS 12 1.254 -33.270 -4.315 132 HG2 LYS 12 HG2 LYS 12 -0.408 -31.430 -4.449 133 HG3 LYS 12 HG3 LYS 12 -1.665 -32.514 -3.822 134 HD2 LYS 12 HD2 LYS 12 -0.498 -32.697 -1.677 135 HD3 LYS 12 HD3 LYS 12 0.916 -31.858 -2.335 136 HE2 LYS 12 HE2 LYS 12 -0.257 -30.250 -1.037 137 HE3 LYS 12 HE3 LYS 12 -0.477 -29.837 -2.742 138 HZ1 LYS 12 HZ1 LYS 12 -2.483 -31.259 -1.059 139 HZ2 LYS 12 HZ2 LYS 12 -2.565 -29.687 -1.477 140 HZ3 LYS 12 HZ3 LYS 12 -2.704 -30.836 -2.623 141 H LYS 13 H LYS 13 1.895 -33.187 -6.911 142 HA LYS 13 HA LYS 13 0.678 -31.142 -8.666 143 HB2 LYS 13 HB2 LYS 13 3.209 -30.779 -7.009 144 HB3 LYS 13 HB3 LYS 13 2.683 -29.688 -8.295 145 HG2 LYS 13 HG2 LYS 13 0.475 -29.432 -7.008 146 HG3 LYS 13 HG3 LYS 13 1.296 -30.203 -5.645 147 HD2 LYS 13 HD2 LYS 13 2.158 -27.638 -7.056 148 HD3 LYS 13 HD3 LYS 13 1.311 -27.733 -5.508 149 HE2 LYS 13 HE2 LYS 13 3.227 -28.949 -4.513 150 HE3 LYS 13 HE3 LYS 13 4.088 -28.875 -6.060 151 HZ1 LYS 13 HZ1 LYS 13 3.270 -26.508 -4.457 152 HZ2 LYS 13 HZ2 LYS 13 4.790 -27.090 -4.569 153 HZ3 LYS 13 HZ3 LYS 13 4.069 -26.446 -5.882 154 H GLU 14 H GLU 14 2.211 -30.404 -10.380 155 HA GLU 14 HA GLU 14 3.093 -30.894 -12.385 156 HB2 GLU 14 HB2 GLU 14 5.075 -31.091 -10.722 157 HB3 GLU 14 HB3 GLU 14 5.004 -32.815 -11.049 158 HG2 GLU 14 HG2 GLU 14 6.671 -31.888 -12.471 159 HG3 GLU 14 HG3 GLU 14 5.317 -32.272 -13.521 160 H ALA 15 H ALA 15 0.785 -32.294 -11.833 161 HA ALA 15 HA ALA 15 0.987 -34.623 -13.669 162 HB1 ALA 15 HB1 ALA 15 -0.222 -34.727 -10.867 163 HB2 ALA 15 HB2 ALA 15 -0.339 -36.007 -12.092 164 HB3 ALA 15 HB3 ALA 15 1.248 -35.574 -11.412 165 H ASN 16 H ASN 16 -1.457 -33.117 -11.509 166 HA ASN 16 HA ASN 16 -3.160 -32.346 -13.795 167 HB2 ASN 16 HB2 ASN 16 -3.712 -34.732 -13.188 168 HB3 ASN 16 HB3 ASN 16 -4.104 -34.199 -11.555 169 HD21 ASN 16 HD21 ASN 16 -6.790 -33.667 -14.563 170 HD22 ASN 16 HD22 ASN 16 -5.208 -34.368 -14.872 171 H ASP 17 H ASP 17 -3.945 -30.418 -13.433 172 HA ASP 17 HA ASP 17 -4.867 -29.545 -10.770 173 HB2 ASP 17 HB2 ASP 17 -2.392 -28.771 -11.314 174 HB3 ASP 17 HB3 ASP 17 -3.188 -27.592 -12.348 175 H SER 18 H SER 18 -6.217 -27.577 -10.897 176 HA SER 18 HA SER 18 -7.613 -27.178 -13.485 177 HB2 SER 18 HB2 SER 18 -9.803 -27.509 -12.412 178 HB3 SER 18 HB3 SER 18 -8.814 -28.974 -12.335 179 HG SER 18 HG SER 18 -9.824 -28.490 -10.319 180 H GLY 19 H GLY 19 -6.047 -25.590 -11.058 181 HA2 GLY 19 HA2 GLY 19 -7.116 -23.108 -12.098 182 HA3 GLY 19 HA3 GLY 19 -7.563 -23.338 -10.408 183 H VAL 20 H VAL 20 -5.172 -22.310 -12.571 184 HA VAL 20 HA VAL 20 -3.103 -21.987 -10.434 185 HB VAL 20 HB VAL 20 -2.448 -22.494 -13.353 186 HG11 VAL 20 HG11 VAL 20 -0.793 -22.666 -10.785 187 HG12 VAL 20 HG12 VAL 20 -0.218 -23.095 -12.414 188 HG13 VAL 20 HG13 VAL 20 -0.627 -21.426 -12.042 189 HG21 VAL 20 HG21 VAL 20 -3.536 -24.532 -12.558 190 HG22 VAL 20 HG22 VAL 20 -1.799 -24.797 -12.661 191 HG23 VAL 20 HG23 VAL 20 -2.552 -24.512 -11.075 192 H THR 21 H THR 21 -5.050 -20.020 -10.848 193 HA THR 21 HA THR 21 -3.327 -17.804 -11.684 194 HB THR 21 HB THR 21 -5.721 -17.073 -12.981 195 HG1 THR 21 HG1 THR 21 -6.001 -18.688 -14.507 196 HG21 THR 21 HG21 THR 21 -3.121 -18.149 -14.141 197 HG22 THR 21 HG22 THR 21 -4.298 -17.091 -14.968 198 HG23 THR 21 HG23 THR 21 -3.397 -16.490 -13.560 199 H LEU 22 H LEU 22 -4.302 -15.670 -11.499 200 HA LEU 22 HA LEU 22 -5.472 -15.518 -8.793 201 HB2 LEU 22 HB2 LEU 22 -3.978 -13.655 -8.448 202 HB3 LEU 22 HB3 LEU 22 -3.064 -15.004 -9.109 203 HG LEU 22 HG LEU 22 -4.054 -13.250 -11.268 204 HD11 LEU 22 HD11 LEU 22 -2.187 -12.011 -9.218 205 HD12 LEU 22 HD12 LEU 22 -2.599 -11.333 -10.811 206 HD13 LEU 22 HD13 LEU 22 -3.852 -11.488 -9.569 207 HD21 LEU 22 HD21 LEU 22 -2.241 -14.935 -11.520 208 HD22 LEU 22 HD22 LEU 22 -1.714 -13.303 -11.959 209 HD23 LEU 22 HD23 LEU 22 -1.235 -14.000 -10.397 210 H ALA 23 H ALA 23 -7.140 -15.502 -11.065 211 HA ALA 23 HA ALA 23 -8.080 -12.705 -11.364 212 HB1 ALA 23 HB1 ALA 23 -8.665 -15.211 -12.966 213 HB2 ALA 23 HB2 ALA 23 -9.214 -13.564 -13.358 214 HB3 ALA 23 HB3 ALA 23 -7.480 -13.951 -13.366 215 HA PRO 24 HA PRO 24 -11.502 -13.962 -8.640 216 HB2 PRO 24 HB2 PRO 24 -12.701 -11.561 -8.249 217 HB3 PRO 24 HB3 PRO 24 -11.089 -11.937 -7.566 218 HG2 PRO 24 HG2 PRO 24 -11.712 -10.433 -10.135 219 HG3 PRO 24 HG3 PRO 24 -10.629 -9.932 -8.801 220 HD2 PRO 24 HD2 PRO 24 -9.700 -11.186 -11.051 221 HD3 PRO 24 HD3 PRO 24 -8.966 -11.485 -9.447 222 H LEU 25 H LEU 25 -11.823 -12.407 -11.736 223 HA LEU 25 HA LEU 25 -14.319 -13.805 -12.384 224 HB2 LEU 25 HB2 LEU 25 -14.709 -11.367 -11.315 225 HB3 LEU 25 HB3 LEU 25 -14.200 -10.820 -12.897 226 HG LEU 25 HG LEU 25 -16.085 -12.356 -13.839 227 HD11 LEU 25 HD11 LEU 25 -16.964 -12.234 -10.922 228 HD12 LEU 25 HD12 LEU 25 -17.929 -12.840 -12.287 229 HD13 LEU 25 HD13 LEU 25 -16.467 -13.702 -11.789 230 HD21 LEU 25 HD21 LEU 25 -16.254 -9.911 -13.762 231 HD22 LEU 25 HD22 LEU 25 -17.810 -10.663 -13.382 232 HD23 LEU 25 HD23 LEU 25 -16.812 -9.986 -12.074 233 H SER 26 H SER 26 -14.640 -12.248 -14.856 234 HA SER 26 HA SER 26 -12.652 -13.541 -16.508 235 HB2 SER 26 HB2 SER 26 -14.098 -12.646 -18.347 236 HB3 SER 26 HB3 SER 26 -14.957 -13.605 -17.125 237 HG SER 26 HG SER 26 -16.057 -11.641 -17.673 238 H VAL 27 H VAL 27 -11.333 -11.762 -14.919 239 HA VAL 27 HA VAL 27 -10.069 -9.882 -16.772 240 HB VAL 27 HB VAL 27 -12.055 -8.685 -16.090 241 HG11 VAL 27 HG11 VAL 27 -11.123 -8.961 -13.217 242 HG12 VAL 27 HG12 VAL 27 -12.449 -7.922 -13.780 243 HG13 VAL 27 HG13 VAL 27 -12.573 -9.675 -13.940 244 HG21 VAL 27 HG21 VAL 27 -10.042 -7.333 -16.464 245 HG22 VAL 27 HG22 VAL 27 -11.072 -6.611 -15.229 246 HG23 VAL 27 HG23 VAL 27 -9.603 -7.473 -14.739 247 HA PRO 28 HA PRO 28 -6.798 -11.015 -13.908 248 HB2 PRO 28 HB2 PRO 28 -4.681 -9.654 -14.924 249 HB3 PRO 28 HB3 PRO 28 -5.485 -10.978 -15.811 250 HG2 PRO 28 HG2 PRO 28 -5.993 -7.995 -16.110 251 HG3 PRO 28 HG3 PRO 28 -5.625 -9.187 -17.401 252 HD2 PRO 28 HD2 PRO 28 -8.172 -8.466 -16.791 253 HD3 PRO 28 HD3 PRO 28 -7.769 -10.142 -17.261 254 H LYS 29 H LYS 29 -8.277 -9.858 -12.408 255 HA LYS 29 HA LYS 29 -8.692 -8.657 -10.565 256 HB2 LYS 29 HB2 LYS 29 -6.294 -9.372 -10.067 257 HB3 LYS 29 HB3 LYS 29 -5.814 -7.744 -10.514 258 HG2 LYS 29 HG2 LYS 29 -6.077 -7.426 -8.244 259 HG3 LYS 29 HG3 LYS 29 -7.727 -7.055 -8.755 260 HD2 LYS 29 HD2 LYS 29 -8.366 -9.422 -8.289 261 HD3 LYS 29 HD3 LYS 29 -6.712 -9.720 -7.712 262 HE2 LYS 29 HE2 LYS 29 -7.009 -7.983 -5.962 263 HE3 LYS 29 HE3 LYS 29 -8.642 -7.652 -6.553 264 HZ1 LYS 29 HZ1 LYS 29 -7.749 -10.256 -5.416 265 HZ2 LYS 29 HZ2 LYS 29 -8.683 -9.161 -4.645 266 HZ3 LYS 29 HZ3 LYS 29 -9.258 -9.935 -5.956 267 HA PRO 30 HA PRO 30 -9.457 -4.731 -12.671 268 HB2 PRO 30 HB2 PRO 30 -11.877 -4.090 -11.630 269 HB3 PRO 30 HB3 PRO 30 -11.665 -5.428 -12.803 270 HG2 PRO 30 HG2 PRO 30 -11.847 -5.608 -9.780 271 HG3 PRO 30 HG3 PRO 30 -12.709 -6.593 -11.004 272 HD2 PRO 30 HD2 PRO 30 -10.389 -7.398 -9.746 273 HD3 PRO 30 HD3 PRO 30 -10.820 -7.914 -11.398 274 H LYS 31 H LYS 31 -9.273 -2.534 -12.141 275 HA LYS 31 HA LYS 31 -7.755 -1.936 -9.812 276 HB2 LYS 31 HB2 LYS 31 -7.722 0.359 -10.586 277 HB3 LYS 31 HB3 LYS 31 -7.391 -0.781 -11.888 278 HG2 LYS 31 HG2 LYS 31 -9.785 -0.531 -12.658 279 HG3 LYS 31 HG3 LYS 31 -10.015 0.707 -11.408 280 HD2 LYS 31 HD2 LYS 31 -8.237 2.088 -12.436 281 HD3 LYS 31 HD3 LYS 31 -7.961 0.830 -13.662 282 HE2 LYS 31 HE2 LYS 31 -10.331 1.071 -14.414 283 HE3 LYS 31 HE3 LYS 31 -10.567 2.362 -13.230 284 HZ1 LYS 31 HZ1 LYS 31 -8.632 2.452 -15.487 285 HZ2 LYS 31 HZ2 LYS 31 -10.049 3.257 -15.428 286 HZ3 LYS 31 HZ3 LYS 31 -8.849 3.649 -14.395 287 H LEU 32 H LEU 32 -8.112 -0.865 -7.917 288 HA LEU 32 HA LEU 32 -10.930 -0.356 -7.127 289 HB2 LEU 32 HB2 LEU 32 -9.953 -2.554 -6.354 290 HB3 LEU 32 HB3 LEU 32 -8.666 -1.653 -5.552 291 HG LEU 32 HG LEU 32 -10.428 -0.467 -4.216 292 HD11 LEU 32 HD11 LEU 32 -12.227 -2.646 -5.380 293 HD12 LEU 32 HD12 LEU 32 -12.653 -1.604 -4.009 294 HD13 LEU 32 HD13 LEU 32 -12.432 -0.895 -5.610 295 HD21 LEU 32 HD21 LEU 32 -9.150 -2.315 -3.264 296 HD22 LEU 32 HD22 LEU 32 -10.810 -2.323 -2.648 297 HD23 LEU 32 HD23 LEU 32 -10.326 -3.484 -3.906 298 H GLU 33 H GLU 33 -11.319 1.350 -5.737 299 HA GLU 33 HA GLU 33 -9.105 3.118 -4.855 300 HB2 GLU 33 HB2 GLU 33 -11.438 3.942 -6.643 301 HB3 GLU 33 HB3 GLU 33 -10.471 5.100 -5.742 302 HG2 GLU 33 HG2 GLU 33 -9.410 3.237 -7.905 303 HG3 GLU 33 HG3 GLU 33 -9.825 4.930 -8.110 304 H GLU 34 H GLU 34 -9.872 1.788 -3.022 305 HA GLU 34 HA GLU 34 -12.031 3.210 -1.515 306 HB2 GLU 34 HB2 GLU 34 -11.704 0.221 -1.874 307 HB3 GLU 34 HB3 GLU 34 -12.564 0.933 -0.491 308 HG2 GLU 34 HG2 GLU 34 -13.923 2.278 -2.206 309 HG3 GLU 34 HG3 GLU 34 -13.257 1.199 -3.433 310 H LEU 35 H LEU 35 -10.121 4.400 -0.986 311 HA LEU 35 HA LEU 35 -9.014 3.488 1.638 312 HB2 LEU 35 HB2 LEU 35 -7.749 5.222 -0.518 313 HB3 LEU 35 HB3 LEU 35 -7.107 5.063 1.102 314 HG LEU 35 HG LEU 35 -7.519 2.431 -0.213 315 HD11 LEU 35 HD11 LEU 35 -5.467 4.333 -1.402 316 HD12 LEU 35 HD12 LEU 35 -5.672 2.604 -1.773 317 HD13 LEU 35 HD13 LEU 35 -6.943 3.752 -2.211 318 HD21 LEU 35 HD21 LEU 35 -6.241 2.698 1.866 319 HD22 LEU 35 HD22 LEU 35 -5.205 2.081 0.572 320 HD23 LEU 35 HD23 LEU 35 -5.094 3.785 1.044 321 H SER 36 H SER 36 -9.000 5.101 3.279 322 HA SER 36 HA SER 36 -10.901 7.333 3.075 323 HB2 SER 36 HB2 SER 36 -8.867 6.742 5.257 324 HB3 SER 36 HB3 SER 36 -10.267 7.822 5.359 325 HG SER 36 HG SER 36 -10.723 5.794 6.302 326 H GLU 37 H GLU 37 -10.108 9.636 3.686 327 HA GLU 37 HA GLU 37 -8.430 10.560 1.656 328 HB2 GLU 37 HB2 GLU 37 -10.088 11.898 2.873 329 HB3 GLU 37 HB3 GLU 37 -9.058 11.902 4.313 330 HG2 GLU 37 HG2 GLU 37 -7.313 13.148 3.072 331 HG3 GLU 37 HG3 GLU 37 -8.287 13.070 1.601 332 H GLN 38 H GLN 38 -7.430 9.993 5.070 333 HA GLN 38 HA GLN 38 -4.659 10.769 4.554 334 HB2 GLN 38 HB2 GLN 38 -5.845 10.926 6.792 335 HB3 GLN 38 HB3 GLN 38 -5.813 9.160 6.868 336 HG2 GLN 38 HG2 GLN 38 -3.222 9.396 6.581 337 HG3 GLN 38 HG3 GLN 38 -3.470 11.109 6.911 338 HE21 GLN 38 HE21 GLN 38 -3.944 8.315 9.918 339 HE22 GLN 38 HE22 GLN 38 -3.965 7.801 8.236 340 H GLN 39 H GLN 39 -6.407 7.663 4.804 341 HA GLN 39 HA GLN 39 -4.232 5.856 4.570 342 HB2 GLN 39 HB2 GLN 39 -7.086 5.695 3.615 343 HB3 GLN 39 HB3 GLN 39 -5.983 4.338 3.545 344 HG2 GLN 39 HG2 GLN 39 -6.434 5.705 6.212 345 HG3 GLN 39 HG3 GLN 39 -7.692 4.667 5.558 346 HE21 GLN 39 HE21 GLN 39 -4.800 2.804 7.493 347 HE22 GLN 39 HE22 GLN 39 -5.156 4.521 7.687 348 H LYS 40 H LYS 40 -6.170 7.464 2.028 349 HA LYS 40 HA LYS 40 -4.929 6.297 -0.258 350 HB2 LYS 40 HB2 LYS 40 -7.084 7.506 -0.241 351 HB3 LYS 40 HB3 LYS 40 -6.262 9.020 0.137 352 HG2 LYS 40 HG2 LYS 40 -5.063 8.942 -2.018 353 HG3 LYS 40 HG3 LYS 40 -5.831 7.397 -2.414 354 HD2 LYS 40 HD2 LYS 40 -7.352 9.993 -1.874 355 HD3 LYS 40 HD3 LYS 40 -6.848 9.454 -3.485 356 HE2 LYS 40 HE2 LYS 40 -8.157 7.349 -3.181 357 HE3 LYS 40 HE3 LYS 40 -8.720 7.938 -1.609 358 HZ1 LYS 40 HZ1 LYS 40 -9.240 9.271 -4.215 359 HZ2 LYS 40 HZ2 LYS 40 -10.333 8.412 -3.364 360 HZ3 LYS 40 HZ3 LYS 40 -9.761 9.819 -2.766 361 H ILE 41 H ILE 41 -4.070 9.292 1.573 362 HA ILE 41 HA ILE 41 -1.892 9.986 -0.182 363 HB ILE 41 HB ILE 41 -2.335 10.751 2.693 364 HG12 ILE 41 HG12 ILE 41 -2.883 12.499 0.242 365 HG13 ILE 41 HG13 ILE 41 -4.124 11.424 0.848 366 HG21 ILE 41 HG21 ILE 41 -0.490 11.981 0.605 367 HG22 ILE 41 HG22 ILE 41 -0.851 12.714 2.180 368 HG23 ILE 41 HG23 ILE 41 -0.010 11.177 2.114 369 HD11 ILE 41 HD11 ILE 41 -2.861 13.704 2.413 370 HD12 ILE 41 HD12 ILE 41 -4.508 13.609 1.766 371 HD13 ILE 41 HD13 ILE 41 -4.014 12.523 3.077 372 H ILE 42 H ILE 42 -1.974 8.040 2.891 373 HA ILE 42 HA ILE 42 0.879 7.696 3.006 374 HB ILE 42 HB ILE 42 -1.312 5.851 4.008 375 HG12 ILE 42 HG12 ILE 42 0.314 7.731 5.756 376 HG13 ILE 42 HG13 ILE 42 -1.122 8.333 4.944 377 HG21 ILE 42 HG21 ILE 42 1.680 5.990 4.615 378 HG22 ILE 42 HG22 ILE 42 0.528 5.045 5.571 379 HG23 ILE 42 HG23 ILE 42 0.802 4.628 3.884 380 HD11 ILE 42 HD11 ILE 42 -1.089 5.943 6.831 381 HD12 ILE 42 HD12 ILE 42 -1.697 7.569 7.186 382 HD13 ILE 42 HD13 ILE 42 -2.503 6.567 5.955 383 H LEU 43 H LEU 43 -1.699 5.793 1.478 384 HA LEU 43 HA LEU 43 -0.117 3.700 0.407 385 HB2 LEU 43 HB2 LEU 43 -2.591 3.773 0.654 386 HB3 LEU 43 HB3 LEU 43 -2.711 4.971 -0.605 387 HG LEU 43 HG LEU 43 -3.361 2.629 -1.139 388 HD11 LEU 43 HD11 LEU 43 -1.213 3.759 -2.943 389 HD12 LEU 43 HD12 LEU 43 -2.478 2.604 -3.388 390 HD13 LEU 43 HD13 LEU 43 -2.914 4.253 -2.901 391 HD21 LEU 43 HD21 LEU 43 -1.563 1.454 0.025 392 HD22 LEU 43 HD22 LEU 43 -1.625 0.972 -1.679 393 HD23 LEU 43 HD23 LEU 43 -0.347 2.074 -1.112 394 H ALA 44 H ALA 44 -1.101 6.811 -1.051 395 HA ALA 44 HA ALA 44 0.239 6.484 -3.542 396 HB1 ALA 44 HB1 ALA 44 -0.654 8.956 -2.010 397 HB2 ALA 44 HB2 ALA 44 -0.216 8.918 -3.733 398 HB3 ALA 44 HB3 ALA 44 -1.642 8.021 -3.158 399 H GLU 45 H GLU 45 1.231 8.381 -0.580 400 HA GLU 45 HA GLU 45 3.642 9.285 -1.766 401 HB2 GLU 45 HB2 GLU 45 4.146 10.269 0.227 402 HB3 GLU 45 HB3 GLU 45 2.388 10.153 0.305 403 HG2 GLU 45 HG2 GLU 45 2.623 8.141 1.766 404 HG3 GLU 45 HG3 GLU 45 4.374 8.303 1.706 405 H TYR 46 H TYR 46 2.961 6.197 -0.245 406 HA TYR 46 HA TYR 46 5.690 5.364 0.135 407 HB2 TYR 46 HB2 TYR 46 3.709 4.405 1.261 408 HB3 TYR 46 HB3 TYR 46 3.123 3.775 -0.269 409 HD1 TYR 46 HD1 TYR 46 2.936 1.744 1.302 410 HD2 TYR 46 HD2 TYR 46 6.712 3.350 -0.067 411 HE1 TYR 46 HE1 TYR 46 4.060 -0.409 1.842 412 HE2 TYR 46 HE2 TYR 46 7.821 1.214 0.509 413 HH TYR 46 HH TYR 46 6.034 -1.560 1.880 414 H ILE 47 H ILE 47 3.318 4.531 -2.448 415 HA ILE 47 HA ILE 47 5.062 3.184 -4.189 416 HB ILE 47 HB ILE 47 2.426 4.642 -4.445 417 HG12 ILE 47 HG12 ILE 47 3.094 1.663 -4.505 418 HG13 ILE 47 HG13 ILE 47 2.635 2.521 -3.042 419 HG21 ILE 47 HG21 ILE 47 3.842 3.047 -6.599 420 HG22 ILE 47 HG22 ILE 47 2.106 3.430 -6.655 421 HG23 ILE 47 HG23 ILE 47 3.283 4.727 -6.698 422 HD11 ILE 47 HD11 ILE 47 0.867 1.992 -5.448 423 HD12 ILE 47 HD12 ILE 47 0.652 1.476 -3.768 424 HD13 ILE 47 HD13 ILE 47 0.475 3.191 -4.196 425 H ALA 48 H ALA 48 4.162 6.661 -3.941 426 HA ALA 48 HA ALA 48 5.462 7.492 -6.369 427 HB1 ALA 48 HB1 ALA 48 4.689 9.029 -3.856 428 HB2 ALA 48 HB2 ALA 48 5.085 9.749 -5.435 429 HB3 ALA 48 HB3 ALA 48 3.641 8.728 -5.260 430 H GLU 49 H GLU 49 6.666 6.949 -3.088 431 HA GLU 49 HA GLU 49 9.281 8.195 -3.666 432 HB2 GLU 49 HB2 GLU 49 8.230 8.462 -1.474 433 HB3 GLU 49 HB3 GLU 49 8.254 6.708 -1.220 434 HG2 GLU 49 HG2 GLU 49 10.686 6.689 -1.211 435 HG3 GLU 49 HG3 GLU 49 10.751 8.381 -1.718 436 H VAL 50 H VAL 50 7.927 4.870 -3.318 437 HA VAL 50 HA VAL 50 10.654 3.812 -3.925 438 HB VAL 50 HB VAL 50 10.274 1.928 -2.772 439 HG11 VAL 50 HG11 VAL 50 8.784 3.982 -1.121 440 HG12 VAL 50 HG12 VAL 50 9.670 2.561 -0.537 441 HG13 VAL 50 HG13 VAL 50 10.547 3.888 -1.317 442 HG21 VAL 50 HG21 VAL 50 8.064 1.224 -3.604 443 HG22 VAL 50 HG22 VAL 50 8.159 1.121 -1.852 444 HG23 VAL 50 HG23 VAL 50 7.279 2.461 -2.610 445 H GLY 51 H GLY 51 7.709 4.199 -5.528 446 HA2 GLY 51 HA2 GLY 51 7.656 4.127 -7.844 447 HA3 GLY 51 HA3 GLY 51 9.101 3.116 -7.874 448 H LEU 52 H LEU 52 6.220 2.265 -6.064 449 HA LEU 52 HA LEU 52 4.938 0.456 -5.976 450 HB2 LEU 52 HB2 LEU 52 4.415 1.712 -8.398 451 HB3 LEU 52 HB3 LEU 52 4.626 0.057 -8.911 452 HG LEU 52 HG LEU 52 2.665 1.034 -6.789 453 HD11 LEU 52 HD11 LEU 52 2.183 0.092 -9.639 454 HD12 LEU 52 HD12 LEU 52 0.942 0.595 -8.473 455 HD13 LEU 52 HD13 LEU 52 2.110 1.779 -9.077 456 HD21 LEU 52 HD21 LEU 52 3.260 -1.298 -6.336 457 HD22 LEU 52 HD22 LEU 52 1.603 -1.155 -6.917 458 HD23 LEU 52 HD23 LEU 52 2.874 -1.729 -8.019 459 H GLN 53 H GLN 53 7.913 0.012 -6.703 460 HA GLN 53 HA GLN 53 7.792 -2.874 -7.498 461 HB2 GLN 53 HB2 GLN 53 9.745 -2.535 -8.810 462 HB3 GLN 53 HB3 GLN 53 8.584 -1.261 -9.182 463 HG2 GLN 53 HG2 GLN 53 9.918 0.186 -7.472 464 HG3 GLN 53 HG3 GLN 53 11.167 -1.055 -7.602 465 HE21 GLN 53 HE21 GLN 53 10.411 1.477 -10.776 466 HE22 GLN 53 HE22 GLN 53 9.132 1.141 -9.604 467 H ASN 54 H ASN 54 8.503 -0.986 -4.888 468 HA ASN 54 HA ASN 54 10.196 -3.137 -3.678 469 HB2 ASN 54 HB2 ASN 54 10.350 -0.162 -3.107 470 HB3 ASN 54 HB3 ASN 54 11.268 -1.400 -2.274 471 HD21 ASN 54 HD21 ASN 54 12.678 0.048 -5.755 472 HD22 ASN 54 HD22 ASN 54 11.162 0.649 -5.096 473 H ILE 55 H ILE 55 7.150 -1.957 -3.666 474 HA ILE 55 HA ILE 55 6.707 -1.955 -0.769 475 HB ILE 55 HB ILE 55 4.407 -1.681 -1.139 476 HG12 ILE 55 HG12 ILE 55 4.812 -2.070 -4.136 477 HG13 ILE 55 HG13 ILE 55 4.019 -3.213 -3.039 478 HG21 ILE 55 HG21 ILE 55 5.653 0.122 -3.236 479 HG22 ILE 55 HG22 ILE 55 4.389 0.484 -2.033 480 HG23 ILE 55 HG23 ILE 55 6.045 0.241 -1.511 481 HD11 ILE 55 HD11 ILE 55 3.069 -0.406 -3.690 482 HD12 ILE 55 HD12 ILE 55 2.316 -1.936 -4.162 483 HD13 ILE 55 HD13 ILE 55 2.339 -1.464 -2.446 484 H THR 56 H THR 56 5.518 -3.498 0.416 485 HA THR 56 HA THR 56 5.121 -6.173 -0.805 486 HB THR 56 HB THR 56 6.035 -6.933 1.603 487 HG1 THR 56 HG1 THR 56 7.843 -5.697 2.168 488 HG21 THR 56 HG21 THR 56 7.951 -6.139 -0.636 489 HG22 THR 56 HG22 THR 56 8.258 -7.342 0.638 490 HG23 THR 56 HG23 THR 56 7.009 -7.646 -0.581 491 H ALA 57 H ALA 57 3.404 -7.339 0.091 492 HA ALA 57 HA ALA 57 1.300 -5.882 1.276 493 HB1 ALA 57 HB1 ALA 57 1.819 -8.892 1.235 494 HB2 ALA 57 HB2 ALA 57 0.263 -8.091 1.540 495 HB3 ALA 57 HB3 ALA 57 1.029 -7.952 -0.055 496 H ILE 58 H ILE 58 3.957 -7.624 2.757 497 HA ILE 58 HA ILE 58 2.992 -7.820 5.469 498 HB ILE 58 HB ILE 58 5.753 -7.721 4.179 499 HG12 ILE 58 HG12 ILE 58 5.891 -10.104 4.948 500 HG13 ILE 58 HG13 ILE 58 4.243 -10.014 5.560 501 HG21 ILE 58 HG21 ILE 58 5.041 -8.120 7.130 502 HG22 ILE 58 HG22 ILE 58 6.633 -8.503 6.430 503 HG23 ILE 58 HG23 ILE 58 6.060 -6.839 6.441 504 HD11 ILE 58 HD11 ILE 58 4.993 -9.681 2.622 505 HD12 ILE 58 HD12 ILE 58 4.521 -11.216 3.376 506 HD13 ILE 58 HD13 ILE 58 3.354 -9.897 3.303 507 H THR 59 H THR 59 5.007 -5.403 3.753 508 HA THR 59 HA THR 59 5.252 -3.690 6.098 509 HB THR 59 HB THR 59 6.076 -3.401 3.196 510 HG1 THR 59 HG1 THR 59 8.010 -4.099 3.926 511 HG21 THR 59 HG21 THR 59 6.924 -1.770 5.628 512 HG22 THR 59 HG22 THR 59 7.666 -1.701 4.008 513 HG23 THR 59 HG23 THR 59 5.990 -1.169 4.233 514 H LEU 60 H LEU 60 3.486 -3.539 2.978 515 HA LEU 60 HA LEU 60 2.168 -1.099 3.454 516 HB2 LEU 60 HB2 LEU 60 2.484 -2.398 1.294 517 HB3 LEU 60 HB3 LEU 60 1.237 -3.505 1.837 518 HG LEU 60 HG LEU 60 -0.372 -1.529 1.860 519 HD11 LEU 60 HD11 LEU 60 1.940 -0.140 0.454 520 HD12 LEU 60 HD12 LEU 60 0.315 0.511 0.689 521 HD13 LEU 60 HD13 LEU 60 1.350 0.282 2.088 522 HD21 LEU 60 HD21 LEU 60 -0.265 -3.060 -0.044 523 HD22 LEU 60 HD22 LEU 60 -0.566 -1.400 -0.589 524 HD23 LEU 60 HD23 LEU 60 1.052 -2.116 -0.751 525 H SER 61 H SER 61 1.252 -4.430 4.445 526 HA SER 61 HA SER 61 -1.203 -3.945 5.663 527 HB2 SER 61 HB2 SER 61 -0.401 -6.157 5.447 528 HB3 SER 61 HB3 SER 61 1.028 -5.811 6.437 529 HG SER 61 HG SER 61 -0.483 -6.884 7.679 530 H LYS 62 H LYS 62 1.965 -3.106 6.695 531 HA LYS 62 HA LYS 62 1.062 -2.297 9.375 532 HB2 LYS 62 HB2 LYS 62 3.855 -2.612 8.238 533 HB3 LYS 62 HB3 LYS 62 3.509 -2.026 9.871 534 HG2 LYS 62 HG2 LYS 62 2.323 -4.114 10.422 535 HG3 LYS 62 HG3 LYS 62 2.599 -4.732 8.787 536 HD2 LYS 62 HD2 LYS 62 5.068 -4.537 9.168 537 HD3 LYS 62 HD3 LYS 62 4.727 -4.043 10.845 538 HE2 LYS 62 HE2 LYS 62 3.510 -6.199 11.200 539 HE3 LYS 62 HE3 LYS 62 3.889 -6.677 9.540 540 HZ1 LYS 62 HZ1 LYS 62 5.898 -6.162 11.672 541 HZ2 LYS 62 HZ2 LYS 62 5.473 -7.633 11.112 542 HZ3 LYS 62 HZ3 LYS 62 6.260 -6.589 10.136 543 H LYS 63 H LYS 63 2.324 -0.743 6.406 544 HA LYS 63 HA LYS 63 2.810 1.854 7.414 545 HB2 LYS 63 HB2 LYS 63 2.012 0.631 4.754 546 HB3 LYS 63 HB3 LYS 63 2.279 2.361 4.881 547 HG2 LYS 63 HG2 LYS 63 4.394 0.416 5.906 548 HG3 LYS 63 HG3 LYS 63 4.242 0.717 4.186 549 HD2 LYS 63 HD2 LYS 63 4.193 3.248 5.644 550 HD3 LYS 63 HD3 LYS 63 5.599 2.311 6.150 551 HE2 LYS 63 HE2 LYS 63 4.897 2.537 3.229 552 HE3 LYS 63 HE3 LYS 63 5.645 3.932 4.027 553 HZ1 LYS 63 HZ1 LYS 63 6.843 1.212 3.919 554 HZ2 LYS 63 HZ2 LYS 63 7.309 2.485 3.009 555 HZ3 LYS 63 HZ3 LYS 63 7.524 2.524 4.626 556 H LEU 64 H LEU 64 -0.229 0.332 6.455 557 HA LEU 64 HA LEU 64 -1.698 2.824 7.220 558 HB2 LEU 64 HB2 LEU 64 -2.564 0.717 5.213 559 HB3 LEU 64 HB3 LEU 64 -3.406 2.181 5.651 560 HG LEU 64 HG LEU 64 -1.027 3.247 4.867 561 HD11 LEU 64 HD11 LEU 64 -1.474 0.831 3.042 562 HD12 LEU 64 HD12 LEU 64 -0.262 2.119 2.831 563 HD13 LEU 64 HD13 LEU 64 -0.143 0.974 4.180 564 HD21 LEU 64 HD21 LEU 64 -3.279 3.850 4.068 565 HD22 LEU 64 HD22 LEU 64 -2.085 3.752 2.773 566 HD23 LEU 64 HD23 LEU 64 -3.275 2.441 2.985 567 H ASN 65 H ASN 65 -0.951 0.128 8.731 568 HA ASN 65 HA ASN 65 -1.828 -1.264 10.270 569 HB2 ASN 65 HB2 ASN 65 -3.661 1.090 10.866 570 HB3 ASN 65 HB3 ASN 65 -3.278 -0.234 11.956 571 HD21 ASN 65 HD21 ASN 65 -0.697 2.870 11.628 572 HD22 ASN 65 HD22 ASN 65 -2.184 2.814 10.692 573 H ILE 66 H ILE 66 -2.571 -2.356 8.162 574 HA ILE 66 HA ILE 66 -5.498 -2.977 8.236 575 HB ILE 66 HB ILE 66 -4.959 -3.382 5.644 576 HG12 ILE 66 HG12 ILE 66 -3.144 -1.019 6.210 577 HG13 ILE 66 HG13 ILE 66 -2.506 -2.593 5.972 578 HG21 ILE 66 HG21 