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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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647314 |
6v88 ![]() ![]() |
30696 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 2 1H SER 2 -17.895 -14.517 -18.360 2 H2 SER 2 2H SER 2 -17.337 -14.142 -16.806 3 H3 SER 2 3H SER 2 -16.727 -13.310 -18.145 4 HA SER 2 HA SER 2 -18.838 -12.329 -18.582 5 HB2 SER 2 2HB SER 2 -20.239 -14.191 -17.736 6 HB3 SER 2 3HB SER 2 -19.753 -13.820 -16.083 7 HG SER 2 HG SER 2 -21.354 -12.476 -16.063 8 H LEU 3 H LEU 3 -19.826 -10.542 -17.198 9 HA LEU 3 HA LEU 3 -17.692 -9.140 -15.827 10 HB2 LEU 3 2HB LEU 3 -20.569 -8.281 -16.358 11 HB3 LEU 3 3HB LEU 3 -19.255 -7.238 -15.835 12 HG LEU 3 HG LEU 3 -19.342 -8.659 -18.525 13 HD11 LEU 3 1HD1 LEU 3 -19.973 -5.759 -17.888 14 HD12 LEU 3 2HD1 LEU 3 -21.128 -6.996 -18.391 15 HD13 LEU 3 3HD1 LEU 3 -19.870 -6.468 -19.504 16 HD21 LEU 3 1HD2 LEU 3 -17.042 -8.206 -17.790 17 HD22 LEU 3 2HD2 LEU 3 -17.441 -6.508 -17.518 18 HD23 LEU 3 3HD2 LEU 3 -17.478 -7.175 -19.152 19 H VAL 4 H VAL 4 -17.364 -9.473 -13.674 20 HA VAL 4 HA VAL 4 -19.472 -10.175 -11.824 21 HB VAL 4 HB VAL 4 -17.738 -9.904 -10.025 22 HG11 VAL 4 1HG1 VAL 4 -18.064 -12.079 -11.122 23 HG12 VAL 4 2HG1 VAL 4 -16.373 -11.858 -10.678 24 HG13 VAL 4 3HG1 VAL 4 -16.875 -11.658 -12.359 25 HG21 VAL 4 1HG2 VAL 4 -16.341 -8.130 -11.020 26 HG22 VAL 4 2HG2 VAL 4 -15.826 -9.224 -12.305 27 HG23 VAL 4 3HG2 VAL 4 -15.356 -9.541 -10.633 28 H LYS 5 H LYS 5 -20.664 -8.852 -10.654 29 HA LYS 5 HA LYS 5 -20.713 -6.013 -11.332 30 HB2 LYS 5 2HB LYS 5 -22.641 -7.682 -9.657 31 HB3 LYS 5 3HB LYS 5 -22.956 -6.087 -10.337 32 HG2 LYS 5 2HG LYS 5 -22.877 -7.018 -12.610 33 HG3 LYS 5 3HG LYS 5 -22.474 -8.610 -11.961 34 HD2 LYS 5 2HD LYS 5 -24.660 -8.702 -10.813 35 HD3 LYS 5 3HD LYS 5 -25.057 -7.096 -11.432 36 HE2 LYS 5 2HE LYS 5 -24.990 -7.954 -13.738 37 HE3 LYS 5 3HE LYS 5 -24.555 -9.558 -13.137 38 HZ1 LYS 5 1HZ LYS 5 -26.925 -9.330 -13.642 39 HZ2 LYS 5 2HZ LYS 5 -27.069 -8.130 -12.459 40 HZ3 LYS 5 3HZ LYS 5 -26.654 -9.710 -12.017 41 H LEU 6 H LEU 6 -19.379 -4.782 -10.089 42 HA LEU 6 HA LEU 6 -19.078 -5.379 -7.203 43 HB2 LEU 6 2HB LEU 6 -17.206 -3.821 -9.036 44 HB3 LEU 6 3HB LEU 6 -16.920 -4.198 -7.342 45 HG LEU 6 HG LEU 6 -17.075 -6.230 -9.604 46 HD11 LEU 6 1HD1 LEU 6 -14.666 -5.276 -8.030 47 HD12 LEU 6 2HD1 LEU 6 -15.029 -4.900 -9.715 48 HD13 LEU 6 3HD1 LEU 6 -14.670 -6.559 -9.246 49 HD21 LEU 6 1HD2 LEU 6 -16.359 -7.908 -7.936 50 HD22 LEU 6 2HD2 LEU 6 -17.922 -7.209 -7.527 51 HD23 LEU 6 3HD2 LEU 6 -16.477 -6.690 -6.660 52 H GLU 7 H GLU 7 -20.839 -4.217 -6.409 53 HA GLU 7 HA GLU 7 -21.329 -1.472 -7.079 54 HB2 GLU 7 2HB GLU 7 -22.232 -3.031 -4.617 55 HB3 GLU 7 3HB GLU 7 -22.745 -1.391 -5.006 56 HG2 GLU 7 2HG GLU 7 -24.509 -2.760 -5.727 57 HG3 GLU 7 3HG GLU 7 -23.644 -2.317 -7.194 58 H SER 8 H SER 8 -20.533 0.341 -6.184 59 HA SER 8 HA SER 8 -18.278 0.237 -4.365 60 HB2 SER 8 2HB SER 8 -18.360 2.747 -4.730 61 HB3 SER 8 3HB SER 8 -18.247 1.805 -6.219 62 HG SER 8 HG SER 8 -20.192 2.413 -6.778 63 H SER 9 H SER 9 -18.365 2.070 -2.575 64 HA SER 9 HA SER 9 -20.341 1.641 -0.618 65 HB2 SER 9 2HB SER 9 -18.529 4.072 -0.935 66 HB3 SER 9 3HB SER 9 -19.306 3.527 0.551 67 HG SER 9 HG SER 9 -17.543 2.443 0.824 68 H ASP 10 H ASP 10 -20.189 3.809 -3.340 69 HA ASP 10 HA ASP 10 -22.557 5.374 -2.612 70 HB2 ASP 10 2HB ASP 10 -20.539 6.402 -3.686 71 HB3 ASP 10 3HB ASP 10 -20.811 5.411 -5.109 72 H GLU 11 H GLU 11 -22.275 2.324 -3.535 73 HA GLU 11 HA GLU 11 -23.773 0.753 -4.127 74 HB2 GLU 11 2HB GLU 11 -25.756 3.033 -4.496 75 HB3 GLU 11 3HB GLU 11 -26.168 1.323 -4.448 76 HG2 GLU 11 2HG GLU 11 -25.392 1.194 -2.110 77 HG3 GLU 11 3HG GLU 11 -24.955 2.900 -2.157 78 H LYS 12 H LYS 12 -22.430 2.774 -6.302 79 HA LYS 12 HA LYS 12 -23.958 2.253 -8.683 80 HB2 LYS 12 2HB LYS 12 -21.112 3.272 -8.293 81 HB3 LYS 12 3HB LYS 12 -21.887 3.147 -9.865 82 HG2 LYS 12 2HG LYS 12 -22.888 4.874 -7.581 83 HG3 LYS 12 3HG LYS 12 -21.897 5.446 -8.927 84 HD2 LYS 12 2HD LYS 12 -23.717 4.722 -10.509 85 HD3 LYS 12 3HD LYS 12 -24.711 4.299 -9.111 86 HE2 LYS 12 2HE LYS 12 -23.660 7.065 -9.784 87 HE3 LYS 12 3HE LYS 12 -25.317 6.507 -9.991 88 HZ1 LYS 12 1HZ LYS 12 -24.980 7.839 -7.978 89 HZ2 LYS 12 2HZ LYS 12 -23.909 6.678 -7.381 90 HZ3 LYS 12 3HZ LYS 12 -25.539 6.280 -7.629 91 H VAL 13 H VAL 13 -23.988 0.427 -9.822 92 HA VAL 13 HA VAL 13 -22.336 -1.852 -9.190 93 HB VAL 13 HB VAL 13 -24.339 -1.496 -11.483 94 HG11 VAL 13 1HG1 VAL 13 -22.821 -3.400 -11.829 95 HG12 VAL 13 2HG1 VAL 13 -24.462 -3.961 -11.518 96 HG13 VAL 13 3HG1 VAL 13 -23.244 -4.052 -10.243 97 HG21 VAL 13 1HG2 VAL 13 -24.858 -2.648 -8.711 98 HG22 VAL 13 2HG2 VAL 13 -26.026 -2.551 -10.033 99 HG23 VAL 13 3HG2 VAL 13 -25.408 -1.075 -9.293 100 H PHE 14 H PHE 14 -20.248 -1.790 -9.893 101 HA PHE 14 HA PHE 14 -19.605 -0.938 -12.650 102 HB2 PHE 14 2HB PHE 14 -17.825 -1.381 -10.213 103 HB3 PHE 14 3HB PHE 14 -17.203 -1.037 -11.826 104 HD1 PHE 14 HD1 PHE 14 -17.888 1.155 -12.953 105 HD2 PHE 14 HD2 PHE 14 -18.508 0.424 -8.783 106 HE1 PHE 14 HE1 PHE 14 -18.140 3.569 -12.565 107 HE2 PHE 14 HE2 PHE 14 -18.754 2.840 -8.408 108 HZ PHE 14 HZ PHE 14 -18.578 4.414 -10.295 109 H GLU 15 H GLU 15 -20.363 -2.723 -13.713 110 HA GLU 15 HA GLU 15 -19.508 -5.410 -13.178 111 HB2 GLU 15 2HB GLU 15 -20.739 -4.220 -15.704 112 HB3 GLU 15 3HB GLU 15 -20.569 -5.935 -15.349 113 HG2 GLU 15 2HG GLU 15 -22.079 -5.617 -13.371 114 HG3 GLU 15 3HG GLU 15 -22.319 -3.949 -13.881 115 H ILE 16 H ILE 16 -17.494 -6.106 -13.544 116 HA ILE 16 HA ILE 16 -15.998 -5.254 -15.949 117 HB ILE 16 HB ILE 16 -15.212 -3.907 -13.981 118 HG12 ILE 16 2HG1 ILE 16 -13.120 -5.909 -14.954 119 HG13 ILE 16 3HG1 ILE 16 -13.657 -4.501 -15.863 120 HG21 ILE 16 1HG2 ILE 16 -15.665 -5.532 -12.177 121 HG22 ILE 16 2HG2 ILE 16 -13.997 -4.967 -12.113 122 HG23 ILE 16 3HG2 ILE 16 -14.361 -6.568 -12.763 123 HD11 ILE 16 1HD1 ILE 16 -12.774 -3.051 -14.086 124 HD12 ILE 16 2HD1 ILE 16 -11.546 -4.076 -14.826 125 HD13 ILE 16 3HD1 ILE 16 -12.190 -4.486 -13.237 126 H GLU 17 H GLU 17 -14.401 -6.887 -16.629 127 HA GLU 17 HA GLU 17 -15.378 -9.493 -16.616 128 HB2 GLU 17 2HB GLU 17 -12.476 -8.737 -17.108 129 HB3 GLU 17 3HB GLU 17 -13.285 -10.190 -17.668 130 HG2 GLU 17 2HG GLU 17 -14.730 -8.776 -19.130 131 HG3 GLU 17 3HG GLU 17 -13.828 -7.355 -18.606 132 H LYS 18 H LYS 18 -15.006 -11.292 -15.447 133 HA LYS 18 HA LYS 18 -14.245 -11.216 -12.755 134 HB2 LYS 18 2HB LYS 18 -15.739 -12.929 -13.701 135 HB3 LYS 18 3HB LYS 18 -14.423 -13.582 -14.669 136 HG2 LYS 18 2HG LYS 18 -13.242 -14.191 -12.529 137 HG3 LYS 18 3HG LYS 18 -14.679 -13.668 -11.645 138 HD2 LYS 18 2HD LYS 18 -16.029 -15.391 -12.739 139 HD3 LYS 18 3HD LYS 18 -14.670 -15.845 -13.770 140 HE2 LYS 18 2HE LYS 18 -13.410 -16.532 -11.708 141 HE3 LYS 18 3HE LYS 18 -14.861 -16.201 -10.762 142 HZ1 LYS 18 1HZ LYS 18 -16.032 -17.899 -11.953 143 HZ2 LYS 18 2HZ LYS 18 -14.589 -18.556 -11.369 144 HZ3 LYS 18 3HZ LYS 18 -14.726 -18.147 -13.000 145 H GLU 19 H GLU 19 -12.437 -12.130 -15.633 146 HA GLU 19 HA GLU 19 -10.092 -13.160 -14.424 147 HB2 GLU 19 2HB GLU 19 -9.079 -12.816 -16.721 148 HB3 GLU 19 3HB GLU 19 -10.587 -13.721 -16.705 149 HG2 GLU 19 2HG GLU 19 -11.755 -11.520 -17.305 150 HG3 GLU 19 3HG GLU 19 -10.149 -10.860 -17.595 151 H ILE 20 H ILE 20 -11.080 -9.867 -15.138 152 HA ILE 20 HA ILE 20 -8.501 -8.638 -14.685 153 HB ILE 20 HB ILE 20 -11.287 -7.371 -14.644 154 HG12 ILE 20 2HG1 ILE 20 -9.228 -7.505 -16.893 155 HG13 ILE 20 3HG1 ILE 20 -10.783 -8.316 -16.871 156 HG21 ILE 20 1HG2 ILE 20 -8.549 -6.064 -14.799 157 HG22 ILE 20 2HG2 ILE 20 -9.654 -6.015 -13.424 158 HG23 ILE 20 3HG2 ILE 20 -10.094 -5.223 -14.932 159 HD11 ILE 20 1HD1 ILE 20 -10.317 -5.335 -17.007 160 HD12 ILE 20 2HD1 ILE 20 -11.900 -6.111 -16.919 161 HD13 ILE 20 3HD1 ILE 20 -10.858 -6.388 -18.314 162 H ALA 21 H ALA 21 -11.466 -9.154 -12.795 163 HA ALA 21 HA ALA 21 -10.772 -7.754 -10.450 164 HB1 ALA 21 1HB ALA 21 -12.641 -10.127 -10.748 165 HB2 ALA 21 2HB ALA 21 -13.068 -8.434 -11.006 166 HB3 ALA 21 3HB ALA 21 -12.615 -8.992 -9.396 167 H CYS 22 H CYS 22 -9.620 -10.778 -11.606 168 HA CYS 22 HA CYS 22 -8.842 -12.003 -9.157 169 HB2 CYS 22 2HB CYS 22 -7.749 -12.423 -11.963 170 HB3 CYS 22 3HB CYS 22 -7.528 -13.515 -10.596 171 HG CYS 22 HG CYS 22 -10.743 -12.933 -11.090 172 H MET 23 H MET 23 -7.370 -9.487 -11.108 173 HA MET 23 HA MET 23 -4.666 -9.718 -10.177 174 HB2 MET 23 2HB MET 23 -6.105 -7.255 -11.251 175 HB3 MET 23 3HB MET 23 -4.366 -7.401 -11.038 176 HG2 MET 23 2HG MET 23 -4.404 -9.287 -12.703 177 HG3 MET 23 3HG MET 23 -6.101 -8.909 -12.996 178 HE1 MET 23 1HE MET 23 -5.767 -5.197 -14.410 179 HE2 MET 23 2HE MET 23 -5.868 -5.581 -12.693 180 HE3 MET 23 3HE MET 23 -6.894 -6.434 -13.847 181 H SER 24 H SER 24 -7.524 -8.065 -8.996 182 HA SER 24 HA SER 24 -6.269 -6.825 -6.720 183 HB2 SER 24 2HB SER 24 -8.414 -5.947 -7.534 184 HB3 SER 24 3HB SER 24 -9.187 -7.519 -7.314 185 HG SER 24 HG SER 24 -7.992 -6.093 -5.184 186 H VAL 25 H VAL 25 -5.379 -8.046 -5.120 187 HA VAL 25 HA VAL 25 -5.741 -10.833 -4.798 188 HB VAL 25 HB VAL 25 -4.620 -8.804 -2.806 189 HG11 VAL 25 1HG1 VAL 25 -3.465 -10.732 -1.733 190 HG12 VAL 25 2HG1 VAL 25 -4.348 -11.840 -2.787 191 HG13 VAL 25 3HG1 VAL 25 -5.221 -10.855 -1.613 192 HG21 VAL 25 1HG2 VAL 25 -3.386 -8.812 -4.936 193 HG22 VAL 25 2HG2 VAL 25 -3.162 -10.561 -4.827 194 HG23 VAL 25 3HG2 VAL 25 -2.397 -9.495 -3.644 195 H THR 26 H THR 26 -7.181 -8.055 -3.142 196 HA THR 26 HA THR 26 -8.520 -9.425 -1.071 197 HB THR 26 HB THR 26 -9.212 -6.753 -2.362 198 HG1 THR 26 HG1 THR 26 -7.517 -7.443 -0.170 199 HG21 THR 26 1HG2 THR 26 -9.960 -7.815 0.396 200 HG22 THR 26 2HG2 THR 26 -11.079 -7.537 -0.941 201 HG23 THR 26 3HG2 THR 26 -10.252 -6.173 -0.188 202 H ILE 27 H ILE 27 -9.809 -8.222 -4.230 203 HA ILE 27 HA ILE 27 -12.441 -9.243 -3.896 204 HB ILE 27 HB ILE 27 -10.975 -8.590 -6.500 205 HG12 ILE 27 2HG1 ILE 27 -12.924 -6.872 -4.878 206 HG13 ILE 27 3HG1 ILE 27 -11.179 -6.648 -4.924 207 HG21 ILE 27 1HG2 ILE 27 -13.226 -8.430 -7.542 208 HG22 ILE 27 2HG2 ILE 27 -13.966 -8.969 -6.033 209 HG23 ILE 27 3HG2 ILE 27 -12.911 -10.057 -6.937 210 HD11 ILE 27 1HD1 ILE 27 -12.280 -5.038 -6.336 211 HD12 ILE 27 2HD1 ILE 27 -13.076 -6.322 -7.242 212 HD13 ILE 27 3HD1 ILE 27 -11.322 -6.141 -7.325 213 H LYS 28 H LYS 28 -9.531 -10.558 -5.456 214 HA LYS 28 HA LYS 28 -10.518 -12.884 -6.634 215 HB2 LYS 28 2HB LYS 28 -8.231 -12.031 -7.018 216 HB3 LYS 28 3HB LYS 28 -7.794 -12.401 -5.354 217 HG2 LYS 28 2HG LYS 28 -8.170 -14.832 -5.846 218 HG3 LYS 28 3HG LYS 28 -8.475 -14.405 -7.532 219 HD2 LYS 28 2HD LYS 28 -6.168 -15.191 -7.253 220 HD3 LYS 28 3HD LYS 28 -6.182 -13.491 -7.725 221 HE2 LYS 28 2HE LYS 28 -4.505 -13.921 -5.983 222 HE3 LYS 28 3HE LYS 28 -5.758 -12.833 -5.389 223 HZ1 LYS 28 1HZ LYS 28 -5.550 -15.740 -4.818 224 HZ2 LYS 28 2HZ LYS 28 -6.800 -14.738 -4.283 225 HZ3 LYS 28 3HZ LYS 28 -5.220 -14.482 -3.741 226 H ASN 29 H ASN 29 -9.100 -12.467 -3.389 227 HA ASN 29 HA ASN 29 -9.396 -15.098 -2.438 228 HB2 ASN 29 2HB ASN 29 -9.145 -12.444 -0.967 229 HB3 ASN 29 3HB ASN 29 -9.244 -13.981 -0.111 230 HD21 ASN 29 1HD2 ASN 29 -7.165 -13.561 0.781 231 HD22 ASN 29 2HD2 ASN 29 -5.726 -13.781 -0.147 232 H MET 30 H MET 30 -11.608 -12.330 -2.344 233 HA MET 30 HA MET 30 -13.629 -13.464 -0.707 234 HB2 MET 30 2HB MET 30 -13.798 -11.344 -2.889 235 HB3 MET 30 3HB MET 30 -15.168 -11.790 -1.878 236 HG2 MET 30 2HG MET 30 -13.927 -11.060 0.123 237 HG3 MET 30 3HG MET 30 -12.560 -10.605 -0.897 238 HE1 MET 30 1HE MET 30 -14.146 -7.153 0.279 239 HE2 MET 30 2HE MET 30 -12.685 -8.141 0.282 240 HE3 MET 30 3HE MET 30 -14.096 -8.649 1.211 241 H ILE 31 H ILE 31 -13.194 -13.440 -4.244 242 HA ILE 31 HA ILE 31 -15.508 -14.883 -4.981 243 HB ILE 31 HB ILE 31 -12.819 -14.642 -6.433 244 HG12 ILE 31 2HG1 ILE 31 -15.418 -13.074 -6.860 245 HG13 ILE 31 3HG1 ILE 31 -13.988 -12.460 -6.043 246 HG21 ILE 31 1HG2 ILE 31 -15.477 -15.612 -7.572 247 HG22 ILE 31 2HG2 ILE 31 -14.036 -16.596 -7.308 248 HG23 ILE 31 3HG2 ILE 31 -14.010 -15.308 -8.509 249 HD11 ILE 31 1HD1 ILE 31 -14.126 -11.596 -8.289 250 HD12 ILE 31 2HD1 ILE 31 -14.180 -13.227 -8.954 251 HD13 ILE 31 3HD1 ILE 31 -12.721 -12.651 -8.142 252 H GLU 32 H GLU 32 -12.317 -15.909 -3.891 253 HA GLU 32 HA GLU 32 -12.551 -18.681 -4.574 254 HB2 GLU 32 2HB GLU 32 -10.683 -17.281 -2.620 255 HB3 GLU 32 3HB GLU 32 -10.540 -18.973 -3.095 256 HG2 GLU 32 2HG GLU 32 -10.174 -18.294 -5.438 257 HG3 GLU 32 3HG GLU 32 -10.330 -16.605 -4.980 258 H ASP 33 H ASP 33 -13.070 -16.866 -1.525 259 HA ASP 33 HA ASP 33 -13.639 -19.154 0.089 260 HB2 ASP 33 2HB ASP 33 -14.126 -16.182 0.476 261 HB3 ASP 33 3HB ASP 33 -14.734 -17.344 1.648 262 H ILE 34 H ILE 34 -15.694 -16.871 -1.644 263 HA ILE 34 HA ILE 34 -18.223 -17.984 -0.852 264 HB ILE 34 HB ILE 34 -17.458 -16.082 -3.123 265 HG12 ILE 34 2HG1 ILE 34 -18.723 -15.461 -0.406 266 HG13 ILE 34 3HG1 ILE 34 -17.013 -15.271 -0.771 267 HG21 ILE 34 1HG2 ILE 34 -19.606 -17.165 -3.665 268 HG22 ILE 34 2HG2 ILE 34 -19.849 -15.463 -3.279 269 HG23 ILE 34 3HG2 ILE 34 -20.256 -16.703 -2.090 270 HD11 ILE 34 1HD1 ILE 34 -17.597 -13.589 -2.475 271 HD12 ILE 34 2HD1 ILE 34 -18.106 -13.153 -0.845 272 HD13 ILE 34 3HD1 ILE 34 -19.293 -13.744 -2.005 273 H GLY 35 H GLY 35 -15.886 -18.652 -3.341 274 HA2 GLY 35 2HA GLY 35 -15.820 -20.406 -4.891 275 HA3 GLY 35 3HA GLY 35 -17.529 -20.734 -4.601 276 H GLU 36 H GLU 36 -16.604 -20.638 -7.177 277 HA GLU 36 HA GLU 36 -16.684 -18.159 -8.502 278 HB2 GLU 36 2HB GLU 36 -17.407 -20.909 -9.608 279 HB3 GLU 36 3HB GLU 36 -17.043 -19.479 -10.574 280 HG2 GLU 36 2HG GLU 36 -14.747 -19.447 -9.669 281 HG3 GLU 36 3HG GLU 36 -15.109 -20.880 -8.705 282 H SER 37 H SER 37 -18.333 -16.853 -8.018 283 HA SER 37 HA SER 37 -21.127 -17.707 -8.559 284 HB2 SER 37 2HB SER 37 -20.182 -15.863 -6.313 285 HB3 SER 37 3HB SER 37 -21.857 -16.312 -6.650 286 HG SER 37 HG SER 37 -19.746 -17.897 -5.668 287 H ASP 38 H ASP 38 -22.227 -16.353 -9.897 288 HA ASP 38 HA ASP 38 -21.044 -13.915 -10.920 289 HB2 ASP 38 2HB ASP 38 -23.048 -13.737 -12.311 290 HB3 ASP 38 3HB ASP 38 -22.410 -15.369 -12.376 291 H SER 39 H SER 39 -22.673 -14.677 -8.124 292 HA SER 39 HA SER 39 -24.389 -12.693 -7.437 293 HB2 SER 39 2HB SER 39 -22.233 -13.921 -5.669 294 HB3 SER 39 3HB SER 39 -23.681 -13.097 -5.086 295 HG SER 39 HG SER 39 -24.740 -14.785 -6.564 296 HA PRO 40 HA PRO 40 -21.910 -8.935 -7.843 297 HB2 PRO 40 2HB PRO 40 -23.679 -7.217 -6.578 298 HB3 PRO 40 3HB PRO 40 -23.888 -7.781 -8.245 299 HG2 PRO 40 2HG PRO 40 -25.164 -8.814 -5.733 300 HG3 PRO 40 3HG PRO 40 -25.903 -8.471 -7.317 301 HD2 PRO 40 2HD PRO 40 -25.264 -10.985 -6.617 302 HD3 PRO 40 3HD PRO 40 -25.058 -10.417 -8.288 303 H ILE 41 H ILE 41 -20.219 -8.269 -6.612 304 HA ILE 41 HA ILE 41 -20.284 -8.740 -3.686 305 HB ILE 41 HB ILE 41 -17.813 -8.427 -5.470 306 HG12 ILE 41 2HG1 ILE 41 -18.960 -10.516 -6.076 307 HG13 ILE 41 3HG1 ILE 41 -17.496 -10.900 -5.183 308 HG21 ILE 41 1HG2 ILE 41 -16.551 -9.280 -3.506 309 HG22 ILE 41 2HG2 ILE 41 -18.039 -9.299 -2.559 310 HG23 ILE 41 3HG2 ILE 41 -17.386 -7.768 -3.140 311 HD11 ILE 41 1HD1 ILE 41 -18.873 -11.305 -3.165 312 HD12 ILE 41 2HD1 ILE 41 -19.302 -12.357 -4.513 313 HD13 ILE 41 3HD1 ILE 41 -20.323 -10.976 -4.119 314 HA PRO 42 HA PRO 42 -20.227 -4.129 -3.713 315 HB2 PRO 42 2HB PRO 42 -21.153 -4.414 -0.894 316 HB3 PRO 42 3HB PRO 42 -21.950 -3.602 -2.257 317 HG2 PRO 42 2HG PRO 42 -22.914 -5.896 -1.219 318 HG3 PRO 42 3HG PRO 42 -23.046 -5.516 -2.954 319 HD2 PRO 42 2HD PRO 42 -21.043 -7.303 -1.564 320 HD3 PRO 42 3HD PRO 42 -21.970 -7.592 -3.056 321 H LEU 43 H LEU 43 -18.681 -2.770 -2.858 322 HA LEU 43 HA LEU 43 -16.707 -3.848 -0.932 323 HB2 LEU 43 2HB LEU 43 -16.243 -1.920 -3.255 324 HB3 LEU 43 3HB LEU 43 -15.019 -2.434 -2.106 325 HG LEU 43 HG LEU 43 -16.425 -4.254 -4.103 326 HD11 LEU 43 1HD1 LEU 43 -14.275 -4.344 -5.297 327 HD12 LEU 43 2HD1 LEU 43 -13.595 -3.160 -4.179 328 HD13 LEU 43 3HD1 LEU 43 -14.925 -2.706 -5.246 329 HD21 LEU 43 1HD2 LEU 43 -14.163 -4.900 -2.175 330 HD22 LEU 43 2HD2 LEU 43 -14.750 -5.967 -3.454 331 HD23 LEU 43 3HD2 LEU 43 -15.814 -5.528 -2.121 332 HA PRO 44 HA PRO 44 -18.729 -0.173 1.024 333 HB2 PRO 44 2HB PRO 44 -18.892 -1.113 3.551 334 HB3 PRO 44 3HB PRO 44 -19.940 -1.756 2.269 335 HG2 PRO 44 2HG PRO 44 -17.458 -2.951 3.442 336 HG3 PRO 44 3HG PRO 44 -18.987 -3.739 2.998 337 HD2 PRO 44 2HD PRO 44 -16.707 -3.718 1.397 338 HD3 PRO 44 3HD PRO 44 -18.357 -4.000 0.803 339 H ASN 45 H ASN 45 -16.371 0.486 0.285 340 HA ASN 45 HA ASN 45 -15.113 1.859 2.484 341 HB2 ASN 45 2HB ASN 45 -13.971 -0.343 2.677 342 HB3 ASN 45 3HB ASN 45 -13.510 -0.266 0.983 343 HD21 ASN 45 1HD2 ASN 45 -12.932 1.030 4.166 344 HD22 ASN 45 2HD2 ASN 45 -11.416 1.780 3.814 345 H VAL 46 H VAL 46 -14.718 0.761 -0.878 346 HA VAL 46 HA VAL 46 -13.554 3.322 -1.700 347 HB VAL 46 HB VAL 46 -12.442 1.291 -2.498 348 HG11 VAL 46 1HG1 VAL 46 -14.329 -0.275 -2.532 349 HG12 VAL 46 2HG1 VAL 46 -13.465 -0.295 -4.069 350 HG13 VAL 46 3HG1 VAL 46 -15.012 0.548 -3.937 351 HG21 VAL 46 1HG2 VAL 46 -12.317 3.264 -3.939 352 HG22 VAL 46 2HG2 VAL 46 -13.794 2.787 -4.779 353 HG23 VAL 46 3HG2 VAL 46 -12.338 1.800 -4.922 354 H THR 47 H THR 47 -14.712 4.895 -2.651 355 HA THR 47 HA THR 47 -17.584 4.666 -3.009 356 HB THR 47 HB THR 47 -17.402 7.125 -3.565 357 HG1 THR 47 HG1 THR 47 -14.702 7.096 -2.796 358 HG21 THR 47 1HG2 THR 47 -15.939 6.311 -1.018 359 HG22 THR 47 2HG2 THR 47 -17.693 6.402 -1.201 360 HG23 THR 47 3HG2 THR 47 -16.715 7.866 -1.317 361 H SER 48 H SER 48 -18.433 6.003 -5.095 362 HA SER 48 HA SER 48 -18.062 4.146 -7.209 363 HB2 SER 48 2HB SER 48 -19.655 5.588 -8.474 364 HB3 SER 48 3HB SER 48 -20.220 5.191 -6.851 365 HG SER 48 HG SER 48 -20.538 7.325 -6.961 366 H THR 49 H THR 49 -17.137 7.546 -6.875 367 HA THR 49 HA THR 49 -16.138 7.994 -9.462 368 HB THR 49 HB THR 49 -14.935 9.937 -8.381 369 HG1 THR 49 HG1 THR 49 -15.534 10.155 -6.044 370 HG21 THR 49 1HG2 THR 49 -17.826 9.567 -7.500 371 HG22 THR 49 2HG2 THR 49 -17.291 10.228 -9.047 372 HG23 THR 49 3HG2 THR 49 -16.958 11.102 -7.551 373 H ILE 50 H ILE 50 -14.619 6.676 -6.571 374 HA ILE 50 HA ILE 50 -11.925 6.765 -7.642 375 HB ILE 50 HB ILE 50 -12.980 5.459 -5.086 376 HG12 ILE 50 2HG1 ILE 50 -13.393 7.863 -5.033 377 HG13 ILE 50 3HG1 ILE 50 -12.044 7.515 -3.962 378 HG21 ILE 50 1HG2 ILE 50 -10.111 6.083 -5.888 379 HG22 ILE 50 2HG2 ILE 50 -10.827 4.477 -5.743 380 HG23 ILE 50 3HG2 ILE 50 -10.631 5.486 -4.311 381 HD11 ILE 50 1HD1 ILE 50 -11.884 8.728 -6.731 382 HD12 ILE 50 2HD1 ILE 50 -10.488 8.304 -5.736 383 HD13 ILE 50 3HD1 ILE 50 -11.614 9.545 -5.190 384 H LEU 51 H LEU 51 -14.346 4.240 -6.889 385 HA LEU 51 HA LEU 51 -12.837 1.998 -7.729 386 HB2 LEU 51 2HB LEU 51 -14.895 1.917 -6.253 387 HB3 LEU 51 3HB LEU 51 -15.875 2.208 -7.682 388 HG LEU 51 HG LEU 51 -15.094 0.062 -8.667 389 HD11 LEU 51 1HD1 LEU 51 -13.569 -0.353 -6.072 390 HD12 LEU 51 2HD1 LEU 51 -12.867 -0.089 -7.669 391 HD13 LEU 51 3HD1 LEU 51 -13.784 -1.557 -7.347 392 HD21 LEU 51 1HD2 LEU 51 -17.164 0.050 -7.331 393 HD22 LEU 51 2HD2 LEU 51 -16.238 -0.300 -5.869 394 HD23 LEU 51 3HD2 LEU 51 -16.305 -1.481 -7.180 395 H GLU 52 H GLU 52 -14.873 4.244 -9.445 396 HA GLU 52 HA GLU 52 -15.186 3.157 -11.978 397 HB2 GLU 52 2HB GLU 52 -16.176 5.294 -11.440 398 HB3 GLU 52 3HB GLU 52 -14.621 5.984 -11.007 399 HG2 GLU 52 2HG GLU 52 -14.058 5.591 -13.562 400 HG3 GLU 52 3HG GLU 52 -15.810 5.545 -13.737 401 H LYS 53 H LYS 53 -12.464 5.090 -10.719 402 HA LYS 53 HA LYS 53 -10.858 4.772 -13.094 403 HB2 LYS 53 2HB LYS 53 -10.534 6.202 -10.462 404 HB3 LYS 53 3HB LYS 53 -9.098 5.917 -11.436 405 HG2 LYS 53 2HG LYS 53 -10.075 7.161 -13.312 406 HG3 LYS 53 3HG LYS 53 -11.575 7.390 -12.407 407 HD2 LYS 53 2HD LYS 53 -8.860 8.460 -11.511 408 HD3 LYS 53 3HD LYS 53 -10.053 9.406 -12.403 409 HE2 LYS 53 2HE LYS 53 -10.459 8.171 -9.656 410 HE3 LYS 53 3HE LYS 53 -10.186 9.880 -9.997 411 HZ1 LYS 53 1HZ LYS 53 -12.244 9.977 -11.185 412 HZ2 LYS 53 2HZ LYS 53 -12.538 9.332 -9.654 413 HZ3 LYS 53 3HZ LYS 53 -12.506 8.317 -11.006 414 H VAL 54 H VAL 54 -10.961 3.227 -9.922 415 HA VAL 54 HA VAL 54 -8.480 1.882 -9.974 416 HB VAL 54 HB VAL 54 -11.125 1.163 -8.612 417 HG11 VAL 54 1HG1 VAL 54 -9.874 -0.466 -7.215 418 HG12 VAL 54 2HG1 VAL 54 -8.448 -0.235 -8.229 419 HG13 VAL 54 3HG1 VAL 54 -9.912 -0.938 -8.913 420 HG21 VAL 54 1HG2 VAL 54 -8.538 2.297 -7.469 421 HG22 VAL 54 2HG2 VAL 54 -10.007 1.941 -6.557 422 HG23 VAL 54 3HG2 VAL 54 -10.020 3.208 -7.779 423 H LEU 55 H LEU 55 -11.730 0.830 -10.969 424 HA LEU 55 HA LEU 55 -10.831 -1.660 -12.063 425 HB2 LEU 55 2HB LEU 55 -13.520 -0.262 -12.207 426 HB3 LEU 55 3HB LEU 55 -13.213 -1.861 -12.861 427 HG LEU 55 HG LEU 55 -13.101 -1.054 -9.928 428 HD11 LEU 55 1HD1 LEU 55 -14.960 -2.629 -9.640 429 HD12 LEU 55 2HD1 LEU 55 -14.967 -2.955 -11.375 430 HD13 LEU 55 3HD1 LEU 55 -15.368 -1.345 -10.777 431 HD21 LEU 55 1HD2 LEU 55 -12.596 -3.419 -9.404 432 HD22 LEU 55 2HD2 LEU 55 -11.301 -2.664 -10.326 433 