ILE 66 -5.558 -0.701 6.943 579 HG22 ILE 66 HG22 ILE 66 -5.889 -1.110 5.253 580 HG23 ILE 66 HG23 ILE 66 -6.721 -1.991 6.536 581 HD11 ILE 66 HD11 ILE 66 -4.051 -0.954 3.931 582 HD12 ILE 66 HD12 ILE 66 -2.362 -1.478 3.865 583 HD13 ILE 66 HD13 ILE 66 -3.665 -2.673 3.699 584 H THR 67 H THR 67 -5.507 -5.093 6.454 585 HA THR 67 HA THR 67 -3.882 -7.163 7.856 586 HB THR 67 HB THR 67 -5.318 -8.803 7.179 587 HG1 THR 67 HG1 THR 67 -6.935 -8.439 5.580 588 HG21 THR 67 HG21 THR 67 -7.275 -6.476 7.379 589 HG22 THR 67 HG22 THR 67 -7.571 -8.185 7.760 590 HG23 THR 67 HG23 THR 67 -6.473 -7.234 8.778 591 H VAL 68 H VAL 68 -2.792 -8.799 6.576 592 HA VAL 68 HA VAL 68 -1.232 -7.796 4.373 593 HB VAL 68 HB VAL 68 -1.743 -10.662 5.264 594 HG11 VAL 68 HG11 VAL 68 0.460 -9.550 3.470 595 HG12 VAL 68 HG12 VAL 68 0.385 -11.203 4.111 596 HG13 VAL 68 HG13 VAL 68 -0.834 -10.662 2.959 597 HG21 VAL 68 HG21 VAL 68 -0.673 -9.301 7.031 598 HG22 VAL 68 HG22 VAL 68 0.483 -10.444 6.351 599 HG23 VAL 68 HG23 VAL 68 0.550 -8.736 5.869 600 H GLU 69 H GLU 69 -4.463 -9.231 4.434 601 HA GLU 69 HA GLU 69 -4.329 -10.052 1.585 602 HB2 GLU 69 HB2 GLU 69 -6.598 -10.075 3.618 603 HB3 GLU 69 HB3 GLU 69 -6.718 -10.643 1.948 604 HG2 GLU 69 HG2 GLU 69 -4.914 -12.312 2.398 605 HG3 GLU 69 HG3 GLU 69 -4.866 -11.789 4.084 606 H LYS 70 H LYS 70 -5.700 -7.493 3.653 607 HA LYS 70 HA LYS 70 -7.142 -6.168 1.599 608 HB2 LYS 70 HB2 LYS 70 -7.403 -6.086 4.124 609 HB3 LYS 70 HB3 LYS 70 -6.012 -5.015 4.197 610 HG2 LYS 70 HG2 LYS 70 -8.558 -4.452 2.628 611 HG3 LYS 70 HG3 LYS 70 -8.309 -4.039 4.331 612 HD2 LYS 70 HD2 LYS 70 -6.282 -2.680 3.577 613 HD3 LYS 70 HD3 LYS 70 -6.913 -2.811 1.931 614 HE2 LYS 70 HE2 LYS 70 -8.659 -1.898 4.260 615 HE3 LYS 70 HE3 LYS 70 -7.590 -0.757 3.456 616 HZ1 LYS 70 HZ1 LYS 70 -9.694 -2.306 2.037 617 HZ2 LYS 70 HZ2 LYS 70 -9.828 -0.740 2.490 618 HZ3 LYS 70 HZ3 LYS 70 -8.717 -1.154 1.380 619 H ALA 71 H ALA 71 -3.984 -5.608 3.040 620 HA ALA 71 HA ALA 71 -2.964 -3.576 1.349 621 HB1 ALA 71 HB1 ALA 71 -1.526 -5.862 2.768 622 HB2 ALA 71 HB2 ALA 71 -0.774 -4.380 2.155 623 HB3 ALA 71 HB3 ALA 71 -1.949 -4.291 3.476 624 H LYS 72 H LYS 72 -2.803 -7.178 0.903 625 HA LYS 72 HA LYS 72 -1.146 -7.021 -1.440 626 HB2 LYS 72 HB2 LYS 72 -1.174 -8.974 0.047 627 HB3 LYS 72 HB3 LYS 72 -2.889 -9.240 -0.255 628 HG2 LYS 72 HG2 LYS 72 -2.510 -9.931 -2.471 629 HG3 LYS 72 HG3 LYS 72 -0.828 -9.365 -2.480 630 HD2 LYS 72 HD2 LYS 72 -1.827 -11.564 -0.610 631 HD3 LYS 72 HD3 LYS 72 -1.226 -11.892 -2.248 632 HE2 LYS 72 HE2 LYS 72 0.927 -10.747 -1.649 633 HE3 LYS 72 HE3 LYS 72 0.340 -10.570 0.012 634 HZ1 LYS 72 HZ1 LYS 72 0.747 -13.160 -1.393 635 HZ2 LYS 72 HZ2 LYS 72 1.718 -12.557 -0.232 636 HZ3 LYS 72 HZ3 LYS 72 0.194 -13.010 0.138 637 H ASN 73 H ASN 73 -4.631 -6.941 -0.935 638 HA ASN 73 HA ASN 73 -5.427 -7.490 -3.531 639 HB2 ASN 73 HB2 ASN 73 -7.414 -7.162 -2.564 640 HB3 ASN 73 HB3 ASN 73 -6.649 -6.471 -1.152 641 HD21 ASN 73 HD21 ASN 73 -7.541 -3.136 -1.960 642 HD22 ASN 73 HD22 ASN 73 -6.606 -4.175 -0.891 643 H TYR 74 H TYR 74 -4.247 -4.359 -2.260 644 HA TYR 74 HA TYR 74 -4.578 -2.777 -4.586 645 HB2 TYR 74 HB2 TYR 74 -2.427 -2.580 -2.456 646 HB3 TYR 74 HB3 TYR 74 -2.916 -1.307 -3.561 647 HD1 TYR 74 HD1 TYR 74 -3.028 -2.145 -0.304 648 HD2 TYR 74 HD2 TYR 74 -5.744 -1.033 -3.463 649 HE1 TYR 74 HE1 TYR 74 -4.614 -1.213 1.387 650 HE2 TYR 74 HE2 TYR 74 -7.354 -0.151 -1.768 651 HH TYR 74 HH TYR 74 -6.544 -0.042 1.701 652 H ILE 75 H ILE 75 -1.815 -4.741 -3.442 653 HA ILE 75 HA ILE 75 -0.053 -4.099 -5.604 654 HB ILE 75 HB ILE 75 -0.108 -6.546 -3.787 655 HG12 ILE 75 HG12 ILE 75 1.354 -3.880 -3.498 656 HG13 ILE 75 HG13 ILE 75 -0.037 -4.372 -2.544 657 HG21 ILE 75 HG21 ILE 75 2.181 -5.365 -5.432 658 HG22 ILE 75 HG22 ILE 75 2.305 -6.744 -4.317 659 HG23 ILE 75 HG23 ILE 75 1.344 -6.896 -5.772 660 HD11 ILE 75 HD11 ILE 75 2.729 -5.590 -2.424 661 HD12 ILE 75 HD12 ILE 75 1.860 -4.679 -1.181 662 HD13 ILE 75 HD13 ILE 75 1.284 -6.291 -1.649 663 H LYS 76 H LYS 76 -2.701 -6.453 -5.343 664 HA LYS 76 HA LYS 76 -1.940 -7.962 -7.698 665 HB2 LYS 76 HB2 LYS 76 -3.823 -8.204 -5.482 666 HB3 LYS 76 HB3 LYS 76 -4.690 -8.356 -6.980 667 HG2 LYS 76 HG2 LYS 76 -4.098 -10.519 -6.522 668 HG3 LYS 76 HG3 LYS 76 -2.903 -10.024 -7.731 669 HD2 LYS 76 HD2 LYS 76 -1.306 -9.520 -5.768 670 HD3 LYS 76 HD3 LYS 76 -2.552 -10.184 -4.712 671 HE2 LYS 76 HE2 LYS 76 -1.324 -12.084 -4.958 672 HE3 LYS 76 HE3 LYS 76 -2.414 -12.285 -6.328 673 HZ1 LYS 76 HZ1 LYS 76 0.368 -11.225 -6.422 674 HZ2 LYS 76 HZ2 LYS 76 -0.125 -12.658 -7.001 675 HZ3 LYS 76 HZ3 LYS 76 -0.614 -11.276 -7.728 676 H ASN 77 H ASN 77 -4.176 -5.217 -7.149 677 HA ASN 77 HA ASN 77 -5.036 -5.466 -9.983 678 HB2 ASN 77 HB2 ASN 77 -6.684 -3.871 -9.592 679 HB3 ASN 77 HB3 ASN 77 -6.830 -5.100 -8.348 680 HD21 ASN 77 HD21 ASN 77 -6.386 -2.819 -5.702 681 HD22 ASN 77 HD22 ASN 77 -6.174 -4.513 -6.116 682 H SER 78 H SER 78 -3.330 -3.207 -7.760 683 HA SER 78 HA SER 78 -2.915 -1.376 -9.974 684 HB2 SER 78 HB2 SER 78 -3.488 -0.646 -7.629 685 HB3 SER 78 HB3 SER 78 -1.812 -1.022 -7.182 686 HG SER 78 HG SER 78 -2.150 1.187 -7.854 687 H ASN 79 H ASN 79 -1.828 -3.138 -11.132 688 HA ASN 79 HA ASN 79 1.132 -3.127 -10.640 689 HB2 ASN 79 HB2 ASN 79 -0.512 -5.240 -10.098 690 HB3 ASN 79 HB3 ASN 79 -0.147 -5.579 -11.788 691 HD21 ASN 79 HD21 ASN 79 2.711 -5.901 -8.878 692 HD22 ASN 79 HD22 ASN 79 1.091 -5.276 -8.546 693 H ARG 80 H ARG 80 -1.293 -2.546 -12.975 694 HA ARG 80 HA ARG 80 0.726 -2.535 -15.203 695 HB2 ARG 80 HB2 ARG 80 -2.314 -2.635 -15.199 696 HB3 ARG 80 HB3 ARG 80 -1.397 -2.105 -16.602 697 HG2 ARG 80 HG2 ARG 80 -1.838 -4.358 -16.997 698 HG3 ARG 80 HG3 ARG 80 -0.130 -4.268 -16.589 699 HD2 ARG 80 HD2 ARG 80 -0.650 -5.084 -14.290 700 HD3 ARG 80 HD3 ARG 80 -2.362 -5.169 -14.698 701 HE ARG 80 HE ARG 80 -0.243 -7.046 -15.386 702 HH11 ARG 80 HH11 ARG 80 -0.651 -8.880 -16.548 703 HH12 ARG 80 HH12 ARG 80 -2.167 -9.071 -17.371 704 HH21 ARG 80 HH21 ARG 80 -3.430 -6.025 -16.424 705 HH22 ARG 80 HH22 ARG 80 -3.684 -7.480 -17.349 706 H LEU 81 H LEU 81 -0.690 -0.464 -12.952 707 HA LEU 81 HA LEU 81 -0.608 1.989 -14.506 708 HB2 LEU 81 HB2 LEU 81 -2.075 1.542 -12.575 709 HB3 LEU 81 HB3 LEU 81 -0.693 1.504 -11.491 710 HG LEU 81 HG LEU 81 -1.130 3.969 -13.201 711 HD11 LEU 81 HD11 LEU 81 -2.690 3.334 -10.663 712 HD12 LEU 81 HD12 LEU 81 -2.663 4.900 -11.509 713 HD13 LEU 81 HD13 LEU 81 -3.364 3.483 -12.301 714 HD21 LEU 81 HD21 LEU 81 0.852 3.877 -11.670 715 HD22 LEU 81 HD22 LEU 81 -0.290 5.132 -11.190 716 HD23 LEU 81 HD23 LEU 81 -0.237 3.596 -10.299 717 H GLY 82 H GLY 82 1.733 0.183 -12.550 718 HA2 GLY 82 HA2 GLY 82 3.940 1.603 -13.781 719 HA3 GLY 82 HA3 GLY 82 3.802 1.966 -12.054 720 H ARG 83 H ARG 83 5.963 0.674 -13.402 721 HA ARG 83 HA ARG 83 6.144 -1.897 -11.954 722 HB2 ARG 83 HB2 ARG 83 4.995 -2.277 -14.234 723 HB3 ARG 83 HB3 ARG 83 6.536 -1.894 -14.964 724 HG2 ARG 83 HG2 ARG 83 6.596 -4.217 -14.804 725 HG3 ARG 83 HG3 ARG 83 7.529 -3.725 -13.392 726 HD2 ARG 83 HD2 ARG 83 6.044 -5.509 -12.711 727 HD3 ARG 83 HD3 ARG 83 5.466 -4.019 -11.973 728 HE ARG 83 HE ARG 83 3.504 -4.171 -13.190 729 HH11 ARG 83 HH11 ARG 83 2.103 -4.851 -14.603 730 HH12 ARG 83 HH12 ARG 83 2.492 -6.086 -15.798 731 HH21 ARG 83 HH21 ARG 83 5.714 -6.491 -14.651 732 HH22 ARG 83 HH22 ARG 83 4.502 -7.035 -15.776 733 H THR 84 H THR 84 7.981 -0.433 -14.629 734 HA THR 84 HA THR 84 10.425 -0.123 -13.011 735 HB THR 84 HB THR 84 10.206 -2.538 -13.244 736 HG1 THR 84 HG1 THR 84 12.206 -2.984 -14.060 737 HG21 THR 84 HG21 THR 84 10.265 -2.117 -16.248 738 HG22 THR 84 HG22 THR 84 10.424 -3.678 -15.408 739 HG23 THR 84 HG23 THR 84 8.923 -2.759 -15.267 740 H ASN 85 H ASN 85 8.792 1.561 -14.815 741 HA ASN 85 HA ASN 85 10.541 1.900 -17.198 742 HB2 ASN 85 HB2 ASN 85 7.681 2.789 -16.662 743 HB3 ASN 85 HB3 ASN 85 8.588 3.122 -18.135 744 HD21 ASN 85 HD21 ASN 85 6.746 -0.413 -17.844 745 HD22 ASN 85 HD22 ASN 85 6.414 0.933 -16.764 746 H ASN 86 H ASN 86 12.206 2.900 -15.920 747 HA ASN 86 HA ASN 86 11.809 5.830 -15.613 748 HB2 ASN 86 HB2 ASN 86 12.790 3.881 -13.495 749 HB3 ASN 86 HB3 ASN 86 13.342 5.552 -13.494 750 HD21 ASN 86 HD21 ASN 86 10.145 6.948 -12.694 751 HD22 ASN 86 HD22 ASN 86 11.602 7.268 -13.626 752 H LEU 87 H LEU 87 13.775 7.050 -15.431 753 HA LEU 87 HA LEU 87 16.030 6.009 -17.041 754 HB2 LEU 87 HB2 LEU 87 14.607 8.704 -17.100 755 HB3 LEU 87 HB3 LEU 87 16.255 8.509 -17.662 756 HG LEU 87 HG LEU 87 15.499 6.813 -19.334 757 HD11 LEU 87 HD11 LEU 87 12.725 7.707 -18.431 758 HD12 LEU 87 HD12 LEU 87 13.057 6.936 -20.001 759 HD13 LEU 87 HD13 LEU 87 13.362 6.046 -18.519 760 HD21 LEU 87 HD21 LEU 87 15.898 9.184 -19.893 761 HD22 LEU 87 HD22 LEU 87 14.589 8.504 -20.868 762 HD23 LEU 87 HD23 LEU 87 14.208 9.568 -19.495 763 H LYS 88 H LYS 88 17.994 7.406 -16.653 764 HA LYS 88 HA LYS 88 18.411 7.966 -13.741 765 HB2 LYS 88 HB2 LYS 88 20.562 6.745 -13.945 766 HB3 LYS 88 HB3 LYS 88 19.149 5.716 -14.187 767 HG2 LYS 88 HG2 LYS 88 19.437 5.722 -16.593 768 HG3 LYS 88 HG3 LYS 88 20.720 6.944 -16.487 769 HD2 LYS 88 HD2 LYS 88 22.062 5.252 -15.086 770 HD3 LYS 88 HD3 LYS 88 20.810 4.069 -15.481 771 HE2 LYS 88 HE2 LYS 88 22.548 3.688 -17.038 772 HE3 LYS 88 HE3 LYS 88 21.279 4.517 -17.942 773 HZ1 LYS 88 HZ1 LYS 88 23.721 5.810 -16.827 774 HZ2 LYS 88 HZ2 LYS 88 23.492 5.442 -18.398 775 HZ3 LYS 88 HZ3 LYS 88 22.570 6.587 -17.692 776 H THR 89 H THR 89 18.143 9.707 -16.268 777 HA THR 89 HA THR 89 20.135 11.607 -15.464 778 HB THR 89 HB THR 89 21.420 10.372 -17.158 779 HG1 THR 89 HG1 THR 89 22.018 12.248 -18.239 780 HG21 THR 89 HG21 THR 89 19.460 11.464 -19.223 781 HG22 THR 89 HG22 THR 89 20.927 10.506 -19.516 782 HG23 THR 89 HG23 THR 89 19.530 9.757 -18.722 783 H ILE 90 H ILE 90 19.158 13.413 -15.325 784 HA ILE 90 HA ILE 90 16.928 14.205 -17.124 785 HB ILE 90 HB ILE 90 15.947 15.209 -14.942 786 HG12 ILE 90 HG12 ILE 90 17.976 14.578 -13.520 787 HG13 ILE 90 HG13 ILE 90 16.352 14.459 -12.877 788 HG21 ILE 90 HG21 ILE 90 15.751 12.232 -15.473 789 HG22 ILE 90 HG22 ILE 90 14.590 13.214 -14.551 790 HG23 ILE 90 HG23 ILE 90 14.838 13.520 -16.277 791 HD11 ILE 90 HD11 ILE 90 17.969 12.056 -13.826 792 HD12 ILE 90 HD12 ILE 90 17.737 12.579 -12.154 793 HD13 ILE 90 HD13 ILE 90 16.350 12.024 -13.098 794 H GLY 91 H GLY 91 19.932 15.085 -16.528 795 HA2 GLY 91 HA2 GLY 91 21.135 17.048 -16.457 796 HA3 GLY 91 HA3 GLY 91 19.682 17.895 -17.002 797 H ILE 92 H ILE 92 19.199 16.173 -14.106 798 HA ILE 92 HA ILE 92 18.632 16.775 -12.026 799 HB ILE 92 HB ILE 92 21.243 18.308 -11.951 800 HG12 ILE 92 HG12 ILE 92 21.923 15.895 -10.945 801 HG13 ILE 92 HG13 ILE 92 20.657 15.326 -12.020 802 HG21 ILE 92 HG21 ILE 92 19.683 16.783 -9.804 803 HG22 ILE 92 HG22 ILE 92 21.273 17.547 -9.588 804 HG23 ILE 92 HG23 ILE 92 19.870 18.545 -9.883 805 HD11 ILE 92 HD11 ILE 92 23.092 16.980 -12.851 806 HD12 ILE 92 HD12 ILE 92 22.963 15.214 -12.961 807 HD13 ILE 92 HD13 ILE 92 21.916 16.227 -13.954 808 H LEU 93 H LEU 93 17.267 18.146 -13.842 809 HA LEU 93 HA LEU 93 15.931 19.865 -14.291 810 HB2 LEU 93 HB2 LEU 93 15.605 19.115 -11.646 811 HB3 LEU 93 HB3 LEU 93 15.696 20.857 -11.506 812 HG LEU 93 HG LEU 93 13.794 19.296 -13.321 813 HD11 LEU 93 HD11 LEU 93 13.272 20.727 -10.682 814 HD12 LEU 93 HD12 LEU 93 12.052 19.933 -11.705 815 HD13 LEU 93 HD13 LEU 93 13.316 18.966 -10.928 816 HD21 LEU 93 HD21 LEU 93 14.170 21.554 -14.222 817 HD22 LEU 93 HD22 LEU 93 12.547 21.426 -13.535 818 HD23 LEU 93 HD23 LEU 93 13.828 22.264 -12.628 819 H GLN 94 H GLN 94 18.781 20.519 -14.392 820 HA GLN 94 HA GLN 94 18.715 23.504 -14.212 821 HB2 GLN 94 HB2 GLN 94 20.711 21.529 -13.055 822 HB3 GLN 94 HB3 GLN 94 21.144 23.216 -13.381 823 HG2 GLN 94 HG2 GLN 94 19.512 24.067 -11.851 824 HG3 GLN 94 HG3 GLN 94 18.761 22.485 -11.642 825 HE21 GLN 94 HE21 GLN 94 21.227 21.230 -9.389 826 HE22 GLN 94 HE22 GLN 94 19.998 20.770 -10.580 827 H GLU 95 H GLU 95 18.121 22.968 -16.523 828 HA GLU 95 HA GLU 95 20.589 23.055 -18.209 829 HB2 GLU 95 HB2 GLU 95 17.961 21.694 -18.927 830 HB3 GLU 95 HB3 GLU 95 19.314 21.976 -20.027 831 HG2 GLU 95 HG2 GLU 95 20.775 20.605 -18.486 832 HG3 GLU 95 HG3 GLU 95 19.325 20.186 -17.567 833 H GLU 96 H GLU 96 20.480 24.389 -20.068 834 HA GLU 96 HA GLU 96 18.727 26.735 -19.773 835 HB2 GLU 96 HB2 GLU 96 21.174 26.917 -20.172 836 HB3 GLU 96 HB3 GLU 96 20.958 26.187 -21.766 837 HG2 GLU 96 HG2 GLU 96 19.428 28.085 -22.384 838 HG3 GLU 96 HG3 GLU 96 19.675 28.780 -20.784 839 H VAL 97 H VAL 97 16.697 25.888 -20.233 840 HA VAL 97 HA VAL 97 16.057 25.934 -23.091 841 HB VAL 97 HB VAL 97 16.439 23.544 -22.628 842 HG11 VAL 97 HG11 VAL 97 14.048 23.674 -20.746 843 HG12 VAL 97 HG12 VAL 97 14.939 22.226 -21.249 844 HG13 VAL 97 HG13 VAL 97 15.739 23.446 -20.248 845 HG21 VAL 97 HG21 VAL 97 14.809 24.280 -24.356 846 HG22 VAL 97 HG22 VAL 97 14.459 22.692 -23.658 847 HG23 VAL 97 HG23 VAL 97 13.498 24.100 -23.162 848 H SER 98 H SER 98 13.978 26.563 -23.568 849 HA SER 98 HA SER 98 12.070 27.274 -21.404 850 HB2 SER 98 HB2 SER 98 13.318 29.328 -23.266 851 HB3 SER 98 HB3 SER 98 11.884 29.613 -22.259 852 HG SER 98 HG SER 98 13.808 30.363 -21.261 853 H SER 99 H SER 99 12.687 27.819 -24.916 854 HA SER 99 HA SER 99 9.786 27.373 -25.473 855 HB2 SER 99 HB2 SER 99 10.802 29.538 -26.078 856 HB3 SER 99 HB3 SER 99 11.932 28.703 -27.159 857 HG SER 99 HG SER 99 10.055 29.510 -28.245 858 H MET 100 H MET 100 13.005 26.419 -26.743 859 HA MET 100 HA MET 100 11.798 24.476 -28.591 860 HB2 MET 100 HB2 MET 100 14.680 25.319 -28.159 861 HB3 MET 100 HB3 MET 100 14.100 24.205 -29.409 862 HG2 MET 100 HG2 MET 100 12.664 25.985 -30.354 863 HG3 MET 100 HG3 MET 100 13.230 27.105 -29.116 864 HE1 MET 100 HE1 MET 100 14.010 25.224 -32.427 865 HE2 MET 100 HE2 MET 100 15.726 25.580 -32.713 866 HE3 MET 100 HE3 MET 100 15.260 24.470 -31.410 867 H GLU 101 H GLU 101 11.059 23.612 -26.270 868 HA GLU 101 HA GLU 101 12.940 21.752 -25.028 869 HB2 GLU 101 HB2 GLU 101 11.196 23.172 -23.831 870 HB3 GLU 101 HB3 GLU 101 9.985 22.028 -24.408 871 HG2 GLU 101 HG2 GLU 101 11.359 20.181 -23.275 872 HG3 GLU 101 HG3 GLU 101 12.410 21.440 -22.641 873 H ALA 102 H ALA 102 13.097 20.854 -27.398 874 HA ALA 102 HA ALA 102 11.572 18.293 -27.481 875 HB1 ALA 102 HB1 ALA 102 12.002 20.176 -29.840 876 HB2 ALA 102 HB2 ALA 102 11.290 18.550 -29.920 877 HB3 ALA 102 HB3 ALA 102 10.455 19.840 -29.032 878 H LYS 103 H LYS 103 12.882 16.636 -27.579 879 HA LYS 103 HA LYS 103 15.553 16.757 -28.935 880 HB2 LYS 103 HB2 LYS 103 15.061 15.789 -26.088 881 HB3 LYS 103 HB3 LYS 103 16.533 15.492 -27.021 882 HG2 LYS 103 HG2 LYS 103 16.915 17.948 -27.214 883 HG3 LYS 103 HG3 LYS 103 15.451 18.243 -26.267 884 HD2 LYS 103 HD2 LYS 103 17.314 18.484 -24.811 885 HD3 LYS 103 HD3 LYS 103 16.442 17.015 -24.350 886 HE2 LYS 103 HE2 LYS 103 18.130 15.640 -25.557 887 HE3 LYS 103 HE3 LYS 103 18.972 17.111 -26.061 888 HZ1 LYS 103 HZ1 LYS 103 18.618 16.231 -23.243 889 HZ2 LYS 103 HZ2 LYS 103 20.005 16.129 -24.097 890 HZ3 LYS 103 HZ3 LYS 103 19.396 17.590 -23.705 891 H SER 104 H SER 104 13.183 14.599 -27.340 892 HA SER 104 HA SER 104 13.276 12.721 -29.606 893 HB2 SER 104 HB2 SER 104 13.655 10.776 -28.126 894 HB3 SER 104 HB3 SER 104 15.050 11.862 -28.183 895 HG SER 104 HG SER 104 14.557 11.204 -26.039 896 H MET 105 H MET 105 11.569 11.106 -29.509 897 HA MET 105 HA MET 105 9.272 11.610 -27.704 898 HB2 MET 105 HB2 MET 105 9.205 11.904 -30.740 899 HB3 MET 105 HB3 MET 105 7.760 11.589 -29.775 900 HG2 MET 105 HG2 MET 105 8.206 13.631 -28.437 901 HG3 MET 105 HG3 MET 105 9.562 14.013 -29.509 902 HE1 MET 105 HE1 MET 105 8.393 16.430 -29.732 903 HE2 MET 105 HE2 MET 105 6.739 16.664 -30.340 904 HE3 MET 105 HE3 MET 105 7.003 15.891 -28.763 905 H THR 106 H THR 106 7.555 10.012 -27.996 906 HA THR 106 HA THR 106 8.324 7.418 -29.215 907 HB THR 106 HB THR 106 8.835 7.301 -26.798 908 HG1 THR 106 HG1 THR 106 7.781 5.362 -26.520 909 HG21 THR 106 HG21 THR 106 5.821 7.560 -26.386 910 HG22 THR 106 HG22 THR 106 7.034 7.170 -25.148 911 HG23 THR 106 HG23 THR 106 7.031 8.771 -25.903 912 H TRP 107 H TRP 107 6.423 5.941 -29.322 913 HA TRP 107 HA TRP 107 4.095 7.488 -30.363 914 HB2 TRP 107 HB2 TRP 107 5.912 6.896 -32.065 915 HB3 TRP 107 HB3 TRP 107 5.394 5.226 -31.895 916 HD1 TRP 107 HD1 TRP 107 3.265 4.536 -33.238 917 HE1 TRP 107 HE1 TRP 107 1.683 5.718 -34.886 918 HE3 TRP 107 HE3 TRP 107 4.778 9.369 -32.475 919 HZ2 TRP 107 HZ2 TRP 107 1.157 8.421 -35.768 920 HZ3 TRP 107 HZ3 TRP 107 3.722 11.231 -33.737 921 HH2 TRP 107 HH2 TRP 107 1.916 10.771 -35.383 Start of MODEL 28 1 H1 GLY -5 H1 GLY -5 -5.571 -19.129 -19.990 2 H2 GLY -5 H2 GLY -5 -6.620 -17.900 -20.253 3 H3 GLY -5 H3 GLY -5 -6.647 -19.220 -21.223 4 HA2 GLY -5 HA2 GLY -5 -7.349 -19.184 -18.357 5 HA3 GLY -5 HA3 GLY -5 -8.502 -19.291 -19.699 6 H SER -4 H SER -4 -6.786 -21.073 -17.459 7 HA SER -4 HA SER -4 -7.065 -23.644 -18.951 8 HB2 SER -4 HB2 SER -4 -4.586 -22.764 -17.416 9 HB3 SER -4 HB3 SER -4 -4.849 -24.350 -18.165 10 HG SER -4 HG SER -4 -3.604 -22.967 -19.504 11 H HIS -3 H HIS -3 -6.920 -25.536 -17.555 12 HA HIS -3 HA HIS -3 -7.719 -25.091 -14.706 13 HB2 HIS -3 HB2 HIS -3 -8.970 -27.039 -16.682 14 HB3 HIS -3 HB3 HIS -3 -9.348 -26.930 -14.965 15 HD2 HIS -3 HD2 HIS -3 -10.595 -24.612 -14.113 16 HE1 HIS -3 HE1 HIS -3 -12.053 -23.511 -17.970 17 HE2 HIS -3 HE2 HIS -3 -12.252 -23.070 -15.469 18 H MET -2 H MET -2 -7.367 -26.888 -13.295 19 HA MET -2 HA MET -2 -5.047 -28.614 -14.074 20 HB2 MET -2 HB2 MET -2 -5.618 -27.199 -11.436 21 HB3 MET -2 HB3 MET -2 -4.383 -28.432 -11.672 22 HG2 MET -2 HG2 MET -2 -3.225 -26.426 -11.800 23 HG3 MET -2 HG3 MET -2 -3.356 -26.981 -13.463 24 HE1 MET -2 HE1 MET -2 -2.530 -24.634 -14.293 25 HE2 MET -2 HE2 MET -2 -3.257 -23.085 -13.811 26 HE3 MET -2 HE3 MET -2 -2.396 -24.074 -12.610 27 H ALA -1 H ALA -1 -4.874 -30.662 -13.255 28 HA ALA -1 HA ALA -1 -7.395 -32.021 -12.719 29 HB1 ALA -1 HB1 ALA -1 -4.539 -33.067 -12.921 30 HB2 ALA -1 HB2 ALA -1 -6.014 -34.055 -12.899 31 HB3 ALA -1 HB3 ALA -1 -5.708 -32.957 -14.259 32 H SER 0 H SER 0 -7.842 -33.389 -10.962 33 HA SER 0 HA SER 0 -6.977 -32.356 -8.352 34 HB2 SER 0 HB2 SER 0 -9.346 -32.878 -8.908 35 HB3 SER 0 HB3 SER 0 -8.913 -34.596 -9.015 36 HG SER 0 HG SER 0 -9.710 -33.992 -6.926 37 H MET 1 H MET 1 -5.724 -33.378 -6.865 38 HA MET 1 HA MET 1 -4.924 -36.190 -7.156 39 HB2 MET 1 HB2 MET 1 -3.362 -34.802 -8.599 40 HB3 MET 1 HB3 MET 1 -2.775 -34.022 -7.139 41 HG2 MET 1 HG2 MET 1 -2.737 -37.022 -7.693 42 HG3 MET 1 HG3 MET 1 -1.399 -35.941 -8.042 43 HE1 MET 1 HE1 MET 1 -1.156 -34.036 -5.481 44 HE2 MET 1 HE2 MET 1 0.016 -34.990 -4.550 45 HE3 MET 1 HE3 MET 1 0.191 -34.851 -6.313 46 H ASP 2 H ASP 2 -5.513 -36.864 -5.239 47 HA ASP 2 HA ASP 2 -6.044 -36.954 -3.022 48 HB2 ASP 2 HB2 ASP 2 -3.048 -36.515 -2.962 49 HB3 ASP 2 HB3 ASP 2 -4.010 -37.205 -1.655 50 HA PRO 3 HA PRO 3 -5.982 -32.369 -2.203 51 HB2 PRO 3 HB2 PRO 3 -8.655 -31.752 -2.271 52 HB3 PRO 3 HB3 PRO 3 -7.665 -31.934 -3.751 53 HG2 PRO 3 HG2 PRO 3 -9.402 -34.045 -2.416 54 HG3 PRO 3 HG3 PRO 3 -9.424 -33.529 -4.136 55 HD2 PRO 3 HD2 PRO 3 -8.016 -35.706 -3.361 56 HD3 PRO 3 HD3 PRO 3 -7.344 -34.571 -4.570 57 H LEU 4 H LEU 4 -7.426 -34.926 -0.583 58 HA LEU 4 HA LEU 4 -7.753 -33.351 1.912 59 HB2 LEU 4 HB2 LEU 4 -9.429 -34.793 2.692 60 HB3 LEU 4 HB3 LEU 4 -9.896 -34.118 1.140 61 HG LEU 4 HG LEU 4 -8.713 -36.925 1.401 62 HD11 LEU 4 HD11 LEU 4 -11.632 -36.065 1.523 63 HD12 LEU 4 HD12 LEU 4 -11.047 -37.746 1.418 64 HD13 LEU 4 HD13 LEU 4 -10.685 -36.772 2.850 65 HD21 LEU 4 HD21 LEU 4 -8.767 -36.112 -0.898 66 HD22 LEU 4 HD22 LEU 4 -10.047 -37.301 -0.690 67 HD23 LEU 4 HD23 LEU 4 -10.449 -35.568 -0.704 68 H ASP 5 H ASP 5 -5.336 -35.070 0.814 69 HA ASP 5 HA ASP 5 -5.098 -37.116 2.825 70 HB2 ASP 5 HB2 ASP 5 -3.787 -36.391 0.400 71 HB3 ASP 5 HB3 ASP 5 -2.543 -36.362 1.621 72 H LYS 6 H LYS 6 -4.929 -33.977 3.383 73 HA LYS 6 HA LYS 6 -2.605 -34.034 5.292 74 HB2 LYS 6 HB2 LYS 6 -3.417 -31.596 3.661 75 HB3 LYS 6 HB3 LYS 6 -1.969 -31.861 4.624 76 HG2 LYS 6 HG2 LYS 6 -1.019 -32.360 2.631 77 HG3 LYS 6 HG3 LYS 6 -1.723 -33.946 2.922 78 HD2 LYS 6 HD2 LYS 6 -2.325 -33.474 0.705 79 HD3 LYS 6 HD3 LYS 6 -3.798 -33.070 1.603 80 HE2 LYS 6 HE2 LYS 6 -3.084 -30.658 1.609 81 HE3 LYS 6 HE3 LYS 6 -1.649 -31.107 0.680 82 HZ1 LYS 6 HZ1 LYS 6 -4.461 -31.394 -0.230 83 HZ2 LYS 6 HZ2 LYS 6 -3.365 -30.329 -0.805 84 HZ3 LYS 6 HZ3 LYS 6 -3.162 -31.926 -1.080 85 H ILE 7 H ILE 7 -5.368 -31.911 4.589 86 HA ILE 7 HA ILE 7 -5.693 -31.433 7.508 87 HB ILE 7 HB ILE 7 -6.880 -29.384 6.888 88 HG12 ILE 7 HG12 ILE 7 -6.486 -28.424 4.596 89 HG13 ILE 7 HG13 ILE 7 -6.091 -30.029 4.004 90 HG21 ILE 7 HG21 ILE 7 -4.099 -29.639 5.664 91 HG22 ILE 7 HG22 ILE 7 -4.862 -28.164 6.288 92 HG23 ILE 7 HG23 ILE 7 -4.453 -29.478 7.397 93 HD11 ILE 7 HD11 ILE 7 -8.763 -29.237 5.251 94 HD12 ILE 7 HD12 ILE 7 -8.423 -29.255 3.512 95 HD13 ILE 7 HD13 ILE 7 -8.397 -30.768 4.413 96 H ILE 8 H ILE 8 -7.187 -33.163 5.065 97 HA ILE 8 HA ILE 8 -9.343 -34.018 4.806 98 HB ILE 8 HB ILE 8 -7.748 -35.532 5.687 99 HG12 ILE 8 HG12 ILE 8 -10.428 -36.318 6.858 100 HG13 ILE 8 HG13 ILE 8 -10.128 -36.194 5.123 101 HG21 ILE 8 HG21 ILE 8 -8.860 -35.041 8.478 102 HG22 ILE 8 HG22 ILE 8 -7.656 -36.262 8.029 103 HG23 ILE 8 HG23 ILE 8 -7.257 -34.556 7.893 104 HD11 ILE 8 HD11 ILE 8 -8.684 -38.048 7.062 105 HD12 ILE 8 HD12 ILE 8 -9.882 -38.496 5.838 106 HD13 ILE 8 HD13 ILE 8 -8.299 -37.873 5.331 107 H ASN 9 H ASN 9 -10.232 -31.655 5.364 108 HA ASN 9 HA ASN 9 -11.946 -31.718 7.766 109 HB2 ASN 9 HB2 ASN 9 -10.290 -29.848 7.060 110 HB3 ASN 9 HB3 ASN 9 -11.574 -29.344 5.952 111 HD21 ASN 9 HD21 ASN 9 -13.735 -28.332 8.709 112 HD22 ASN 9 HD22 ASN 9 -13.820 -29.188 7.159 113 H ASP 10 H ASP 10 -12.804 -33.461 5.711 114 HA ASP 10 HA ASP 10 -15.276 -32.130 4.715 115 HB2 ASP 10 HB2 ASP 10 -13.766 -34.544 3.667 116 HB3 ASP 10 HB3 ASP 10 -15.292 -33.956 3.002 117 H ILE 11 H ILE 11 -14.630 -33.602 7.305 118 HA ILE 11 HA ILE 11 -17.230 -34.929 7.603 119 HB ILE 11 HB ILE 11 -15.660 -36.622 6.600 120 HG12 ILE 11 HG12 ILE 11 -16.151 -38.536 7.921 121 HG13 ILE 11 HG13 ILE 11 -16.522 -37.582 9.345 122 HG21 ILE 11 HG21 ILE 11 -14.167 -36.511 9.247 123 HG22 ILE 11 HG22 ILE 11 -13.871 -37.629 7.905 124 HG23 ILE 11 HG23 ILE 11 -13.570 -35.900 7.691 125 HD11 ILE 11 HD11 ILE 11 -18.081 -37.473 6.723 126 HD12 ILE 11 HD12 ILE 11 -18.542 -38.417 8.155 127 HD13 ILE 11 HD13 ILE 11 -18.518 -36.650 8.243 128 H LYS 12 H LYS 12 -16.208 -32.608 8.714 129 HA LYS 12 HA LYS 12 -16.480 -33.284 11.602 130 HB2 LYS 12 HB2 LYS 12 -14.052 -33.050 10.812 131 HB3 LYS 12 HB3 LYS 12 -14.354 -31.336 10.598 132 HG2 LYS 12 HG2 LYS 12 -14.713 -32.851 13.230 133 HG3 LYS 12 HG3 LYS 12 -13.207 -32.084 12.724 134 HD2 LYS 12 HD2 LYS 12 -14.477 -29.892 12.543 135 HD3 LYS 12 HD3 LYS 12 -15.821 -30.682 13.388 136 HE2 LYS 12 HE2 LYS 12 -12.983 -30.422 14.436 137 HE3 LYS 12 HE3 LYS 12 -14.324 -29.349 14.850 138 HZ1 LYS 12 HZ1 LYS 12 -14.234 -32.258 15.458 139 HZ2 LYS 12 HZ2 LYS 12 -14.049 -31.056 16.541 140 HZ3 LYS 12 HZ3 LYS 12 -15.490 -31.270 15.809 141 H LYS 13 H LYS 13 -16.492 -30.674 9.216 142 HA LYS 13 HA LYS 13 -18.643 -29.250 10.665 143 HB2 LYS 13 HB2 LYS 13 -15.978 -28.154 9.726 144 HB3 LYS 13 HB3 LYS 13 -17.389 -27.094 9.793 145 HG2 LYS 13 HG2 LYS 13 -17.679 -27.412 12.150 146 HG3 LYS 13 HG3 LYS 13 -16.513 -28.729 12.193 147 HD2 LYS 13 HD2 LYS 13 -15.517 -26.738 13.135 148 HD3 LYS 13 HD3 LYS 13 -14.676 -27.178 11.642 149 HE2 LYS 13 HE2 LYS 13 -15.955 -25.439 10.408 150 HE3 LYS 13 HE3 LYS 13 -16.834 -25.029 11.886 151 HZ1 LYS 13 HZ1 LYS 13 -13.895 -24.748 11.520 152 HZ2 LYS 13 HZ2 LYS 13 -14.967 -23.518 11.509 153 HZ3 LYS 13 HZ3 LYS 13 -14.712 -24.360 12.882 154 H GLU 14 H GLU 14 -19.880 -27.782 9.432 155 HA GLU 14 HA GLU 14 -20.219 -28.573 6.567 156 HB2 GLU 14 HB2 GLU 14 -22.142 -27.301 8.552 157 HB3 GLU 14 HB3 GLU 14 -22.478 -27.570 6.831 158 HG2 GLU 14 HG2 GLU 14 -22.066 -29.996 7.135 159 HG3 GLU 14 HG3 GLU 14 -21.786 -29.737 8.858 160 H ALA 15 H ALA 15 -19.022 -27.310 5.313 161 HA ALA 15 HA ALA 15 -19.215 -24.370 5.401 162 HB1 ALA 15 HB1 ALA 15 -16.636 -25.918 5.919 163 HB2 ALA 15 HB2 ALA 15 -16.771 -24.148 5.747 164 HB3 ALA 15 HB3 ALA 15 -17.534 -24.976 7.124 165 H ASN 16 H ASN 16 -17.662 -23.428 3.703 166 HA ASN 16 HA ASN 16 -17.303 -25.180 1.317 167 HB2 ASN 16 HB2 ASN 16 -19.565 -24.173 1.207 168 HB3 ASN 16 HB3 ASN 16 -18.864 -22.561 1.360 169 HD21 ASN 16 HD21 ASN 16 -18.534 -24.585 -2.211 170 HD22 ASN 16 HD22 ASN 16 -18.924 -25.475 -0.746 171 H ASP 17 H ASP 17 -16.754 -21.836 2.586 172 HA ASP 17 HA ASP 17 -13.949 -21.962 1.680 173 HB2 ASP 17 HB2 ASP 17 -15.416 -21.036 -0.204 174 HB3 ASP 17 HB3 ASP 17 -15.751 -19.656 0.835 175 H SER 18 H SER 18 -12.628 -20.961 3.096 176 HA SER 18 HA SER 18 -13.721 -19.043 5.104 177 HB2 SER 18 HB2 SER 18 -11.778 -21.299 5.707 178 HB3 SER 18 HB3 SER 18 -12.367 -20.081 6.854 179 HG SER 18 HG SER 18 -13.530 -22.042 7.025 180 H GLY 19 H GLY 19 -12.215 -18.628 2.580 181 HA2 GLY 19 HA2 GLY 19 -10.830 -16.896 1.958 182 HA3 GLY 19 HA3 GLY 19 -10.355 -16.628 3.645 183 H VAL 20 H VAL 20 -10.071 -19.030 1.052 184 HA VAL 20 HA VAL 20 -7.232 -19.628 1.765 185 HB VAL 20 HB VAL 20 -8.923 -21.179 2.724 186 HG11 VAL 20 HG11 VAL 20 -9.465 -22.033 -0.142 187 HG12 VAL 20 HG12 VAL 20 -10.094 -22.795 1.334 188 HG13 VAL 20 HG13 VAL 20 -10.586 -21.147 0.913 189 HG21 VAL 20 HG21 VAL 20 -6.602 -21.941 2.310 190 HG22 VAL 20 HG22 VAL 20 -7.821 -23.227 2.310 191 HG23 VAL 20 HG23 VAL 20 -7.146 -22.665 0.777 192 H THR 21 H THR 21 -8.593 -18.047 -0.465 193 HA THR 21 HA THR 21 -7.553 -19.511 -2.860 194 HB THR 21 HB THR 21 -10.134 -17.984 -2.857 195 HG1 THR 21 HG1 THR 21 -11.205 -19.771 -2.330 196 HG21 THR 21 HG21 THR 21 -9.007 -20.221 -4.608 197 HG22 THR 21 HG22 THR 21 -10.633 -19.520 -4.771 198 HG23 THR 21 HG23 THR 21 -9.213 -18.519 -5.088 199 H LEU 22 H LEU 22 -6.974 -18.326 -4.663 200 HA LEU 22 HA LEU 22 -5.951 -15.658 -4.022 201 HB2 LEU 22 HB2 LEU 22 -4.231 -16.078 -5.591 202 HB3 LEU 22 HB3 LEU 22 -4.376 -17.479 -4.547 203 HG LEU 22 HG LEU 22 -5.752 -17.487 -7.263 204 HD11 LEU 22 HD11 LEU 22 -2.829 -18.151 -6.736 205 HD12 LEU 22 HD12 LEU 22 -3.715 -18.447 -8.251 206 HD13 LEU 22 HD13 LEU 22 -3.442 -16.789 -7.703 207 HD21 LEU 22 HD21 LEU 22 -6.227 -19.418 -5.799 208 HD22 LEU 22 HD22 LEU 22 -5.226 -19.910 -7.156 209 HD23 LEU 22 HD23 LEU 22 -4.484 -19.679 -5.561 210 H ALA 23 H ALA 23 -8.649 -15.757 -4.817 211 HA ALA 23 HA ALA 23 -8.588 -13.718 -6.931 212 HB1 ALA 23 HB1 ALA 23 -10.221 -16.276 -7.243 213 HB2 ALA 23 HB2 ALA 23 -10.311 -14.857 -8.310 214 HB3 ALA 23 HB3 ALA 23 -8.813 -15.804 -8.219 215 HA PRO 24 HA PRO 24 -11.720 -12.162 -4.237 216 HB2 PRO 24 HB2 PRO 24 -12.841 -10.134 -5.675 217 HB3 PRO 24 HB3 PRO 24 -11.154 -10.104 -5.082 218 HG2 PRO 24 HG2 PRO 24 -12.143 -10.815 -7.857 219 HG3 PRO 24 HG3 PRO 24 -10.778 -9.765 -7.390 220 HD2 PRO 24 HD2 PRO 24 -10.476 -12.414 -8.118 221 HD3 PRO 24 HD3 PRO 24 -9.386 -11.600 -6.961 222 H LEU 25 H LEU 25 -13.081 -12.549 -7.548 223 HA LEU 25 HA LEU 25 -15.117 -14.375 -6.604 224 HB2 LEU 25 HB2 LEU 25 -15.822 -11.693 -6.314 225 HB3 LEU 25 HB3 LEU 25 -16.529 -12.079 -7.869 226 HG LEU 25 HG LEU 25 -17.005 -13.602 -5.265 227 HD11 LEU 25 HD11 LEU 25 -18.799 -11.671 -6.796 228 HD12 LEU 25 HD12 LEU 25 -19.230 -12.561 -5.318 229 HD13 LEU 25 HD13 LEU 25 -17.964 -11.325 -5.265 230 HD21 LEU 25 HD21 LEU 25 -17.343 -15.097 -7.184 231 HD22 LEU 25 HD22 LEU 25 -18.900 -14.654 -6.482 232 HD23 LEU 25 HD23 LEU 25 -18.360 -13.876 -7.986 233 H SER 26 H SER 26 -14.466 -12.150 -9.153 234 HA SER 26 HA SER 26 -14.162 -14.206 -11.236 235 HB2 SER 26 HB2 SER 26 -16.632 -13.648 -11.167 236 HB3 SER 26 HB3 SER 26 -16.208 -11.979 -11.596 237 HG SER 26 HG SER 26 -16.734 -13.315 -13.427 238 H VAL 27 H VAL 27 -13.453 -13.199 -13.293 239 HA VAL 27 HA VAL 27 -11.756 -12.233 -14.414 240 HB VAL 27 HB VAL 27 -12.751 -9.855 -12.864 241 HG11 VAL 27 HG11 VAL 27 -10.716 -9.584 -15.100 242 HG12 VAL 27 HG12 VAL 27 -11.553 -8.300 -14.239 243 HG13 VAL 27 HG13 VAL 27 -10.379 -9.285 -13.374 244 HG21 VAL 27 HG21 VAL 27 -14.201 -10.811 -14.602 245 HG22 VAL 27 HG22 VAL 27 -13.645 -9.192 -15.040 246 HG23 VAL 27 HG23 VAL 27 -12.902 -10.616 -15.800 247 HA PRO 28 HA PRO 28 -7.978 -12.601 -11.984 248 HB2 PRO 28 HB2 PRO 28 -6.106 -11.539 -13.696 249 HB3 PRO 28 HB3 PRO 28 -6.848 -13.149 -13.893 250 HG2 PRO 28 HG2 PRO 28 -7.725 -10.553 -15.209 251 HG3 PRO 28 HG3 PRO 28 -7.372 -12.129 -15.996 252 HD2 PRO 28 HD2 PRO 28 -9.902 -11.487 -15.410 253 HD3 PRO 28 HD3 PRO 28 -9.320 -13.129 -15.063 254 H LYS 29 H LYS 29 -9.139 -11.134 -10.613 255 HA LYS 29 HA LYS 29 -9.289 -9.472 -9.126 256 HB2 LYS 29 HB2 LYS 29 -7.011 -10.340 -8.728 257 HB3 LYS 29 HB3 LYS 29 -6.338 -9.094 -9.768 258 HG2 LYS 29 HG2 LYS 29 -6.095 -8.634 -7.347 259 HG3 LYS 29 HG3 LYS 29 -6.924 -7.361 -8.196 260 HD2 LYS 29 HD2 LYS 29 -9.049 -8.014 -7.253 261 HD3 LYS 29 HD3 LYS 29 -8.379 -9.576 -6.702 262 HE2 LYS 29 HE2 LYS 29 -6.865 -8.367 -5.152 263 HE3 LYS 29 HE3 LYS 29 -7.583 -6.832 -5.651 264 HZ1 LYS 29 HZ1 LYS 29 -9.016 -9.076 -4.307 265 HZ2 LYS 29 HZ2 LYS 29 -8.675 -7.629 -3.637 266 HZ3 LYS 29 HZ3 LYS 29 -9.757 -7.714 -4.846 267 HA PRO 30 HA PRO 30 -10.040 -6.104 -12.131 268 HB2 PRO 30 HB2 PRO 30 -12.614 -5.492 -11.342 269 HB3 PRO 30 HB3 PRO 30 -12.201 -6.767 -12.535 270 HG2 PRO 30 HG2 PRO 30 -12.780 -7.063 -9.577 271 HG3 PRO 30 HG3 PRO 30 -13.379 -8.075 -10.930 272 HD2 PRO 30 HD2 PRO 30 -11.279 -8.806 -9.369 273 HD3 PRO 30 HD3 PRO 30 -11.316 -9.208 -11.107 274 H LYS 31 H LYS 31 -9.682 -4.001 -11.820 275 HA LYS 31 HA LYS 31 -8.476 -3.152 -9.512 276 HB2 LYS 31 HB2 LYS 31 -8.195 -0.993 -10.571 277 HB3 LYS 31 HB3 LYS 31 -7.994 -2.301 -11.717 278 HG2 LYS 31 HG2 LYS 31 -9.227 -0.901 -13.007 279 HG3 LYS 31 HG3 LYS 31 -10.551 -1.823 -12.302 280 HD2 LYS 31 HD2 LYS 31 -10.859 0.033 -10.607 281 HD3 LYS 31 HD3 LYS 31 -9.544 0.920 -11.402 282 HE2 LYS 31 HE2 LYS 31 -10.835 0.877 -13.536 283 HE3 LYS 31 HE3 LYS 31 -12.143 0.009 -12.723 284 HZ1 LYS 31 HZ1 LYS 31 -11.218 2.747 -12.021 285 HZ2 LYS 31 HZ2 LYS 31 -12.594 2.389 -12.818 286 HZ3 LYS 31 HZ3 LYS 31 -12.424 1.943 -11.259 287 H LEU 32 H LEU 32 -8.724 -1.493 -7.996 288 HA LEU 32 HA LEU 32 -11.478 -0.860 -7.123 289 HB2 LEU 32 HB2 LEU 32 -10.492 -3.008 -6.139 290 HB3 LEU 32 HB3 LEU 32 -9.169 -2.024 -5.507 291 HG LEU 32 HG LEU 32 -10.931 -0.657 -4.296 292 HD11 LEU 32 HD11 LEU 32 -12.628 -3.100 -5.006 293 HD12 LEU 32 HD12 LEU 32 -13.073 -1.865 -3.811 294 HD13 LEU 32 HD13 LEU 32 -12.943 -1.432 -5.522 295 HD21 LEU 32 HD21 LEU 32 -9.464 -2.277 -3.172 296 HD22 LEU 32 HD22 LEU 32 -11.078 -2.249 -2.434 297 HD23 LEU 32 HD23 LEU 32 -10.623 -3.577 -3.527 298 H GLU 33 H GLU 33 -11.651 1.045 -5.915 299 HA GLU 33 HA GLU 33 -9.251 2.675 -5.276 300 HB2 GLU 33 HB2 GLU 33 -11.558 3.503 -7.082 301 HB3 GLU 33 HB3 GLU 33 -10.607 4.698 -6.207 302 HG2 GLU 33 HG2 GLU 33 -9.284 2.723 -8.097 303 HG3 GLU 33 HG3 GLU 33 -9.996 4.229 -8.638 304 H GLU 34 H GLU 34 -9.937 1.645 -3.254 305 HA GLU 34 HA GLU 34 -11.958 3.306 -1.805 306 HB2 GLU 34 HB2 GLU 34 -11.884 0.279 -1.956 307 HB3 GLU 34 HB3 GLU 34 -12.622 1.154 -0.599 308 HG2 GLU 34 HG2 GLU 34 -13.956 2.470 -2.361 309 HG3 GLU 34 HG3 GLU 34 -13.444 1.235 -3.514 310 H LEU 35 H LEU 35 -10.122 4.453 -1.164 311 HA LEU 35 HA LEU 35 -9.063 3.447 1.440 312 HB2 LEU 35 HB2 LEU 35 -7.687 5.171 -0.657 313 HB3 LEU 35 HB3 LEU 35 -7.117 5.015 0.991 314 HG LEU 35 HG LEU 35 -7.506 2.374 -0.297 315 HD11 LEU 35 HD11 LEU 35 -5.383 4.214 -1.454 316 HD12 LEU 35 HD12 LEU 35 -5.618 2.484 -1.798 317 HD13 LEU 35 HD13 LEU 35 -6.841 3.653 -2.306 318 HD21 LEU 35 HD21 LEU 35 -6.290 2.688 1.822 319 HD22 LEU 35 HD22 LEU 35 -5.225 2.021 0.578 320 HD23 LEU 35 HD23 LEU 35 -5.107 3.737 0.996 321 H SER 36 H SER 36 -8.919 5.087 3.072 322 HA SER 36 HA SER 36 -10.857 7.320 2.863 323 HB2 SER 36 HB2 SER 36 -10.625 5.957 4.942 324 HB3 SER 36 HB3 SER 36 -8.984 6.603 5.143 325 HG SER 36 HG SER 36 -10.629 7.781 6.306 326 H GLU 37 H GLU 37 -10.008 9.577 3.607 327 HA GLU 37 HA GLU 37 -8.313 10.506 1.556 328 HB2 GLU 37 HB2 GLU 37 -9.977 11.860 2.766 329 HB3 GLU 37 HB3 GLU 37 -8.957 11.847 4.212 330 HG2 GLU 37 HG2 GLU 37 -7.184 13.070 2.987 331 HG3 GLU 37 HG3 GLU 37 -8.146 13.004 1.506 332 H GLN 38 H GLN 38 -7.392 9.912 4.980 333 HA GLN 38 HA GLN 38 -4.601 10.665 4.559 334 HB2 GLN 38 HB2 GLN 38 -5.828 10.753 6.776 335 HB3 GLN 38 HB3 GLN 38 -5.847 8.987 6.779 336 HG2 GLN 38 HG2 GLN 38 -3.247 9.151 6.572 337 HG3 GLN 38 HG3 GLN 38 -3.448 10.855 6.966 338 HE21 GLN 38 HE21 GLN 38 -4.022 7.965 9.853 339 HE22 GLN 38 HE22 GLN 38 -3.961 7.502 8.157 340 H GLN 39 H GLN 39 -6.396 7.584 4.645 341 HA GLN 39 HA GLN 39 -4.163 5.815 4.466 342 HB2 GLN 39 HB2 GLN 39 -7.007 5.448 3.500 343 HB3 GLN 39 HB3 GLN 39 -5.830 4.158 3.690 344 HG2 GLN 39 HG2 GLN 39 -6.831 5.907 5.992 345 HG3 GLN 39 HG3 GLN 39 -7.496 4.345 5.556 346 HE21 GLN 39 HE21 GLN 39 -4.971 2.498 7.230 347 HE22 GLN 39 HE22 GLN 39 -6.424 2.442 6.246 348 H LYS 40 H LYS 40 -6.126 7.385 1.939 349 HA LYS 40 HA LYS 40 -4.890 6.220 -0.358 350 HB2 LYS 40 HB2 LYS 40 -7.049 7.451 -0.306 351 HB3 LYS 40 HB3 LYS 40 -6.197 8.956 0.052 352 HG2 LYS 40 HG2 LYS 40 -4.997 8.787 -2.124 353 HG3 LYS 40 HG3 LYS 40 -5.880 7.297 -2.492 354 HD2 LYS 40 HD2 LYS 40 -7.167 10.015 -1.959 355 HD3 LYS 40 HD3 LYS 40 -6.798 9.376 -3.570 356 HE2 LYS 40 HE2 LYS 40 -8.284 7.419 -3.120 357 HE3 LYS 40 HE3 LYS 40 -8.699 8.107 -1.544 358 HZ1 LYS 40 HZ1 LYS 40 -9.242 9.401 -4.165 359 HZ2 LYS 40 HZ2 LYS 40 -10.360 8.680 -3.220 360 HZ3 LYS 40 HZ3 LYS 40 -9.621 10.044 -2.712 361 H ILE 41 H ILE 41 -4.060 9.222 1.494 362 HA ILE 41 HA ILE 41 -1.846 9.931 -0.198 363 HB ILE 41 HB ILE 41 -2.353 10.616 2.682 364 HG12 ILE 41 HG12 ILE 41 -2.759 12.437 0.258 365 HG13 ILE 41 HG13 ILE 41 -4.047 11.378 0.789 366 HG21 ILE 41 HG21 ILE 41 -0.397 11.870 0.718 367 HG22 ILE 41 HG22 ILE 41 -0.807 12.556 2.301 368 HG23 ILE 41 HG23 ILE 41 0.005 11.005 2.217 369 HD11 ILE 41 HD11 ILE 41 -2.798 13.598 2.451 370 HD12 ILE 41 HD12 ILE 41 -4.421 13.549 1.744 371 HD13 ILE 41 HD13 ILE 41 -3.997 12.426 3.049 372 H ILE 42 H ILE 42 -1.964 7.910 2.830 373 HA ILE 42 HA ILE 42 0.897 7.558 2.951 374 HB ILE 42 HB ILE 42 -1.323 5.734 3.932 375 HG12 ILE 42 HG12 ILE 42 0.372 7.553 5.684 376 HG13 ILE 42 HG13 ILE 42 -1.057 8.198 4.894 377 HG21 ILE 42 HG21 ILE 42 1.674 5.779 4.541 378 HG22 ILE 42 HG22 ILE 42 0.492 4.844 5.465 379 HG23 ILE 42 HG23 ILE 42 0.766 4.460 3.772 380 HD11 ILE 42 HD11 ILE 42 -1.068 5.790 6.757 381 HD12 ILE 42 HD12 ILE 42 -1.624 7.428 7.138 382 HD13 ILE 42 HD13 ILE 42 -2.471 6.466 5.903 383 H LEU 43 H LEU 43 -1.674 5.637 1.424 384 HA LEU 43 HA LEU 43 -0.089 3.572 0.310 385 HB2 LEU 43 HB2 LEU 43 -2.538 3.586 0.557 386 HB3 LEU 43 HB3 LEU 43 -2.699 4.860 -0.622 387 HG LEU 43 HG LEU 43 -3.341 2.559 -1.298 388 HD11 LEU 43 HD11 LEU 43 -1.231 3.809 -3.071 389 HD12 LEU 43 HD12 LEU 43 -2.491 2.668 -3.558 390 HD13 LEU 43 HD13 LEU 43 -2.934 4.281 -2.970 391 HD21 LEU 43 HD21 LEU 43 -1.590 1.285 -0.260 392 HD22 LEU 43 HD22 LEU 43 -1.582 0.963 -1.999 393 HD23 LEU 43 HD23 LEU 43 -0.331 2.007 -1.285 394 H ALA 44 H ALA 44 -1.144 6.659 -1.146 395 HA ALA 44 HA ALA 44 0.218 6.403 -3.618 396 HB1 ALA 44 HB1 ALA 44 -0.686 8.841 -2.044 397 HB2 ALA 44 HB2 ALA 44 -0.250 8.840 -3.770 398 HB3 ALA 44 HB3 ALA 44 -1.670 7.922 -3.211 399 H GLU 45 H GLU 45 1.208 8.327 -0.671 400 HA GLU 45 HA GLU 45 3.670 9.219 -1.784 401 HB2 GLU 45 HB2 GLU 45 2.755 8.789 1.080 402 HB3 GLU 45 HB3 GLU 45 4.318 9.493 0.684 403 HG2 GLU 45 HG2 GLU 45 1.684 10.670 -0.300 404 HG3 GLU 45 HG3 GLU 45 2.486 11.154 1.190 405 H TYR 46 H TYR 46 2.923 6.095 -0.258 406 HA TYR 46 HA TYR 46 5.659 5.263 0.099 407 HB2 TYR 46 HB2 TYR 46 3.719 4.306 1.262 408 HB3 TYR 46 HB3 TYR 46 3.073 3.699 -0.253 409 HD1 TYR 46 HD1 TYR 46 6.683 3.226 -0.061 410 HD2 TYR 46 HD2 TYR 46 2.865 1.641 1.211 411 HE1 TYR 46 HE1 TYR 46 7.759 1.070 0.479 412 HE2 TYR 46 HE2 TYR 46 3.954 -0.563 1.654 413 HH TYR 46 HH TYR 46 7.463 -1.076 1.251 414 H ILE 47 H ILE 47 3.277 4.435 -2.472 415 HA ILE 47 HA ILE 47 5.019 3.091 -4.226 416 HB ILE 47 HB ILE 47 2.366 4.507 -4.412 417 HG12 ILE 47 HG12 ILE 47 3.124 1.546 -4.431 418 HG13 ILE 47 HG13 ILE 47 2.615 2.420 -2.998 419 HG21 ILE 47 HG21 ILE 47 3.695 2.911 -6.619 420 HG22 ILE 47 HG22 ILE 47 1.962 3.309 -6.606 421 HG23 ILE 47 HG23 ILE 47 3.148 4.594 -6.697 422 HD11 ILE 47 HD11 ILE 47 0.887 1.759 -5.399 423 HD12 ILE 47 HD12 ILE 47 0.688 1.269 -3.708 424 HD13 ILE 47 HD13 ILE 47 0.443 2.967 -4.173 425 H ALA 48 H ALA 48 4.144 6.561 -3.933 426 HA ALA 48 HA ALA 48 5.436 7.395 -6.377 427 HB1 ALA 48 HB1 ALA 48 4.683 8.925 -3.856 428 HB2 ALA 48 HB2 ALA 48 5.100 9.651 -5.425 429 HB3 ALA 48 HB3 ALA 48 3.637 8.656 -5.267 430 H GLU 49 H GLU 49 6.618 6.856 -3.078 431 HA GLU 49 HA GLU 49 9.236 8.083 -3.627 432 HB2 GLU 49 HB2 GLU 49 8.095 8.181 -1.398 433 HB3 GLU 49 HB3 GLU 49 8.296 6.432 -1.257 434 HG2 GLU 49 HG2 GLU 49 10.017 7.448 0.022 435 HG3 GLU 49 HG3 GLU 49 10.800 6.781 -1.398 436 H VAL 50 H VAL 50 7.902 4.739 -3.356 437 HA VAL 50 HA VAL 50 10.608 3.710 -4.107 438 HB VAL 50 HB VAL 50 10.317 1.823 -2.944 439 HG11 VAL 50 HG11 VAL 50 8.838 3.806 -1.198 440 HG12 VAL 50 HG12 VAL 50 9.799 2.410 -0.679 441 HG13 VAL 50 HG13 VAL 50 10.595 3.779 -1.471 442 HG21 VAL 50 HG21 VAL 50 8.084 1.080 -3.679 443 HG22 VAL 50 HG22 VAL 50 8.254 0.978 -1.930 444 HG23 VAL 50 HG23 VAL 50 7.322 2.306 -2.652 445 H GLY 51 H GLY 51 7.642 4.194 -5.545 446 HA2 GLY 51 HA2 GLY 51 7.480 4.228 -7.848 447 HA3 GLY 51 HA3 GLY 51 8.898 3.188 -7.992 448 H LEU 52 H LEU 52 6.201 2.193 -6.043 449 HA LEU 52 HA LEU 52 5.052 0.309 -5.940 450 HB2 LEU 52 HB2 LEU 52 4.193 1.538 -8.292 451 HB3 LEU 52 HB3 LEU 52 4.510 -0.081 -8.848 452 HG LEU 52 HG LEU 52 2.709 0.628 -6.491 453 HD11 LEU 52 HD11 LEU 52 1.987 -0.130 -9.344 454 HD12 LEU 52 HD12 LEU 52 0.842 0.115 -8.005 455 HD13 LEU 52 HD13 LEU 52 1.803 1.476 -8.598 456 HD21 LEU 52 HD21 LEU 52 3.507 -1.659 -6.260 457 HD22 LEU 52 HD22 LEU 52 1.815 -1.670 -6.748 458 HD23 LEU 52 HD23 LEU 52 3.086 -2.011 -7.946 459 H GLN 53 H GLN 53 7.984 0.220 -7.041 460 HA GLN 53 HA GLN 53 8.157 -2.560 -8.101 461 HB2 GLN 53 HB2 GLN 53 10.003 -0.157 -8.031 462 HB3 GLN 53 HB3 GLN 53 10.624 -1.760 -8.427 463 HG2 GLN 53 HG2 GLN 53 9.435 -1.939 -10.414 464 HG3 GLN 53 HG3 GLN 53 8.183 -0.805 -9.912 465 HE21 GLN 53 HE21 GLN 53 9.828 2.105 -11.007 466 HE22 GLN 53 HE22 GLN 53 8.691 1.467 -9.818 467 H ASN 54 H ASN 54 8.539 -0.939 -5.144 468 HA ASN 54 HA ASN 54 10.186 -3.174 -4.005 469 HB2 ASN 54 HB2 ASN 54 10.478 -0.223 -3.387 470 HB3 ASN 54 HB3 ASN 54 11.431 -1.518 -2.690 471 HD21 ASN 54 HD21 ASN 54 12.470 -0.015 -6.308 472 HD22 ASN 54 HD22 ASN 54 11.025 0.572 -5.495 473 H ILE 55 H ILE 55 7.152 -2.099 -3.830 474 HA ILE 55 HA ILE 55 6.894 -1.953 -0.908 475 HB ILE 55 HB ILE 55 4.561 -1.735 -1.156 476 HG12 ILE 55 HG12 ILE 55 4.856 -2.252 -4.145 477 HG13 ILE 55 HG13 ILE 55 4.094 -3.333 -2.968 478 HG21 ILE 55 HG21 ILE 55 5.715 0.001 -3.361 479 HG22 ILE 55 HG22 ILE 55 4.464 0.396 -2.152 480 HG23 ILE 55 HG23 ILE 55 6.130 0.200 -1.650 481 HD11 ILE 55 HD11 ILE 55 3.138 -0.562 -3.747 482 HD12 ILE 55 HD12 ILE 55 2.366 -2.109 -4.110 483 HD13 ILE 55 HD13 ILE 55 2.436 -1.540 -2.422 484 H THR 56 H THR 56 5.762 -3.456 0.427 485 HA THR 56 HA THR 56 5.340 -6.171 -0.710 486 HB THR 56 HB THR 56 6.118 -6.835 1.766 487 HG1 THR 56 HG1 THR 56 7.921 -5.593 2.355 488 HG21 THR 56 HG21 THR 56 8.133 -6.143 -0.420 489 HG22 THR 56 HG22 THR 56 8.388 -7.286 0.919 490 HG23 THR 56 HG23 THR 56 7.190 -7.647 -0.334 491 H ALA 57 H ALA 57 3.601 -7.315 0.135 492 HA ALA 57 HA ALA 57 1.403 -5.862 1.157 493 HB1 ALA 57 HB1 ALA 57 1.984 -8.862 1.223 494 HB2 ALA 57 HB2 ALA 57 0.398 -8.082 1.409 495 HB3 ALA 57 HB3 ALA 57 1.255 -7.984 -0.141 496 H ILE 58 H ILE 58 4.028 -7.544 2.780 497 HA ILE 58 HA ILE 58 2.941 -7.648 5.450 498 HB ILE 58 HB ILE 58 5.784 -7.550 4.349 499 HG12 ILE 58 HG12 ILE 58 5.891 -9.917 5.182 500 HG13 ILE 58 HG13 ILE 58 4.190 -9.844 5.632 501 HG21 ILE 58 HG21 ILE 58 4.825 -7.925 7.241 502 HG22 ILE 58 HG22 ILE 58 6.478 -8.276 6.686 503 HG23 ILE 58 HG23 ILE 58 5.868 -6.628 6.629 504 HD11 ILE 58 HD11 ILE 58 5.207 -9.545 2.772 505 HD12 ILE 58 HD12 ILE 58 4.713 -11.082 3.506 506 HD13 ILE 58 HD13 ILE 58 3.518 -9.801 3.303 507 H THR 59 H THR 59 5.182 -5.312 3.841 508 HA THR 59 HA THR 59 5.241 -3.520 6.087 509 HB THR 59 HB THR 59 6.046 -3.250 3.176 510 HG1 THR 59 HG1 THR 59 7.989 -3.841 3.906 511 HG21 THR 59 HG21 THR 59 6.692 -1.448 5.557 512 HG22 THR 59 HG22 THR 59 7.536 -1.416 3.984 513 HG23 THR 59 HG23 THR 59 5.822 -1.003 4.067 514 H LEU 60 H LEU 60 3.518 -3.429 2.933 515 HA LEU 60 HA LEU 60 2.080 -1.071 3.377 516 HB2 LEU 60 HB2 LEU 60 2.431 -2.444 1.252 517 HB3 LEU 60 HB3 LEU 60 1.217 -3.562 1.842 518 HG LEU 60 HG LEU 60 -0.449 -1.643 1.777 519 HD11 LEU 60 HD11 LEU 60 1.831 -0.237 0.335 520 HD12 LEU 60 HD12 LEU 60 0.181 0.363 0.520 521 HD13 LEU 60 HD13 LEU 60 1.199 0.225 1.942 522 HD21 LEU 60 HD21 LEU 60 -0.256 -3.238 -0.078 523 HD22 LEU 60 HD22 LEU 60 -0.643 -1.612 -0.669 524 HD23 LEU 60 HD23 LEU 60 1.011 -2.243 -0.814 525 H SER 61 H SER 61 1.272 -4.431 4.494 526 HA SER 61 HA SER 61 -1.204 -3.734 5.608 527 HB2 SER 61 HB2 SER 61 -1.273 -5.757 6.705 528 HB3 SER 61 HB3 SER 61 -0.399 -6.052 5.221 529 HG SER 61 HG SER 61 1.561 -5.814 6.554 530 H LYS 62 H LYS 62 1.879 -2.865 6.648 531 HA LYS 62 HA LYS 62 0.957 -2.221 9.395 532 HB2 LYS 62 HB2 LYS 62 3.667 -2.907 8.269 533 HB3 LYS 62 HB3 LYS 62 3.590 -1.823 9.650 534 HG2 LYS 62 HG2 LYS 62 3.940 -4.120 10.358 535 HG3 LYS 62 HG3 LYS 62 2.428 -3.463 11.005 536 HD2 LYS 62 HD2 LYS 62 1.113 -4.728 9.430 537 HD3 LYS 62 HD3 LYS 62 2.573 -5.186 8.531 538 HE2 LYS 62 HE2 LYS 62 3.350 -6.570 10.354 539 HE3 LYS 62 HE3 LYS 62 1.970 -6.080 11.361 540 HZ1 LYS 62 HZ1 LYS 62 1.719 -7.483 8.750 541 HZ2 LYS 62 HZ2 LYS 62 1.595 -8.228 10.210 542 HZ3 LYS 62 HZ3 LYS 62 0.493 -7.109 9.741 543 H LYS 63 H LYS 63 2.302 -0.623 6.449 544 HA LYS 63 HA LYS 63 2.678 1.930 7.686 545 HB2 LYS 