HD23 LEU 55 3HD2 LEU 55 -12.422 -3.767 -11.128 434 H ASP 56 H ASP 56 -11.419 1.556 -13.432 435 HA ASP 56 HA ASP 56 -11.403 0.682 -16.175 436 HB2 ASP 56 2HB ASP 56 -12.432 2.855 -15.410 437 HB3 ASP 56 3HB ASP 56 -10.809 3.491 -15.155 438 H TYR 57 H TYR 57 -8.934 1.846 -13.924 439 HA TYR 57 HA TYR 57 -6.690 1.799 -15.660 440 HB2 TYR 57 2HB TYR 57 -6.435 2.828 -13.473 441 HB3 TYR 57 3HB TYR 57 -6.893 1.344 -12.645 442 HD1 TYR 57 HD1 TYR 57 -4.175 2.926 -14.690 443 HD2 TYR 57 HD2 TYR 57 -5.222 -0.335 -12.124 444 HE1 TYR 57 HE1 TYR 57 -1.815 2.244 -14.570 445 HE2 TYR 57 HE2 TYR 57 -2.866 -1.003 -12.004 446 HH TYR 57 HH TYR 57 -0.319 0.960 -13.155 447 H CYS 58 H CYS 58 -8.263 -0.648 -13.669 448 HA CYS 58 HA CYS 58 -6.480 -2.779 -14.209 449 HB2 CYS 58 2HB CYS 58 -9.341 -2.716 -13.188 450 HB3 CYS 58 3HB CYS 58 -8.385 -4.194 -13.292 451 HG CYS 58 HG CYS 58 -7.310 -1.497 -11.484 452 H ARG 59 H ARG 59 -9.371 -1.583 -15.909 453 HA ARG 59 HA ARG 59 -9.643 -3.625 -17.869 454 HB2 ARG 59 2HB ARG 59 -10.229 -0.637 -18.069 455 HB3 ARG 59 3HB ARG 59 -10.673 -1.798 -19.312 456 HG2 ARG 59 2HG ARG 59 -12.212 -2.909 -17.758 457 HG3 ARG 59 3HG ARG 59 -11.731 -1.805 -16.467 458 HD2 ARG 59 2HD ARG 59 -12.546 0.110 -17.902 459 HD3 ARG 59 3HD ARG 59 -13.180 -1.085 -19.040 460 HE ARG 59 HE ARG 59 -14.496 -1.921 -17.013 461 HH11 ARG 59 1HH1 ARG 59 -13.701 1.479 -17.504 462 HH12 ARG 59 2HH1 ARG 59 -15.089 2.043 -16.624 463 HH21 ARG 59 1HH2 ARG 59 -16.324 -1.146 -15.876 464 HH22 ARG 59 2HH2 ARG 59 -16.572 0.563 -15.704 465 H HIS 60 H HIS 60 -7.863 -0.544 -17.892 466 HA HIS 60 HA HIS 60 -6.575 -0.732 -20.367 467 HB2 HIS 60 2HB HIS 60 -6.610 1.378 -19.157 468 HB3 HIS 60 3HB HIS 60 -5.729 0.681 -17.802 469 HD1 HIS 60 HD1 HIS 60 -5.186 1.664 -21.421 470 HD2 HIS 60 HD2 HIS 60 -2.984 0.912 -17.987 471 HE1 HIS 60 HE1 HIS 60 -2.823 2.230 -22.010 472 HE2 HIS 60 HE2 HIS 60 -1.609 2.112 -19.816 473 H HIS 61 H HIS 61 -5.579 -1.896 -17.198 474 HA HIS 61 HA HIS 61 -2.904 -2.596 -17.845 475 HB2 HIS 61 2HB HIS 61 -3.720 -2.082 -15.545 476 HB3 HIS 61 3HB HIS 61 -4.705 -3.539 -15.567 477 HD1 HIS 61 HD1 HIS 61 -3.468 -5.804 -15.221 478 HD2 HIS 61 HD2 HIS 61 -1.005 -2.464 -15.070 479 HE1 HIS 61 HE1 HIS 61 -1.313 -6.607 -14.227 480 HE2 HIS 61 HE2 HIS 61 0.229 -4.625 -14.369 481 H HIS 62 H HIS 62 -5.980 -4.335 -17.896 482 HA HIS 62 HA HIS 62 -4.784 -6.950 -18.285 483 HB2 HIS 62 2HB HIS 62 -6.861 -6.674 -16.971 484 HB3 HIS 62 3HB HIS 62 -7.702 -6.080 -18.398 485 HD1 HIS 62 HD1 HIS 62 -6.251 -9.208 -16.905 486 HD2 HIS 62 HD2 HIS 62 -8.667 -8.106 -20.106 487 HE1 HIS 62 HE1 HIS 62 -7.160 -11.349 -17.836 488 HE2 HIS 62 HE2 HIS 62 -8.547 -10.662 -19.813 489 H GLN 63 H GLN 63 -6.648 -4.663 -20.265 490 HA GLN 63 HA GLN 63 -6.700 -6.358 -22.604 491 HB2 GLN 63 2HB GLN 63 -7.507 -3.438 -22.236 492 HB3 GLN 63 3HB GLN 63 -7.804 -4.378 -23.693 493 HG2 GLN 63 2HG GLN 63 -8.968 -4.985 -20.952 494 HG3 GLN 63 3HG GLN 63 -9.816 -4.165 -22.261 495 HE21 GLN 63 1HE2 GLN 63 -10.543 -6.634 -20.894 496 HE22 GLN 63 2HE2 GLN 63 -10.622 -7.856 -22.108 497 H HIS 64 H HIS 64 -4.744 -3.709 -21.435 498 HA HIS 64 HA HIS 64 -2.887 -4.023 -23.722 499 HB2 HIS 64 2HB HIS 64 -3.518 -1.450 -22.186 500 HB3 HIS 64 3HB HIS 64 -2.212 -1.613 -23.360 501 HD1 HIS 64 HD1 HIS 64 -2.811 -1.023 -25.714 502 HD2 HIS 64 HD2 HIS 64 -6.197 -1.814 -23.445 503 HE1 HIS 64 HE1 HIS 64 -4.754 -0.452 -27.189 504 HE2 HIS 64 HE2 HIS 64 -6.781 -1.133 -25.874 505 HA PRO 65 HA PRO 65 -0.731 -5.656 -19.972 506 HB2 PRO 65 2HB PRO 65 1.355 -6.242 -22.080 507 HB3 PRO 65 3HB PRO 65 0.680 -7.311 -20.829 508 HG2 PRO 65 2HG PRO 65 -0.069 -7.598 -23.358 509 HG3 PRO 65 3HG PRO 65 -1.270 -7.739 -22.050 510 HD2 PRO 65 2HD PRO 65 -0.764 -5.417 -23.906 511 HD3 PRO 65 3HD PRO 65 -2.307 -6.095 -23.340 512 H GLY 66 H GLY 66 -0.254 -3.784 -18.890 513 HA2 GLY 66 2HA GLY 66 2.357 -2.770 -18.821 514 HA3 GLY 66 3HA GLY 66 1.387 -1.660 -19.784 515 H GLY 67 H GLY 67 -0.086 -0.316 -18.777 516 HA2 GLY 67 2HA GLY 67 -1.115 0.842 -17.053 517 HA3 GLY 67 3HA GLY 67 -0.718 -0.468 -15.948 518 H SER 68 H SER 68 2.022 0.459 -17.602 519 HA SER 68 HA SER 68 2.964 2.583 -15.870 520 HB2 SER 68 2HB SER 68 4.302 -0.173 -15.788 521 HB3 SER 68 3HB SER 68 4.855 1.274 -14.943 522 HG SER 68 HG SER 68 2.420 0.994 -14.139 523 H GLY 69 H GLY 69 5.093 3.338 -16.582 524 HA2 GLY 69 2HA GLY 69 6.214 2.305 -19.087 525 HA3 GLY 69 3HA GLY 69 5.550 3.939 -19.130 526 H LEU 70 H LEU 70 8.361 2.796 -19.317 527 HA LEU 70 HA LEU 70 9.791 3.803 -16.995 528 HB2 LEU 70 2HB LEU 70 10.858 2.837 -19.685 529 HB3 LEU 70 3HB LEU 70 11.818 3.099 -18.237 530 HG LEU 70 HG LEU 70 9.658 0.974 -18.546 531 HD11 LEU 70 1HD1 LEU 70 11.604 0.447 -19.928 532 HD12 LEU 70 2HD1 LEU 70 11.482 -0.668 -18.570 533 HD13 LEU 70 3HD1 LEU 70 12.673 0.635 -18.533 534 HD21 LEU 70 1HD2 LEU 70 9.817 1.708 -16.219 535 HD22 LEU 70 2HD2 LEU 70 11.565 1.456 -16.228 536 HD23 LEU 70 3HD2 LEU 70 10.471 0.080 -16.390 537 H ASP 71 H ASP 71 10.410 4.521 -20.436 538 HA ASP 71 HA ASP 71 10.402 7.439 -19.865 539 HB2 ASP 71 2HB ASP 71 12.606 6.475 -20.592 540 HB3 ASP 71 3HB ASP 71 11.865 5.941 -22.093 541 H ASP 72 H ASP 72 8.502 5.079 -21.008 542 HA ASP 72 HA ASP 72 7.293 6.579 -23.236 543 HB2 ASP 72 2HB ASP 72 6.238 4.411 -23.871 544 HB3 ASP 72 3HB ASP 72 7.990 4.319 -23.855 545 H ILE 73 H ILE 73 6.110 8.050 -22.053 546 HA ILE 73 HA ILE 73 4.196 7.163 -20.025 547 HB ILE 73 HB ILE 73 4.894 9.967 -21.027 548 HG12 ILE 73 2HG1 ILE 73 5.701 10.250 -18.580 549 HG13 ILE 73 3HG1 ILE 73 5.574 8.505 -18.424 550 HG21 ILE 73 1HG2 ILE 73 3.445 10.855 -19.223 551 HG22 ILE 73 2HG2 ILE 73 2.926 9.215 -18.828 552 HG23 ILE 73 3HG2 ILE 73 2.523 9.914 -20.396 553 HD11 ILE 73 1HD1 ILE 73 7.861 9.217 -18.824 554 HD12 ILE 73 2HD1 ILE 73 7.383 9.988 -20.335 555 HD13 ILE 73 3HD1 ILE 73 7.278 8.234 -20.166 556 HA PRO 74 HA PRO 74 1.187 7.055 -23.491 557 HB2 PRO 74 2HB PRO 74 -0.564 5.519 -21.668 558 HB3 PRO 74 3HB PRO 74 0.228 4.975 -23.159 559 HG2 PRO 74 2HG PRO 74 0.942 4.056 -20.706 560 HG3 PRO 74 3HG PRO 74 2.097 4.191 -22.054 561 HD2 PRO 74 2HD PRO 74 1.659 6.088 -19.742 562 HD3 PRO 74 3HD PRO 74 3.185 5.478 -20.428 563 HA PRO 75 HA PRO 75 -1.271 10.621 -22.384 564 HB2 PRO 75 2HB PRO 75 -3.472 9.309 -24.000 565 HB3 PRO 75 3HB PRO 75 -2.796 10.952 -24.126 566 HG2 PRO 75 2HG PRO 75 -2.122 9.126 -25.911 567 HG3 PRO 75 3HG PRO 75 -0.882 10.231 -25.263 568 HD2 PRO 75 2HD PRO 75 -1.406 7.350 -24.557 569 HD3 PRO 75 3HD PRO 75 0.146 8.190 -24.772 570 H TYR 76 H TYR 76 -3.268 7.604 -22.355 571 HA TYR 76 HA TYR 76 -5.231 8.414 -20.550 572 HB2 TYR 76 2HB TYR 76 -5.644 6.346 -21.700 573 HB3 TYR 76 3HB TYR 76 -4.143 5.624 -21.122 574 HD1 TYR 76 HD1 TYR 76 -4.171 4.275 -19.132 575 HD2 TYR 76 HD2 TYR 76 -7.483 6.867 -19.909 576 HE1 TYR 76 HE1 TYR 76 -5.338 3.363 -17.176 577 HE2 TYR 76 HE2 TYR 76 -8.649 5.942 -17.958 578 HH TYR 76 HH TYR 76 -8.635 3.965 -16.558 579 H ASP 77 H ASP 77 -2.201 6.692 -19.849 580 HA ASP 77 HA ASP 77 -2.680 6.230 -17.111 581 HB2 ASP 77 2HB ASP 77 -0.050 6.281 -18.651 582 HB3 ASP 77 3HB ASP 77 -0.247 5.614 -17.032 583 H ARG 78 H ARG 78 -1.156 8.911 -18.807 584 HA ARG 78 HA ARG 78 -0.166 10.220 -16.431 585 HB2 ARG 78 2HB ARG 78 0.816 10.547 -18.704 586 HB3 ARG 78 3HB ARG 78 -0.645 11.397 -19.204 587 HG2 ARG 78 2HG ARG 78 -0.211 13.153 -17.544 588 HG3 ARG 78 3HG ARG 78 1.205 12.277 -16.959 589 HD2 ARG 78 2HD ARG 78 2.280 12.553 -19.172 590 HD3 ARG 78 3HD ARG 78 0.866 13.454 -19.739 591 HE ARG 78 HE ARG 78 1.860 14.662 -17.398 592 HH11 ARG 78 1HH1 ARG 78 2.796 14.259 -20.767 593 HH12 ARG 78 2HH1 ARG 78 3.723 15.726 -20.806 594 HH21 ARG 78 1HH2 ARG 78 3.058 16.595 -17.473 595 HH22 ARG 78 2HH2 ARG 78 3.869 17.053 -18.938 596 H ASP 79 H ASP 79 -3.011 10.660 -18.548 597 HA ASP 79 HA ASP 79 -4.206 12.797 -17.092 598 HB2 ASP 79 2HB ASP 79 -5.326 10.857 -19.136 599 HB3 ASP 79 3HB ASP 79 -6.357 12.043 -18.349 600 H PHE 80 H PHE 80 -4.155 9.405 -16.607 601 HA PHE 80 HA PHE 80 -6.385 9.060 -14.882 602 HB2 PHE 80 2HB PHE 80 -5.298 7.146 -15.990 603 HB3 PHE 80 3HB PHE 80 -3.772 7.494 -15.185 604 HD1 PHE 80 HD1 PHE 80 -3.299 6.538 -13.043 605 HD2 PHE 80 HD2 PHE 80 -7.293 6.445 -14.568 606 HE1 PHE 80 HE1 PHE 80 -3.986 5.095 -11.174 607 HE2 PHE 80 HE2 PHE 80 -7.958 5.009 -12.708 608 HZ PHE 80 HZ PHE 80 -6.324 4.337 -11.001 609 H CYS 81 H CYS 81 -2.982 9.829 -14.405 610 HA CYS 81 HA CYS 81 -3.065 9.874 -11.530 611 HB2 CYS 81 2HB CYS 81 -0.954 10.850 -13.491 612 HB3 CYS 81 3HB CYS 81 -0.719 10.640 -11.751 613 HG CYS 81 HG CYS 81 -1.772 7.993 -13.586 614 H LYS 82 H LYS 82 -3.916 12.150 -13.973 615 HA LYS 82 HA LYS 82 -3.487 14.578 -12.454 616 HB2 LYS 82 2HB LYS 82 -5.247 14.054 -14.889 617 HB3 LYS 82 3HB LYS 82 -4.911 15.647 -14.215 618 HG2 LYS 82 2HG LYS 82 -2.538 15.407 -14.782 619 HG3 LYS 82 3HG LYS 82 -2.840 13.781 -15.401 620 HD2 LYS 82 2HD LYS 82 -4.417 14.778 -17.094 621 HD3 LYS 82 3HD LYS 82 -3.946 16.383 -16.529 622 HE2 LYS 82 2HE LYS 82 -1.634 15.983 -17.250 623 HE3 LYS 82 3HE LYS 82 -2.047 14.333 -17.728 624 HZ1 LYS 82 1HZ LYS 82 -3.577 15.232 -19.379 625 HZ2 LYS 82 2HZ LYS 82 -2.009 15.815 -19.632 626 HZ3 LYS 82 3HZ LYS 82 -3.171 16.814 -18.921 627 H VAL 83 H VAL 83 -4.483 13.788 -10.482 628 HA VAL 83 HA VAL 83 -7.381 14.360 -10.333 629 HB VAL 83 HB VAL 83 -7.553 12.702 -8.437 630 HG11 VAL 83 1HG1 VAL 83 -8.327 12.026 -10.671 631 HG12 VAL 83 2HG1 VAL 83 -7.654 10.647 -9.802 632 HG13 VAL 83 3HG1 VAL 83 -6.713 11.432 -11.073 633 HG21 VAL 83 1HG2 VAL 83 -5.800 10.989 -8.108 634 HG22 VAL 83 2HG2 VAL 83 -5.167 12.602 -7.792 635 HG23 VAL 83 3HG2 VAL 83 -4.775 11.784 -9.306 636 H ASP 84 H ASP 84 -8.001 15.226 -8.163 637 HA ASP 84 HA ASP 84 -6.105 17.170 -7.212 638 HB2 ASP 84 2HB ASP 84 -8.649 17.458 -7.285 639 HB3 ASP 84 3HB ASP 84 -8.742 16.393 -5.885 640 H GLN 85 H GLN 85 -5.397 17.306 -4.874 641 HA GLN 85 HA GLN 85 -3.892 15.013 -4.308 642 HB2 GLN 85 2HB GLN 85 -3.123 17.299 -3.753 643 HB3 GLN 85 3HB GLN 85 -4.337 17.416 -2.489 644 HG2 GLN 85 2HG GLN 85 -2.083 16.941 -1.590 645 HG3 GLN 85 3HG GLN 85 -3.232 15.668 -1.201 646 HE21 GLN 85 1HE2 GLN 85 -2.930 13.597 -2.096 647 HE22 GLN 85 2HE2 GLN 85 -1.479 13.138 -2.901 648 HA PRO 86 HA PRO 86 -7.045 14.049 -0.544 649 HB2 PRO 86 2HB PRO 86 -9.468 15.201 -1.956 650 HB3 PRO 86 3HB PRO 86 -9.152 15.019 -0.213 651 HG2 PRO 86 2HG PRO 86 -8.897 17.395 -1.329 652 HG3 PRO 86 3HG PRO 86 -7.694 16.841 -0.137 653 HD2 PRO 86 2HD PRO 86 -7.463 16.969 -3.138 654 HD3 PRO 86 3HD PRO 86 -6.247 17.341 -1.894 655 H THR 87 H THR 87 -8.336 14.276 -3.870 656 HA THR 87 HA THR 87 -9.593 11.763 -4.034 657 HB THR 87 HB THR 87 -8.370 13.361 -6.331 658 HG1 THR 87 HG1 THR 87 -10.779 13.718 -4.858 659 HG21 THR 87 1HG2 THR 87 -10.214 12.418 -7.678 660 HG22 THR 87 2HG2 THR 87 -10.754 11.471 -6.291 661 HG23 THR 87 3HG2 THR 87 -9.185 11.142 -7.031 662 H LEU 88 H LEU 88 -6.271 12.728 -4.482 663 HA LEU 88 HA LEU 88 -5.289 10.436 -5.874 664 HB2 LEU 88 2HB LEU 88 -4.321 12.872 -5.649 665 HB3 LEU 88 3HB LEU 88 -3.583 12.300 -4.166 666 HG LEU 88 HG LEU 88 -3.076 11.048 -6.903 667 HD11 LEU 88 1HD1 LEU 88 -1.382 13.112 -5.458 668 HD12 LEU 88 2HD1 LEU 88 -2.305 13.362 -6.942 669 HD13 LEU 88 3HD1 LEU 88 -0.936 12.257 -6.939 670 HD21 LEU 88 1HD2 LEU 88 -2.596 9.510 -5.069 671 HD22 LEU 88 2HD2 LEU 88 -1.572 10.715 -4.287 672 HD23 LEU 88 3HD2 LEU 88 -1.100 10.028 -5.843 673 H PHE 89 H PHE 89 -5.338 11.479 -2.470 674 HA PHE 89 HA PHE 89 -4.082 9.212 -1.335 675 HB2 PHE 89 2HB PHE 89 -6.035 11.218 -0.154 676 HB3 PHE 89 3HB PHE 89 -5.252 9.967 0.806 677 HD1 PHE 89 HD1 PHE 89 -5.101 13.239 0.683 678 HD2 PHE 89 HD2 PHE 89 -2.486 9.999 -0.285 679 HE1 PHE 89 HE1 PHE 89 -3.149 14.676 1.121 680 HE2 PHE 89 HE2 PHE 89 -0.558 11.436 0.154 681 HZ PHE 89 HZ PHE 89 -0.870 13.775 0.858 682 H GLU 90 H GLU 90 -7.417 9.864 -2.220 683 HA GLU 90 HA GLU 90 -8.655 7.596 -1.089 684 HB2 GLU 90 2HB GLU 90 -9.377 9.265 -3.522 685 HB3 GLU 90 3HB GLU 90 -10.425 8.022 -2.852 686 HG2 GLU 90 2HG GLU 90 -9.486 10.500 -1.390 687 HG3 GLU 90 3HG GLU 90 -11.075 10.282 -2.127 688 H LEU 91 H LEU 91 -7.025 8.078 -4.197 689 HA LEU 91 HA LEU 91 -7.555 5.513 -5.316 690 HB2 LEU 91 2HB LEU 91 -5.264 7.444 -5.854 691 HB3 LEU 91 3HB LEU 91 -5.602 6.018 -6.821 692 HG LEU 91 HG LEU 91 -7.417 8.455 -6.560 693 HD11 LEU 91 1HD1 LEU 91 -5.759 7.509 -8.927 694 HD12 LEU 91 2HD1 LEU 91 -5.405 8.904 -7.904 695 HD13 LEU 91 3HD1 LEU 91 -6.852 8.898 -8.908 696 HD21 LEU 91 1HD2 LEU 91 -8.741 6.398 -6.847 697 HD22 LEU 91 2HD2 LEU 91 -7.798 5.975 -8.276 698 HD23 LEU 91 3HD2 LEU 91 -8.822 7.412 -8.286 699 H ILE 92 H ILE 92 -4.994 6.757 -3.201 700 HA ILE 92 HA ILE 92 -3.333 4.439 -3.147 701 HB ILE 92 HB ILE 92 -3.641 6.609 -1.000 702 HG12 ILE 92 2HG1 ILE 92 -1.609 6.389 -3.279 703 HG13 ILE 92 3HG1 ILE 92 -2.937 7.539 -3.196 704 HG21 ILE 92 1HG2 ILE 92 -1.396 4.578 -1.361 705 HG22 ILE 92 2HG2 ILE 92 -2.594 4.580 -0.066 706 HG23 ILE 92 3HG2 ILE 92 -1.416 5.886 -0.173 707 HD11 ILE 92 1HD1 ILE 92 -0.551 7.444 -1.354 708 HD12 ILE 92 2HD1 ILE 92 -1.896 8.580 -1.232 709 HD13 ILE 92 3HD1 ILE 92 -0.847 8.605 -2.648 710 H LEU 93 H LEU 93 -6.038 5.540 -1.118 711 HA LEU 93 HA LEU 93 -6.060 3.526 0.843 712 HB2 LEU 93 2HB LEU 93 -8.317 5.242 -0.268 713 HB3 LEU 93 3HB LEU 93 -8.531 4.164 1.102 714 HG LEU 93 HG LEU 93 -6.618 6.530 1.050 715 HD11 LEU 93 1HD1 LEU 93 -9.321 6.284 2.423 716 HD12 LEU 93 2HD1 LEU 93 -8.969 7.268 1.000 717 HD13 LEU 93 3HD1 LEU 93 -8.210 7.654 2.539 718 HD21 LEU 93 1HD2 LEU 93 -6.388 6.143 3.467 719 HD22 LEU 93 2HD2 LEU 93 -5.836 4.753 2.540 720 HD23 LEU 93 3HD2 LEU 93 -7.405 4.703 3.345 721 H ALA 94 H ALA 94 -7.812 3.777 -2.233 722 HA ALA 94 HA ALA 94 -9.304 1.365 -2.025 723 HB1 ALA 94 1HB ALA 94 -8.578 2.985 -4.489 724 HB2 ALA 94 2HB ALA 94 -9.984 3.244 -3.453 725 HB3 ALA 94 3HB ALA 94 -9.843 1.759 -4.395 726 H ALA 95 H ALA 95 -6.172 2.159 -3.449 727 HA ALA 95 HA ALA 95 -5.759 -0.320 -4.828 728 HB1 ALA 95 1HB ALA 95 -4.654 1.781 -5.491 729 