63 HB2 LYS 63 2.129 1.016 4.831 546 HB3 LYS 63 HB3 LYS 63 2.542 2.690 5.289 547 HG2 LYS 63 HG2 LYS 63 4.622 1.557 6.447 548 HG3 LYS 63 HG3 LYS 63 4.250 0.183 5.420 549 HD2 LYS 63 HD2 LYS 63 5.357 1.123 3.717 550 HD3 LYS 63 HD3 LYS 63 4.177 2.426 3.684 551 HE2 LYS 63 HE2 LYS 63 6.246 3.478 3.936 552 HE3 LYS 63 HE3 LYS 63 5.476 3.515 5.546 553 HZ1 LYS 63 HZ1 LYS 63 7.597 1.611 4.687 554 HZ2 LYS 63 HZ2 LYS 63 7.827 2.885 5.677 555 HZ3 LYS 63 HZ3 LYS 63 6.906 1.636 6.173 556 H LEU 64 H LEU 64 -0.191 0.331 6.466 557 HA LEU 64 HA LEU 64 -1.851 2.733 7.112 558 HB2 LEU 64 HB2 LEU 64 -2.282 0.479 5.130 559 HB3 LEU 64 HB3 LEU 64 -3.469 1.715 5.509 560 HG LEU 64 HG LEU 64 -1.292 3.273 4.883 561 HD11 LEU 64 HD11 LEU 64 -1.228 0.890 2.970 562 HD12 LEU 64 HD12 LEU 64 -0.274 2.387 2.834 563 HD13 LEU 64 HD13 LEU 64 0.026 1.247 4.156 564 HD21 LEU 64 HD21 LEU 64 -3.563 3.525 4.014 565 HD22 LEU 64 HD22 LEU 64 -2.347 3.613 2.736 566 HD23 LEU 64 HD23 LEU 64 -3.324 2.135 2.926 567 H ASN 65 H ASN 65 -1.033 0.029 8.710 568 HA ASN 65 HA ASN 65 -1.928 -1.300 10.302 569 HB2 ASN 65 HB2 ASN 65 -3.867 0.996 10.748 570 HB3 ASN 65 HB3 ASN 65 -3.402 -0.237 11.911 571 HD21 ASN 65 HD21 ASN 65 -1.040 3.017 11.389 572 HD22 ASN 65 HD22 ASN 65 -2.507 2.789 10.445 573 H ILE 66 H ILE 66 -2.581 -2.593 8.294 574 HA ILE 66 HA ILE 66 -5.492 -3.269 8.314 575 HB ILE 66 HB ILE 66 -4.946 -3.539 5.697 576 HG12 ILE 66 HG12 ILE 66 -3.425 -0.992 6.256 577 HG13 ILE 66 HG13 ILE 66 -2.552 -2.478 6.152 578 HG21 ILE 66 HG21 ILE 66 -5.762 -0.981 7.134 579 HG22 ILE 66 HG22 ILE 66 -6.025 -1.270 5.412 580 HG23 ILE 66 HG23 ILE 66 -6.821 -2.309 6.612 581 HD11 ILE 66 HD11 ILE 66 -4.179 -1.151 3.964 582 HD12 ILE 66 HD12 ILE 66 -2.442 -1.526 3.985 583 HD13 ILE 66 HD13 ILE 66 -3.630 -2.837 3.847 584 H THR 67 H THR 67 -5.785 -5.343 6.810 585 HA THR 67 HA THR 67 -3.959 -7.396 7.859 586 HB THR 67 HB THR 67 -5.359 -9.028 7.153 587 HG1 THR 67 HG1 THR 67 -6.956 -8.691 5.537 588 HG21 THR 67 HG21 THR 67 -7.385 -6.764 7.365 589 HG22 THR 67 HG22 THR 67 -7.634 -8.487 7.709 590 HG23 THR 67 HG23 THR 67 -6.581 -7.527 8.762 591 H VAL 68 H VAL 68 -2.834 -8.949 6.492 592 HA VAL 68 HA VAL 68 -1.306 -7.750 4.346 593 HB VAL 68 HB VAL 68 -1.612 -10.651 5.200 594 HG11 VAL 68 HG11 VAL 68 0.472 -9.409 3.352 595 HG12 VAL 68 HG12 VAL 68 0.507 -11.065 3.986 596 HG13 VAL 68 HG13 VAL 68 -0.766 -10.592 2.860 597 HG21 VAL 68 HG21 VAL 68 -0.583 -9.173 6.920 598 HG22 VAL 68 HG22 VAL 68 0.615 -10.277 6.238 599 HG23 VAL 68 HG23 VAL 68 0.576 -8.578 5.716 600 H GLU 69 H GLU 69 -4.433 -9.371 4.359 601 HA GLU 69 HA GLU 69 -4.299 -10.055 1.479 602 HB2 GLU 69 HB2 GLU 69 -6.540 -10.220 3.538 603 HB3 GLU 69 HB3 GLU 69 -6.685 -10.696 1.840 604 HG2 GLU 69 HG2 GLU 69 -4.885 -12.376 2.143 605 HG3 GLU 69 HG3 GLU 69 -4.742 -11.928 3.844 606 H LYS 70 H LYS 70 -5.741 -7.639 3.659 607 HA LYS 70 HA LYS 70 -7.178 -6.201 1.685 608 HB2 LYS 70 HB2 LYS 70 -7.439 -6.259 4.209 609 HB3 LYS 70 HB3 LYS 70 -6.058 -5.179 4.338 610 HG2 LYS 70 HG2 LYS 70 -8.627 -4.595 2.822 611 HG3 LYS 70 HG3 LYS 70 -8.333 -4.199 4.521 612 HD2 LYS 70 HD2 LYS 70 -6.349 -2.804 3.717 613 HD3 LYS 70 HD3 LYS 70 -7.025 -2.933 2.091 614 HE2 LYS 70 HE2 LYS 70 -8.746 -2.068 4.445 615 HE3 LYS 70 HE3 LYS 70 -7.693 -0.904 3.650 616 HZ1 LYS 70 HZ1 LYS 70 -9.768 -2.465 2.206 617 HZ2 LYS 70 HZ2 LYS 70 -9.946 -0.918 2.704 618 HZ3 LYS 70 HZ3 LYS 70 -8.822 -1.268 1.582 619 H ALA 71 H ALA 71 -4.002 -5.701 3.123 620 HA ALA 71 HA ALA 71 -3.050 -3.560 1.513 621 HB1 ALA 71 HB1 ALA 71 -1.511 -5.905 2.722 622 HB2 ALA 71 HB2 ALA 71 -0.826 -4.359 2.196 623 HB3 ALA 71 HB3 ALA 71 -1.949 -4.408 3.562 624 H LYS 72 H LYS 72 -2.757 -7.123 0.884 625 HA LYS 72 HA LYS 72 -1.230 -6.794 -1.523 626 HB2 LYS 72 HB2 LYS 72 -1.136 -8.787 -0.069 627 HB3 LYS 72 HB3 LYS 72 -2.841 -9.128 -0.364 628 HG2 LYS 72 HG2 LYS 72 -2.428 -9.705 -2.644 629 HG3 LYS 72 HG3 LYS 72 -0.755 -9.122 -2.575 630 HD2 LYS 72 HD2 LYS 72 -1.763 -11.364 -0.761 631 HD3 LYS 72 HD3 LYS 72 -1.180 -11.674 -2.411 632 HE2 LYS 72 HE2 LYS 72 0.979 -10.525 -1.799 633 HE3 LYS 72 HE3 LYS 72 0.400 -10.409 -0.130 634 HZ1 LYS 72 HZ1 LYS 72 0.804 -12.941 -1.638 635 HZ2 LYS 72 HZ2 LYS 72 1.781 -12.386 -0.458 636 HZ3 LYS 72 HZ3 LYS 72 0.258 -12.855 -0.099 637 H ASN 73 H ASN 73 -4.656 -6.868 -0.848 638 HA ASN 73 HA ASN 73 -5.657 -7.266 -3.389 639 HB2 ASN 73 HB2 ASN 73 -7.490 -7.039 -2.096 640 HB3 ASN 73 HB3 ASN 73 -6.599 -6.234 -0.845 641 HD21 ASN 73 HD21 ASN 73 -7.724 -3.002 -1.638 642 HD22 ASN 73 HD22 ASN 73 -6.653 -3.991 -0.648 643 H TYR 74 H TYR 74 -4.176 -4.258 -2.106 644 HA TYR 74 HA TYR 74 -4.733 -2.647 -4.420 645 HB2 TYR 74 HB2 TYR 74 -2.544 -2.384 -2.328 646 HB3 TYR 74 HB3 TYR 74 -3.106 -1.117 -3.412 647 HD1 TYR 74 HD1 TYR 74 -3.083 -1.926 -0.163 648 HD2 TYR 74 HD2 TYR 74 -6.005 -1.115 -3.237 649 HE1 TYR 74 HE1 TYR 74 -4.663 -1.060 1.564 650 HE2 TYR 74 HE2 TYR 74 -7.593 -0.272 -1.498 651 HH TYR 74 HH TYR 74 -6.656 -0.028 1.937 652 H ILE 75 H ILE 75 -1.916 -4.579 -3.320 653 HA ILE 75 HA ILE 75 -0.146 -3.867 -5.441 654 HB ILE 75 HB ILE 75 -0.178 -6.409 -3.757 655 HG12 ILE 75 HG12 ILE 75 1.072 -3.684 -3.192 656 HG13 ILE 75 HG13 ILE 75 -0.265 -4.410 -2.317 657 HG21 ILE 75 HG21 ILE 75 2.127 -5.014 -5.197 658 HG22 ILE 75 HG22 ILE 75 2.257 -6.473 -4.189 659 HG23 ILE 75 HG23 ILE 75 1.372 -6.548 -5.691 660 HD11 ILE 75 HD11 ILE 75 2.609 -5.353 -2.277 661 HD12 ILE 75 HD12 ILE 75 1.650 -4.667 -0.961 662 HD13 ILE 75 HD13 ILE 75 1.232 -6.268 -1.607 663 H LYS 76 H LYS 76 -2.651 -6.353 -5.239 664 HA LYS 76 HA LYS 76 -1.929 -7.588 -7.799 665 HB2 LYS 76 HB2 LYS 76 -2.740 -8.732 -5.627 666 HB3 LYS 76 HB3 LYS 76 -4.326 -8.098 -6.008 667 HG2 LYS 76 HG2 LYS 76 -4.365 -10.293 -6.836 668 HG3 LYS 76 HG3 LYS 76 -4.110 -9.321 -8.273 669 HD2 LYS 76 HD2 LYS 76 -2.679 -11.213 -8.448 670 HD3 LYS 76 HD3 LYS 76 -1.621 -9.839 -8.101 671 HE2 LYS 76 HE2 LYS 76 -1.535 -10.506 -5.708 672 HE3 LYS 76 HE3 LYS 76 -2.674 -11.822 -6.023 673 HZ1 LYS 76 HZ1 LYS 76 0.050 -11.613 -7.195 674 HZ2 LYS 76 HZ2 LYS 76 -0.391 -12.633 -6.000 675 HZ3 LYS 76 HZ3 LYS 76 -1.008 -12.822 -7.496 676 H ASN 77 H ASN 77 -4.075 -5.045 -6.778 677 HA ASN 77 HA ASN 77 -5.738 -5.094 -9.232 678 HB2 ASN 77 HB2 ASN 77 -5.596 -3.378 -6.710 679 HB3 ASN 77 HB3 ASN 77 -6.445 -2.811 -8.134 680 HD21 ASN 77 HD21 ASN 77 -8.681 -4.848 -5.791 681 HD22 ASN 77 HD22 ASN 77 -7.278 -3.929 -5.303 682 H SER 78 H SER 78 -3.279 -3.063 -7.622 683 HA SER 78 HA SER 78 -2.656 -1.797 -10.244 684 HB2 SER 78 HB2 SER 78 -2.445 -0.625 -7.451 685 HB3 SER 78 HB3 SER 78 -1.915 0.178 -8.942 686 HG SER 78 HG SER 78 -4.046 0.801 -8.321 687 H ASN 79 H ASN 79 -0.900 -2.511 -11.120 688 HA ASN 79 HA ASN 79 1.573 -2.711 -9.510 689 HB2 ASN 79 HB2 ASN 79 0.158 -4.941 -9.630 690 HB3 ASN 79 HB3 ASN 79 0.829 -5.102 -11.238 691 HD21 ASN 79 HD21 ASN 79 3.111 -5.618 -7.909 692 HD22 ASN 79 HD22 ASN 79 1.390 -5.180 -7.867 693 H ARG 80 H ARG 80 0.667 -3.787 -12.812 694 HA ARG 80 HA ARG 80 3.061 -2.556 -13.987 695 HB2 ARG 80 HB2 ARG 80 0.719 -4.169 -15.070 696 HB3 ARG 80 HB3 ARG 80 1.860 -3.374 -16.144 697 HG2 ARG 80 HG2 ARG 80 2.518 -5.649 -15.894 698 HG3 ARG 80 HG3 ARG 80 3.744 -4.606 -15.180 699 HD2 ARG 80 HD2 ARG 80 2.990 -5.181 -12.932 700 HD3 ARG 80 HD3 ARG 80 1.631 -6.112 -13.582 701 HE ARG 80 HE ARG 80 3.280 -7.651 -14.615 702 HH11 ARG 80 HH11 ARG 80 5.081 -8.901 -14.306 703 HH12 ARG 80 HH12 ARG 80 6.147 -8.567 -12.973 704 HH21 ARG 80 HH21 ARG 80 4.357 -5.948 -11.724 705 HH22 ARG 80 HH22 ARG 80 5.816 -6.892 -11.636 706 H LEU 81 H LEU 81 -0.101 -1.466 -13.382 707 HA LEU 81 HA LEU 81 0.077 0.821 -15.251 708 HB2 LEU 81 HB2 LEU 81 -1.941 -0.689 -15.097 709 HB3 LEU 81 HB3 LEU 81 -2.218 -0.081 -13.477 710 HG LEU 81 HG LEU 81 -1.930 2.207 -15.254 711 HD11 LEU 81 HD11 LEU 81 -3.956 0.164 -16.234 712 HD12 LEU 81 HD12 LEU 81 -3.783 1.844 -16.794 713 HD13 LEU 81 HD13 LEU 81 -2.484 0.676 -17.093 714 HD21 LEU 81 HD21 LEU 81 -3.254 2.128 -13.148 715 HD22 LEU 81 HD22 LEU 81 -4.218 2.692 -14.525 716 HD23 LEU 81 HD23 LEU 81 -4.411 1.026 -13.926 717 H GLY 82 H GLY 82 1.792 0.550 -12.747 718 HA2 GLY 82 HA2 GLY 82 0.905 2.562 -10.874 719 HA3 GLY 82 HA3 GLY 82 2.521 1.856 -10.982 720 H ARG 83 H ARG 83 4.150 3.095 -11.852 721 HA ARG 83 HA ARG 83 3.497 5.468 -13.524 722 HB2 ARG 83 HB2 ARG 83 5.176 5.565 -10.989 723 HB3 ARG 83 HB3 ARG 83 5.300 6.762 -12.292 724 HG2 ARG 83 HG2 ARG 83 2.844 7.195 -12.107 725 HG3 ARG 83 HG3 ARG 83 2.790 6.153 -10.673 726 HD2 ARG 83 HD2 ARG 83 4.243 7.614 -9.445 727 HD3 ARG 83 HD3 ARG 83 4.686 8.526 -10.887 728 HE ARG 83 HE ARG 83 2.234 8.807 -9.288 729 HH11 ARG 83 HH11 ARG 83 0.854 10.498 -9.717 730 HH12 ARG 83 HH12 ARG 83 1.038 11.421 -11.179 731 HH21 ARG 83 HH21 ARG 83 3.721 9.654 -12.357 732 HH22 ARG 83 HH22 ARG 83 2.607 10.962 -12.633 733 H THR 84 H THR 84 5.216 6.364 -14.644 734 HA THR 84 HA THR 84 6.753 4.306 -16.024 735 HB THR 84 HB THR 84 5.204 5.816 -17.144 736 HG1 THR 84 HG1 THR 84 6.517 6.263 -18.884 737 HG21 THR 84 HG21 THR 84 7.214 8.055 -16.683 738 HG22 THR 84 HG22 THR 84 5.705 8.129 -17.612 739 HG23 THR 84 HG23 THR 84 5.652 7.906 -15.856 740 H ASN 85 H ASN 85 7.889 4.782 -13.514 741 HA ASN 85 HA ASN 85 10.544 5.977 -14.210 742 HB2 ASN 85 HB2 ASN 85 8.995 6.309 -11.610 743 HB3 ASN 85 HB3 ASN 85 10.701 6.694 -11.804 744 HD21 ASN 85 HD21 ASN 85 7.969 9.363 -13.102 745 HD22 ASN 85 HD22 ASN 85 7.491 7.879 -12.289 746 H ASN 86 H ASN 86 12.316 4.865 -13.587 747 HA ASN 86 HA ASN 86 12.045 2.364 -12.007 748 HB2 ASN 86 HB2 ASN 86 11.748 1.673 -14.301 749 HB3 ASN 86 HB3 ASN 86 13.141 2.632 -14.827 750 HD21 ASN 86 HD21 ASN 86 13.880 -0.903 -12.857 751 HD22 ASN 86 HD22 ASN 86 12.371 -0.063 -12.505 752 H LEU 87 H LEU 87 14.017 1.540 -11.211 753 HA LEU 87 HA LEU 87 16.019 3.641 -10.544 754 HB2 LEU 87 HB2 LEU 87 14.479 1.598 -8.926 755 HB3 LEU 87 HB3 LEU 87 16.082 2.089 -8.401 756 HG LEU 87 HG LEU 87 15.347 4.471 -8.330 757 HD11 LEU 87 HD11 LEU 87 12.578 3.288 -8.830 758 HD12 LEU 87 HD12 LEU 87 12.876 4.906 -8.155 759 HD13 LEU 87 HD13 LEU 87 13.410 4.539 -9.789 760 HD21 LEU 87 HD21 LEU 87 15.392 3.028 -6.326 761 HD22 LEU 87 HD22 LEU 87 14.088 4.220 -6.238 762 HD23 LEU 87 HD23 LEU 87 13.715 2.528 -6.643 763 H LYS 88 H LYS 88 18.057 2.768 -9.788 764 HA LYS 88 HA LYS 88 19.022 0.430 -11.387 765 HB2 LYS 88 HB2 LYS 88 21.105 1.806 -11.731 766 HB3 LYS 88 HB3 LYS 88 19.662 2.367 -12.573 767 HG2 LYS 88 HG2 LYS 88 19.297 4.149 -10.989 768 HG3 LYS 88 HG3 LYS 88 20.568 3.535 -9.909 769 HD2 LYS 88 HD2 LYS 88 22.270 3.967 -11.667 770 HD3 LYS 88 HD3 LYS 88 20.999 4.568 -12.754 771 HE2 LYS 88 HE2 LYS 88 20.464 6.368 -11.129 772 HE3 LYS 88 HE3 LYS 88 21.719 5.765 -10.038 773 HZ1 LYS 88 HZ1 LYS 88 22.208 6.813 -12.778 774 HZ2 LYS 88 HZ2 LYS 88 22.532 7.612 -11.393 775 HZ3 LYS 88 HZ3 LYS 88 23.366 6.261 -11.766 776 H THR 89 H THR 89 18.256 0.771 -8.487 777 HA THR 89 HA THR 89 20.422 -0.834 -7.477 778 HB THR 89 HB THR 89 21.181 1.399 -6.816 779 HG1 THR 89 HG1 THR 89 21.513 0.759 -4.672 780 HG21 THR 89 HG21 THR 89 18.775 1.505 -4.946 781 HG22 THR 89 HG22 THR 89 20.091 2.690 -5.090 782 HG23 THR 89 HG23 THR 89 18.940 2.491 -6.420 783 H ILE 90 H ILE 90 19.489 -2.515 -6.729 784 HA ILE 90 HA ILE 90 16.965 -2.408 -5.180 785 HB ILE 90 HB ILE 90 16.420 -4.594 -6.454 786 HG12 ILE 90 HG12 ILE 90 18.695 -4.713 -7.614 787 HG13 ILE 90 HG13 ILE 90 17.234 -5.177 -8.458 788 HG21 ILE 90 HG21 ILE 90 16.146 -1.947 -7.903 789 HG22 ILE 90 HG22 ILE 90 15.181 -3.413 -8.185 790 HG23 ILE 90 HG23 ILE 90 15.089 -2.576 -6.628 791 HD11 ILE 90 HD11 ILE 90 18.675 -2.526 -8.898 792 HD12 ILE 90 HD12 ILE 90 18.767 -3.963 -9.920 793 HD13 ILE 90 HD13 ILE 90 17.232 -3.105 -9.759 794 H GLY 91 H GLY 91 19.978 -2.965 -4.618 795 HA2 GLY 91 HA2 GLY 91 21.186 -4.350 -3.158 796 HA3 GLY 91 HA3 GLY 91 19.750 -5.360 -2.921 797 H ILE 92 H ILE 92 19.744 -5.326 -6.059 798 HA ILE 92 HA ILE 92 19.868 -6.941 -7.579 799 HB ILE 92 HB ILE 92 22.674 -7.599 -6.629 800 HG12 ILE 92 HG12 ILE 92 23.202 -6.244 -8.820 801 HG13 ILE 92 HG13 ILE 92 21.638 -5.481 -8.565 802 HG21 ILE 92 HG21 ILE 92 21.235 -8.061 -9.286 803 HG22 ILE 92 HG22 ILE 92 22.900 -8.531 -8.888 804 HG23 ILE 92 HG23 ILE 92 21.551 -9.315 -8.072 805 HD11 ILE 92 HD11 ILE 92 23.921 -5.494 -6.532 806 HD12 ILE 92 HD12 ILE 92 23.638 -4.207 -7.719 807 HD13 ILE 92 HD13 ILE 92 22.442 -4.504 -6.459 808 H LEU 93 H LEU 93 18.247 -8.172 -6.969 809 HA LEU 93 HA LEU 93 18.123 -9.760 -4.642 810 HB2 LEU 93 HB2 LEU 93 16.235 -8.676 -5.859 811 HB3 LEU 93 HB3 LEU 93 16.413 -9.852 -7.156 812 HG LEU 93 HG LEU 93 15.851 -11.684 -5.494 813 HD11 LEU 93 HD11 LEU 93 15.229 -9.326 -3.665 814 HD12 LEU 93 HD12 LEU 93 14.754 -11.012 -3.376 815 HD13 LEU 93 HD13 LEU 93 16.464 -10.576 -3.383 816 HD21 LEU 93 HD21 LEU 93 14.147 -10.708 -6.978 817 HD22 LEU 93 HD22 LEU 93 13.457 -11.155 -5.410 818 HD23 LEU 93 HD23 LEU 93 13.804 -9.448 -5.772 819 H GLN 94 H GLN 94 20.161 -10.929 -4.886 820 HA GLN 94 HA GLN 94 20.147 -13.333 -6.625 821 HB2 GLN 94 HB2 GLN 94 22.166 -12.234 -4.636 822 HB3 GLN 94 HB3 GLN 94 22.366 -13.754 -5.525 823 HG2 GLN 94 HG2 GLN 94 22.176 -12.501 -7.673 824 HG3 GLN 94 HG3 GLN 94 22.093 -10.997 -6.752 825 HE21 GLN 94 HE21 GLN 94 25.621 -11.243 -7.714 826 HE22 GLN 94 HE22 GLN 94 24.073 -10.884 -8.466 827 H GLU 95 H GLU 95 20.089 -12.690 -3.097 828 HA GLU 95 HA GLU 95 19.197 -15.484 -2.538 829 HB2 GLU 95 HB2 GLU 95 21.617 -14.079 -1.318 830 HB3 GLU 95 HB3 GLU 95 20.931 -15.599 -0.741 831 HG2 GLU 95 HG2 GLU 95 21.514 -16.739 -2.807 832 HG3 GLU 95 HG3 GLU 95 22.049 -15.234 -3.553 833 H GLU 96 H GLU 96 18.007 -15.727 -0.635 834 HA GLU 96 HA GLU 96 17.167 -13.232 0.777 835 HB2 GLU 96 HB2 GLU 96 15.408 -14.589 -0.374 836 HB3 GLU 96 HB3 GLU 96 15.816 -15.952 0.662 837 HG2 GLU 96 HG2 GLU 96 13.873 -14.904 1.573 838 HG3 GLU 96 HG3 GLU 96 15.200 -14.550 2.670 839 H VAL 97 H VAL 97 18.645 -12.863 2.243 840 HA VAL 97 HA VAL 97 19.252 -14.972 4.258 841 HB VAL 97 HB VAL 97 21.176 -13.188 2.760 842 HG11 VAL 97 HG11 VAL 97 21.680 -14.587 5.411 843 HG12 VAL 97 HG12 VAL 97 22.967 -14.039 4.310 844 HG13 VAL 97 HG13 VAL 97 21.878 -12.852 5.025 845 HG21 VAL 97 HG21 VAL 97 20.695 -15.422 1.823 846 HG22 VAL 97 HG22 VAL 97 22.364 -15.314 2.397 847 HG23 VAL 97 HG23 VAL 97 21.146 -16.174 3.369 848 H SER 98 H SER 98 19.923 -11.559 3.818 849 HA SER 98 HA SER 98 19.947 -9.778 5.147 850 HB2 SER 98 HB2 SER 98 17.840 -9.050 5.812 851 HB3 SER 98 HB3 SER 98 17.652 -10.123 4.406 852 HG SER 98 HG SER 98 16.073 -10.547 6.014 853 H SER 99 H SER 99 20.788 -12.356 6.741 854 HA SER 99 HA SER 99 20.888 -11.022 9.430 855 HB2 SER 99 HB2 SER 99 19.447 -13.022 9.316 856 HB3 SER 99 HB3 SER 99 20.833 -13.987 8.778 857 HG SER 99 HG SER 99 20.464 -14.108 11.060 858 H MET 100 H MET 100 22.753 -13.191 7.243 859 HA MET 100 HA MET 100 25.271 -12.012 8.283 860 HB2 MET 100 HB2 MET 100 24.500 -14.362 9.271 861 HB3 MET 100 HB3 MET 100 25.214 -14.976 7.787 862 HG2 MET 100 HG2 MET 100 26.523 -13.222 9.909 863 HG3 MET 100 HG3 MET 100 26.792 -14.943 9.705 864 HE1 MET 100 HE1 MET 100 27.346 -15.505 6.710 865 HE2 MET 100 HE2 MET 100 29.094 -15.215 6.613 866 HE3 MET 100 HE3 MET 100 28.411 -16.038 8.030 867 H GLU 101 H GLU 101 24.503 -10.897 6.293 868 HA GLU 101 HA GLU 101 24.796 -12.238 3.726 869 HB2 GLU 101 HB2 GLU 101 23.036 -10.540 4.425 870 HB3 GLU 101 HB3 GLU 101 24.260 -9.290 4.211 871 HG2 GLU 101 HG2 GLU 101 24.492 -9.954 1.818 872 HG3 GLU 101 HG3 GLU 101 23.358 -11.283 2.073 873 H ALA 102 H ALA 102 27.177 -12.632 4.672 874 HA ALA 102 HA ALA 102 29.127 -10.550 4.116 875 HB1 ALA 102 HB1 ALA 102 29.423 -13.519 4.718 876 HB2 ALA 102 HB2 ALA 102 30.747 -12.335 4.670 877 HB3 ALA 102 HB3 ALA 102 29.469 -12.180 5.887 878 H LYS 103 H LYS 103 28.943 -9.895 2.023 879 HA LYS 103 HA LYS 103 29.782 -11.761 -0.186 880 HB2 LYS 103 HB2 LYS 103 27.735 -9.506 -0.211 881 HB3 LYS 103 HB3 LYS 103 28.300 -10.334 -1.655 882 HG2 LYS 103 HG2 LYS 103 27.017 -11.891 0.625 883 HG3 LYS 103 HG3 LYS 103 26.026 -11.001 -0.504 884 HD2 LYS 103 HD2 LYS 103 28.035 -13.071 -1.483 885 HD3 LYS 103 HD3 LYS 103 26.403 -13.490 -0.941 886 HE2 LYS 103 HE2 LYS 103 25.521 -11.721 -2.563 887 HE3 LYS 103 HE3 LYS 103 27.143 -11.663 -3.263 888 HZ1 LYS 103 HZ1 LYS 103 25.439 -14.097 -3.066 889 HZ2 LYS 103 HZ2 LYS 103 25.641 -13.210 -4.423 890 HZ3 LYS 103 HZ3 LYS 103 26.909 -14.038 -3.780 891 H SER 104 H SER 104 31.840 -11.214 -0.641 892 HA SER 104 HA SER 104 32.502 -8.429 -1.369 893 HB2 SER 104 HB2 SER 104 32.904 -8.605 1.102 894 HB3 SER 104 HB3 SER 104 34.123 -9.847 0.779 895 HG SER 104 HG SER 104 35.021 -7.721 0.932 896 H MET 105 H MET 105 32.595 -9.396 -3.438 897 HA MET 105 HA MET 105 35.306 -10.066 -4.184 898 HB2 MET 105 HB2 MET 105 34.885 -12.112 -5.394 899 HB3 MET 105 HB3 MET 105 34.412 -12.363 -3.715 900 HG2 MET 105 HG2 MET 105 32.026 -11.964 -4.373 901 HG3 MET 105 HG3 MET 105 32.544 -11.799 -6.058 902 HE1 MET 105 HE1 MET 105 30.691 -13.623 -6.676 903 HE2 MET 105 HE2 MET 105 30.621 -15.241 -5.944 904 HE3 MET 105 HE3 MET 105 30.269 -13.806 -4.957 905 H THR 106 H THR 106 35.629 -10.031 -6.507 906 HA THR 106 HA THR 106 33.414 -9.058 -8.197 907 HB THR 106 HB THR 106 36.080 -7.622 -8.296 908 HG1 THR 106 HG1 THR 106 35.164 -5.944 -7.144 909 HG21 THR 106 HG21 THR 106 33.259 -6.958 -9.260 910 HG22 THR 106 HG22 THR 106 34.647 -5.849 -9.386 911 HG23 THR 106 HG23 THR 106 34.656 -7.370 -10.283 912 H TRP 107 H TRP 107 33.606 -9.535 -10.327 913 HA TRP 107 HA TRP 107 35.698 -11.537 -11.001 914 HB2 TRP 107 HB2 TRP 107 33.232 -12.229 -10.487 915 HB3 TRP 107 HB3 TRP 107 32.895 -11.637 -12.103 916 HD1 TRP 107 HD1 TRP 107 34.396 -12.917 -14.101 917 HE1 TRP 107 HE1 TRP 107 35.089 -15.387 -14.289 918 HE3 TRP 107 HE3 TRP 107 33.866 -14.273 -9.190 919 HZ2 TRP 107 HZ2 TRP 107 35.369 -17.661 -12.527 920 HZ3 TRP 107 HZ3 TRP 107 34.350 -16.604 -8.471 921 HH2 TRP 107 HH2 TRP 107 35.101 -18.302 -10.126 Start of MODEL 29 1 H1 GLY -5 H1 GLY -5 -49.040 -12.044 -5.286 2 H2 GLY -5 H2 GLY -5 -47.446 -12.217 -5.626 3 H3 GLY -5 H3 GLY -5 -48.322 -11.051 -6.372 4 HA2 GLY -5 HA2 GLY -5 -47.722 -11.145 -3.487 5 HA3 GLY -5 HA3 GLY -5 -46.921 -10.085 -4.661 6 H SER -4 H SER -4 -48.610 -9.496 -2.239 7 HA SER -4 HA SER -4 -50.535 -7.609 -3.513 8 HB2 SER -4 HB2 SER -4 -51.528 -9.869 -2.663 9 HB3 SER -4 HB3 SER -4 -51.326 -9.169 -1.051 10 HG SER -4 HG SER -4 -53.401 -8.741 -1.985 11 H HIS -3 H HIS -3 -47.848 -7.281 -2.212 12 HA HIS -3 HA HIS -3 -48.558 -5.205 -0.190 13 HB2 HIS -3 HB2 HIS -3 -46.434 -7.364 0.138 14 HB3 HIS -3 HB3 HIS -3 -46.633 -5.971 1.197 15 HD2 HIS -3 HD2 HIS -3 -48.952 -5.859 2.687 16 HE1 HIS -3 HE1 HIS -3 -49.799 -10.030 2.415 17 HE2 HIS -3 HE2 HIS -3 -50.367 -7.870 3.636 18 H MET -2 H MET -2 -47.116 -3.507 0.020 19 HA MET -2 HA MET -2 -45.194 -3.114 -2.226 20 HB2 MET -2 HB2 MET -2 -47.151 -1.599 -2.064 21 HB3 MET -2 HB3 MET -2 -46.571 -1.021 -0.499 22 HG2 MET -2 HG2 MET -2 -44.568 -0.111 -1.501 23 HG3 MET -2 HG3 MET -2 -44.879 -0.925 -3.026 24 HE1 MET -2 HE1 MET -2 -47.868 -0.327 -3.826 25 HE2 MET -2 HE2 MET -2 -47.659 1.207 -4.691 26 HE3 MET -2 HE3 MET -2 -46.459 -0.088 -4.885 27 H ALA -1 H ALA -1 -43.954 -4.682 -0.843 28 HA ALA -1 HA ALA -1 -41.870 -3.215 0.583 29 HB1 ALA -1 HB1 ALA -1 -43.534 -5.373 1.972 30 HB2 ALA -1 HB2 ALA -1 -42.090 -4.583 2.650 31 HB3 ALA -1 HB3 ALA -1 -43.560 -3.639 2.355 32 H SER 0 H SER 0 -40.110 -4.756 1.314 33 HA SER 0 HA SER 0 -39.806 -7.120 -0.498 34 HB2 SER 0 HB2 SER 0 -38.448 -5.214 -1.280 35 HB3 SER 0 HB3 SER 0 -37.643 -5.147 0.299 36 HG SER 0 HG SER 0 -36.478 -6.388 -1.287 37 H MET 1 H MET 1 -38.955 -8.931 0.359 38 HA MET 1 HA MET 1 -37.940 -9.010 3.133 39 HB2 MET 1 HB2 MET 1 -40.514 -9.228 3.061 40 HB3 MET 1 HB3 MET 1 -40.254 -10.807 2.316 41 HG2 MET 1 HG2 MET 1 -38.953 -11.497 4.334 42 HG3 MET 1 HG3 MET 1 -39.182 -9.888 5.022 43 HE1 MET 1 HE1 MET 1 -39.991 -11.143 7.243 44 HE2 MET 1 HE2 MET 1 -41.334 -12.306 7.280 45 HE3 MET 1 HE3 MET 1 -39.826 -12.721 6.437 46 H ASP 2 H ASP 2 -36.720 -9.387 0.519 47 HA ASP 2 HA ASP 2 -36.054 -12.314 0.495 48 HB2 ASP 2 HB2 ASP 2 -36.269 -10.336 -1.787 49 HB3 ASP 2 HB3 ASP 2 -35.622 -11.973 -1.914 50 HA PRO 3 HA PRO 3 -32.059 -10.269 1.333 51 HB2 PRO 3 HB2 PRO 3 -30.990 -12.041 3.119 52 HB3 PRO 3 HB3 PRO 3 -32.250 -10.854 3.576 53 HG2 PRO 3 HG2 PRO 3 -32.623 -13.770 2.834 54 HG3 PRO 3 HG3 PRO 3 -33.308 -12.887 4.232 55 HD2 PRO 3 HD2 PRO 3 -34.706 -13.311 1.912 56 HD3 PRO 3 HD3 PRO 3 -34.919 -11.833 2.898 57 H LEU 4 H LEU 4 -32.791 -13.165 -0.140 58 HA LEU 4 HA LEU 4 -29.984 -13.833 -0.795 59 HB2 LEU 4 HB2 LEU 4 -32.558 -15.444 -0.947 60 HB3 LEU 4 HB3 LEU 4 -30.999 -16.058 -1.473 61 HG LEU 4 HG LEU 4 -31.587 -15.194 1.373 62 HD11 LEU 4 HD11 LEU 4 -31.406 -17.971 0.146 63 HD12 LEU 4 HD12 LEU 4 -31.609 -17.598 1.873 64 HD13 LEU 4 HD13 LEU 4 -32.887 -17.177 0.725 65 HD21 LEU 4 HD21 LEU 4 -29.185 -15.036 0.850 66 HD22 LEU 4 HD22 LEU 4 -29.500 -16.413 1.905 67 HD23 LEU 4 HD23 LEU 4 -29.215 -16.683 0.174 68 H ASP 5 H ASP 5 -30.869 -11.614 -2.157 69 HA ASP 5 HA ASP 5 -30.870 -12.613 -4.983 70 HB2 ASP 5 HB2 ASP 5 -31.862 -10.067 -3.696 71 HB3 ASP 5 HB3 ASP 5 -31.370 -10.043 -5.377 72 H LYS 6 H LYS 6 -28.662 -11.759 -2.799 73 HA LYS 6 HA LYS 6 -26.882 -10.325 -4.759 74 HB2 LYS 6 HB2 LYS 6 -26.760 -9.654 -1.818 75 HB3 LYS 6 HB3 LYS 6 -26.180 -8.765 -3.210 76 HG2 LYS 6 HG2 LYS 6 -28.016 -7.490 -2.784 77 HG3 LYS 6 HG3 LYS 6 -28.787 -8.685 -3.820 78 HD2 LYS 6 HD2 LYS 6 -30.228 -8.470 -1.943 79 HD3 LYS 6 HD3 LYS 6 -29.348 -9.979 -1.644 80 HE2 LYS 6 HE2 LYS 6 -27.724 -8.673 -0.209 81 HE3 LYS 6 HE3 LYS 6 -28.729 -7.239 -0.444 82 HZ1 LYS 6 HZ1 LYS 6 -29.647 -9.779 0.802 83 HZ2 LYS 6 HZ2 LYS 6 -29.263 -8.412 1.626 84 HZ3 LYS 6 HZ3 LYS 6 -30.556 -8.416 0.629 85 H ILE 7 H ILE 7 -26.710 -11.947 -1.614 86 HA ILE 7 HA ILE 7 -24.051 -13.078 -2.326 87 HB ILE 7 HB ILE 7 -23.672 -13.273 0.104 88 HG12 ILE 7 HG12 ILE 7 -24.979 -11.903 1.677 89 HG13 ILE 7 HG13 ILE 7 -26.198 -11.583 0.451 90 HG21 ILE 7 HG21 ILE 7 -24.330 -10.462 -0.874 91 HG22 ILE 7 HG22 ILE 7 -23.186 -10.903 0.409 92 HG23 ILE 7 HG23 ILE 7 -22.861 -11.378 -1.263 93 HD11 ILE 7 HD11 ILE 7 -25.527 -14.354 1.539 94 HD12 ILE 7 HD12 ILE 7 -26.841 -13.321 2.131 95 HD13 ILE 7 HD13 ILE 7 -26.893 -13.929 0.473 96 H ILE 8 H ILE 8 -27.002 -14.116 -2.714 97 HA ILE 8 HA ILE 8 -27.262 -16.551 -1.359 98 HB ILE 8 HB ILE 8 -29.026 -15.579 -2.640 99 HG12 ILE 8 HG12 ILE 8 -28.304 -18.425 -3.436 100 HG13 ILE 8 HG13 ILE 8 -29.187 -17.895 -2.003 101 HG21 ILE 8 HG21 ILE 8 -27.757 -16.516 -5.235 102 HG22 ILE 8 HG22 ILE 8 -29.249 -15.591 -5.017 103 HG23 ILE 8 HG23 ILE 8 -27.699 -14.836 -4.662 104 HD11 ILE 8 HD11 ILE 8 -30.157 -17.795 -4.888 105 HD12 ILE 8 HD12 ILE 8 -30.728 -18.852 -3.590 106 HD13 ILE 8 HD13 ILE 8 -31.047 -17.112 -3.509 107 H ASN 9 H ASN 9 -25.915 -18.234 -1.212 108 HA ASN 9 HA ASN 9 -24.664 -19.428 -3.609 109 HB2 ASN 9 HB2 ASN 9 -23.199 -17.551 -2.395 110 HB3 ASN 9 HB3 ASN 9 -22.869 -18.834 -1.243 111 HD21 ASN 9 HD21 ASN 9 -20.855 -20.674 -3.627 112 HD22 ASN 9 HD22 ASN 9 -22.028 -20.945 -2.334 113 H ASP 10 H ASP 10 -26.700 -20.193 -1.393 114 HA ASP 10 HA ASP 10 -25.242 -22.263 -0.003 115 HB2 ASP 10 HB2 ASP 10 -26.944 -20.711 1.043 116 HB3 ASP 10 HB3 ASP 10 -28.200 -21.567 0.152 117 H ILE 11 H ILE 11 -26.209 -22.392 -2.923 118 HA ILE 11 HA ILE 11 -26.810 -25.279 -3.008 119 HB ILE 11 HB ILE 11 -28.941 -23.971 -2.668 120 HG12 ILE 11 HG12 ILE 11 -29.037 -25.528 -5.267 121 HG13 ILE 11 HG13 ILE 11 -28.854 -26.273 -3.676 122 HG21 ILE 11 HG21 ILE 11 -28.567 -23.013 -5.533 123 HG22 ILE 11 HG22 ILE 11 -29.935 -22.676 -4.456 124 HG23 ILE 11 HG23 ILE 11 -28.351 -22.008 -4.083 125 HD11 ILE 11 HD11 ILE 11 -31.208 -24.577 -4.609 126 HD12 ILE 11 HD12 ILE 11 -31.182 -26.327 -4.346 127 HD13 ILE 11 HD13 ILE 11 -31.007 -25.229 -2.964 128 H LYS 12 H LYS 12 -24.576 -23.622 -3.896 129 HA LYS 12 HA LYS 12 -24.537 -24.609 -6.720 130 HB2 LYS 12 HB2 LYS 12 -24.542 -22.094 -6.387 131 HB3 LYS 12 HB3 LYS 12 -22.927 -22.253 -5.680 132 HG2 LYS 12 HG2 LYS 12 -22.116 -23.275 -7.819 133 HG3 LYS 12 HG3 LYS 12 -23.760 -23.195 -8.466 134 HD2 LYS 12 HD2 LYS 12 -22.576 -21.361 -9.398 135 HD3 LYS 12 HD3 LYS 12 -23.691 -20.691 -8.195 136 HE2 LYS 12 HE2 LYS 12 -21.814 -20.551 -6.555 137 HE3 LYS 12 HE3 LYS 12 -20.718 -21.248 -7.758 138 HZ1 LYS 12 HZ1 LYS 12 -22.146 -18.655 -8.047 139 HZ2 LYS 12 HZ2 LYS 12 -20.559 -18.824 -7.716 140 HZ3 LYS 12 HZ3 LYS 12 -21.141 -19.297 -9.165 141 H LYS 13 H LYS 13 -22.459 -24.126 -3.895 142 HA LYS 13 HA LYS 13 -20.345 -24.850 -3.333 143 HB2 LYS 13 HB2 LYS 13 -21.512 -27.399 -4.519 144 HB3 LYS 13 HB3 LYS 13 -19.977 -27.355 -3.656 145 HG2 LYS 13 HG2 LYS 13 -21.031 -26.507 -1.638 146 HG3 LYS 13 HG3 LYS 13 -22.611 -26.435 -2.445 147 HD2 LYS 13 HD2 LYS 13 -22.678 -28.852 -2.694 148 HD3 LYS 13 HD3 LYS 13 -21.001 -29.005 -2.165 149 HE2 LYS 13 HE2 LYS 13 -22.455 -29.682 -0.363 150 HE3 LYS 13 HE3 LYS 13 -21.580 -28.219 0.089 151 HZ1 LYS 13 HZ1 LYS 13 -24.399 -28.281 -0.867 152 HZ2 LYS 13 HZ2 LYS 13 -23.940 -28.111 0.689 153 HZ3 LYS 13 HZ3 LYS 13 -23.593 -26.938 -0.385 154 H GLU 14 H GLU 14 -18.383 -26.318 -4.232 155 HA GLU 14 HA GLU 14 -16.522 -26.306 -5.529 156 HB2 GLU 14 HB2 GLU 14 -18.506 -26.524 -7.813 157 HB3 GLU 14 HB3 GLU 14 -16.822 -27.073 -7.790 158 HG2 GLU 14 HG2 GLU 14 -17.423 -28.587 -5.857 159 HG3 GLU 14 HG3 GLU 14 -19.115 -28.151 -6.114 160 H ALA 15 H ALA 15 -17.212 -23.690 -4.838 161 HA ALA 15 HA ALA 15 -16.724 -22.033 -7.254 162 HB1 ALA 15 HB1 ALA 15 -18.018 -21.373 -4.589 163 HB2 ALA 15 HB2 ALA 15 -17.975 -20.337 -6.038 164 HB3 ALA 15 HB3 ALA 15 -18.876 -21.872 -6.066 165 H ASN 16 H ASN 16 -14.594 -23.251 -5.327 166 HA ASN 16 HA ASN 16 -13.165 -20.730 -4.588 167 HB2 ASN 16 HB2 ASN 16 -13.724 -22.274 -2.750 168 HB3 ASN 16 HB3 ASN 16 -12.811 -23.561 -3.539 169 HD21 ASN 16 HD21 ASN 16 -10.607 -22.067 -0.974 170 HD22 ASN 16 HD22 ASN 16 -12.124 -22.957 -0.993 171 H ASP 17 H ASP 17 -11.701 -20.095 -5.963 172 HA ASP 17 HA ASP 17 -10.167 -22.035 -7.649 173 HB2 ASP 17 HB2 ASP 17 -10.971 -19.154 -8.185 174 HB3 ASP 17 HB3 ASP 17 -9.922 -20.108 -9.230 175 H SER 18 H SER 18 -9.502 -20.845 -4.833 176 HA SER 18 HA SER 18 -7.064 -19.445 -5.336 177 HB2 SER 18 HB2 SER 18 -8.000 -20.969 -2.876 178 HB3 SER 18 HB3 SER 18 -6.517 -19.999 -2.941 179 HG SER 18 HG SER 18 -8.341 -18.826 -2.125 180 H GLY 19 H GLY 19 -5.338 -20.177 -6.272 181 HA2 GLY 19 HA2 GLY 19 -3.317 -21.608 -5.727 182 HA3 GLY 19 HA3 GLY 19 -4.392 -23.001 -5.899 183 H VAL 20 H VAL 20 -5.616 -21.240 -8.266 184 HA VAL 20 HA VAL 20 -3.502 -21.796 -10.310 185 HB VAL 20 HB VAL 20 -6.429 -22.591 -10.466 186 HG11 VAL 20 HG11 VAL 20 -4.252 -22.670 -12.612 187 HG12 VAL 20 HG12 VAL 20 -5.824 -23.494 -12.731 188 HG13 VAL 20 HG13 VAL 20 -5.764 -21.737 -12.661 189 HG21 VAL 20 HG21 VAL 20 -5.053 -24.233 -9.257 190 HG22 VAL 20 HG22 VAL 20 -5.504 -24.867 -10.839 191 HG23 VAL 20 HG23 VAL 20 -3.862 -24.237 -10.577 192 H THR 21 H THR 21 -3.098 -20.145 -11.551 193 HA THR 21 HA THR 21 -3.100 -18.058 -12.464 194 HB THR 21 HB THR 21 -6.070 -17.947 -12.686 195 HG1 THR 21 HG1 THR 21 -5.991 -19.382 -14.408 196 HG21 THR 21 HG21 THR 21 -3.805 -17.549 -14.697 197 HG22 THR 21 HG22 THR 21 -5.530 -17.271 -15.005 198 HG23 THR 21 HG23 THR 21 -4.663 -16.229 -13.879 199 H LEU 22 H LEU 22 -4.873 -15.812 -12.223 200 HA LEU 22 HA LEU 22 -4.988 -15.246 -9.327 201 HB2 LEU 22 HB2 LEU 22 -3.815 -13.164 -9.536 202 HB3 LEU 22 HB3 LEU 22 -2.767 -14.479 -10.011 203 HG LEU 22 HG LEU 22 -4.258 -12.976 -12.189 204 HD11 LEU 22 HD11 LEU 22 -1.740 -11.973 -10.797 205 HD12 LEU 22 HD12 LEU 22 -2.450 -11.307 -12.287 206 HD13 LEU 22 HD13 LEU 22 -3.342 -11.198 -10.764 207 HD21 LEU 22 HD21 LEU 22 -2.820 -14.917 -12.816 208 HD22 LEU 22 HD22 LEU 22 -2.194 -13.399 -13.460 209 HD23 LEU 22 HD23 LEU 22 -1.437 -14.134 -12.030 210 H ALA 23 H ALA 23 -7.095 -15.859 -10.985 211 HA ALA 23 HA ALA 23 -8.463 -13.277 -11.525 212 HB1 ALA 23 HB1 ALA 23 -8.906 -16.054 -12.668 213 HB2 ALA 23 HB2 ALA 23 -9.841 -14.602 -13.089 214 HB3 ALA 23 HB3 ALA 23 -8.110 -14.680 -13.468 215 HA PRO 24 HA PRO 24 -10.956 -14.669 -7.986 216 HB2 PRO 24 HB2 PRO 24 -12.092 -12.317 -7.248 217 HB3 PRO 24 HB3 PRO 24 -10.360 -12.675 -6.974 218 HG2 PRO 24 HG2 PRO 24 -11.593 -11.101 -9.259 219 HG3 PRO 24 HG3 PRO 24 -10.224 -10.633 -8.207 220 HD2 PRO 24 HD2 PRO 24 -9.868 -11.779 -10.666 221 HD3 PRO 24 HD3 PRO 24 -8.748 -12.106 -9.313 222 H LEU 25 H LEU 25 -12.233 -12.843 -10.756 223 HA LEU 25 HA LEU 25 -14.708 -14.429 -10.759 224 HB2 LEU 25 HB2 LEU 25 -15.020 -12.420 -9.192 225 HB3 LEU 25 HB3 LEU 25 -14.835 -11.392 -10.606 226 HG LEU 25 HG LEU 25 -16.864 -12.545 -11.621 227 HD11 LEU 25 HD11 LEU 25 -17.065 -13.798 -8.847 228 HD12 LEU 25 HD12 LEU 25 -18.349 -13.803 -10.076 229 HD13 LEU 25 HD13 LEU 25 -16.845 -14.671 -10.379 230 HD21 LEU 25 HD21 LEU 25 -17.051 -10.399 -10.424 231 HD22 LEU 25 HD22 LEU 25 -18.488 -11.401 -10.179 232 HD23 LEU 25 HD23 LEU 25 -17.272 -11.265 -8.887 233 H SER 26 H SER 26 -13.134 -14.996 -12.615 234 HA SER 26 HA SER 26 -12.633 -15.053 -14.823 235 HB2 SER 26 HB2 SER 26 -15.174 -15.404 -14.642 236 HB3 SER 26 HB3 SER 26 -15.325 -13.799 -15.368 237 HG SER 26 HG SER 26 -15.316 -15.507 -16.934 238 H VAL 27 H VAL 27 -11.413 -12.956 -13.677 239 HA VAL 27 HA VAL 27 -10.954 -11.075 -15.882 240 HB VAL 27 HB VAL 27 -12.867 -10.172 -14.575 241 HG11 VAL 27 HG11 VAL 27 -10.910 -9.802 -12.282 242 HG12 VAL 27 HG12 VAL 27 -12.587 -9.227 -12.355 243 HG13 VAL 27 HG13 VAL 27 -12.256 -10.961 -12.304 244 HG21 VAL 27 HG21 VAL 27 -11.391 -8.621 -15.786 245 HG22 VAL 27 HG22 VAL 27 -12.044 -7.888 -14.319 246 HG23 VAL 27 HG23 VAL 27 -10.364 -8.450 -14.337 247 HA PRO 28 HA PRO 28 -6.945 -11.727 -13.964 248 HB2 PRO 28 HB2 PRO 28 -5.310 -10.107 -15.408 249 HB3 PRO 28 HB3 PRO 28 -6.163 -11.501 -16.125 250 HG2 PRO 28 HG2 PRO 28 -7.054 -8.595 -16.151 251 HG3 PRO 28 HG3 PRO 28 -6.887 -9.708 -17.548 252 HD2 PRO 28 HD2 PRO 28 -9.271 -9.317 -16.310 253 HD3 PRO 28 HD3 PRO 28 -8.806 -10.925 -16.929 254 H LYS 29 H LYS 29 -8.193 -10.735 -12.129 255 HA LYS 29 HA LYS 29 -8.500 -9.528 -10.302 256 HB2 LYS 29 HB2 LYS 29 -6.051 -9.888 -10.019 257 HB3 LYS 29 HB3 LYS 29 -5.772 -8.289 -10.714 258 HG2 LYS 29 HG2 LYS 29 -5.699 -7.880 -8.399 259 HG3 LYS 29 HG3 LYS 29 -7.345 -7.408 -8.829 260 HD2 LYS 29 HD2 LYS 29 -8.076 -9.724 -8.093 261 HD3 LYS 29 HD3 LYS 29 -6.409 -9.993 -7.549 262 HE2 LYS 29 HE2 LYS 29 -6.598 -8.032 -6.026 263 HE3 LYS 29 HE3 LYS 29 -8.247 -7.747 -6.589 264 HZ1 LYS 29 HZ1 LYS 29 -7.344 -10.197 -5.155 265 HZ2 LYS 29 HZ2 LYS 29 -8.257 -9.002 -4.513 266 HZ3 LYS 29 HZ3 LYS 29 -8.864 -9.939 -5.693 267 HA PRO 30 HA PRO 30 -10.221 -5.819 -12.171 268 HB2 PRO 30 HB2 PRO 30 -12.250 -5.297 -10.463 269 HB3 PRO 30 HB3 PRO 30 -12.265 -6.734 -11.533 270 HG2 PRO 30 HG2 PRO 30 -11.464 -6.595 -8.609 271 HG3 PRO 30 HG3 PRO 30 -12.553 -7.774 -9.403 272 HD2 PRO 30 HD2 PRO 30 -9.875 -8.238 -8.918 273 HD3 PRO 30 HD3 PRO 30 -10.759 -8.973 -10.284 274 H LYS 31 H LYS 31 -10.024 -3.580 -11.869 275 HA LYS 31 HA LYS 31 -8.095 -2.656 -9.924 276 HB2 LYS 31 HB2 LYS 31 -9.887 -1.173 -11.881 277 HB3 LYS 31 HB3 LYS 31 -8.709 -0.375 -10.819 278 HG2 LYS 31 HG2 LYS 31 -6.857 -1.569 -11.831 279 HG3 LYS 31 HG3 LYS 31 -7.949 -2.574 -12.782 280 HD2 LYS 31 HD2 LYS 31 -6.940 -0.919 -14.187 281 HD3 LYS 31 HD3 LYS 31 -8.670 -0.629 -14.109 282 HE2 LYS 31 HE2 LYS 31 -6.772 0.875 -12.267 283 HE3 LYS 31 HE3 LYS 31 -6.891 1.335 -13.965 284 HZ1 LYS 31 HZ1 LYS 31 -9.192 1.310 -12.088 285 HZ2 LYS 31 HZ2 LYS 31 -8.424 2.633 -12.648 286 HZ3 LYS 31 HZ3 LYS 31 -9.271 1.695 -13.675 287 H LEU 32 H LEU 32 -8.336 -1.794 -7.923 288 HA LEU 32 HA LEU 32 -10.957 -0.886 -6.969 289 HB2 LEU 32 HB2 LEU 32 -10.858 -3.334 -6.630 290 HB3 LEU 32 HB3 LEU 32 -9.352 -3.178 -5.726 291 HG LEU 32 HG LEU 32 -11.480 -1.381 -4.792 292 HD11 LEU 32 HD11 LEU 32 -11.936 -4.374 -4.507 293 HD12 LEU 32 HD12 LEU 32 -12.847 -3.102 -3.659 294 HD13 LEU 32 HD13 LEU 32 -12.946 -3.231 -5.423 295 HD21 LEU 32 HD21 LEU 32 -9.338 -1.889 -3.542 296 HD22 LEU 32 HD22 LEU 32 -10.817 -2.111 -2.583 297 HD23 LEU 32 HD23 LEU 32 -9.976 -3.521 -3.251 298 H GLU 33 H GLU 33 -10.817 0.757 -5.633 299 HA GLU 33 HA GLU 33 -8.403 1.310 -3.982 300 HB2 GLU 33 HB2 GLU 33 -9.877 3.310 -5.751 301 HB3 GLU 33 HB3 GLU 33 -8.762 3.744 -4.451 302 HG2 GLU 33 HG2 GLU 33 -6.912 2.619 -5.618 303 HG3 GLU 33 HG3 GLU 33 -8.012 2.100 -6.905 304 H GLU 34 H GLU 34 -9.185 1.198 -1.897 305 HA GLU 34 HA GLU 34 -11.681 2.579 -1.166 306 HB2 GLU 34 HB2 GLU 34 -12.258 0.248 -1.868 307 HB3 GLU 34 HB3 GLU 34 -11.102 -0.381 -0.698 308 HG2 GLU 34 HG2 GLU 34 -13.279 -0.564 0.241 309 HG3 GLU 34 HG3 GLU 34 -12.413 0.683 1.130 310 H LEU 35 H LEU 35 -10.152 4.036 -0.246 311 HA LEU 35 HA LEU 35 -8.966 3.206 2.366 312 HB2 LEU 35 HB2 LEU 35 -7.752 4.851 0.114 313 HB3 LEU 35 HB3 LEU 35 -7.036 4.704 1.712 314 HG LEU 35 HG LEU 35 -7.568 2.256 -0.022 315 HD11 LEU 35 HD11 LEU 35 -4.996 3.831 0.098 316 HD12 LEU 35 HD12 LEU 35 -5.346 2.330 -0.807 317 HD13 LEU 35 HD13 LEU 35 -6.145 3.838 -1.267 318 HD21 LEU 35 HD21 LEU 35 -7.088 1.912 2.427 319 HD22 LEU 35 HD22 LEU 35 -5.851 1.225 1.357 320 HD23 LEU 35 HD23 LEU 35 -5.531 2.740 2.185 321 H SER 36 H SER 36 -8.721 4.909 3.902 322 HA SER 36 HA SER 36 -10.713 7.077 3.777 323 HB2 SER 36 HB2 SER 36 -8.501 6.472 5.780 324 HB3 SER 36 HB3 SER 36 -9.729 7.742 5.955 325 HG SER 36 HG SER 36 -10.331 5.813 7.046 326 H GLU 37 H GLU 37 -9.981 9.415 4.107 327 HA GLU 37 HA GLU 37 -8.474 10.288 1.936 328 HB2 GLU 37 HB2 GLU 37 -10.062 11.652 3.241 329 HB3 GLU 37 HB3 GLU 37 -8.916 11.725 4.585 330 HG2 GLU 37 HG2 GLU 37 -7.299 12.944 3.153 331 HG3 GLU 37 HG3 GLU 37 -8.398 12.806 1.778 332 H GLN 38 H GLN 38 -7.234 9.853 5.273 333 HA GLN 38 HA GLN 38 -4.529 10.687 4.567 334 HB2 GLN 38 HB2 GLN 38 -3.899 9.878 6.784 335 HB3 GLN 38 HB3 GLN 38 -5.233 11.022 6.835 336 HG2 GLN 38 HG2 GLN 38 -6.821 9.356 7.433 337 HG3 GLN 38 HG3 GLN 38 -5.778 8.029 6.925 338 HE21 GLN 38 HE21 GLN 38 -3.840 7.949 9.912 339 HE22 GLN 38 HE22 GLN 38 -3.807 7.550 8.201 340 H GLN 39 H GLN 39 -6.221 7.570 4.696 341 HA GLN 39 HA GLN 39 -3.837 5.955 4.466 342 HB2 GLN 39 HB2 GLN 39 -6.764 5.377 4.043 343 HB3 GLN 39 HB3 GLN 39 -5.493 4.187 3.760 344 HG2 GLN 39 HG2 GLN 39 -4.702 4.435 6.093 345 HG3 GLN 39 HG3 GLN 39 -6.047 5.530 6.426 346 HE21 GLN 39 HE21 GLN 39 -6.874 1.840 7.205 347 HE22 GLN 39 HE22 GLN 39 -5.361 2.675 7.486 348 H LYS 40 H LYS 40 -6.128 7.326 2.099 349 HA LYS 40 HA LYS 40 -4.959 6.136 -0.261 350 HB2 LYS 40 HB2 LYS 40 -7.135 7.144 -0.358 351 HB3 LYS 40 HB3 LYS 40 -6.546 8.689 0.263 352 HG2 LYS 40 HG2 LYS 40 -5.306 9.143 -1.763 353 HG3 LYS 40 HG3 LYS 40 -5.658 7.543 -2.420 354 HD2 LYS 40 HD2 LYS 40 -7.880 9.489 -1.675 355 HD3 LYS 40 HD3 LYS 40 -7.040 9.644 -3.212 356 HE2 LYS 40 HE2 LYS 40 -8.382 7.052 -2.330 357 HE3 LYS 40 HE3 LYS 40 -9.220 8.315 -3.238 358 HZ1 LYS 40 HZ1 LYS 40 -6.771 6.929 -4.202 359 HZ2 LYS 40 HZ2 LYS 40 -8.257 6.619 -4.742 360 HZ3 LYS 40 HZ3 LYS 40 -7.595 8.075 -5.018 361 H ILE 41 H ILE 41 -4.157 9.178 1.516 362 HA ILE 41 HA ILE 41 -2.036 9.933 -0.284 363 HB ILE 41 HB ILE 41 -2.465 10.675 2.597 364 HG12 ILE 41 HG12 ILE 41 -3.071 12.402 0.145 365 HG13 ILE 41 HG13 ILE 41 -4.281 11.306 0.776 366 HG21 ILE 41 HG21 ILE 41 -0.652 11.955 0.517 367 HG22 ILE 41 HG22 ILE 41 -1.034 12.677 2.093 368 HG23 ILE 41 HG23 ILE 41 -0.155 11.162 2.028 369 HD11 ILE 41 HD11 ILE 41 -3.057 13.634 2.300 370 HD12 ILE 41 HD12 ILE 41 -4.710 13.483 1.681 371 HD13 ILE 41 HD13 ILE 41 -4.164 12.426 2.996 372 H ILE 42 H ILE 42 -1.937 7.982 2.814 373 HA ILE 42 HA ILE 42 0.938 7.765 2.790 374 HB ILE 42 HB ILE 42 -1.158 5.881 3.916 375 HG12 ILE 42 HG12 ILE 42 0.587 7.740 5.568 376 HG13 ILE 42 HG13 ILE 42 -0.868 8.375 4.821 377 HG21 ILE 42 HG21 ILE 42 1.866 5.989 4.357 378 HG22 ILE 42 HG22 ILE 42 0.754 5.056 5.369 379 HG23 ILE 42 HG23 ILE 42 0.938 4.639 3.670 380 HD11 ILE 42 HD11 ILE 42 -0.775 6.019 6.747 381 HD12 ILE 42 HD12 ILE 42 -1.408 7.648 7.066 382 HD13 ILE 42 HD13 ILE 42 -2.223 6.590 5.892 383 H LEU 43 H LEU 43 -1.622 5.741 1.385 384 HA LEU 43 HA LEU 43 -0.021 3.702 0.263 385 HB2 LEU 43 HB2 LEU 43 -2.484 3.694 0.550 386 HB3 LEU 43 HB3 LEU 43 -2.666 4.899 -0.697 387 HG LEU 43 HG LEU 43 -3.244 2.515 -1.229 388 HD11 LEU 43 HD11 LEU 43 -1.207 3.777 -3.081 389 HD12 LEU 43 HD12 LEU 43 -2.417 2.558 -3.506 390 HD13 LEU 43 HD13 LEU 43 -2.929 4.177 -2.991 391 HD21 LEU 43 HD21 LEU 43 -1.374 1.433 -0.128 392 HD22 LEU 43 HD22 LEU 43 -1.478 0.946 -1.829 393 HD23 LEU 43 HD23 LEU 43 -0.225 2.097 -1.311 394 H ALA 44 H ALA 44 -1.186 6.726 -1.243 395 HA ALA 44 HA ALA 44 0.230 6.543 -3.686 396 HB1 ALA 44 HB1 ALA 44 -0.700 8.946 -2.068 397 HB2 ALA 44 HB2 ALA 44 -0.255 8.979 -3.790 398 HB3 ALA 44 HB3 ALA 44 -1.676 8.047 -3.255 399 H GLU 45 H GLU 45 1.170 8.425 -0.702 400 HA GLU 45 HA GLU 45 3.653 9.353 -1.703 401 HB2 GLU 45 HB2 GLU 45 2.663 8.761 1.109 402 HB3 GLU 45 HB3 GLU 45 4.253 9.447 0.810 403 HG2 GLU 45 HG2 GLU 45 1.707 10.765 -0.216 404 HG3 GLU 45 HG3 GLU 45 2.399 11.094 1.368 405 H TYR 46 H TYR 46 2.898 6.167 -0.290 406 HA TYR 46 HA TYR 46 5.634 5.356 0.057 407 HB2 TYR 46 HB2 TYR 46 3.668 4.372 1.191 408 HB3 TYR 46 HB3 TYR 46 3.101 3.717 -0.337 409 HD1 TYR 46 HD1 TYR 46 6.702 3.381 -0.113 410 HD2 TYR 46 HD2 TYR 46 2.961 1.698 1.238 411 HE1 TYR 46 HE1 TYR 46 7.858 1.283 0.467 412 HE2 TYR 46 HE2 TYR 46 4.132 -0.448 1.773 413 HH TYR 46 HH TYR 46 7.658 -0.844 1.297 414 H ILE 47 H ILE 47 3.270 4.522 -2.546 415 HA ILE 47 HA ILE 47 5.055 3.188 -4.260 416 HB ILE 47 HB ILE 47 2.406 4.612 -4.568 417 HG12 ILE 47 HG12 ILE 47 3.115 1.641 -4.537 418 HG13 ILE 47 HG13 ILE 47 2.589 2.528 -3.114 419 HG21 ILE 47 HG21 ILE 47 3.840 2.949 -6.664 420 HG22 ILE 47 HG22 ILE 47 2.113 3.359 -6.755 421 HG23 ILE 47 HG23 ILE 47 3.313 4.634 -6.817 422 HD11 ILE 47 HD11 ILE 47 0.914 1.889 -5.559 423 HD12 ILE 47 HD12 ILE 47 0.658 1.415 -3.872 424 HD13 ILE 47 HD13 ILE 47 0.452 3.113 -4.356 425 H ALA 48 H ALA 48 4.141 6.662 -3.993 426 HA ALA 48 HA ALA 48 5.455 7.515 -6.410 427 HB1 ALA 48 HB1 ALA 48 4.659 9.026 -3.887 428 HB2 ALA 48 HB2 ALA 48 5.088 9.765 -5.449 429 HB3 ALA 48 HB3 ALA 48 3.633 8.754 -5.313 430 H GLU 49 H GLU 49 6.620 6.943 -3.118 431 HA GLU 49 HA GLU 49 9.237 8.199 -3.659 432 HB2 GLU 49 HB2 GLU 49 8.142 8.434 -1.474 433 HB3 GLU 49 HB3 GLU 49 8.220 6.679 -1.231 434 HG2 GLU 49 HG2 GLU 49 10.661 6.749 -1.220 435 HG3 GLU 49 HG3 GLU 49 10.658 8.451 -1.694 436 H VAL 50 H VAL 50 7.896 4.870 -3.373 437 HA VAL 50 HA VAL 50 10.627 3.827 -4.012 438 HB VAL 50 HB VAL 50 10.269 1.928 -2.886 439 HG11 VAL 50 HG11 VAL 50 8.798 3.944 -1.173 440 HG12 VAL 50 HG12 VAL 50 9.712 2.524 -0.630 441 HG13 VAL 50 HG13 VAL 50 10.558 3.871 -1.408 442 HG21 VAL 50 HG21 VAL 50 8.043 1.226 -3.683 443 HG22 VAL 50 HG22 VAL 50 8.166 1.104 -1.933 444 HG23 VAL 50 HG23 VAL 50 7.275 2.453 -2.662 445 H GLY 51 H GLY 51 7.700 4.277 -5.576 446 HA2 GLY 51 HA2 GLY 51 7.570 4.226 -7.883 447 HA3 GLY 51 HA3 GLY 51 9.048 3.265 -7.964 448 H LEU 52 H LEU 52 6.254 2.274 -6.100 449 HA LEU 52 HA LEU 52 5.079 0.409 -5.982 450 HB2 LEU 52 HB2 LEU 52 4.424 1.582 -8.414 451 HB3 LEU 52 HB3 LEU 52 4.743 -0.059 -8.909 452 HG LEU 52 HG LEU 52 2.746 0.804 -6.771 453 HD11 LEU 52 HD11 LEU 52 2.312 -0.190 -9.614 454 HD12 LEU 52 HD12 LEU 52 1.039 0.199 -8.435 455 HD13 LEU 52 HD13 LEU 52 2.094 1.483 -9.045 456 HD21 LEU 52 HD21 LEU 52 3.491 -1.480 -6.303 457 HD22 LEU 52 HD22 LEU 52 1.834 -1.472 -6.902 458 HD23 LEU 52 HD23 LEU 52 3.159 -1.950 -7.986 459 H GLN 53 H GLN 53 8.073 0.162 -6.856 460 HA GLN 53 HA GLN 53 8.183 -2.677 -7.777 461 HB2 GLN 53 HB2 GLN 53 10.146 -0.369 -7.698 462 HB3 GLN 53 HB3 GLN 53 10.672 -2.012 -8.055 463 HG2 GLN 53 HG2 GLN 53 9.497 -2.141 -10.075 464 HG3 GLN 53 HG3 GLN 53 8.385 -0.840 -9.651 465 HE21 GLN 53 HE21 GLN 53 10.607 1.808 -10.545 466 HE22 GLN 53 HE22 GLN 53 9.175 1.354 -9.602 467 H ASN 54 H ASN 54 8.538 -0.912 -4.883 468 HA ASN 54 HA ASN 54 10.108 -3.130 -3.597 469 HB2 ASN 54 HB2 ASN 54 10.347 -0.166 -3.029 470 HB3 ASN 54 HB3 ASN 54 11.262 -1.441 -2.251 471 HD21 ASN 54 HD21 ASN 54 12.532 -0.033 -5.832 472 HD22 ASN 54 HD22 ASN 54 11.038 0.582 -5.144 473 H ILE 55 H ILE 55 7.074 -2.044 -3.639 474 HA ILE 55 HA ILE 55 6.622 -1.976 -0.732 475 HB ILE 55 HB ILE 55 4.345 -1.643 -1.111 476 HG12 ILE 55 HG12 ILE 55 4.760 -2.141 -4.092 477 HG13 ILE 55 HG13 ILE 55 3.917 -3.215 -2.963 478 HG21 ILE 55 HG21 ILE 55 5.630 0.075 -3.259 479 HG22 ILE 55 HG22 ILE 55 4.373 0.503 -2.069 480 HG23 ILE 55 HG23 ILE 55 6.027 0.240 -1.541 481 HD11 ILE 55 HD11 ILE 55 3.077 -0.409 -3.731 482 HD12 ILE 55 HD12 ILE 55 2.278 -1.926 -4.163 483 HD13 ILE 55 HD13 ILE 55 2.288 -1.398 -2.460 484 H THR 56 H THR 56 5.440 -3.524 0.453 485 HA THR 56 HA THR 56 5.002 -6.175 -0.802 486 HB THR 56 HB THR 56 5.882 -6.884 1.690 487 HG1 THR 56 HG1 THR 56 7.830 -5.779 2.054 488 HG21 THR 56 HG21 THR 56 7.722 -6.429 -0.703 489 HG22 THR 56 HG22 THR 56 8.020 -7.541 0.655 490 HG23 THR 56 HG23 THR 56 6.681 -7.850 -0.462 491 H ALA 57 H ALA 57 3.271 -7.359 0.118 492 HA ALA 57 HA ALA 57 1.179 -5.833 1.252 493 HB1 ALA 57 HB1 ALA 57 1.598 -8.857 1.235 494 HB2 ALA 57 HB2 ALA 57 0.066 -7.993 1.493 495 HB3 ALA 57 HB3 ALA 57 0.876 -7.904 -0.082 496 H ILE 58 H ILE 58 3.827 -7.480 2.782 497 HA ILE 58 HA ILE 58 2.780 -7.588 5.497 498 HB ILE 58 HB ILE 58 5.590 -7.667 4.319 499 HG12 ILE 58 HG12 ILE 58 5.574 -10.044 5.144 500 HG13 ILE 58 HG13 ILE 58 3.883 -9.876 5.602 501 HG21 ILE 58 HG21 ILE 58 4.671 -7.991 7.234 502 HG22 ILE 58 HG22 ILE 58 6.283 -8.454 6.641 503 HG23 ILE 58 HG23 ILE 58 5.787 -6.770 6.592 504 HD11 ILE 58 HD11 ILE 58 4.903 -9.600 2.739 505 HD12 ILE 58 HD12 ILE 58 4.339 -11.121 3.458 506 HD13 ILE 58 HD13 ILE 58 3.207 -9.782 3.276 507 H THR 59 H THR 59 5.109 -5.397 3.771 508 HA THR 59 HA THR 59 5.280 -3.572 5.985 509 HB THR 59 HB THR 59 5.977 -3.239 3.048 510 HG1 THR 59 HG1 THR 59 7.852 -4.086 3.586 511 HG21 THR 59 HG21 THR 59 6.856 -1.695 5.541 512 HG22 THR 59 HG22 