HB2 ALA 95 2HB ALA 95 -3.488 0.492 -5.193 730 HB3 ALA 95 3HB ALA 95 -3.725 1.765 -3.990 731 H ASN 96 H ASN 96 -4.938 0.885 -1.605 732 HA ASN 96 HA ASN 96 -3.384 -1.420 -0.794 733 HB2 ASN 96 2HB ASN 96 -2.998 0.826 0.194 734 HB3 ASN 96 3HB ASN 96 -4.634 0.843 0.838 735 HD21 ASN 96 1HD2 ASN 96 -3.760 1.185 2.933 736 HD22 ASN 96 2HD2 ASN 96 -3.054 -0.107 3.837 737 H TYR 97 H TYR 97 -6.722 -0.330 -0.483 738 HA TYR 97 HA TYR 97 -7.725 -2.289 1.297 739 HB2 TYR 97 2HB TYR 97 -9.042 -0.306 1.010 740 HB3 TYR 97 3HB TYR 97 -9.053 -0.464 -0.739 741 HD1 TYR 97 HD1 TYR 97 -11.076 -1.184 -1.717 742 HD2 TYR 97 HD2 TYR 97 -10.230 -2.420 2.292 743 HE1 TYR 97 HE1 TYR 97 -13.258 -2.308 -1.600 744 HE2 TYR 97 HE2 TYR 97 -12.417 -3.540 2.400 745 HH TYR 97 HH TYR 97 -14.331 -4.122 -0.344 746 H LEU 98 H LEU 98 -7.438 -2.172 -2.224 747 HA LEU 98 HA LEU 98 -8.577 -4.868 -2.513 748 HB2 LEU 98 2HB LEU 98 -7.837 -2.760 -4.569 749 HB3 LEU 98 3HB LEU 98 -8.454 -4.355 -4.974 750 HG LEU 98 HG LEU 98 -9.954 -2.184 -3.453 751 HD11 LEU 98 1HD1 LEU 98 -11.484 -2.168 -5.382 752 HD12 LEU 98 2HD1 LEU 98 -10.462 -3.344 -6.213 753 HD13 LEU 98 3HD1 LEU 98 -9.842 -1.732 -5.851 754 HD21 LEU 98 1HD2 LEU 98 -10.555 -4.346 -2.514 755 HD22 LEU 98 2HD2 LEU 98 -10.856 -5.002 -4.124 756 HD23 LEU 98 3HD2 LEU 98 -11.894 -3.728 -3.479 757 H ASP 99 H ASP 99 -5.603 -3.443 -2.077 758 HA ASP 99 HA ASP 99 -3.450 -4.094 -2.120 759 HB2 ASP 99 2HB ASP 99 -4.569 -5.984 -0.782 760 HB3 ASP 99 3HB ASP 99 -4.503 -6.953 -2.246 761 H ILE 100 H ILE 100 -4.595 -3.436 -4.616 762 HA ILE 100 HA ILE 100 -3.570 -5.186 -6.688 763 HB ILE 100 HB ILE 100 -4.522 -2.281 -6.954 764 HG12 ILE 100 2HG1 ILE 100 -6.133 -4.850 -7.338 765 HG13 ILE 100 3HG1 ILE 100 -6.314 -3.721 -6.003 766 HG21 ILE 100 1HG2 ILE 100 -4.846 -2.832 -9.353 767 HG22 ILE 100 2HG2 ILE 100 -4.215 -4.455 -9.067 768 HG23 ILE 100 3HG2 ILE 100 -3.164 -3.054 -8.863 769 HD11 ILE 100 1HD1 ILE 100 -6.919 -3.161 -8.902 770 HD12 ILE 100 2HD1 ILE 100 -7.060 -1.995 -7.583 771 HD13 ILE 100 3HD1 ILE 100 -8.080 -3.431 -7.602 772 H LYS 101 H LYS 101 -1.399 -5.361 -6.704 773 HA LYS 101 HA LYS 101 0.432 -3.564 -5.621 774 HB2 LYS 101 2HB LYS 101 1.104 -5.664 -7.719 775 HB3 LYS 101 3HB LYS 101 2.208 -4.951 -6.553 776 HG2 LYS 101 2HG LYS 101 -0.103 -6.812 -5.945 777 HG3 LYS 101 3HG LYS 101 1.610 -7.220 -5.907 778 HD2 LYS 101 2HD LYS 101 1.899 -5.572 -4.021 779 HD3 LYS 101 3HD LYS 101 0.151 -5.315 -4.036 780 HE2 LYS 101 2HE LYS 101 -0.177 -7.746 -3.555 781 HE3 LYS 101 3HE LYS 101 1.576 -7.935 -3.447 782 HZ1 LYS 101 1HZ LYS 101 0.692 -7.693 -1.271 783 HZ2 LYS 101 2HZ LYS 101 -0.167 -6.298 -1.691 784 HZ3 LYS 101 3HZ LYS 101 1.527 -6.264 -1.625 785 HA PRO 102 HA PRO 102 1.538 -2.067 -10.237 786 HB2 PRO 102 2HB PRO 102 -0.699 -2.017 -11.944 787 HB3 PRO 102 3HB PRO 102 0.590 -3.236 -11.990 788 HG2 PRO 102 2HG PRO 102 -2.102 -3.390 -10.678 789 HG3 PRO 102 3HG PRO 102 -1.224 -4.631 -11.604 790 HD2 PRO 102 2HD PRO 102 -1.303 -4.714 -8.927 791 HD3 PRO 102 3HD PRO 102 0.182 -5.162 -9.803 792 H LEU 103 H LEU 103 -1.897 -1.595 -9.264 793 HA LEU 103 HA LEU 103 -2.060 1.137 -9.972 794 HB2 LEU 103 2HB LEU 103 -4.058 -0.267 -9.675 795 HB3 LEU 103 3HB LEU 103 -3.711 -0.443 -7.962 796 HG LEU 103 HG LEU 103 -4.122 1.983 -7.621 797 HD11 LEU 103 1HD1 LEU 103 -5.089 3.379 -9.396 798 HD12 LEU 103 2HD1 LEU 103 -4.848 2.079 -10.564 799 HD13 LEU 103 3HD1 LEU 103 -3.458 2.851 -9.798 800 HD21 LEU 103 1HD2 LEU 103 -5.980 0.416 -7.310 801 HD22 LEU 103 2HD2 LEU 103 -6.429 0.574 -9.010 802 HD23 LEU 103 3HD2 LEU 103 -6.563 1.960 -7.925 803 H LEU 104 H LEU 104 -1.399 -0.445 -6.868 804 HA LEU 104 HA LEU 104 -1.356 1.874 -5.251 805 HB2 LEU 104 2HB LEU 104 -1.642 -0.422 -4.356 806 HB3 LEU 104 3HB LEU 104 0.013 -0.808 -4.797 807 HG LEU 104 HG LEU 104 0.835 0.867 -3.140 808 HD11 LEU 104 1HD1 LEU 104 -0.703 1.873 -1.488 809 HD12 LEU 104 2HD1 LEU 104 -2.086 1.228 -2.378 810 HD13 LEU 104 3HD1 LEU 104 -1.040 2.437 -3.125 811 HD21 LEU 104 1HD2 LEU 104 0.306 -0.427 -1.118 812 HD22 LEU 104 2HD2 LEU 104 0.598 -1.497 -2.485 813 HD23 LEU 104 3HD2 LEU 104 -1.056 -1.196 -1.943 814 H ASP 105 H ASP 105 1.175 0.116 -6.997 815 HA ASP 105 HA ASP 105 3.385 1.541 -5.922 816 HB2 ASP 105 2HB ASP 105 3.577 -0.725 -6.953 817 HB3 ASP 105 3HB ASP 105 3.250 -0.023 -8.538 818 H VAL 106 H VAL 106 1.617 1.805 -9.025 819 HA VAL 106 HA VAL 106 3.078 3.905 -10.173 820 HB VAL 106 HB VAL 106 0.170 3.078 -10.617 821 HG11 VAL 106 1HG1 VAL 106 0.362 5.448 -11.281 822 HG12 VAL 106 2HG1 VAL 106 0.174 4.422 -12.699 823 HG13 VAL 106 3HG1 VAL 106 1.762 5.076 -12.292 824 HG21 VAL 106 1HG2 VAL 106 2.654 2.605 -12.318 825 HG22 VAL 106 2HG2 VAL 106 1.021 2.038 -12.677 826 HG23 VAL 106 3HG2 VAL 106 1.878 1.412 -11.273 827 H THR 107 H THR 107 0.163 4.015 -8.109 828 HA THR 107 HA THR 107 -0.202 6.834 -8.215 829 HB THR 107 HB THR 107 -1.223 4.881 -6.098 830 HG1 THR 107 HG1 THR 107 -2.437 4.168 -7.672 831 HG21 THR 107 1HG2 THR 107 -1.531 7.252 -5.429 832 HG22 THR 107 2HG2 THR 107 -3.079 6.500 -5.814 833 HG23 THR 107 3HG2 THR 107 -2.316 7.589 -6.974 834 H CYS 108 H CYS 108 1.596 4.725 -5.976 835 HA CYS 108 HA CYS 108 2.373 6.792 -4.132 836 HB2 CYS 108 2HB CYS 108 3.552 4.026 -4.626 837 HB3 CYS 108 3HB CYS 108 4.037 5.089 -3.303 838 HG CYS 108 HG CYS 108 0.793 4.085 -3.667 839 H LYS 109 H LYS 109 3.680 5.545 -7.142 840 HA LYS 109 HA LYS 109 6.201 6.932 -6.954 841 HB2 LYS 109 2HB LYS 109 4.897 5.157 -8.972 842 HB3 LYS 109 3HB LYS 109 5.995 6.355 -9.643 843 HG2 LYS 109 2HG LYS 109 7.073 4.150 -9.209 844 HG3 LYS 109 3HG LYS 109 7.855 5.482 -8.361 845 HD2 LYS 109 2HD LYS 109 6.710 4.832 -6.269 846 HD3 LYS 109 3HD LYS 109 5.894 3.512 -7.115 847 HE2 LYS 109 2HE LYS 109 8.901 3.772 -6.748 848 HE3 LYS 109 3HE LYS 109 7.842 2.731 -5.799 849 HZ1 LYS 109 1HZ LYS 109 7.250 1.559 -7.848 850 HZ2 LYS 109 2HZ LYS 109 8.907 1.467 -7.524 851 HZ3 LYS 109 3HZ LYS 109 8.341 2.521 -8.718 852 H THR 110 H THR 110 2.999 7.679 -8.219 853 HA THR 110 HA THR 110 3.567 9.872 -9.860 854 HB THR 110 HB THR 110 1.103 9.395 -8.122 855 HG1 THR 110 HG1 THR 110 0.954 7.831 -9.560 856 HG21 THR 110 1HG2 THR 110 1.200 11.774 -8.832 857 HG22 THR 110 2HG2 THR 110 -0.088 10.920 -9.681 858 HG23 THR 110 3HG2 THR 110 1.430 11.273 -10.510 859 H VAL 111 H VAL 111 2.670 9.853 -6.384 860 HA VAL 111 HA VAL 111 3.152 12.616 -5.916 861 HB VAL 111 HB VAL 111 3.180 12.025 -3.460 862 HG11 VAL 111 1HG1 VAL 111 0.810 11.360 -3.339 863 HG12 VAL 111 2HG1 VAL 111 0.842 10.906 -5.046 864 HG13 VAL 111 3HG1 VAL 111 1.077 12.590 -4.574 865 HG21 VAL 111 1HG2 VAL 111 4.173 9.775 -3.575 866 HG22 VAL 111 2HG2 VAL 111 2.756 9.166 -4.433 867 HG23 VAL 111 3HG2 VAL 111 2.609 9.715 -2.760 868 H ALA 112 H ALA 112 5.236 9.777 -5.768 869 HA ALA 112 HA ALA 112 7.449 10.907 -4.440 870 HB1 ALA 112 1HB ALA 112 7.148 8.486 -4.720 871 HB2 ALA 112 2HB ALA 112 8.723 8.996 -5.328 872 HB3 ALA 112 3HB ALA 112 7.413 8.637 -6.459 873 H ASN 113 H ASN 113 6.577 10.802 -7.883 874 HA ASN 113 