THR 59 7.625 -1.571 3.939 513 HG23 THR 59 HG23 THR 59 5.946 -1.046 4.154 514 H LEU 60 H LEU 60 3.424 -3.489 2.929 515 HA LEU 60 HA LEU 60 2.052 -1.078 3.391 516 HB2 LEU 60 HB2 LEU 60 2.326 -2.559 1.274 517 HB3 LEU 60 HB3 LEU 60 1.005 -3.524 1.906 518 HG LEU 60 HG LEU 60 -0.429 -1.411 1.818 519 HD11 LEU 60 HD11 LEU 60 2.041 -0.378 0.366 520 HD12 LEU 60 HD12 LEU 60 0.469 0.415 0.377 521 HD13 LEU 60 HD13 LEU 60 1.354 0.265 1.886 522 HD21 LEU 60 HD21 LEU 60 -0.456 -3.112 0.039 523 HD22 LEU 60 HD22 LEU 60 -0.700 -1.482 -0.610 524 HD23 LEU 60 HD23 LEU 60 0.877 -2.284 -0.783 525 H SER 61 H SER 61 1.295 -4.388 4.531 526 HA SER 61 HA SER 61 -1.169 -3.866 5.768 527 HB2 SER 61 HB2 SER 61 -0.694 -6.078 5.657 528 HB3 SER 61 HB3 SER 61 0.952 -5.895 6.237 529 HG SER 61 HG SER 61 -1.364 -5.539 7.835 530 H LYS 62 H LYS 62 1.968 -2.860 6.664 531 HA LYS 62 HA LYS 62 1.060 -2.015 9.364 532 HB2 LYS 62 HB2 LYS 62 3.837 -2.755 8.380 533 HB3 LYS 62 HB3 LYS 62 3.592 -1.794 9.832 534 HG2 LYS 62 HG2 LYS 62 3.800 -3.943 10.678 535 HG3 LYS 62 HG3 LYS 62 2.062 -3.641 10.711 536 HD2 LYS 62 HD2 LYS 62 1.899 -4.910 8.527 537 HD3 LYS 62 HD3 LYS 62 3.621 -5.302 8.688 538 HE2 LYS 62 HE2 LYS 62 3.261 -6.743 10.470 539 HE3 LYS 62 HE3 LYS 62 1.734 -5.958 10.938 540 HZ1 LYS 62 HZ1 LYS 62 2.133 -7.667 8.547 541 HZ2 LYS 62 HZ2 LYS 62 1.261 -8.057 9.874 542 HZ3 LYS 62 HZ3 LYS 62 0.749 -6.858 8.875 543 H LYS 63 H LYS 63 2.253 -0.661 6.350 544 HA LYS 63 HA LYS 63 2.914 1.967 7.328 545 HB2 LYS 63 HB2 LYS 63 1.991 0.842 4.661 546 HB3 LYS 63 HB3 LYS 63 2.379 2.545 4.855 547 HG2 LYS 63 HG2 LYS 63 4.388 0.347 5.518 548 HG3 LYS 63 HG3 LYS 63 4.142 0.954 3.889 549 HD2 LYS 63 HD2 LYS 63 4.628 3.294 4.813 550 HD3 LYS 63 HD3 LYS 63 5.156 2.471 6.307 551 HE2 LYS 63 HE2 LYS 63 6.777 1.136 4.970 552 HE3 LYS 63 HE3 LYS 63 6.236 1.958 3.498 553 HZ1 LYS 63 HZ1 LYS 63 7.535 3.298 5.814 554 HZ2 LYS 63 HZ2 LYS 63 8.255 2.975 4.387 555 HZ3 LYS 63 HZ3 LYS 63 7.034 4.055 4.454 556 H LEU 64 H LEU 64 -0.153 0.464 6.423 557 HA LEU 64 HA LEU 64 -1.599 2.980 7.148 558 HB2 LEU 64 HB2 LEU 64 -2.541 0.852 5.203 559 HB3 LEU 64 HB3 LEU 64 -3.296 2.381 5.581 560 HG LEU 64 HG LEU 64 -0.844 3.263 4.758 561 HD11 LEU 64 HD11 LEU 64 -1.450 0.845 2.988 562 HD12 LEU 64 HD12 LEU 64 -0.142 2.033 2.775 563 HD13 LEU 64 HD13 LEU 64 -0.127 0.905 4.143 564 HD21 LEU 64 HD21 LEU 64 -3.039 3.969 3.947 565 HD22 LEU 64 HD22 LEU 64 -1.875 3.738 2.644 566 HD23 LEU 64 HD23 LEU 64 -3.147 2.519 2.921 567 H ASN 65 H ASN 65 -0.925 0.234 8.653 568 HA ASN 65 HA ASN 65 -1.819 -1.072 10.253 569 HB2 ASN 65 HB2 ASN 65 -3.789 1.183 10.763 570 HB3 ASN 65 HB3 ASN 65 -3.230 -0.031 11.903 571 HD21 ASN 65 HD21 ASN 65 -1.061 3.342 11.322 572 HD22 ASN 65 HD22 ASN 65 -2.556 3.043 10.442 573 H ILE 66 H ILE 66 -2.494 -2.305 8.192 574 HA ILE 66 HA ILE 66 -5.417 -2.924 8.216 575 HB ILE 66 HB ILE 66 -5.029 -3.167 5.642 576 HG12 ILE 66 HG12 ILE 66 -3.028 -0.939 6.154 577 HG13 ILE 66 HG13 ILE 66 -2.537 -2.550 5.838 578 HG21 ILE 66 HG21 ILE 66 -5.467 -0.527 7.077 579 HG22 ILE 66 HG22 ILE 66 -5.825 -0.785 5.368 580 HG23 ILE 66 HG23 ILE 66 -6.683 -1.737 6.585 581 HD11 ILE 66 HD11 ILE 66 -4.065 -0.762 3.919 582 HD12 ILE 66 HD12 ILE 66 -2.425 -1.410 3.749 583 HD13 ILE 66 HD13 ILE 66 -3.829 -2.500 3.645 584 H THR 67 H THR 67 -5.906 -4.915 6.880 585 HA THR 67 HA THR 67 -4.226 -7.086 7.814 586 HB THR 67 HB THR 67 -5.751 -8.586 6.739 587 HG1 THR 67 HG1 THR 67 -7.518 -7.646 5.526 588 HG21 THR 67 HG21 THR 67 -7.432 -6.282 7.814 589 HG22 THR 67 HG22 THR 67 -7.860 -8.006 7.758 590 HG23 THR 67 HG23 THR 67 -6.563 -7.455 8.832 591 H VAL 68 H VAL 68 -3.029 -8.578 6.570 592 HA VAL 68 HA VAL 68 -1.565 -7.608 4.287 593 HB VAL 68 HB VAL 68 -1.982 -10.428 5.350 594 HG11 VAL 68 HG11 VAL 68 0.086 -9.451 3.335 595 HG12 VAL 68 HG12 VAL 68 0.065 -11.049 4.104 596 HG13 VAL 68 HG13 VAL 68 -1.230 -10.601 2.993 597 HG21 VAL 68 HG21 VAL 68 -0.812 -8.891 6.919 598 HG22 VAL 68 HG22 VAL 68 0.289 -10.119 6.286 599 HG23 VAL 68 HG23 VAL 68 0.341 -8.466 5.638 600 H GLU 69 H GLU 69 -4.781 -9.038 4.500 601 HA GLU 69 HA GLU 69 -4.758 -10.119 1.774 602 HB2 GLU 69 HB2 GLU 69 -6.954 -9.759 3.859 603 HB3 GLU 69 HB3 GLU 69 -7.189 -10.486 2.264 604 HG2 GLU 69 HG2 GLU 69 -5.530 -12.245 2.804 605 HG3 GLU 69 HG3 GLU 69 -5.283 -11.540 4.402 606 H LYS 70 H LYS 70 -6.059 -7.202 3.516 607 HA LYS 70 HA LYS 70 -7.192 -6.298 1.028 608 HB2 LYS 70 HB2 LYS 70 -8.324 -4.703 2.161 609 HB3 LYS 70 HB3 LYS 70 -8.129 -5.926 3.394 610 HG2 LYS 70 HG2 LYS 70 -7.478 -4.196 4.699 611 HG3 LYS 70 HG3 LYS 70 -5.920 -4.409 3.921 612 HD2 LYS 70 HD2 LYS 70 -6.366 -2.096 3.702 613 HD3 LYS 70 HD3 LYS 70 -6.795 -2.725 2.118 614 HE2 LYS 70 HE2 LYS 70 -9.174 -2.744 2.711 615 HE3 LYS 70 HE3 LYS 70 -8.807 -2.303 4.383 616 HZ1 LYS 70 HZ1 LYS 70 -8.190 -0.572 2.050 617 HZ2 LYS 70 HZ2 LYS 70 -9.517 -0.393 2.968 618 HZ3 LYS 70 HZ3 LYS 70 -8.040 -0.156 3.629 619 H ALA 71 H ALA 71 -4.243 -5.682 2.812 620 HA ALA 71 HA ALA 71 -3.172 -3.575 1.220 621 HB1 ALA 71 HB1 ALA 71 -1.768 -5.827 2.724 622 HB2 ALA 71 HB2 ALA 71 -1.034 -4.313 2.180 623 HB3 ALA 71 HB3 ALA 71 -2.288 -4.283 3.426 624 H LYS 72 H LYS 72 -2.920 -7.171 0.840 625 HA LYS 72 HA LYS 72 -1.183 -7.057 -1.437 626 HB2 LYS 72 HB2 LYS 72 -1.396 -8.973 0.155 627 HB3 LYS 72 HB3 LYS 72 -3.061 -9.233 -0.358 628 HG2 LYS 72 HG2 LYS 72 -2.320 -9.912 -2.563 629 HG3 LYS 72 HG3 LYS 72 -0.635 -9.508 -2.178 630 HD2 LYS 72 HD2 LYS 72 -2.272 -11.559 -0.609 631 HD3 LYS 72 HD3 LYS 72 -1.296 -11.984 -2.028 632 HE2 LYS 72 HE2 LYS 72 0.730 -11.088 -0.872 633 HE3 LYS 72 HE3 LYS 72 -0.256 -10.739 0.556 634 HZ1 LYS 72 HZ1 LYS 72 0.169 -13.442 -0.609 635 HZ2 LYS 72 HZ2 LYS 72 0.864 -12.888 0.757 636 HZ3 LYS 72 HZ3 LYS 72 -0.750 -13.131 0.706 637 H ASN 73 H ASN 73 -4.675 -7.007 -1.044 638 HA ASN 73 HA ASN 73 -5.413 -7.577 -3.658 639 HB2 ASN 73 HB2 ASN 73 -7.381 -7.359 -2.608 640 HB3 ASN 73 HB3 ASN 73 -6.658 -6.474 -1.287 641 HD21 ASN 73 HD21 ASN 73 -7.779 -3.314 -2.387 642 HD22 ASN 73 HD22 ASN 73 -6.749 -4.182 -1.253 643 H TYR 74 H TYR 74 -4.192 -4.464 -2.401 644 HA TYR 74 HA TYR 74 -4.560 -2.912 -4.763 645 HB2 TYR 74 HB2 TYR 74 -2.459 -2.633 -2.583 646 HB3 TYR 74 HB3 TYR 74 -2.911 -1.399 -3.755 647 HD1 TYR 74 HD1 TYR 74 -5.704 -1.147 -3.836 648 HD2 TYR 74 HD2 TYR 74 -3.221 -2.168 -0.452 649 HE1 TYR 74 HE1 TYR 74 -7.519 -0.442 -2.305 650 HE2 TYR 74 HE2 TYR 74 -5.022 -1.351 1.087 651 HH TYR 74 HH TYR 74 -8.232 -0.322 -0.160 652 H ILE 75 H ILE 75 -1.804 -4.820 -3.522 653 HA ILE 75 HA ILE 75 0.007 -4.163 -5.631 654 HB ILE 75 HB ILE 75 -0.022 -6.586 -3.784 655 HG12 ILE 75 HG12 ILE 75 1.301 -3.851 -3.457 656 HG13 ILE 75 HG13 ILE 75 -0.101 -4.407 -2.554 657 HG21 ILE 75 HG21 ILE 75 2.287 -5.311 -5.329 658 HG22 ILE 75 HG22 ILE 75 2.415 -6.684 -4.208 659 HG23 ILE 75 HG23 ILE 75 1.532 -6.878 -5.705 660 HD11 ILE 75 HD11 ILE 75 2.712 -5.490 -2.321 661 HD12 ILE 75 HD12 ILE 75 1.748 -4.624 -1.115 662 HD13 ILE 75 HD13 ILE 75 1.270 -6.260 -1.607 663 H LYS 76 H LYS 76 -2.527 -6.646 -5.407 664 HA LYS 76 HA LYS 76 -1.671 -8.068 -7.807 665 HB2 LYS 76 HB2 LYS 76 -4.197 -8.166 -6.112 666 HB3 LYS 76 HB3 LYS 76 -3.893 -9.234 -7.481 667 HG2 LYS 76 HG2 LYS 76 -2.093 -9.096 -5.030 668 HG3 LYS 76 HG3 LYS 76 -3.431 -10.226 -5.231 669 HD2 LYS 76 HD2 LYS 76 -2.317 -11.162 -7.260 670 HD3 LYS 76 HD3 LYS 76 -0.946 -10.057 -6.995 671 HE2 LYS 76 HE2 LYS 76 -0.587 -11.037 -4.744 672 HE3 LYS 76 HE3 LYS 76 -1.952 -12.133 -4.995 673 HZ1 LYS 76 HZ1 LYS 76 0.540 -12.120 -6.616 674 HZ2 LYS 76 HZ2 LYS 76 0.153 -13.229 -5.485 675 HZ3 LYS 76 HZ3 LYS 76 -0.725 -13.129 -6.854 676 H ASN 77 H ASN 77 -4.059 -5.412 -7.211 677 HA ASN 77 HA ASN 77 -4.933 -5.737 -10.016 678 HB2 ASN 77 HB2 ASN 77 -6.627 -4.293 -9.686 679 HB3 ASN 77 HB3 ASN 77 -6.672 -5.372 -8.283 680 HD21 ASN 77 HD21 ASN 77 -6.443 -2.636 -6.029 681 HD22 ASN 77 HD22 ASN 77 -6.123 -4.370 -6.142 682 H SER 78 H SER 78 -3.353 -3.327 -7.870 683 HA SER 78 HA SER 78 -2.739 -1.738 -10.246 684 HB2 SER 78 HB2 SER 78 -2.584 -1.067 -7.296 685 HB3 SER 78 HB3 SER 78 -1.861 -0.041 -8.548 686 HG SER 78 HG SER 78 -4.027 0.570 -8.004 687 H ASN 79 H ASN 79 -1.129 -2.871 -11.240 688 HA ASN 79 HA ASN 79 1.517 -2.804 -9.873 689 HB2 ASN 79 HB2 ASN 79 0.159 -5.117 -9.824 690 HB3 ASN 79 HB3 ASN 79 0.837 -5.301 -11.435 691 HD21 ASN 79 HD21 ASN 79 3.180 -5.453 -8.088 692 HD22 ASN 79 HD22 ASN 79 1.448 -5.085 -8.046 693 H ARG 80 H ARG 80 0.037 -3.666 -13.047 694 HA ARG 80 HA ARG 80 2.368 -2.699 -14.540 695 HB2 ARG 80 HB2 ARG 80 -0.369 -3.765 -15.356 696 HB3 ARG 80 HB3 ARG 80 0.747 -3.065 -16.513 697 HG2 ARG 80 HG2 ARG 80 1.128 -5.349 -16.683 698 HG3 ARG 80 HG3 ARG 80 2.507 -4.702 -15.812 699 HD2 ARG 80 HD2 ARG 80 1.900 -6.807 -14.822 700 HD3 ARG 80 HD3 ARG 80 1.528 -5.547 -13.671 701 HE ARG 80 HE ARG 80 -0.758 -6.049 -13.852 702 HH11 ARG 80 HH11 ARG 80 -2.523 -7.263 -14.420 703 HH12 ARG 80 HH12 ARG 80 -2.397 -8.423 -15.707 704 HH21 ARG 80 HH21 ARG 80 0.891 -7.784 -16.414 705 HH22 ARG 80 HH22 ARG 80 -0.526 -8.717 -16.808 706 H LEU 81 H LEU 81 -0.300 -1.106 -13.181 707 HA LEU 81 HA LEU 81 -0.544 1.095 -15.024 708 HB2 LEU 81 HB2 LEU 81 -2.248 0.337 -13.303 709 HB3 LEU 81 HB3 LEU 81 -1.169 0.939 -12.046 710 HG LEU 81 HG LEU 81 -1.375 3.257 -13.092 711 HD11 LEU 81 HD11 LEU 81 -3.602 1.892 -14.673 712 HD12 LEU 81 HD12 LEU 81 -3.331 3.645 -14.567 713 HD13 LEU 81 HD13 LEU 81 -2.130 2.620 -15.355 714 HD21 LEU 81 HD21 LEU 81 -2.645 2.608 -11.113 715 HD22 LEU 81 HD22 LEU 81 -3.613 3.658 -12.159 716 HD23 LEU 81 HD23 LEU 81 -3.923 1.904 -12.131 717 H GLY 82 H GLY 82 1.579 0.509 -12.238 718 HA2 GLY 82 HA2 GLY 82 2.620 3.216 -12.152 719 HA3 GLY 82 HA3 GLY 82 3.279 1.803 -11.310 720 H ARG 83 H ARG 83 4.538 3.986 -13.031 721 HA ARG 83 HA ARG 83 5.786 2.317 -15.195 722 HB2 ARG 83 HB2 ARG 83 5.058 5.265 -15.234 723 HB3 ARG 83 HB3 ARG 83 6.028 4.452 -16.463 724 HG2 ARG 83 HG2 ARG 83 3.472 3.042 -15.952 725 HG3 ARG 83 HG3 ARG 83 3.215 4.718 -16.406 726 HD2 ARG 83 HD2 ARG 83 4.991 2.811 -17.982 727 HD3 ARG 83 HD3 ARG 83 3.272 2.995 -18.298 728 HE ARG 83 HE ARG 83 5.410 4.888 -18.969 729 HH11 ARG 83 HH11 ARG 83 4.934 6.681 -20.194 730 HH12 ARG 83 HH12 ARG 83 3.278 7.149 -20.444 731 HH21 ARG 83 HH21 ARG 83 1.936 4.606 -18.580 732 HH22 ARG 83 HH22 ARG 83 1.622 6.012 -19.561 733 H THR 84 H THR 84 7.863 2.516 -15.653 734 HA THR 84 HA THR 84 9.691 3.140 -13.533 735 HB THR 84 HB THR 84 10.045 1.317 -15.028 736 HG1 THR 84 HG1 THR 84 12.206 1.677 -15.368 737 HG21 THR 84 HG21 THR 84 10.836 3.165 -17.294 738 HG22 THR 84 HG22 THR 84 10.576 1.411 -17.307 739 HG23 THR 84 HG23 THR 84 9.193 2.511 -17.174 740 H ASN 85 H ASN 85 9.978 5.128 -12.877 741 HA ASN 85 HA ASN 85 10.868 7.244 -14.797 742 HB2 ASN 85 HB2 ASN 85 8.862 7.485 -12.515 743 HB3 ASN 85 HB3 ASN 85 9.678 8.864 -13.245 744 HD21 ASN 85 HD21 ASN 85 6.613 7.105 -15.260 745 HD22 ASN 85 HD22 ASN 85 7.286 6.308 -13.836 746 H ASN 86 H ASN 86 12.937 7.572 -14.387 747 HA ASN 86 HA ASN 86 13.942 7.893 -11.620 748 HB2 ASN 86 HB2 ASN 86 14.751 5.728 -13.599 749 HB3 ASN 86 HB3 ASN 86 15.936 6.365 -12.468 750 HD21 ASN 86 HD21 ASN 86 14.399 4.995 -9.558 751 HD22 ASN 86 HD22 ASN 86 15.369 6.348 -10.126 752 H LEU 87 H LEU 87 16.067 8.776 -11.493 753 HA LEU 87 HA LEU 87 16.670 10.730 -13.604 754 HB2 LEU 87 HB2 LEU 87 17.385 10.473 -10.667 755 HB3 LEU 87 HB3 LEU 87 18.334 11.487 -11.738 756 HG LEU 87 HG LEU 87 16.319 12.794 -12.355 757 HD11 LEU 87 HD11 LEU 87 14.959 11.174 -10.156 758 HD12 LEU 87 HD12 LEU 87 14.333 12.693 -10.836 759 HD13 LEU 87 HD13 LEU 87 14.476 11.275 -11.869 760 HD21 LEU 87 HD21 LEU 87 17.872 13.527 -10.585 761 HD22 LEU 87 HD22 LEU 87 16.212 14.028 -10.233 762 HD23 LEU 87 HD23 LEU 87 16.918 12.642 -9.371 763 H LYS 88 H LYS 88 18.935 11.135 -14.043 764 HA LYS 88 HA LYS 88 20.527 8.640 -14.491 765 HB2 LYS 88 HB2 LYS 88 20.989 9.583 -16.772 766 HB3 LYS 88 HB3 LYS 88 19.327 9.070 -16.501 767 HG2 LYS 88 HG2 LYS 88 18.541 11.318 -16.202 768 HG3 LYS 88 HG3 LYS 88 20.181 11.978 -16.173 769 HD2 LYS 88 HD2 LYS 88 18.893 10.621 -18.582 770 HD3 LYS 88 HD3 LYS 88 18.958 12.370 -18.311 771 HE2 LYS 88 HE2 LYS 88 21.450 12.271 -18.280 772 HE3 LYS 88 HE3 LYS 88 21.380 10.537 -18.614 773 HZ1 LYS 88 HZ1 LYS 88 20.335 12.659 -20.412 774 HZ2 LYS 88 HZ2 LYS 88 21.702 11.801 -20.653 775 HZ3 LYS 88 HZ3 LYS 88 20.254 11.056 -20.716 776 H THR 89 H THR 89 20.733 11.075 -12.613 777 HA THR 89 HA THR 89 23.606 11.173 -12.703 778 HB THR 89 HB THR 89 23.090 13.119 -14.105 779 HG1 THR 89 HG1 THR 89 24.388 14.509 -12.891 780 HG21 THR 89 HG21 THR 89 21.865 14.434 -11.643 781 HG22 THR 89 HG22 THR 89 22.083 15.131 -13.261 782 HG23 THR 89 HG23 THR 89 20.911 13.825 -13.016 783 H ILE 90 H ILE 90 24.168 10.649 -10.738 784 HA ILE 90 HA ILE 90 22.821 11.830 -8.390 785 HB ILE 90 HB ILE 90 23.508 9.465 -7.395 786 HG12 ILE 90 HG12 ILE 90 24.530 8.617 -9.535 787 HG13 ILE 90 HG13 ILE 90 23.516 7.579 -8.569 788 HG21 ILE 90 HG21 ILE 90 20.983 9.903 -9.012 789 HG22 ILE 90 HG22 ILE 90 21.207 8.670 -7.746 790 HG23 ILE 90 HG23 ILE 90 21.273 10.391 -7.332 791 HD11 ILE 90 HD11 ILE 90 22.652 8.875 -11.190 792 HD12 ILE 90 HD12 ILE 90 23.008 7.174 -10.884 793 HD13 ILE 90 HD13 ILE 90 21.601 7.903 -10.136 794 H GLY 91 H GLY 91 25.593 11.762 -10.086 795 HA2 GLY 91 HA2 GLY 91 27.830 12.065 -9.660 796 HA3 GLY 91 HA3 GLY 91 27.426 12.446 -7.973 797 H ILE 92 H ILE 92 26.363 9.377 -9.218 798 HA ILE 92 HA ILE 92 28.582 7.995 -7.861 799 HB ILE 92 HB ILE 92 25.962 6.767 -7.466 800 HG12 ILE 92 HG12 ILE 92 26.970 9.235 -5.992 801 HG13 ILE 92 HG13 ILE 92 25.460 9.025 -6.897 802 HG21 ILE 92 HG21 ILE 92 28.469 7.058 -5.736 803 HG22 ILE 92 HG22 ILE 92 27.136 5.894 -5.498 804 HG23 ILE 92 HG23 ILE 92 28.230 5.736 -6.874 805 HD11 ILE 92 HD11 ILE 92 26.302 7.698 -4.320 806 HD12 ILE 92 HD12 ILE 92 25.003 8.900 -4.528 807 HD13 ILE 92 HD13 ILE 92 24.820 7.259 -5.220 808 H LEU 93 H LEU 93 26.314 7.895 -10.214 809 HA LEU 93 HA LEU 93 27.177 5.379 -11.493 810 HB2 LEU 93 HB2 LEU 93 24.862 6.329 -11.704 811 HB3 LEU 93 HB3 LEU 93 25.518 7.570 -12.775 812 HG LEU 93 HG LEU 93 26.267 5.694 -14.332 813 HD11 LEU 93 HD11 LEU 93 24.636 3.967 -12.414 814 HD12 LEU 93 HD12 LEU 93 25.198 3.469 -14.024 815 HD13 LEU 93 HD13 LEU 93 26.374 3.804 -12.756 816 HD21 LEU 93 HD21 LEU 93 24.152 6.911 -14.686 817 HD22 LEU 93 HD22 LEU 93 24.007 5.214 -15.168 818 HD23 LEU 93 HD23 LEU 93 23.303 5.760 -13.628 819 H GLN 94 H GLN 94 29.338 6.539 -10.889 820 HA GLN 94 HA GLN 94 30.507 8.274 -12.935 821 HB2 GLN 94 HB2 GLN 94 31.075 7.413 -10.088 822 HB3 GLN 94 HB3 GLN 94 32.444 7.934 -11.086 823 HG2 GLN 94 HG2 GLN 94 31.081 10.037 -11.653 824 HG3 GLN 94 HG3 GLN 94 29.977 9.549 -10.363 825 HE21 GLN 94 HE21 GLN 94 32.249 10.639 -7.803 826 HE22 GLN 94 HE22 GLN 94 30.662 9.969 -8.160 827 H GLU 95 H GLU 95 30.408 4.878 -12.582 828 HA GLU 95 HA GLU 95 33.102 4.349 -13.612 829 HB2 GLU 95 HB2 GLU 95 31.942 2.806 -12.073 830 HB3 GLU 95 HB3 GLU 95 30.721 2.485 -13.308 831 HG2 GLU 95 HG2 GLU 95 32.513 1.607 -14.820 832 HG3 GLU 95 HG3 GLU 95 33.716 1.952 -13.580 833 H GLU 96 H GLU 96 33.560 5.013 -15.626 834 HA GLU 96 HA GLU 96 32.008 3.962 -17.910 835 HB2 GLU 96 HB2 GLU 96 31.035 6.219 -17.264 836 HB3 GLU 96 HB3 GLU 96 32.581 6.949 -17.688 837 HG2 GLU 96 HG2 GLU 96 32.327 6.054 -20.015 838 HG3 GLU 96 HG3 GLU 96 30.815 5.281 -19.546 839 H VAL 97 H VAL 97 33.973 2.653 -17.717 840 HA VAL 97 HA VAL 97 36.034 3.707 -19.565 841 HB VAL 97 HB VAL 97 36.774 2.178 -17.043 842 HG11 VAL 97 HG11 VAL 97 38.508 3.504 -19.180 843 HG12 VAL 97 HG12 VAL 97 39.102 2.699 -17.710 844 HG13 VAL 97 HG13 VAL 97 38.295 1.754 -18.961 845 HG21 VAL 97 HG21 VAL 97 36.206 4.455 -16.370 846 HG22 VAL 97 HG22 VAL 97 37.953 4.226 -16.304 847 HG23 VAL 97 HG23 VAL 97 37.232 5.121 -17.663 848 H SER 98 H SER 98 34.799 2.494 -21.048 849 HA SER 98 HA SER 98 36.085 -0.009 -21.572 850 HB2 SER 98 HB2 SER 98 34.463 -0.960 -20.042 851 HB3 SER 98 HB3 SER 98 33.121 -0.237 -20.943 852 HG SER 98 HG SER 98 33.533 -2.463 -21.489 853 H SER 99 H SER 99 32.785 0.970 -22.603 854 HA SER 99 HA SER 99 33.596 0.842 -25.422 855 HB2 SER 99 HB2 SER 99 31.154 1.108 -25.813 856 HB3 SER 99 HB3 SER 99 31.567 -0.258 -24.761 857 HG SER 99 HG SER 99 29.815 0.990 -23.927 858 H MET 100 H MET 100 32.709 3.318 -23.109 859 HA MET 100 HA MET 100 33.625 5.422 -25.011 860 HB2 MET 100 HB2 MET 100 31.273 5.554 -23.081 861 HB3 MET 100 HB3 MET 100 32.103 6.994 -23.683 862 HG2 MET 100 HG2 MET 100 31.618 6.350 -26.002 863 HG3 MET 100 HG3 MET 100 30.752 4.914 -25.439 864 HE1 MET 100 HE1 MET 100 28.926 6.033 -27.231 865 HE2 MET 100 HE2 MET 100 28.093 7.569 -26.909 866 HE3 MET 100 HE3 MET 100 29.810 7.571 -27.356 867 H GLU 101 H GLU 101 35.059 6.833 -24.193 868 HA GLU 101 HA GLU 101 35.486 7.277 -21.358 869 HB2 GLU 101 HB2 GLU 101 36.783 5.133 -21.925 870 HB3 GLU 101 HB3 GLU 101 37.836 6.102 -22.934 871 HG2 GLU 101 HG2 GLU 101 37.296 6.611 -19.972 872 HG3 GLU 101 HG3 GLU 101 38.596 5.588 -20.562 873 H ALA 102 H ALA 102 34.953 9.422 -21.892 874 HA ALA 102 HA ALA 102 36.885 10.973 -23.515 875 HB1 ALA 102 HB1 ALA 102 33.892 10.855 -24.102 876 HB2 ALA 102 HB2 ALA 102 35.072 11.916 -24.900 877 HB3 ALA 102 HB3 ALA 102 35.182 10.162 -25.112 878 H LYS 103 H LYS 103 36.660 13.248 -23.356 879 HA LYS 103 HA LYS 103 35.975 14.119 -20.610 880 HB2 LYS 103 HB2 LYS 103 37.619 15.452 -22.799 881 HB3 LYS 103 HB3 LYS 103 37.416 16.047 -21.146 882 HG2 LYS 103 HG2 LYS 103 38.506 14.010 -20.255 883 HG3 LYS 103 HG3 LYS 103 38.712 13.390 -21.905 884 HD2 LYS 103 HD2 LYS 103 40.079 15.397 -22.476 885 HD3 LYS 103 HD3 LYS 103 39.944 15.944 -20.790 886 HE2 LYS 103 HE2 LYS 103 41.035 13.856 -20.021 887 HE3 LYS 103 HE3 LYS 103 41.127 13.276 -21.689 888 HZ1 LYS 103 HZ1 LYS 103 42.503 15.699 -20.654 889 HZ2 LYS 103 HZ2 LYS 103 43.224 14.276 -20.992 890 HZ3 LYS 103 HZ3 LYS 103 42.582 15.166 -22.197 891 H SER 104 H SER 104 33.652 13.984 -21.147 892 HA SER 104 HA SER 104 32.669 16.657 -22.026 893 HB2 SER 104 HB2 SER 104 32.358 14.920 -23.868 894 HB3 SER 104 HB3 SER 104 31.202 14.117 -22.784 895 HG SER 104 HG SER 104 30.012 15.555 -23.990 896 H MET 105 H MET 105 30.403 17.026 -21.383 897 HA MET 105 HA MET 105 29.598 15.796 -18.784 898 HB2 MET 105 HB2 MET 105 30.961 17.795 -18.298 899 HB3 MET 105 HB3 MET 105 29.905 18.781 -19.316 900 HG2 MET 105 HG2 MET 105 27.998 18.271 -17.806 901 HG3 MET 105 HG3 MET 105 29.060 17.276 -16.805 902 HE1 MET 105 HE1 MET 105 28.153 18.681 -14.702 903 HE2 MET 105 HE2 MET 105 28.240 20.454 -14.600 904 HE3 MET 105 HE3 MET 105 27.167 19.686 -15.791 905 H THR 106 H THR 106 27.919 14.733 -19.730 906 HA THR 106 HA THR 106 25.829 14.350 -20.549 907 HB THR 106 HB THR 106 25.037 17.081 -19.678 908 HG1 THR 106 HG1 THR 106 25.065 16.401 -17.514 909 HG21 THR 106 HG21 THR 106 23.850 14.303 -19.140 910 HG22 THR 106 HG22 THR 106 23.123 15.839 -18.607 911 HG23 THR 106 HG23 THR 106 23.229 15.458 -20.328 912 H TRP 107 H TRP 107 27.583 15.692 -22.331 913 HA TRP 107 HA TRP 107 25.625 16.399 -24.445 914 HB2 TRP 107 HB2 TRP 107 27.193 18.294 -23.245 915 HB3 TRP 107 HB3 TRP 107 28.242 17.828 -24.566 916 HD1 TRP 107 HD1 TRP 107 27.555 18.679 -26.962 917 HE1 TRP 107 HE1 TRP 107 25.776 20.313 -27.848 918 HE3 TRP 107 HE3 TRP 107 24.630 19.032 -22.772 919 HZ2 TRP 107 HZ2 TRP 107 23.403 21.625 -26.849 920 HZ3 TRP 107 HZ3 TRP 107 22.617 20.492 -22.763 921 HH2 TRP 107 HH2 TRP 107 21.996 21.791 -24.790 Start of MODEL 30 1 H1 GLY -5 H1 GLY -5 35.746 -10.354 -13.676 2 H2 GLY -5 H2 GLY -5 34.864 -9.435 -14.707 3 H3 GLY -5 H3 GLY -5 36.121 -8.775 -13.889 4 HA2 GLY -5 HA2 GLY -5 36.765 -9.137 -16.162 5 HA3 GLY -5 HA3 GLY -5 37.700 -10.168 -15.067 6 H SER -4 H SER -4 37.998 -12.118 -16.002 7 HA SER -4 HA SER -4 36.170 -13.133 -18.038 8 HB2 SER -4 HB2 SER -4 37.944 -14.845 -18.331 9 HB3 SER -4 HB3 SER -4 38.539 -13.180 -18.432 10 HG SER -4 HG SER -4 39.882 -14.515 -17.113 11 H HIS -3 H HIS -3 36.396 -13.706 -14.649 12 HA HIS -3 HA HIS -3 35.740 -16.509 -14.646 13 HB2 HIS -3 HB2 HIS -3 36.908 -15.291 -12.809 14 HB3 HIS -3 HB3 HIS -3 35.395 -14.471 -12.419 15 HD2 HIS -3 HD2 HIS -3 36.951 -18.035 -12.488 16 HE1 HIS -3 HE1 HIS -3 33.677 -18.155 -9.753 17 HE2 HIS -3 HE2 HIS -3 35.630 -19.476 -10.717 18 H MET -2 H MET -2 33.867 -17.593 -14.561 19 HA MET -2 HA MET -2 31.258 -16.351 -14.058 20 HB2 MET -2 HB2 MET -2 31.815 -15.901 -16.523 21 HB3 MET -2 HB3 MET -2 31.856 -17.643 -16.758 22 HG2 MET -2 HG2 MET -2 29.711 -16.849 -17.461 23 HG3 MET -2 HG3 MET -2 29.479 -17.773 -15.988 24 HE1 MET -2 HE1 MET -2 29.240 -14.375 -17.809 25 HE2 MET -2 HE2 MET -2 28.995 -13.190 -16.509 26 HE3 MET -2 HE3 MET -2 30.580 -13.960 -16.716 27 H ALA -1 H ALA -1 29.834 -17.805 -13.220 28 HA ALA -1 HA ALA -1 30.052 -20.603 -13.940 29 HB1 ALA -1 HB1 ALA -1 30.343 -19.765 -11.013 30 HB2 ALA -1 HB2 ALA -1 30.158 -21.436 -11.591 31 HB3 ALA -1 HB3 ALA -1 31.609 -20.509 -12.015 32 H SER 0 H SER 0 28.188 -21.483 -14.206 33 HA SER 0 HA SER 0 25.682 -20.659 -12.850 34 HB2 SER 0 HB2 SER 0 26.328 -20.223 -15.789 35 HB3 SER 0 HB3 SER 0 24.660 -20.275 -15.162 36 HG SER 0 HG SER 0 25.441 -18.137 -15.295 37 H MET 1 H MET 1 26.191 -22.959 -12.169 38 HA MET 1 HA MET 1 25.156 -24.955 -14.129 39 HB2 MET 1 HB2 MET 1 27.733 -24.713 -14.012 40 HB3 MET 1 HB3 MET 1 27.614 -25.509 -12.442 41 HG2 MET 1 HG2 MET 1 26.523 -27.459 -13.561 42 HG3 MET 1 HG3 MET 1 26.591 -26.601 -15.101 43 HE1 MET 1 HE1 MET 1 27.696 -28.721 -16.218 44 HE2 MET 1 HE2 MET 1 29.142 -29.534 -15.583 45 HE3 MET 1 HE3 MET 1 27.626 -29.573 -14.658 46 H ASP 2 H ASP 2 23.771 -23.766 -11.873 47 HA ASP 2 HA ASP 2 23.634 -25.965 -9.876 48 HB2 ASP 2 HB2 ASP 2 24.041 -23.537 -9.248 49 HB3 ASP 2 HB3 ASP 2 22.346 -23.245 -9.656 50 HA PRO 3 HA PRO 3 19.658 -26.930 -11.847 51 HB2 PRO 3 HB2 PRO 3 19.190 -29.402 -10.821 52 HB3 PRO 3 HB3 PRO 3 20.525 -29.106 -11.978 53 HG2 PRO 3 HG2 PRO 3 20.679 -29.216 -8.947 54 HG3 PRO 3 HG3 PRO 3 21.711 -30.071 -10.134 55 HD2 PRO 3 HD2 PRO 3 22.436 -27.691 -8.967 56 HD3 PRO 3 HD3 PRO 3 22.916 -28.124 -10.635 57 H LEU 4 H LEU 4 20.094 -26.017 -8.698 58 HA LEU 4 HA LEU 4 17.226 -26.373 -7.972 59 HB2 LEU 4 HB2 LEU 4 19.620 -25.896 -6.165 60 HB3 LEU 4 HB3 LEU 4 17.962 -26.145 -5.647 61 HG LEU 4 HG LEU 4 19.674 -28.226 -7.053 62 HD11 LEU 4 HD11 LEU 4 18.739 -28.003 -4.163 63 HD12 LEU 4 HD12 LEU 4 19.669 -29.345 -4.870 64 HD13 LEU 4 HD13 LEU 4 20.395 -27.736 -4.750 65 HD21 LEU 4 HD21 LEU 4 17.294 -28.588 -7.569 66 HD22 LEU 4 HD22 LEU 4 17.854 -29.796 -6.411 67 HD23 LEU 4 HD23 LEU 4 16.875 -28.423 -5.847 68 H ASP 5 H ASP 5 17.838 -24.348 -9.778 69 HA ASP 5 HA ASP 5 17.477 -21.867 -8.186 70 HB2 ASP 5 HB2 ASP 5 18.886 -22.542 -10.625 71 HB3 ASP 5 HB3 ASP 5 17.677 -21.342 -11.009 72 H LYS 6 H LYS 6 15.404 -24.024 -9.303 73 HA LYS 6 HA LYS 6 13.416 -22.045 -10.397 74 HB2 LYS 6 HB2 LYS 6 13.286 -24.961 -11.156 75 HB3 LYS 6 HB3 LYS 6 12.650 -23.547 -11.959 76 HG2 LYS 6 HG2 LYS 6 14.382 -23.880 -13.366 77 HG3 LYS 6 HG3 LYS 6 15.274 -22.957 -12.160 78 HD2 LYS 6 HD2 LYS 6 16.599 -24.865 -12.746 79 HD3 LYS 6 HD3 LYS 6 15.986 -25.160 -11.112 80 HE2 LYS 6 HE2 LYS 6 14.215 -26.630 -12.019 81 HE3 LYS 6 HE3 LYS 6 14.738 -26.276 -13.669 82 HZ1 LYS 6 HZ1 LYS 6 16.469 -27.580 -11.631 83 HZ2 LYS 6 HZ2 LYS 6 15.631 -28.397 -12.783 84 HZ3 LYS 6 HZ3 LYS 6 16.824 -27.372 -13.215 85 H ILE 7 H ILE 7 13.447 -25.236 -8.912 86 HA ILE 7 HA ILE 7 10.943 -24.636 -7.397 87 HB ILE 7 HB ILE 7 10.220 -26.987 -7.878 88 HG12 ILE 7 HG12 ILE 7 11.055 -28.074 -9.942 89 HG13 ILE 7 HG13 ILE 7 12.386 -26.926 -10.030 90 HG21 ILE 7 HG21 ILE 7 10.512 -25.204 -10.324 91 HG22 ILE 7 HG22 ILE 7 9.280 -26.447 -10.035 92 HG23 ILE 7 HG23 ILE 7 9.312 -24.994 -9.029 93 HD11 ILE 7 HD11 ILE 7 11.947 -28.892 -7.742 94 HD12 ILE 7 HD12 ILE 7 13.018 -29.161 -9.130 95 HD13 ILE 7 HD13 ILE 7 13.377 -27.854 -7.996 96 H ILE 8 H ILE 8 13.920 -24.840 -6.755 97 HA ILE 8 HA ILE 8 14.709 -26.815 -5.087 98 HB ILE 8 HB ILE 8 15.974 -24.806 -5.520 99 HG12 ILE 8 HG12 ILE 8 15.698 -25.392 -2.534 100 HG13 ILE 8 HG13 ILE 8 16.622 -26.347 -3.691 101 HG21 ILE 8 HG21 ILE 8 14.449 -23.346 -3.342 102 HG22 ILE 8 HG22 ILE 8 15.674 -22.698 -4.452 103 HG23 ILE 8 HG23 ILE 8 14.074 -23.153 -5.058 104 HD11 ILE 8 HD11 ILE 8 17.204 -23.487 -2.811 105 HD12 ILE 8 HD12 ILE 8 18.126 -24.947 -2.422 106 HD13 ILE 8 HD13 ILE 8 18.099 -24.345 -4.088 107 H ASN 9 H ASN 9 13.895 -27.937 -3.462 108 HA ASN 9 HA ASN 9 12.695 -26.746 -1.093 109 HB2 ASN 9 HB2 ASN 9 11.030 -27.936 -3.294 110 HB3 ASN 9 HB3 ASN 9 10.635 -28.487 -1.659 111 HD21 ASN 9 HD21 ASN 9 9.599 -25.176 -0.611 112 HD22 ASN 9 HD22 ASN 9 10.635 -26.481 -0.021 113 H ASP 10 H ASP 10 13.917 -27.907 0.410 114 HA ASP 10 HA ASP 10 13.637 -30.738 0.652 115 HB2 ASP 10 HB2 ASP 10 15.297 -30.708 -1.209 116 HB3 ASP 10 HB3 ASP 10 16.322 -29.635 -0.252 117 H ILE 11 H ILE 11 12.923 -29.937 2.622 118 HA ILE 11 HA ILE 11 12.885 -28.950 4.608 119 HB ILE 11 HB ILE 11 15.638 -30.167 4.727 120 HG12 ILE 11 HG12 ILE 11 13.942 -31.838 4.186 121 HG13 ILE 11 HG13 ILE 11 14.618 -32.091 5.777 122 HG21 ILE 11 HG21 ILE 11 13.850 -29.067 6.910 123 HG22 ILE 11 HG22 ILE 11 15.113 -30.285 7.251 124 HG23 ILE 11 HG23 ILE 11 15.559 -28.715 6.597 125 HD11 ILE 11 HD11 ILE 11 11.881 -30.864 5.211 126 HD12 ILE 11 HD12 ILE 11 12.211 -32.508 5.777 127 HD13 ILE 11 HD13 ILE 11 12.579 -31.133 6.827 128 H LYS 12 H LYS 12 12.742 -27.049 3.265 129 HA LYS 12 HA LYS 12 14.403 -24.909 4.388 130 HB2 LYS 12 HB2 LYS 12 14.943 -25.932 1.716 131 HB3 LYS 12 HB3 LYS 12 14.346 -24.291 1.562 132 HG2 LYS 12 HG2 LYS 12 16.565 -25.062 3.506 133 HG3 LYS 12 HG3 LYS 12 16.889 -24.651 1.832 134 HD2 LYS 12 HD2 LYS 12 15.422 -22.739 3.704 135 HD3 LYS 12 HD3 LYS 12 17.184 -22.799 3.557 136 HE2 LYS 12 HE2 LYS 12 16.979 -22.444 1.095 137 HE3 LYS 12 HE3 LYS 12 15.235 -22.255 1.274 138 HZ1 LYS 12 HZ1 LYS 12 17.227 -20.534 2.666 139 HZ2 LYS 12 HZ2 LYS 12 16.521 -20.123 1.262 140 HZ3 LYS 12 HZ3 LYS 12 15.611 -20.267 2.601 141 H LYS 13 H LYS 13 11.734 -25.741 2.246 142 HA LYS 13 HA LYS 13 9.874 -24.603 1.527 143 HB2 LYS 13 HB2 LYS 13 9.357 -25.498 3.837 144 HB3 LYS 13 HB3 LYS 13 9.551 -23.845 4.438 145 HG2 LYS 13 HG2 LYS 13 7.791 -23.126 2.732 146 HG3 LYS 13 HG3 LYS 13 7.582 -24.828 2.309 147 HD2 LYS 13 HD2 LYS 13 6.881 -25.333 4.619 148 HD3 LYS 13 HD3 LYS 13 7.120 -23.646 5.089 149 HE2 LYS 13 HE2 LYS 13 5.169 -24.606 2.941 150 HE3 LYS 13 HE3 LYS 13 4.726 -24.288 4.619 151 HZ1 LYS 13 HZ1 LYS 13 5.789 -22.251 2.733 152 HZ2 LYS 13 HZ2 LYS 13 4.244 -22.371 3.236 153 HZ3 LYS 13 HZ3 LYS 13 5.411 -21.968 4.300 154 H GLU 14 H GLU 14 11.515 -23.158 0.439 155 HA GLU 14 HA GLU 14 10.972 -20.296 1.142 156 HB2 GLU 14 HB2 GLU 14 13.365 -21.283 1.497 157 HB3 GLU 14 HB3 GLU 14 13.472 -21.258 -0.258 158 HG2 GLU 14 HG2 GLU 14 14.396 -19.210 0.287 159 HG3 GLU 14 HG3 GLU 14 12.732 -18.729 -0.012 160 H ALA 15 H ALA 15 10.155 -19.032 -0.443 161 HA ALA 15 HA ALA 15 10.491 -19.633 -3.281 162 HB1 ALA 15 HB1 ALA 15 7.710 -19.628 -2.018 163 HB2 ALA 15 HB2 ALA 15 8.073 -19.707 -3.757 164 HB3 ALA 15 HB3 ALA 15 8.537 -21.051 -2.698 165 H ASN 16 H ASN 16 9.325 -17.925 -4.626 166 HA ASN 16 HA ASN 16 8.920 -15.327 -3.286 167 HB2 ASN 16 HB2 ASN 16 11.424 -15.744 -3.839 168 HB3 ASN 16 HB3 ASN 16 10.958 -15.618 -5.531 169 HD21 ASN 16 HD21 ASN 16 11.109 -12.285 -3.144 170 HD22 ASN 16 HD22 ASN 16 11.226 -13.891 -2.445 171 H ASP 17 H ASP 17 7.724 -13.836 -4.529 172 HA ASP 17 HA ASP 17 6.252 -14.996 -6.857 173 HB2 ASP 17 HB2 ASP 17 5.552 -12.740 -4.950 174 HB3 ASP 17 HB3 ASP 17 4.591 -13.232 -6.346 175 H SER 18 H SER 18 7.548 -14.604 -8.576 176 HA SER 18 HA SER 18 8.102 -11.742 -9.282 177 HB2 SER 18 HB2 SER 18 10.136 -13.066 -8.812 178 HB3 SER 18 HB3 SER 18 9.694 -14.182 -10.120 179 HG SER 18 HG SER 18 11.134 -12.506 -10.811 180 H GLY 19 H GLY 19 6.501 -11.159 -10.561 181 HA2 GLY 19 HA2 GLY 19 5.173 -10.951 -12.399 182 HA3 GLY 19 HA3 GLY 19 6.365 -11.947 -13.275 183 H VAL 20 H VAL 20 4.258 -12.807 -10.592 184 HA VAL 20 HA VAL 20 3.250 -15.173 -11.977 185 HB VAL 20 HB VAL 20 2.622 -14.023 -9.247 186 HG11 VAL 20 HG11 VAL 20 2.132 -16.824 -10.399 187 HG12 VAL 20 HG12 VAL 20 1.913 -16.376 -8.694 188 HG13 VAL 20 HG13 VAL 20 0.873 -15.669 -9.927 189 HG21 VAL 20 HG21 VAL 20 5.003 -14.566 -9.431 190 HG22 VAL 20 HG22 VAL 20 4.201 -15.764 -8.410 191 HG23 VAL 20 HG23 VAL 20 4.617 -16.166 -10.093 192 H THR 21 H THR 21 1.206 -15.599 -12.591 193 HA THR 21 HA THR 21 -0.670 -13.780 -13.532 194 HB THR 21 HB THR 21 -0.979 -16.585 -12.498 195 HG1 THR 21 HG1 THR 21 -0.953 -17.020 -14.711 196 HG21 THR 21 HG21 THR 21 -3.004 -14.831 -13.936 197 HG22 THR 21 HG22 THR 21 -3.085 -16.622 -13.920 198 HG23 THR 21 HG23 THR 21 -3.185 -15.718 -12.401 199 H LEU 22 H LEU 22 -2.627 -13.011 -12.871 200 HA LEU 22 HA LEU 22 -3.287 -12.863 -9.997 201 HB2 LEU 22 HB2 LEU 22 -3.302 -10.321 -10.277 202 HB3 LEU 22 HB3 LEU 22 -1.747 -11.143 -10.208 203 HG LEU 22 HG LEU 22 -1.327 -10.866 -12.539 204 HD11 LEU 22 HD11 LEU 22 -4.103 -9.664 -12.803 205 HD12 LEU 22 HD12 LEU 22 -2.847 -9.641 -14.060 206 HD13 LEU 22 HD13 LEU 22 -3.534 -11.183 -13.545 207 HD21 LEU 22 HD21 LEU 22 -0.869 -8.947 -11.046 208 HD22 LEU 22 HD22 LEU 22 -1.206 -8.455 -12.716 209 HD23 LEU 22 HD23 LEU 22 -2.456 -8.264 -11.469 210 H ALA 23 H ALA 23 -4.697 -14.234 -11.953 211 HA ALA 23 HA ALA 23 -7.156 -12.583 -12.383 212 HB1 ALA 23 HB1 ALA 23 -6.049 -14.894 -13.996 213 HB2 ALA 23 HB2 ALA 23 -7.558 -14.008 -14.324 214 HB3 ALA 23 HB3 ALA 23 -5.995 -13.170 -14.424 215 HA PRO 24 HA PRO 24 -8.657 -15.839 -9.482 216 HB2 PRO 24 HB2 PRO 24 -10.451 -14.384 -8.074 217 HB3 PRO 24 HB3 PRO 24 -8.689 -14.179 -7.832 218 HG2 PRO 24 HG2 PRO 24 -10.524 -12.509 -9.596 219 HG3 PRO 24 HG3 PRO 24 -9.400 -11.935 -8.332 220 HD2 PRO 24 HD2 PRO 24 -8.701 -12.017 -10.973 221 HD3 PRO 24 HD3 PRO 24 -7.506 -12.378 -9.693 222 H LEU 25 H LEU 25 -10.275 -13.866 -11.817 223 HA LEU 25 HA LEU 25 -12.409 -15.842 -12.306 224 HB2 LEU 25 HB2 LEU 25 -13.016 -13.774 -10.662 225 HB3 LEU 25 HB3 LEU 25 -13.121 -12.902 -12.176 226 HG LEU 25 HG LEU 25 -14.794 -14.736 -12.930 227 HD11 LEU 25 HD11 LEU 25 -14.772 -15.317 -9.934 228 HD12 LEU 25 HD12 LEU 25 -15.937 -15.955 -11.113 229 HD13 LEU 25 HD13 LEU 25 -14.239 -16.437 -11.201 230 HD21 LEU 25 HD21 LEU 25 -15.497 -12.479 -12.245 231 HD22 LEU 25 HD22 LEU 25 -16.654 -13.698 -11.686 232 HD23 LEU 25 HD23 LEU 25 -15.497 -12.982 -10.540 233 H SER 26 H SER 26 -13.697 -14.136 -14.284 234 HA SER 26 HA SER 26 -11.775 -14.303 -16.475 235 HB2 SER 26 HB2 SER 26 -14.252 -14.963 -16.533 236 HB3 SER 26 HB3 SER 26 -14.593 -13.231 -16.689 237 HG SER 26 HG SER 26 -14.377 -14.310 -18.727 238 H VAL 27 H VAL 27 -10.730 -12.575 -14.734 239 HA VAL 27 HA VAL 27 -10.459 -10.092 -16.209 240 HB VAL 27 HB VAL 27 -12.524 -9.741 -14.869 241 HG11 VAL 27 HG11 VAL 27 -10.757 -9.749 -12.396 242 HG12 VAL 27 HG12 VAL 27 -12.493 -9.398 -12.487 243 HG13 VAL 27 HG13 VAL 27 -11.905 -11.032 -12.827 244 HG21 VAL 27 HG21 VAL 27 -11.166 -7.813 -15.554 245 HG22 VAL 27 HG22 VAL 27 -11.955 -7.532 -13.998 246 HG23 VAL 27 HG23 VAL 27 -10.225 -7.920 -14.042 247 HA PRO 28 HA PRO 28 -6.520 -10.636 -14.009 248 HB2 PRO 28 HB2 PRO 28 -5.069 -8.575 -15.007 249 HB3 PRO 28 HB3 PRO 28 -5.588 -9.953 -16.017 250 HG2 PRO 28 HG2 PRO 28 -6.948 -7.249 -15.747 251 HG3 PRO 28 HG3 PRO 28 -6.477 -8.102 -17.252 252 HD2 PRO 28 HD2 PRO 28 -8.997 -8.248 -16.217 253 HD3 PRO 28 HD3 PRO 28 -8.242 -9.635 -17.051 254 H LYS 29 H LYS 29 -8.072 -10.185 -12.220 255 HA LYS 29 HA LYS 29 -8.635 -9.406 -10.221 256 HB2 LYS 29 HB2 LYS 29 -6.048 -9.076 -10.108 257 HB3 LYS 29 HB3 LYS 29 -6.426 -7.370 -10.208 258 HG2 LYS 29 HG2 LYS 29 -6.247 -7.752 -7.906 259 HG3 LYS 29 HG3 LYS 29 -8.003 -7.815 -8.162 260 HD2 LYS 29 HD2 LYS 29 -7.912 -10.267 -8.240 261 HD3 LYS 29 HD3 LYS 29 -6.159 -10.215 -7.995 262 HE2 LYS 29 HE2 LYS 29 -6.531 -9.034 -5.814 263 HE3 LYS 29 HE3 LYS 29 -8.273 -9.121 -6.068 264 HZ1 LYS 29 HZ1 LYS 29 -6.487 -11.495 -5.802 265 HZ2 LYS 29 HZ2 LYS 29 -7.473 -10.927 -4.634 266 HZ3 LYS 29 HZ3 LYS 29 -8.109 -11.552 -5.993 267 HA PRO 30 HA PRO 30 -11.140 -5.864 -11.416 268 HB2 PRO 30 HB2 PRO 30 -13.093 -5.998 -9.557 269 HB3 PRO 30 HB3 PRO 30 -12.966 -7.156 -10.926 270 HG2 PRO 30 HG2 PRO 30 -12.116 -7.547 -8.044 271 HG3 PRO 30 HG3 PRO 30 -12.943 -8.705 -9.127 272 HD2 PRO 30 HD2 PRO 30 -10.214 -8.701 -8.641 273 HD3 PRO 30 HD3 PRO 30 -10.948 -9.313 -10.150 274 H LYS 31 H LYS 31 -10.389 -3.884 -11.055 275 HA LYS 31 HA LYS 31 -8.852 -3.072 -8.915 276 HB2 LYS 31 HB2 LYS 31 -10.471 -1.364 -10.851 277 HB3 LYS 31 HB3 LYS 31 -9.283 -0.718 -9.716 278 HG2 LYS 31 HG2 LYS 31 -7.485 -2.031 -10.757 279 HG3 LYS 31 HG3 LYS 31 -8.648 -2.762 -11.866 280 HD2 LYS 31 HD2 LYS 31 -7.534 -1.098 -13.086 281 HD3 LYS 31 HD3 LYS 31 -9.148 -0.472 -12.801 282 HE2 LYS 31 HE2 LYS 31 -6.720 0.294 -11.098 283 HE3 LYS 31 HE3 LYS 31 -7.130 1.109 -12.605 284 HZ1 LYS 31 HZ1 LYS 31 -8.732 1.141 -10.106 285 HZ2 LYS 31 HZ2 LYS 31 -8.091 2.382 -10.914 286 HZ3 LYS 31 HZ3 LYS 31 -9.359 1.594 -11.565 287 H LEU 32 H LEU 32 -9.025 -1.892 -7.072 288 HA LEU 32 HA LEU 32 -11.655 -1.133 -5.968 289 HB2 LEU 32 HB2 LEU 32 -11.192 -3.493 -5.394 290 HB3 LEU 32 HB3 LEU 32 -9.590 -3.060 -4.823 291 HG LEU 32 HG LEU 32 -11.440 -1.374 -3.451 292 HD11 LEU 32 HD11 LEU 32 -12.225 -4.308 -3.302 293 HD12 LEU 32 HD12 LEU 32 -12.848 -3.005 -2.262 294 HD13 LEU 32 HD13 LEU 32 -13.204 -2.999 -4.001 295 HD21 LEU 32 HD21 LEU 32 -9.216 -2.245 -2.657 296 HD22 LEU 32 HD22 LEU 32 -10.527 -2.386 -1.456 297 HD23 LEU 32 HD23 LEU 32 -9.998 -3.811 -2.371 298 H GLU 33 H GLU 33 -11.523 0.741 -4.868 299 HA GLU 33 HA GLU 33 -8.898 1.792 -3.894 300 HB2 GLU 33 HB2 GLU 33 -11.005 3.376 -5.444 301 HB3 GLU 33 HB3 GLU 33 -9.565 4.023 -4.674 302 HG2 GLU 33 HG2 GLU 33 -8.956 3.925 -6.890 303 HG3 GLU 33 HG3 GLU 33 -8.164 2.529 -6.173 304 H GLU 34 H GLU 34 -9.804 0.762 -1.950 305 HA GLU 34 HA GLU 34 -11.920 2.360 -0.612 306 HB2 GLU 34 HB2 GLU 34 -12.070 -0.190 -1.202 307 HB3 GLU 34 HB3 GLU 34 -11.145 -0.420 0.276 308 HG2 GLU 34 HG2 GLU 34 -13.725 1.179 0.000 309 HG3 GLU 34 HG3 GLU 34 -13.668 -0.517 0.477 310 H LEU 35 H LEU 35 -10.345 3.985 -0.170 311 HA LEU 35 HA LEU 35 -9.179 3.644 2.541 312 HB2 LEU 35 HB2 LEU 35 -7.845 4.917 0.110 313 HB3 LEU 35 HB3 LEU 35 -7.223 5.018 1.749 314 HG LEU 35 HG LEU 35 -7.580 2.401 0.221 315 HD11 LEU 35 HD11 LEU 35 -5.063 3.996 0.717 316 HD12 LEU 35 HD12 LEU 35 -5.200 2.407 -0.077 317 HD13 LEU 35 HD13 LEU 35 -5.912 3.835 -0.846 318 HD21 LEU 35 HD21 LEU 35 -7.546 2.161 2.718 319 HD22 LEU 35 HD22 LEU 35 -6.120 1.449 1.944 320 HD23 LEU 35 HD23 LEU 35 -5.985 3.010 2.751 321 H SER 36 H SER 36 -9.195 5.500 3.814 322 HA SER 36 HA SER 36 -11.053 7.678 3.171 323 HB2 SER 36 HB2 SER 36 -9.094 7.395 5.484 324 HB3 SER 36 HB3 SER 36 -10.431 8.551 5.362 325 HG SER 36 HG SER 36 -11.016 6.726 6.609 326 H GLU 37 H GLU 37 -10.208 10.063 3.464 327 HA GLU 37 HA GLU 37 -8.534 10.597 1.311 328 HB2 GLU 37 HB2 GLU 37 -10.208 12.113 2.491 329 HB3 GLU 37 HB3 GLU 37 -8.971 12.417 3.707 330 HG2 GLU 37 HG2 GLU 37 -8.865 14.241 2.239 331 HG3 GLU 37 HG3 GLU 37 -7.475 13.258 1.805 332 H GLN 38 H GLN 38 -7.521 10.539 4.766 333 HA GLN 38 HA GLN 38 -4.747 11.210 4.145 334 HB2 GLN 38 HB2 GLN 38 -5.921 11.687 6.337 335 HB3 GLN 38 HB3 GLN 38 -5.893 9.951 6.667 336 HG2 GLN 38 HG2 GLN 38 -3.314 10.108 6.353 337 HG3 GLN 38 HG3 GLN 38 -3.530 11.858 6.382 338 HE21 GLN 38 HE21 GLN 38 -3.963 9.641 9.832 339 HE22 GLN 38 HE22 GLN 38 -3.957 8.841 8.266 340 H GLN 39 H GLN 39 -6.491 8.188 4.884 341 HA GLN 39 HA GLN 39 -4.372 6.300 4.813 342 HB2 GLN 39 HB2 GLN 39 -7.313 6.279 4.268 343 HB3 GLN 39 HB3 GLN 39 -6.386 4.851 3.889 344 HG2 GLN 39 HG2 GLN 39 -6.086 6.100 6.633 345 HG3 GLN 39 HG3 GLN 39 -7.550 5.202 6.264 346 HE21 GLN 39 HE21 GLN 39 -4.933 2.857 7.718 347 HE22 GLN 39 HE22 GLN 39 -5.454 4.459 8.255 348 H LYS 40 H LYS 40 -6.336 7.597 2.115 349 HA LYS 40 HA LYS 40 -5.145 6.150 -0.028 350 HB2 LYS 40 HB2 LYS 40 -7.273 7.378 -0.091 351 HB3 LYS 40 HB3 LYS 40 -6.421 8.919 0.062 352 HG2 LYS 40 HG2 LYS 40 -5.276 8.524 -2.089 353 HG3 LYS 40 HG3 LYS 40 -6.096 6.964 -2.258 354 HD2 LYS 40 HD2 LYS 40 -7.488 9.678 -2.067 355 HD3 LYS 40 HD3 LYS 40 -7.129 8.831 -3.581 356 HE2 LYS 40 HE2 LYS 40 -8.539 6.914 -2.843 357 HE3 LYS 40 HE3 LYS 40 -8.926 7.775 -1.347 358 HZ1 LYS 40 HZ1 LYS 40 -9.612 8.722 -4.079 359 HZ2 LYS 40 HZ2 LYS 40 -10.663 8.088 -3.003 360 HZ3 LYS 40 HZ3 LYS 40 -9.954 9.526 -2.696 361 H ILE 41 H ILE 41 -4.159 9.264 1.505 362 HA ILE 41 HA ILE 41 -1.999 9.666 -0.391 363 HB ILE 41 HB ILE 41 -2.545 10.943 2.298 364 HG12 ILE 41 HG12 ILE 41 -2.953 12.245 -0.434 365 HG13 ILE 41 HG13 ILE 41 -4.228 11.283 0.287 366 HG21 ILE 41 HG21 ILE 41 -0.584 11.825 0.147 367 HG22 ILE 41 HG22 ILE 41 -1.027 12.792 1.567 368 HG23 ILE 41 HG23 ILE 41 -0.188 11.270 1.790 369 HD11 ILE 41 HD11 ILE 41 -3.029 13.802 1.497 370 HD12 ILE 41 HD12 ILE 41 -4.650 13.583 0.817 371 HD13 ILE 41 HD13 ILE 41 -4.201 12.736 2.310 372 H ILE 42 H ILE 42 -2.111 8.170 2.900 373 HA ILE 42 HA ILE 42 0.743 7.811 3.107 374 HB ILE 42 HB ILE 42 -1.496 6.025 4.118 375 HG12 ILE 42 HG12 ILE 42 0.115 7.988 5.801 376 HG13 ILE 42 HG13 ILE 42 -1.323 8.527 4.949 377 HG21 ILE 42 HG21 ILE 42 1.468 6.133 4.865 378 HG22 ILE 42 HG22 ILE 42 0.244 5.208 5.751 379 HG23 ILE 42 HG23 ILE 42 0.626 4.777 4.092 380 HD11 ILE 42 HD11 ILE 42 -1.242 6.304 7.019 381 HD12 ILE 42 HD12 ILE 42 -1.978 7.911 7.178 382 HD13 ILE 42 HD13 ILE 42 -2.653 6.731 6.031 383 H LEU 43 H LEU 43 -1.796 5.889 1.553 384 HA LEU 43 HA LEU 43 -0.190 3.770 0.550 385 HB2 LEU 43 HB2 LEU 43 -2.788 4.128 0.644 386 HB3 LEU 43 HB3 LEU 43 -2.605 4.943 -0.887 387 HG LEU 43 HG LEU 43 -3.351 2.745 -1.299 388 HD11 LEU 43 HD11 LEU 43 -0.388 2.596 -1.891 389 HD12 LEU 43 HD12 LEU 43 -1.731 1.873 -2.795 390 HD13 LEU 43 HD13 LEU 43 -1.524 3.640 -2.792 391 HD21 LEU 43 HD21 LEU 43 -2.780 1.664 0.769 392 HD22 LEU 43 HD22 LEU 43 -2.067 0.735 -0.561 393 HD23 LEU 43 HD23 LEU 43 -1.047 1.806 0.433 394 H ALA 44 H ALA 44 -1.177 6.812 -1.059 395 HA ALA 44 HA ALA 44 0.278 6.432 -3.455 396 HB1 ALA 44 HB1 ALA 44 -0.640 8.972 -2.056 397 HB2 ALA 44 HB2 ALA 44 -0.233 8.830 -3.782 398 HB3 ALA 44 HB3 ALA 44 -1.642 7.962 -3.122 399 H GLU 45 H GLU 45 1.198 8.434 -0.574 400 HA GLU 45 HA GLU 45 3.672 9.356 -1.628 401 HB2 GLU 45 HB2 GLU 45 2.666 8.973 1.210 402 HB3 GLU 45 HB3 GLU 45 4.226 9.703 0.854 403 HG2 GLU 45 HG2 GLU 45 1.604 10.788 -0.255 404 HG3 GLU 45 HG3 GLU 45 2.336 11.329 1.252 405 H TYR 46 H TYR 46 2.919 6.215 -0.199 406 HA TYR 46 HA TYR 46 5.675 5.493 0.326 407 HB2 TYR 46 HB2 TYR 46 3.782 4.525 1.517 408 HB3 TYR 46 HB3 TYR 46 3.134 3.869 0.022 409 HD1 TYR 46 HD1 TYR 46 2.952 1.789 1.338 410 HD2 TYR 46 HD2 TYR 46 6.783 3.536 0.385 411 HE1 TYR 46 HE1 TYR 46 4.064 -0.420 1.699 412 HE2 TYR 46 HE2 TYR 46 7.877 1.334 0.758 413 HH TYR 46 HH TYR 46 6.019 -1.564 1.700 414 H ILE 47 H ILE 47 3.390 4.512 -2.335 415 HA ILE 47 HA ILE 47 5.270 3.250 -4.027 416 HB ILE 47 HB ILE 47 2.661 4.706 -4.432 417 HG12 ILE 47 HG12 ILE 47 3.293 1.739 -4.676 418 HG13 ILE 47 HG13 ILE 47 2.936 2.451 -3.117 419 HG21 ILE 47 HG21 ILE 47 4.218 3.147 -6.535 420 HG22 ILE 47 HG22 ILE 47 2.508 3.593 -6.695 421 HG23 ILE 47 HG23 ILE 47 3.729 4.852 -6.616 422 HD11 ILE 47 HD11 ILE 47 1.024 2.443 -5.489 423 HD12 ILE 47 HD12 ILE 47 0.898 1.486 -4.002 424 HD13 ILE 47 HD13 ILE 47 0.738 3.256 -3.946 425 H ALA 48 H ALA 48 4.347 6.716 -3.704 426 HA ALA 48 HA ALA 48 5.861 7.665 -5.943 427 HB1 ALA 48 HB1 ALA 48 4.985 9.059 -3.387 428 HB2 ALA 48 HB2 ALA 48 5.470 9.861 -4.898 429 HB3 ALA 48 HB3 ALA 48 3.997 8.868 -4.852 430 H GLU 49 H GLU 49 6.905 6.688 -2.742 431 HA GLU 49 HA GLU 49 9.533 8.031 -3.019 432 HB2 GLU 49 HB2 GLU 49 8.266 8.196 -0.918 433 HB3 GLU 49 HB3 GLU 49 8.342 6.437 -0.721 434 HG2 GLU 49 HG2 GLU 49 10.773 6.527 -0.504 435 HG3 GLU 49 HG3 GLU 49 10.790 8.240 -0.938 436 H VAL 50 H VAL 50 8.153 4.718 -3.258 437 HA VAL 50 HA VAL 50 10.949 3.707 -3.656 438 HB VAL 50 HB VAL 50 10.448 1.688 -2.613 439 HG11 VAL 50 HG11 VAL 50 9.223 3.809 -0.812 440 HG12 VAL 50 HG12 VAL 50 10.037 2.310 -0.326 441 HG13 VAL 50 HG13 VAL 50 10.967 3.602 -1.102 442 HG21 VAL 50 HG21 VAL 50 8.161 1.227 -3.309 443 HG22 VAL 50 HG22 VAL 50 8.306 1.109 -1.567 444 HG23 VAL 50 HG23 VAL 50 7.535 2.532 -2.298 445 H GLY 51 H GLY 51 7.788 3.855 -5.091 446 HA2 GLY 51 HA2 GLY 51 7.234 3.238 -7.274 447 HA3 GLY 51 HA3 GLY 51 8.640 2.187 -7.389 448 H LEU 52 H LEU 52 5.720 1.781 -7.908 449 HA LEU 52 HA LEU 52 4.407 0.286 -6.001 450 HB2 LEU 52 HB2 LEU 52 3.493 1.344 -8.114 451 HB3 LEU 52 HB3 LEU 52 4.306 0.106 -9.057 452 HG LEU 52 HG LEU 52 2.767 -1.627 -7.980 453 HD11 LEU 52 HD11 LEU 52 1.259 0.866 -7.091 454 HD12 LEU 52 HD12 LEU 52 0.733 -0.820 -6.912 455 HD13 LEU 52 HD13 LEU 52 2.116 -0.226 -5.979 456 HD21 LEU 52 HD21 LEU 52 2.379 -0.815 -10.199 457 HD22 LEU 52 HD22 LEU 52 0.817 -0.808 -9.348 458 HD23 LEU 52 HD23 LEU 52 1.712 0.698 -9.576 459 H GLN 53 H GLN 53 6.971 -0.718 -7.799 460 HA GLN 53 HA GLN 53 6.505 -3.656 -7.713 461 HB2 GLN 53 HB2 GLN 53 8.820 -2.014 -8.808 462 HB3 GLN 53 HB3 GLN 53 8.651 -3.766 -8.960 463 HG2 GLN 53 HG2 GLN 53 6.600 -3.512 -10.287 464 HG3 GLN 53 HG3 GLN 53 6.657 -1.754 -10.103 465 HE21 GLN 53 HE21 GLN 53 9.405 -1.324 -12.403 466 HE22 GLN 53 HE22 GLN 53 8.730 -0.655 -10.922 467 H ASN 54 H ASN 54 8.097 -1.236 -5.802 468 HA ASN 54 HA ASN 54 9.822 -3.259 -4.458 469 HB2 ASN 54 HB2 ASN 54 10.065 -0.240 -4.434 470 HB3 ASN 54 HB3 ASN 54 11.247 -1.393 -3.824 471 HD21 ASN 54 HD21 ASN 54 11.536 -0.255 -7.620 472 HD22 ASN 54 HD22 ASN 54 10.690 0.622 -6.339 473 H ILE 55 H ILE 55 6.988 -1.593 -3.900 474 HA ILE 55 HA ILE 55 7.018 -1.669 -0.987 475 HB ILE 55 HB ILE 55 4.607 -1.512 -1.089 476 HG12 ILE 55 HG12 ILE 55 4.867 -1.782 -4.100 477 HG13 ILE 55 HG13 ILE 55 4.156 -2.987 -3.023 478 HG21 ILE 55 HG21 ILE 55 5.679 0.415 -3.183 479 HG22 ILE 55 HG22 ILE 55 4.411 0.679 -1.956 480 HG23 ILE 55 HG23 ILE 55 6.081 0.512 -1.456 481 HD11 