HA ASN 113 9.002 11.972 -8.858 875 HB2 ASN 113 2HB ASN 113 6.282 11.503 -10.128 876 HB3 ASN 113 3HB ASN 113 7.504 12.439 -10.975 877 HD21 ASN 113 1HD2 ASN 113 6.416 9.290 -10.237 878 HD22 ASN 113 2HD2 ASN 113 7.704 8.421 -10.978 879 H MET 114 H MET 114 5.876 13.283 -7.816 880 HA MET 114 HA MET 114 6.295 15.921 -8.841 881 HB2 MET 114 2HB MET 114 4.346 14.907 -6.733 882 HB3 MET 114 3HB MET 114 4.345 16.553 -7.356 883 HG2 MET 114 2HG MET 114 3.974 15.594 -9.656 884 HG3 MET 114 3HG MET 114 3.768 14.018 -8.896 885 HE1 MET 114 1HE MET 114 0.492 14.668 -6.727 886 HE2 MET 114 2HE MET 114 2.143 14.910 -6.158 887 HE3 MET 114 3HE MET 114 1.743 13.491 -7.130 888 H ILE 115 H ILE 115 6.902 14.432 -5.655 889 HA ILE 115 HA ILE 115 7.656 16.953 -4.421 890 HB ILE 115 HB ILE 115 8.224 15.644 -2.401 891 HG12 ILE 115 2HG1 ILE 115 7.528 13.177 -4.073 892 HG13 ILE 115 3HG1 ILE 115 9.130 13.590 -3.480 893 HG21 ILE 115 1HG2 ILE 115 5.541 14.843 -3.597 894 HG22 ILE 115 2HG2 ILE 115 5.888 16.359 -2.763 895 HG23 ILE 115 3HG2 ILE 115 5.949 14.834 -1.878 896 HD11 ILE 115 1HD1 ILE 115 8.099 11.823 -2.173 897 HD12 ILE 115 2HD1 ILE 115 6.747 12.875 -1.766 898 HD13 ILE 115 3HD1 ILE 115 8.370 13.254 -1.182 899 H ARG 116 H ARG 116 9.345 14.345 -6.036 900 HA ARG 116 HA ARG 116 11.998 15.343 -5.254 901 HB2 ARG 116 2HB ARG 116 11.095 12.969 -6.929 902 HB3 ARG 116 3HB ARG 116 12.789 13.410 -6.726 903 HG2 ARG 116 2HG ARG 116 12.597 13.061 -4.285 904 HG3 ARG 116 3HG ARG 116 10.896 12.632 -4.484 905 HD2 ARG 116 2HD ARG 116 11.485 10.652 -5.761 906 HD3 ARG 116 3HD ARG 116 13.191 11.109 -5.779 907 HE ARG 116 HE ARG 116 11.646 10.086 -3.495 908 HH11 ARG 116 1HH1 ARG 116 14.779 11.031 -4.779 909 HH12 ARG 116 2HH1 ARG 116 15.664 10.295 -3.483 910 HH21 ARG 116 1HH2 ARG 116 12.798 9.148 -1.811 911 HH22 ARG 116 2HH2 ARG 116 14.532 9.224 -1.798 912 H GLY 117 H GLY 117 9.728 15.793 -7.796 913 HA2 GLY 117 2HA GLY 117 11.750 16.642 -9.782 914 HA3 GLY 117 3HA GLY 117 10.033 16.383 -10.070 915 H1 SER 2 1H SER 2 17.669 -14.572 18.429 916 H2 SER 2 2H SER 2 17.182 -14.154 16.865 917 H3 SER 2 3H SER 2 16.498 -13.377 18.202 918 HA SER 2 HA SER 2 18.572 -12.381 18.776 919 HB2 SER 2 2HB SER 2 20.029 -14.205 17.916 920 HB3 SER 2 3HB SER 2 19.635 -13.750 16.260 921 HG SER 2 HG SER 2 21.172 -12.328 16.384 922 H LEU 3 H LEU 3 19.562 -10.510 17.517 923 HA LEU 3 HA LEU 3 17.464 -9.112 16.084 924 HB2 LEU 3 2HB LEU 3 20.295 -8.218 16.778 925 HB3 LEU 3 3HB LEU 3 18.994 -7.181 16.214 926 HG LEU 3 HG LEU 3 18.982 -8.666 18.873 927 HD11 LEU 3 1HD1 LEU 3 19.571 -5.739 18.330 928 HD12 LEU 3 2HD1 LEU 3 20.729 -6.961 18.860 929 HD13 LEU 3 3HD1 LEU 3 19.409 -6.485 19.923 930 HD21 LEU 3 1HD2 LEU 3 16.708 -8.249 18.043 931 HD22 LEU 3 2HD2 LEU 3 17.078 -6.536 17.833 932 HD23 LEU 3 3HD2 LEU 3 17.055 -7.245 19.449 933 H VAL 4 H VAL 4 17.257 -9.393 13.894 934 HA VAL 4 HA VAL 4 19.479 -10.010 12.152 935 HB VAL 4 HB VAL 4 17.842 -9.724 10.266 936 HG11 VAL 4 1HG1 VAL 4 18.154 -11.920 11.326 937 HG12 VAL 4 2HG1 VAL 4 16.484 -11.721 10.801 938 HG13 VAL 4 3HG1 VAL 4 16.896 -11.552 12.509 939 HG21 VAL 4 1HG2 VAL 4 16.358 -8.002 11.230 940 HG22 VAL 4 2HG2 VAL 4 15.801 -9.139 12.458 941 HG23 VAL 4 3HG2 VAL 4 15.423 -9.422 10.757 942 H LYS 5 H LYS 5 20.712 -8.634 11.066 943 HA LYS 5 HA LYS 5 20.665 -5.812 11.819 944 HB2 LYS 5 2HB LYS 5 22.728 -7.396 10.219 945 HB3 LYS 5 3HB LYS 5 22.964 -5.811 10.951 946 HG2 LYS 5 2HG LYS 5 22.783 -6.793 13.195 947 HG3 LYS 5 3HG LYS 5 22.451 -8.377 12.494 948 HD2 LYS 5 2HD LYS 5 24.709 -8.404 11.476 949 HD3 LYS 5 3HD LYS 5 25.038 -6.807 12.157 950 HE2 LYS 5 2HE LYS 5 24.849 -7.716 14.437 951 HE3 LYS 5 3HE LYS 5 24.447 -9.308 13.783 952 HZ1 LYS 5 1HZ LYS 5 26.780 -9.108 14.439 953 HZ2 LYS 5 2HZ LYS 5 27.005 -7.879 13.300 954 HZ3 LYS 5 3HZ LYS 5 26.617 -9.445 12.792 955 H LEU 6 H LEU 6 19.390 -4.565 10.529 956 HA LEU 6 HA LEU 6 19.251 -5.104 7.618 957 HB2 LEU 6 2HB LEU 6 17.247 -3.627 9.380 958 HB3 LEU 6 3HB LEU 6 17.062 -3.973 7.666 959 HG LEU 6 HG LEU 6 17.145 -6.050 9.890 960 HD11 LEU 6 1HD1 LEU 6 14.798 -5.113 8.217 961 HD12 LEU 6 2HD1 LEU 6 15.066 -4.772 9.927 962 HD13 LEU 6 3HD1 LEU 6 14.768 -6.425 9.399 963 HD21 LEU 6 1HD2 LEU 6 16.549 -7.706 8.153 964 HD22 LEU 6 2HD2 LEU 6 18.117 -6.970 7.841 965 HD23 LEU 6 3HD2 LEU 6 16.708 -6.459 6.910 966 H GLU 7 H GLU 7 21.030 -3.887 6.956 967 HA GLU 7 HA GLU 7 21.416 -1.149 7.709 968 HB2 GLU 7 2HB GLU 7 22.491 -2.618 5.259 969 HB3 GLU 7 3HB GLU 7 22.943 -0.979 5.724 970 HG2 GLU 7 2HG GLU 7 24.702 -2.325 6.487 971 HG3 GLU 7 3HG GLU 7 23.759 -1.963 7.929 972 H SER 8 H SER 8 20.642 0.666 6.800 973 HA SER 8 HA SER 8 18.479 0.562 4.873 974 HB2 SER 8 2HB SER 8 18.497 3.064 5.308 975 HB3 SER 8 3HB SER 8 18.324 2.077 6.760 976 HG SER 8 HG SER 8 20.205 2.724 7.448 977 H SER 9 H SER 9 18.631 2.452 3.142 978 HA SER 9 HA SER 9 20.716 2.072 1.286 979 HB2 SER 9 2HB SER 9 18.849 4.471 1.531 980 HB3 SER 9 3HB SER 9 19.704 3.947 0.079 981 HG SER 9 HG SER 9 17.911 2.905 -0.258 982 H ASP 10 H ASP 10 20.348 4.210 4.025 983 HA ASP 10 HA ASP 10 22.754 5.788 3.478 984 HB2 ASP 10 2HB ASP 10 20.689 6.823 4.437 985 HB3 ASP 10 3HB ASP 10 20.861 5.814 5.864 986 H GLU 11 H GLU 11 22.491 2.736 4.288 987 HA GLU 11 HA GLU 11 23.983 1.184 4.944 988 HB2 GLU 11 2HB GLU 11 25.867 3.521 5.453 989 HB3 GLU 11 3HB GLU 11 26.341 1.827 5.381 990 HG2 GLU 11 2HG GLU 11 25.702 1.720 3.013 991 HG3 GLU 11 3HG GLU 11 25.143 3.392 3.072 992 H LYS 12 H LYS 12 22.467 3.108 7.079 993 HA LYS 12 HA LYS 12 23.876 2.573 9.530 994 HB2 LYS 12 2HB LYS 12 21.040 3.568 9.006 995 HB3 LYS 12 3HB LYS 12 21.726 3.405 10.616 996 HG2 LYS 12 2HG LYS 12 22.830 5.210 8.447 997 HG3 LYS 12 3HG LYS 12 21.756 5.731 9.748 998 HD2 LYS 12 2HD LYS 12 23.501 4.988 11.409 999 HD3 LYS 12 3HD LYS 12 24.580 4.632 10.057 1000 HE2 LYS 12 2HE LYS 12 23.427 7.355 10.746 1001 HE3 LYS 12 3HE LYS 12 25.083 6.828 11.033 1002 HZ1 LYS 12 1HZ LYS 12 24.869 8.186 9.042 1003 HZ2 LYS 12 2HZ LYS 12 23.806 7.063 8.361 1004 HZ3 LYS 12 3HZ LYS 12 25.413 6.629 8.674 1005 H VAL 13 H VAL 13 23.852 0.750 10.649 1006 HA VAL 13 HA VAL 13 22.307 -1.558 9.865 1007 HB VAL 13 HB VAL 13 24.150 -1.217 12.287 1008 HG11 VAL 13 1HG1 VAL 13 22.690 -3.188 12.453 1009 HG12 VAL 13 2HG1 VAL 13 24.366 -3.679 12.219 1010 HG13 VAL 13 3HG1 VAL 13 23.229 -3.754 10.870 1011 HG21 VAL 13 1HG2 VAL 13 24.889 -2.218 9.511 1012 HG22 VAL 13 2HG2 VAL 13 25.963 -2.132 10.909 1013 HG23 VAL 13 3HG2 VAL 13 25.331 -0.652 10.191 1014 H PHE 14 H PHE 14 20.186 -1.556 10.450 1015 HA PHE 14 HA PHE 14 19.382 -0.791 13.187 1016 HB2 PHE 14 2HB PHE 14 17.740 -1.215 10.654 1017 HB3 PHE 14 3HB PHE 14 17.031 -0.918 12.242 1018 HD1 PHE 14 HD1 PHE 14 17.613 1.260 13.449 1019 HD2 PHE 14 HD2 PHE 14 18.462 0.643 9.302 1020 HE1 PHE 14 HE1 PHE 14 17.851 3.686 13.136 1021 HE2 PHE 14 HE2 PHE 14 18.693 3.072 9.000 1022 HZ PHE 14 HZ PHE 14 18.394 4.595 10.913 1023 H GLU 15 H GLU 15 20.144 -2.585 14.246 1024 HA GLU 15 HA GLU 15 19.382 -5.281 13.607 