ILE 55 HD11 ILE 55 3.063 -0.211 -3.578 482 HD12 ILE 55 HD12 ILE 55 2.388 -1.762 -4.097 483 HD13 ILE 55 HD13 ILE 55 2.409 -1.346 -2.368 484 H THR 56 H THR 56 5.869 -3.198 0.309 485 HA THR 56 HA THR 56 5.435 -5.911 -0.840 486 HB THR 56 HB THR 56 6.153 -6.449 1.758 487 HG1 THR 56 HG1 THR 56 8.077 -5.326 2.167 488 HG21 THR 56 HG21 THR 56 8.076 -6.233 -0.591 489 HG22 THR 56 HG22 THR 56 8.336 -7.194 0.892 490 HG23 THR 56 HG23 THR 56 7.023 -7.621 -0.209 491 H ALA 57 H ALA 57 3.632 -7.007 -0.032 492 HA ALA 57 HA ALA 57 1.510 -5.580 1.162 493 HB1 ALA 57 HB1 ALA 57 2.064 -8.581 1.098 494 HB2 ALA 57 HB2 ALA 57 0.494 -7.799 1.388 495 HB3 ALA 57 HB3 ALA 57 1.277 -7.647 -0.196 496 H ILE 58 H ILE 58 4.227 -7.264 2.608 497 HA ILE 58 HA ILE 58 3.273 -7.540 5.310 498 HB ILE 58 HB ILE 58 6.112 -7.115 4.268 499 HG12 ILE 58 HG12 ILE 58 5.373 -9.000 3.056 500 HG13 ILE 58 HG13 ILE 58 6.369 -9.594 4.369 501 HG21 ILE 58 HG21 ILE 58 5.007 -8.219 6.877 502 HG22 ILE 58 HG22 ILE 58 6.719 -8.360 6.383 503 HG23 ILE 58 HG23 ILE 58 5.989 -6.766 6.638 504 HD11 ILE 58 HD11 ILE 58 3.325 -9.679 4.227 505 HD12 ILE 58 HD12 ILE 58 4.447 -11.035 4.048 506 HD13 ILE 58 HD13 ILE 58 4.290 -10.227 5.625 507 H THR 59 H THR 59 5.110 -4.998 3.614 508 HA THR 59 HA THR 59 5.275 -3.310 6.023 509 HB THR 59 HB THR 59 6.160 -2.941 3.153 510 HG1 THR 59 HG1 THR 59 8.133 -3.429 3.965 511 HG21 THR 59 HG21 THR 59 6.698 -1.226 5.633 512 HG22 THR 59 HG22 THR 59 7.556 -1.075 4.078 513 HG23 THR 59 HG23 THR 59 5.827 -0.716 4.171 514 H LEU 60 H LEU 60 3.501 -3.384 2.945 515 HA LEU 60 HA LEU 60 2.067 -0.951 3.293 516 HB2 LEU 60 HB2 LEU 60 2.403 -2.415 1.194 517 HB3 LEU 60 HB3 LEU 60 1.131 -3.436 1.819 518 HG LEU 60 HG LEU 60 -0.405 -1.384 1.742 519 HD11 LEU 60 HD11 LEU 60 2.076 -0.298 0.324 520 HD12 LEU 60 HD12 LEU 60 0.479 0.379 0.088 521 HD13 LEU 60 HD13 LEU 60 1.202 0.423 1.707 522 HD21 LEU 60 HD21 LEU 60 -0.356 -3.135 -0.033 523 HD22 LEU 60 HD22 LEU 60 -0.698 -1.529 -0.694 524 HD23 LEU 60 HD23 LEU 60 0.919 -2.238 -0.870 525 H SER 61 H SER 61 1.293 -4.314 4.411 526 HA SER 61 HA SER 61 -1.193 -3.702 5.583 527 HB2 SER 61 HB2 SER 61 -1.064 -5.702 6.786 528 HB3 SER 61 HB3 SER 61 -0.344 -5.983 5.208 529 HG SER 61 HG SER 61 0.873 -6.852 6.991 530 H LYS 62 H LYS 62 1.965 -2.965 6.610 531 HA LYS 62 HA LYS 62 1.110 -2.226 9.339 532 HB2 LYS 62 HB2 LYS 62 3.872 -2.556 8.137 533 HB3 LYS 62 HB3 LYS 62 3.577 -1.992 9.788 534 HG2 LYS 62 HG2 LYS 62 2.360 -4.066 10.330 535 HG3 LYS 62 HG3 LYS 62 2.590 -4.659 8.680 536 HD2 LYS 62 HD2 LYS 62 5.075 -4.513 9.021 537 HD3 LYS 62 HD3 LYS 62 4.763 -4.073 10.719 538 HE2 LYS 62 HE2 LYS 62 3.500 -6.213 11.009 539 HE3 LYS 62 HE3 LYS 62 3.845 -6.633 9.326 540 HZ1 LYS 62 HZ1 LYS 62 5.896 -6.255 11.446 541 HZ2 LYS 62 HZ2 LYS 62 5.423 -7.691 10.838 542 HZ3 LYS 62 HZ3 LYS 62 6.224 -6.633 9.889 543 H LYS 63 H LYS 63 2.223 -0.620 6.406 544 HA LYS 63 HA LYS 63 2.741 2.007 7.452 545 HB2 LYS 63 HB2 LYS 63 1.881 0.840 4.784 546 HB3 LYS 63 HB3 LYS 63 2.094 2.577 4.966 547 HG2 LYS 63 HG2 LYS 63 4.329 0.625 5.641 548 HG3 LYS 63 HG3 LYS 63 3.994 1.136 3.987 549 HD2 LYS 63 HD2 LYS 63 4.246 3.538 4.789 550 HD3 LYS 63 HD3 LYS 63 4.851 2.854 6.327 551 HE2 LYS 63 HE2 LYS 63 6.586 1.601 5.018 552 HE3 LYS 63 HE3 LYS 63 5.993 2.372 3.539 553 HZ1 LYS 63 HZ1 LYS 63 7.161 3.812 5.865 554 HZ2 LYS 63 HZ2 LYS 63 7.914 3.554 4.442 555 HZ3 LYS 63 HZ3 LYS 63 6.609 4.531 4.504 556 H LEU 64 H LEU 64 -0.210 0.400 6.394 557 HA LEU 64 HA LEU 64 -1.850 2.801 7.089 558 HB2 LEU 64 HB2 LEU 64 -2.279 0.555 5.099 559 HB3 LEU 64 HB3 LEU 64 -3.462 1.798 5.462 560 HG LEU 64 HG LEU 64 -1.115 3.244 4.871 561 HD11 LEU 64 HD11 LEU 64 -1.469 1.005 2.830 562 HD12 LEU 64 HD12 LEU 64 -0.323 2.371 2.742 563 HD13 LEU 64 HD13 LEU 64 -0.133 1.107 3.970 564 HD21 LEU 64 HD21 LEU 64 -3.380 3.851 4.189 565 HD22 LEU 64 HD22 LEU 64 -2.265 3.849 2.818 566 HD23 LEU 64 HD23 LEU 64 -3.415 2.506 3.026 567 H ASN 65 H ASN 65 -1.045 0.052 8.615 568 HA ASN 65 HA ASN 65 -1.913 -1.313 10.178 569 HB2 ASN 65 HB2 ASN 65 -3.815 0.997 10.721 570 HB3 ASN 65 HB3 ASN 65 -3.419 -0.311 11.825 571 HD21 ASN 65 HD21 ASN 65 -0.890 2.844 11.494 572 HD22 ASN 65 HD22 ASN 65 -2.351 2.740 10.521 573 H ILE 66 H ILE 66 -2.541 -2.536 8.188 574 HA ILE 66 HA ILE 66 -5.418 -3.310 8.165 575 HB ILE 66 HB ILE 66 -4.851 -3.542 5.557 576 HG12 ILE 66 HG12 ILE 66 -3.447 -0.931 6.092 577 HG13 ILE 66 HG13 ILE 66 -2.480 -2.357 6.021 578 HG21 ILE 66 HG21 ILE 66 -5.735 -1.004 6.994 579 HG22 ILE 66 HG22 ILE 66 -5.998 -1.319 5.278 580 HG23 ILE 66 HG23 ILE 66 -6.761 -2.368 6.485 581 HD11 ILE 66 HD11 ILE 66 -4.206 -1.214 3.782 582 HD12 ILE 66 HD12 ILE 66 -2.446 -1.428 3.815 583 HD13 ILE 66 HD13 ILE 66 -3.507 -2.842 3.712 584 H THR 67 H THR 67 -5.572 -5.394 6.602 585 HA THR 67 HA THR 67 -3.676 -7.360 7.710 586 HB THR 67 HB THR 67 -5.013 -9.060 7.063 587 HG1 THR 67 HG1 THR 67 -6.616 -8.846 5.439 588 HG21 THR 67 HG21 THR 67 -7.131 -6.877 7.212 589 HG22 THR 67 HG22 THR 67 -7.308 -8.599 7.603 590 HG23 THR 67 HG23 THR 67 -6.297 -7.567 8.629 591 H VAL 68 H VAL 68 -2.537 -8.923 6.361 592 HA VAL 68 HA VAL 68 -1.014 -7.753 4.204 593 HB VAL 68 HB VAL 68 -1.371 -10.658 5.033 594 HG11 VAL 68 HG11 VAL 68 0.741 -9.415 3.212 595 HG12 VAL 68 HG12 VAL 68 0.770 -11.074 3.841 596 HG13 VAL 68 HG13 VAL 68 -0.499 -10.592 2.715 597 HG21 VAL 68 HG21 VAL 68 -0.333 -9.228 6.788 598 HG22 VAL 68 HG22 VAL 68 0.838 -10.357 6.104 599 HG23 VAL 68 HG23 VAL 68 0.863 -8.655 5.602 600 H GLU 69 H GLU 69 -4.160 -9.363 4.220 601 HA GLU 69 HA GLU 69 -3.999 -10.010 1.323 602 HB2 GLU 69 HB2 GLU 69 -6.234 -10.338 3.367 603 HB3 GLU 69 HB3 GLU 69 -6.333 -10.793 1.661 604 HG2 GLU 69 HG2 GLU 69 -4.399 -12.343 1.974 605 HG3 GLU 69 HG3 GLU 69 -4.375 -11.949 3.694 606 H LYS 70 H LYS 70 -5.516 -7.689 3.549 607 HA LYS 70 HA LYS 70 -7.064 -6.273 1.645 608 HB2 LYS 70 HB2 LYS 70 -7.082 -6.306 4.234 609 HB3 LYS 70 HB3 LYS 70 -5.809 -5.098 4.169 610 HG2 LYS 70 HG2 LYS 70 -8.562 -4.863 2.905 611 HG3 LYS 70 HG3 LYS 70 -8.146 -4.339 4.541 612 HD2 LYS 70 HD2 LYS 70 -6.524 -2.694 3.553 613 HD3 LYS 70 HD3 LYS 70 -7.170 -3.094 1.945 614 HE2 LYS 70 HE2 LYS 70 -9.412 -2.453 2.584 615 HE3 LYS 70 HE3 LYS 70 -8.962 -2.290 4.283 616 HZ1 LYS 70 HZ1 LYS 70 -7.844 -0.564 2.148 617 HZ2 LYS 70 HZ2 LYS 70 -9.145 -0.145 3.016 618 HZ3 LYS 70 HZ3 LYS 70 -7.697 -0.336 3.766 619 H ALA 71 H ALA 71 -3.861 -5.714 2.943 620 HA ALA 71 HA ALA 71 -2.946 -3.586 1.299 621 HB1 ALA 71 HB1 ALA 71 -1.463 -5.928 2.589 622 HB2 ALA 71 HB2 ALA 71 -0.703 -4.479 1.936 623 HB3 ALA 71 HB3 ALA 71 -1.791 -4.349 3.328 624 H LYS 72 H LYS 72 -2.660 -7.169 0.715 625 HA LYS 72 HA LYS 72 -1.137 -6.797 -1.690 626 HB2 LYS 72 HB2 LYS 72 -0.917 -8.749 -0.205 627 HB3 LYS 72 HB3 LYS 72 -2.588 -9.221 -0.515 628 HG2 LYS 72 HG2 LYS 72 -2.107 -9.784 -2.781 629 HG3 LYS 72 HG3 LYS 72 -0.500 -9.041 -2.718 630 HD2 LYS 72 HD2 LYS 72 -1.302 -11.388 -0.935 631 HD3 LYS 72 HD3 LYS 72 -0.629 -11.607 -2.564 632 HE2 LYS 72 HE2 LYS 72 1.372 -10.241 -1.872 633 HE3 LYS 72 HE3 LYS 72 0.725 -10.192 -0.225 634 HZ1 LYS 72 HZ1 LYS 72 1.466 -12.669 -1.700 635 HZ2 LYS 72 HZ2 LYS 72 2.330 -11.998 -0.492 636 HZ3 LYS 72 HZ3 LYS 72 0.859 -12.636 -0.183 637 H ASN 73 H ASN 73 -4.585 -6.980 -1.047 638 HA ASN 73 HA ASN 73 -5.498 -7.506 -3.598 639 HB2 ASN 73 HB2 ASN 73 -7.465 -7.088 -2.611 640 HB3 ASN 73 HB3 ASN 73 -6.627 -6.502 -1.188 641 HD21 ASN 73 HD21 ASN 73 -7.386 -3.096 -1.865 642 HD22 ASN 73 HD22 ASN 73 -6.545 -4.218 -0.811 643 H TYR 74 H TYR 74 -4.113 -4.426 -2.416 644 HA TYR 74 HA TYR 74 -4.700 -2.888 -4.749 645 HB2 TYR 74 HB2 TYR 74 -2.508 -2.565 -2.651 646 HB3 TYR 74 HB3 TYR 74 -3.024 -1.328 -3.793 647 HD1 TYR 74 HD1 TYR 74 -5.928 -1.402 -3.772 648 HD2 TYR 74 HD2 TYR 74 -3.140 -1.947 -0.487 649 HE1 TYR 74 HE1 TYR 74 -7.613 -0.505 -2.196 650 HE2 TYR 74 HE2 TYR 74 -4.873 -1.051 1.087 651 HH TYR 74 HH TYR 74 -8.129 -0.060 -0.057 652 H ILE 75 H ILE 75 -1.891 -4.791 -3.686 653 HA ILE 75 HA ILE 75 -0.155 -4.138 -5.879 654 HB ILE 75 HB ILE 75 -0.096 -6.475 -3.929 655 HG12 ILE 75 HG12 ILE 75 1.228 -3.727 -3.764 656 HG13 ILE 75 HG13 ILE 75 -0.135 -4.249 -2.782 657 HG21 ILE 75 HG21 ILE 75 2.131 -5.283 -5.643 658 HG22 ILE 75 HG22 ILE 75 2.332 -6.576 -4.438 659 HG23 ILE 75 HG23 ILE 75 1.378 -6.879 -5.869 660 HD11 ILE 75 HD11 ILE 75 2.693 -5.320 -2.621 661 HD12 ILE 75 HD12 ILE 75 1.778 -4.418 -1.409 662 HD13 ILE 75 HD13 ILE 75 1.284 -6.069 -1.824 663 H LYS 76 H LYS 76 -2.685 -6.582 -5.481 664 HA LYS 76 HA LYS 76 -2.056 -7.987 -7.992 665 HB2 LYS 76 HB2 LYS 76 -4.444 -8.034 -6.105 666 HB3 LYS 76 HB3 LYS 76 -4.265 -9.075 -7.518 667 HG2 LYS 76 HG2 LYS 76 -2.241 -9.081 -5.257 668 HG3 LYS 76 HG3 LYS 76 -3.707 -10.064 -5.246 669 HD2 LYS 76 HD2 LYS 76 -3.013 -11.151 -7.366 670 HD3 LYS 76 HD3 LYS 76 -1.525 -10.179 -7.386 671 HE2 LYS 76 HE2 LYS 76 -0.796 -11.174 -5.268 672 HE3 LYS 76 HE3 LYS 76 -2.319 -12.059 -5.117 673 HZ1 LYS 76 HZ1 LYS 76 -0.330 -12.486 -7.288 674 HZ2 LYS 76 HZ2 LYS 76 -0.552 -13.472 -6.006 675 HZ3 LYS 76 HZ3 LYS 76 -1.731 -13.312 -7.117 676 H ASN 77 H ASN 77 -4.130 -5.284 -7.028 677 HA ASN 77 HA ASN 77 -5.702 -5.372 -9.492 678 HB2 ASN 77 HB2 ASN 77 -5.615 -3.659 -6.969 679 HB3 ASN 77 HB3 ASN 77 -6.442 -3.054 -8.398 680 HD21 ASN 77 HD21 ASN 77 -8.652 -5.332 -6.219 681 HD22 ASN 77 HD22 ASN 77 -7.318 -4.383 -5.604 682 H SER 78 H SER 78 -3.291 -3.239 -7.985 683 HA SER 78 HA SER 78 -2.507 -2.410 -10.737 684 HB2 SER 78 HB2 SER 78 -3.487 -0.546 -9.357 685 HB3 SER 78 HB3 SER 78 -2.071 -0.683 -8.290 686 HG SER 78 HG SER 78 -1.927 0.869 -10.075 687 H ASN 79 H ASN 79 -0.639 -2.883 -11.456 688 HA ASN 79 HA ASN 79 1.601 -3.613 -9.625 689 HB2 ASN 79 HB2 ASN 79 -0.086 -5.519 -10.065 690 HB3 ASN 79 HB3 ASN 79 0.503 -5.536 -11.717 691 HD21 ASN 79 HD21 ASN 79 2.761 -6.982 -8.611 692 HD22 ASN 79 HD22 ASN 79 1.222 -6.132 -8.368 693 H ARG 80 H ARG 80 0.585 -3.462 -13.069 694 HA ARG 80 HA ARG 80 3.285 -2.391 -13.814 695 HB2 ARG 80 HB2 ARG 80 1.363 -4.080 -15.479 696 HB3 ARG 80 HB3 ARG 80 2.761 -3.235 -16.122 697 HG2 ARG 80 HG2 ARG 80 3.703 -5.267 -15.862 698 HG3 ARG 80 HG3 ARG 80 4.146 -4.522 -14.333 699 HD2 ARG 80 HD2 ARG 80 3.442 -6.716 -13.790 700 HD3 ARG 80 HD3 ARG 80 2.111 -5.684 -13.314 701 HE ARG 80 HE ARG 80 0.759 -6.566 -15.013 702 HH11 ARG 80 HH11 ARG 80 0.133 -8.207 -16.372 703 HH12 ARG 80 HH12 ARG 80 1.315 -9.321 -16.993 704 HH21 ARG 80 HH21 ARG 80 3.986 -7.882 -15.405 705 HH22 ARG 80 HH22 ARG 80 3.435 -9.149 -16.466 706 H LEU 81 H LEU 81 0.810 -0.977 -12.825 707 HA LEU 81 HA LEU 81 0.510 0.966 -15.073 708 HB2 LEU 81 HB2 LEU 81 -1.377 -0.655 -14.857 709 HB3 LEU 81 HB3 LEU 81 -1.752 0.011 -13.275 710 HG LEU 81 HG LEU 81 -1.649 1.750 -15.784 711 HD11 LEU 81 HD11 LEU 81 -4.045 0.220 -14.687 712 HD12 LEU 81 HD12 LEU 81 -4.081 1.416 -16.006 713 HD13 LEU 81 HD13 LEU 81 -3.203 -0.102 -16.221 714 HD21 LEU 81 HD21 LEU 81 -1.796 3.052 -13.709 715 HD22 LEU 81 HD22 LEU 81 -3.347 3.103 -14.529 716 HD23 LEU 81 HD23 LEU 81 -3.131 2.035 -13.126 717 H GLY 82 H GLY 82 -0.060 0.677 -11.507 718 HA2 GLY 82 HA2 GLY 82 0.218 2.268 -9.850 719 HA3 GLY 82 HA3 GLY 82 1.592 2.811 -10.819 720 H ARG 83 H ARG 83 1.564 4.894 -11.140 721 HA ARG 83 HA ARG 83 -0.893 6.360 -11.950 722 HB2 ARG 83 HB2 ARG 83 1.086 7.236 -9.800 723 HB3 ARG 83 HB3 ARG 83 -0.016 8.345 -10.611 724 HG2 ARG 83 HG2 ARG 83 -0.929 5.976 -8.927 725 HG3 ARG 83 HG3 ARG 83 -0.792 7.652 -8.385 726 HD2 ARG 83 HD2 ARG 83 -2.338 8.252 -10.362 727 HD3 ARG 83 HD3 ARG 83 -2.702 6.524 -10.456 728 HE ARG 83 HE ARG 83 -3.351 6.739 -7.982 729 HH11 ARG 83 HH11 ARG 83 -4.910 7.720 -6.748 730 HH12 ARG 83 HH12 ARG 83 -5.649 9.198 -7.292 731 HH21 ARG 83 HH21 ARG 83 -3.835 9.438 -10.181 732 HH22 ARG 83 HH22 ARG 83 -5.057 10.151 -9.166 733 H THR 84 H THR 84 -0.423 8.390 -12.948 734 HA THR 84 HA THR 84 1.636 8.094 -14.996 735 HB THR 84 HB THR 84 -0.789 8.551 -15.376 736 HG1 THR 84 HG1 THR 84 -0.423 9.908 -17.094 737 HG21 THR 84 HG21 THR 84 -0.137 11.420 -14.602 738 HG22 THR 84 HG22 THR 84 -1.676 10.787 -15.220 739 HG23 THR 84 HG23 THR 84 -1.101 10.298 -13.618 740 H ASN 85 H ASN 85 2.397 9.069 -12.176 741 HA ASN 85 HA ASN 85 3.107 11.839 -12.594 742 HB2 ASN 85 HB2 ASN 85 3.840 10.064 -10.237 743 HB3 ASN 85 HB3 ASN 85 3.824 11.828 -10.274 744 HD21 ASN 85 HD21 ASN 85 0.132 11.867 -10.261 745 HD22 ASN 85 HD22 ASN 85 1.404 12.599 -11.222 746 H ASN 86 H ASN 86 4.507 9.864 -14.317 747 HA ASN 86 HA ASN 86 7.355 10.213 -13.526 748 HB2 ASN 86 HB2 ASN 86 7.777 8.252 -14.874 749 HB3 ASN 86 HB3 ASN 86 6.464 7.915 -13.757 750 HD21 ASN 86 HD21 ASN 86 5.801 7.644 -17.748 751 HD22 ASN 86 HD22 ASN 86 7.371 8.128 -17.118 752 H LEU 87 H LEU 87 5.438 12.102 -15.203 753 HA LEU 87 HA LEU 87 7.213 12.445 -17.572 754 HB2 LEU 87 HB2 LEU 87 4.533 11.548 -17.448 755 HB3 LEU 87 HB3 LEU 87 4.374 13.211 -17.922 756 HG LEU 87 HG LEU 87 4.380 11.818 -19.858 757 HD11 LEU 87 HD11 LEU 87 7.127 13.117 -19.789 758 HD12 LEU 87 HD12 LEU 87 6.179 12.684 -21.223 759 HD13 LEU 87 HD13 LEU 87 5.599 13.957 -20.138 760 HD21 LEU 87 HD21 LEU 87 5.530 9.864 -18.922 761 HD22 LEU 87 HD22 LEU 87 6.198 10.326 -20.495 762 HD23 LEU 87 HD23 LEU 87 7.087 10.715 -19.008 763 H LYS 88 H LYS 88 7.328 13.983 -15.019 764 HA LYS 88 HA LYS 88 6.633 16.726 -15.971 765 HB2 LYS 88 HB2 LYS 88 6.851 17.506 -13.760 766 HB3 LYS 88 HB3 LYS 88 5.777 16.125 -13.745 767 HG2 LYS 88 HG2 LYS 88 8.661 15.500 -13.163 768 HG3 LYS 88 HG3 LYS 88 7.872 16.576 -12.014 769 HD2 LYS 88 HD2 LYS 88 6.092 14.940 -11.614 770 HD3 LYS 88 HD3 LYS 88 6.815 13.829 -12.800 771 HE2 LYS 88 HE2 LYS 88 8.860 13.660 -11.470 772 HE3 LYS 88 HE3 LYS 88 8.282 14.892 -10.340 773 HZ1 LYS 88 HZ1 LYS 88 6.928 12.282 -10.765 774 HZ2 LYS 88 HZ2 LYS 88 7.957 12.591 -9.522 775 HZ3 LYS 88 HZ3 LYS 88 6.541 13.398 -9.634 776 H THR 89 H THR 89 9.273 14.649 -15.939 777 HA THR 89 HA THR 89 10.983 16.734 -16.884 778 HB THR 89 HB THR 89 11.431 16.926 -14.470 779 HG1 THR 89 HG1 THR 89 13.656 16.815 -14.716 780 HG21 THR 89 HG21 THR 89 12.700 14.164 -14.598 781 HG22 THR 89 HG22 THR 89 12.528 15.233 -13.187 782 HG23 THR 89 HG23 THR 89 11.096 14.458 -13.896 783 H ILE 90 H ILE 90 11.797 15.924 -18.637 784 HA ILE 90 HA ILE 90 12.778 13.139 -18.794 785 HB ILE 90 HB ILE 90 11.678 13.104 -21.092 786 HG12 ILE 90 HG12 ILE 90 11.037 15.463 -21.314 787 HG13 ILE 90 HG13 ILE 90 9.800 14.284 -21.680 788 HG21 ILE 90 HG21 ILE 90 9.844 12.919 -18.692 789 HG22 ILE 90 HG22 ILE 90 9.599 12.166 -20.279 790 HG23 ILE 90 HG23 ILE 90 10.966 11.678 -19.267 791 HD11 ILE 90 HD11 ILE 90 9.869 16.141 -19.277 792 HD12 ILE 90 HD12 ILE 90 8.718 16.086 -20.606 793 HD13 ILE 90 HD13 ILE 90 8.737 14.778 -19.420 794 H GLY 91 H GLY 91 13.910 16.111 -18.956 795 HA2 GLY 91 HA2 GLY 91 15.723 17.105 -20.048 796 HA3 GLY 91 HA3 GLY 91 15.872 15.688 -21.096 797 H ILE 92 H ILE 92 12.778 16.351 -21.493 798 HA ILE 92 HA ILE 92 11.546 16.959 -23.262 799 HB ILE 92 HB ILE 92 13.125 19.549 -23.373 800 HG12 ILE 92 HG12 ILE 92 10.898 20.308 -22.123 801 HG13 ILE 92 HG13 ILE 92 10.859 18.644 -21.557 802 HG21 ILE 92 HG21 ILE 92 10.310 18.792 -24.293 803 HG22 ILE 92 HG22 ILE 92 11.052 20.401 -24.407 804 HG23 ILE 92 HG23 ILE 92 11.705 19.074 -25.357 805 HD11 ILE 92 HD11 ILE 92 13.191 20.586 -21.171 806 HD12 ILE 92 HD12 ILE 92 11.913 20.283 -19.982 807 HD13 ILE 92 HD13 ILE 92 13.026 18.984 -20.413 808 H LEU 93 H LEU 93 12.196 15.253 -24.439 809 HA LEU 93 HA LEU 93 14.614 14.847 -25.723 810 HB2 LEU 93 HB2 LEU 93 12.931 13.138 -25.089 811 HB3 LEU 93 HB3 LEU 93 11.867 13.707 -26.371 812 HG LEU 93 HG LEU 93 13.636 13.032 -28.061 813 HD11 LEU 93 HD11 LEU 93 14.935 11.741 -25.622 814 HD12 LEU 93 HD12 LEU 93 15.379 11.440 -27.316 815 HD13 LEU 93 HD13 LEU 93 15.636 13.040 -26.614 816 HD21 LEU 93 HD21 LEU 93 11.718 11.586 -27.536 817 HD22 LEU 93 HD22 LEU 93 13.166 10.629 -27.882 818 HD23 LEU 93 HD23 LEU 93 12.627 10.844 -26.200 819 H GLN 94 H GLN 94 15.272 16.614 -26.896 820 HA GLN 94 HA GLN 94 14.169 16.834 -29.685 821 HB2 GLN 94 HB2 GLN 94 14.924 19.119 -27.816 822 HB3 GLN 94 HB3 GLN 94 14.649 19.291 -29.555 823 HG2 GLN 94 HG2 GLN 94 12.324 18.468 -29.280 824 HG3 GLN 94 HG3 GLN 94 12.577 18.322 -27.540 825 HE21 GLN 94 HE21 GLN 94 10.858 21.526 -27.881 826 HE22 GLN 94 HE22 GLN 94 10.493 19.808 -27.981 827 H GLU 95 H GLU 95 16.973 17.955 -27.708 828 HA GLU 95 HA GLU 95 18.880 17.017 -29.783 829 HB2 GLU 95 HB2 GLU 95 18.492 19.888 -28.840 830 HB3 GLU 95 HB3 GLU 95 20.025 19.344 -29.490 831 HG2 GLU 95 HG2 GLU 95 17.376 19.329 -30.985 832 HG3 GLU 95 HG3 GLU 95 18.671 20.502 -31.165 833 H GLU 96 H GLU 96 21.112 17.122 -29.097 834 HA GLU 96 HA GLU 96 21.565 17.135 -26.137 835 HB2 GLU 96 HB2 GLU 96 21.483 14.820 -27.032 836 HB3 GLU 96 HB3 GLU 96 22.797 15.211 -28.147 837 HG2 GLU 96 HG2 GLU 96 24.266 15.739 -26.187 838 HG3 GLU 96 HG3 GLU 96 22.935 15.350 -25.098 839 H VAL 97 H VAL 97 22.440 19.083 -25.903 840 HA VAL 97 HA VAL 97 25.130 19.504 -26.969 841 HB VAL 97 HB VAL 97 23.778 20.552 -28.681 842 HG11 VAL 97 HG11 VAL 97 22.605 22.417 -26.582 843 HG12 VAL 97 HG12 VAL 97 22.352 22.477 -28.334 844 HG13 VAL 97 HG13 VAL 97 21.726 21.109 -27.407 845 HG21 VAL 97 HG21 VAL 97 25.933 21.585 -28.081 846 HG22 VAL 97 HG22 VAL 97 24.773 22.756 -28.721 847 HG23 VAL 97 HG23 VAL 97 25.095 22.700 -26.977 848 H SER 98 H SER 98 26.444 20.377 -25.480 849 HA SER 98 HA SER 98 25.599 22.323 -23.536 850 HB2 SER 98 HB2 SER 98 24.678 20.364 -22.365 851 HB3 SER 98 HB3 SER 98 26.248 19.551 -22.439 852 HG SER 98 HG SER 98 25.851 20.627 -20.423 853 H SER 99 H SER 99 28.110 19.730 -23.555 854 HA SER 99 HA SER 99 30.181 21.699 -22.886 855 HB2 SER 99 HB2 SER 99 29.925 19.465 -21.789 856 HB3 SER 99 HB3 SER 99 30.437 18.704 -23.307 857 HG SER 99 HG SER 99 32.166 19.051 -21.788 858 H MET 100 H MET 100 29.221 19.895 -25.740 859 HA MET 100 HA MET 100 31.249 21.356 -27.365 860 HB2 MET 100 HB2 MET 100 30.442 18.437 -27.715 861 HB3 MET 100 HB3 MET 100 31.398 19.384 -28.863 862 HG2 MET 100 HG2 MET 100 33.140 19.723 -27.126 863 HG3 MET 100 HG3 MET 100 32.206 18.720 -26.009 864 HE1 MET 100 HE1 MET 100 34.297 17.192 -25.547 865 HE2 MET 100 HE2 MET 100 35.271 16.433 -26.824 866 HE3 MET 100 HE3 MET 100 35.262 18.201 -26.648 867 H GLU 101 H GLU 101 30.392 22.431 -29.001 868 HA GLU 101 HA GLU 101 27.648 21.803 -30.003 869 HB2 GLU 101 HB2 GLU 101 27.038 24.094 -29.833 870 HB3 GLU 101 HB3 GLU 101 27.623 23.581 -28.262 871 HG2 GLU 101 HG2 GLU 101 29.267 25.193 -30.276 872 HG3 GLU 101 HG3 GLU 101 28.316 25.884 -28.977 873 H ALA 102 H ALA 102 30.686 21.789 -31.031 874 HA ALA 102 HA ALA 102 30.210 23.170 -33.637 875 HB1 ALA 102 HB1 ALA 102 32.815 22.646 -32.152 876 HB2 ALA 102 HB2 ALA 102 32.641 23.504 -33.698 877 HB3 ALA 102 HB3 ALA 102 31.947 24.196 -32.221 878 H LYS 103 H LYS 103 31.238 22.288 -35.512 879 HA LYS 103 HA LYS 103 31.382 19.286 -35.577 880 HB2 LYS 103 HB2 LYS 103 30.437 21.288 -37.661 881 HB3 LYS 103 HB3 LYS 103 30.720 19.563 -37.975 882 HG2 LYS 103 HG2 LYS 103 29.010 18.911 -36.379 883 HG3 LYS 103 HG3 LYS 103 28.809 20.573 -35.830 884 HD2 LYS 103 HD2 LYS 103 26.965 19.990 -37.205 885 HD3 LYS 103 HD3 LYS 103 27.894 21.236 -38.023 886 HE2 LYS 103 HE2 LYS 103 28.331 18.293 -38.668 887 HE3 LYS 103 HE3 LYS 103 26.920 19.134 -39.305 888 HZ1 LYS 103 HZ1 LYS 103 29.721 19.969 -39.820 889 HZ2 LYS 103 HZ2 LYS 103 28.726 19.239 -40.884 890 HZ3 LYS 103 HZ3 LYS 103 28.389 20.744 -40.364 891 H SER 104 H SER 104 33.435 18.706 -35.536 892 HA SER 104 HA SER 104 35.313 19.681 -37.597 893 HB2 SER 104 HB2 SER 104 35.516 21.177 -35.546 894 HB3 SER 104 HB3 SER 104 36.142 19.770 -34.674 895 HG SER 104 HG SER 104 37.801 21.076 -35.636 896 H MET 105 H MET 105 34.398 17.428 -38.054 897 HA MET 105 HA MET 105 36.359 15.364 -37.165 898 HB2 MET 105 HB2 MET 105 33.331 15.052 -37.292 899 HB3 MET 105 HB3 MET 105 34.453 13.688 -37.282 900 HG2 MET 105 HG2 MET 105 35.418 14.490 -35.141 901 HG3 MET 105 HG3 MET 105 34.222 15.790 -35.097 902 HE1 MET 105 HE1 MET 105 33.757 14.898 -32.588 903 HE2 MET 105 HE2 MET 105 33.218 13.243 -32.225 904 HE3 MET 105 HE3 MET 105 34.866 13.526 -32.821 905 H THR 106 H THR 106 36.391 13.476 -38.607 906 HA THR 106 HA THR 106 35.819 14.133 -41.460 907 HB THR 106 HB THR 106 38.189 14.548 -40.903 908 HG1 THR 106 HG1 THR 106 38.939 13.433 -42.689 909 HG21 THR 106 HG21 THR 106 38.390 11.523 -40.542 910 HG22 THR 106 HG22 THR 106 39.735 12.682 -40.580 911 HG23 THR 106 HG23 THR 106 38.575 12.724 -39.246 912 H TRP 107 H TRP 107 35.858 12.363 -42.871 913 HA TRP 107 HA TRP 107 34.315 10.057 -41.800 914 HB2 TRP 107 HB2 TRP 107 34.277 11.592 -44.367 915 HB3 TRP 107 HB3 TRP 107 33.991 9.871 -44.469 916 HD1 TRP 107 HD1 TRP 107 31.636 9.152 -44.335 917 HE1 TRP 107 HE1 TRP 107 29.418 10.031 -43.394 918 HE3 TRP 107 HE3 TRP 107 33.337 13.450 -42.091 919 HZ2 TRP 107 HZ2 TRP 107 28.506 12.266 -41.831 920 HZ3 TRP 107 HZ3 TRP 107 31.763 14.917 -40.861 921 HH2 TRP 107 HH2 TRP 107 29.348 14.339 -40.720
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