1025 HB2 GLU 15 2HB GLU 15 20.437 -4.124 16.228 1026 HB3 GLU 15 3HB GLU 15 20.332 -5.832 15.819 1027 HG2 GLU 15 2HG GLU 15 21.947 -5.397 13.930 1028 HG3 GLU 15 3HG GLU 15 22.128 -3.758 14.546 1029 H ILE 16 H ILE 16 17.351 -6.012 13.831 1030 HA ILE 16 HA ILE 16 15.715 -5.249 16.168 1031 HB ILE 16 HB ILE 16 15.003 -3.872 14.195 1032 HG12 ILE 16 2HG1 ILE 16 12.906 -5.932 15.027 1033 HG13 ILE 16 3HG1 ILE 16 13.376 -4.538 15.988 1034 HG21 ILE 16 1HG2 ILE 16 15.568 -5.441 12.372 1035 HG22 ILE 16 2HG2 ILE 16 13.895 -4.905 12.246 1036 HG23 ILE 16 3HG2 ILE 16 14.258 -6.515 12.872 1037 HD11 ILE 16 1HD1 ILE 16 12.541 -3.062 14.211 1038 HD12 ILE 16 2HD1 ILE 16 11.304 -4.130 14.869 1039 HD13 ILE 16 3HD1 ILE 16 12.027 -4.486 13.301 1040 H GLU 17 H GLU 17 14.117 -6.918 16.730 1041 HA GLU 17 HA GLU 17 15.138 -9.507 16.722 1042 HB2 GLU 17 2HB GLU 17 12.205 -8.799 17.093 1043 HB3 GLU 17 3HB GLU 17 13.013 -10.243 17.677 1044 HG2 GLU 17 2HG GLU 17 14.359 -8.840 19.227 1045 HG3 GLU 17 3HG GLU 17 13.499 -7.410 18.658 1046 H LYS 18 H LYS 18 14.853 -11.292 15.502 1047 HA LYS 18 HA LYS 18 14.250 -11.161 12.770 1048 HB2 LYS 18 2HB LYS 18 15.721 -12.868 13.762 1049 HB3 LYS 18 3HB LYS 18 14.366 -13.571 14.635 1050 HG2 LYS 18 2HG LYS 18 13.328 -14.162 12.423 1051 HG3 LYS 18 3HG LYS 18 14.793 -13.572 11.628 1052 HD2 LYS 18 2HD LYS 18 16.136 -15.276 12.759 1053 HD3 LYS 18 3HD LYS 18 14.737 -15.799 13.697 1054 HE2 LYS 18 2HE LYS 18 13.623 -16.466 11.546 1055 HE3 LYS 18 3HE LYS 18 15.130 -16.090 10.704 1056 HZ1 LYS 18 1HZ LYS 18 16.253 -17.780 11.939 1057 HZ2 LYS 18 2HZ LYS 18 14.850 -18.465 11.287 1058 HZ3 LYS 18 3HZ LYS 18 14.905 -18.050 12.922 1059 H GLU 19 H GLU 19 12.313 -12.179 15.520 1060 HA GLU 19 HA GLU 19 10.063 -13.220 14.163 1061 HB2 GLU 19 2HB GLU 19 8.913 -12.963 16.391 1062 HB3 GLU 19 3HB GLU 19 10.442 -13.828 16.447 1063 HG2 GLU 19 2HG GLU 19 11.502 -11.608 17.190 1064 HG3 GLU 19 3HG GLU 19 9.853 -11.021 17.412 1065 H ILE 20 H ILE 20 10.931 -9.926 15.024 1066 HA ILE 20 HA ILE 20 8.361 -8.747 14.452 1067 HB ILE 20 HB ILE 20 11.117 -7.422 14.587 1068 HG12 ILE 20 2HG1 ILE 20 8.941 -7.653 16.717 1069 HG13 ILE 20 3HG1 ILE 20 10.515 -8.427 16.760 1070 HG21 ILE 20 1HG2 ILE 20 8.346 -6.173 14.628 1071 HG22 ILE 20 2HG2 ILE 20 9.521 -6.067 13.314 1072 HG23 ILE 20 3HG2 ILE 20 9.867 -5.307 14.863 1073 HD11 ILE 20 1HD1 ILE 20 9.974 -5.462 16.932 1074 HD12 ILE 20 2HD1 ILE 20 11.576 -6.202 16.913 1075 HD13 ILE 20 3HD1 ILE 20 10.470 -6.531 18.245 1076 H ALA 21 H ALA 21 11.427 -9.158 12.708 1077 HA ALA 21 HA ALA 21 10.829 -7.718 10.360 1078 HB1 ALA 21 1HB ALA 21 12.731 -10.058 10.712 1079 HB2 ALA 21 2HB ALA 21 13.106 -8.361 11.025 1080 HB3 ALA 21 3HB ALA 21 12.753 -8.896 9.383 1081 H CYS 22 H CYS 22 9.684 -10.795 11.389 1082 HA CYS 22 HA CYS 22 9.050 -11.970 8.873 1083 HB2 CYS 22 2HB CYS 22 7.859 -12.492 11.624 1084 HB3 CYS 22 3HB CYS 22 7.673 -13.535 10.214 1085 HG CYS 22 HG CYS 22 10.874 -12.943 10.883 1086 H MET 23 H MET 23 7.444 -9.525 10.805 1087 HA MET 23 HA MET 23 4.799 -9.775 9.723 1088 HB2 MET 23 2HB MET 23 6.126 -7.319 10.943 1089 HB3 MET 23 3HB MET 23 4.404 -7.491 10.626 1090 HG2 MET 23 2HG MET 23 4.379 -9.416 12.244 1091 HG3 MET 23 3HG MET 23 6.053 -9.028 12.638 1092 HE1 MET 23 1HE MET 23 5.578 -5.342 14.107 1093 HE2 MET 23 2HE MET 23 5.765 -5.694 12.391 1094 HE3 MET 23 3HE MET 23 6.761 -6.541 13.577 1095 H SER 24 H SER 24 7.698 -8.068 8.728 1096 HA SER 24 HA SER 24 6.527 -6.788 6.426 1097 HB2 SER 24 2HB SER 24 8.612 -5.887 7.366 1098 HB3 SER 24 3HB SER 24 9.429 -7.437 7.144 1099 HG SER 24 HG SER 24 8.300 -5.986 4.996 1100 H VAL 25 H VAL 25 5.736 -7.992 4.760 1101 HA VAL 25 HA VAL 25 6.172 -10.758 4.379 1102 HB VAL 25 HB VAL 25 5.129 -8.693 2.380 1103 HG11 VAL 25 1HG1 VAL 25 4.064 -10.607 1.196 1104 HG12 VAL 25 2HG1 VAL 25 4.913 -11.728 2.267 1105 HG13 VAL 25 3HG1 VAL 25 5.827 -10.695 1.168 1106 HG21 VAL 25 1HG2 VAL 25 3.771 -8.776 4.433 1107 HG22 VAL 25 2HG2 VAL 25 3.585 -10.523 4.267 1108 HG23 VAL 25 3HG2 VAL 25 2.872 -9.439 3.069 1109 H THR 26 H THR 26 7.637 -7.912 2.864 1110 HA THR 26 HA THR 26 9.118 -9.202 0.846 1111 HB THR 26 HB THR 26 9.689 -6.550 2.229 1112 HG1 THR 26 HG1 THR 26 8.116 -7.228 -0.053 1113 HG21 THR 26 1HG2 THR 26 10.595 -7.537 -0.509 1114 HG22 THR 26 2HG2 THR 26 11.639 -7.271 0.888 1115 HG23 THR 26 3HG2 THR 26 10.829 -5.905 0.124 1116 H ILE 27 H ILE 27 10.210 -8.059 4.099 1117 HA ILE 27 HA ILE 27 12.881 -9.015 3.877 1118 HB ILE 27 HB ILE 27 11.265 -8.455 6.413 1119 HG12 ILE 27 2HG1 ILE 27 13.260 -6.659 4.940 1120 HG13 ILE 27 3HG1 ILE 27 11.511 -6.471 4.899 1121 HG21 ILE 27 1HG2 ILE 27 13.449 -8.276 7.581 1122 HG22 ILE 27 2HG2 ILE 27 14.284 -8.762 6.105 1123 HG23 ILE 27 3HG2 ILE 27 13.204 -9.893 6.921 1124 HD11 ILE 27 1HD1 ILE 27 12.503 -4.874 6.403 1125 HD12 ILE 27 2HD1 ILE 27 13.275 -6.162 7.322 1126 HD13 ILE 27 3HD1 ILE 27 11.516 -6.017 7.313 1127 H LYS 28 H LYS 28 9.919 -10.427 5.243 1128 HA LYS 28 HA LYS 28 10.891 -12.760 6.421 1129 HB2 LYS 28 2HB LYS 28 8.568 -11.963 6.699 1130 HB3 LYS 28 3HB LYS 28 8.228 -12.309 5.007 1131 HG2 LYS 28 2HG LYS 28 8.626 -14.742 5.474 1132 HG3 LYS 28 3HG LYS 28 8.840 -14.346 7.180 1133 HD2 LYS 28 2HD LYS 28 6.559 -15.174 6.757 1134 HD3 LYS 28 3HD LYS 28 6.522 -13.491 7.288 1135 HE2 LYS 28 2HE LYS 28 4.937 -13.872 5.453 1136 HE3 LYS 28 3HE LYS 28 6.207 -12.756 4.953 1137 HZ1 LYS 28 1HZ LYS 28 6.047 -15.643 4.288 1138 HZ2 LYS 28 2HZ LYS 28 7.311 -14.623 3.836 1139 HZ3 LYS 28 3HZ LYS 28 5.756 -14.359 3.230 1140 H ASN 29 H ASN 29 9.663 -12.276 3.113 1141 HA ASN 29 HA ASN 29 10.044 -14.881 2.118 1142 HB2 ASN 29 2HB ASN 29 9.828 -12.195 0.705 1143 HB3 ASN 29 3HB ASN 29 9.995 -13.707 -0.186 1144 HD21 ASN 29 1HD2 ASN 29 7.947 -13.279 -1.160 1145 HD22 ASN 29 2HD2 ASN 29 6.472 -13.559 -0.304 1146 H MET 30 H MET 30 12.211 -12.083 2.216 1147 HA MET 30 HA MET 30 14.334 -13.147 0.664 1148 HB2 MET 30 2HB MET 30 14.345 -11.060 2.884 1149 HB3 MET 30 3HB MET 30 15.779 -11.469 1.949 1150 HG2 MET 30 2HG MET 30 14.637 -10.731 -0.112 1151 HG3 MET 30 3HG MET 30 13.212 -10.306 0.838 1152 HE1 MET 30 1HE MET 30 14.734 -6.805 -0.186 1153 HE2 MET 30 2HE MET 30 13.311 -7.845 -0.261 1154 HE3 MET 30 3HE MET 30 14.770 -8.277 -1.156 1155 H ILE 31 H ILE 31 13.703 -13.205 4.172 1156 HA ILE 31 HA ILE 31 16.003 -14.626 5.003 1157 HB ILE 31 HB ILE 31 13.240 -14.467 6.319 1158 HG12 ILE 31 2HG1 ILE 31 15.778 -12.851 6.908 1159 HG13 ILE 31 3HG1 ILE 31 14.377 -12.252 6.029 1160 HG21 ILE 31 1HG2 ILE 31 15.862 -15.399 7.571 1161 HG22 ILE 31 2HG2 ILE 31 14.463 -16.410 7.212 1162 HG23 ILE 31 3HG2 ILE 31 14.341 -15.153 8.437 1163 HD11 ILE 31 1HD1 ILE 31 14.382 -11.434 8.295 1164 HD12 ILE 31 2HD1 ILE 31 14.434 -13.078 8.928 1165 HD13 ILE 31 3HD1 ILE 31 13.009 -12.513 8.051 1166 H GLU 32 H GLU 32 12.889 -15.678 3.732 1167 HA GLU 32 HA GLU 32 13.138 -18.453 4.377 1168 HB2 GLU 32 2HB GLU 32 11.360 -17.036 2.349 1169 HB3 GLU 32 3HB GLU 32 11.224 -18.742 2.769 1170 HG2 GLU 32 2HG GLU 32 10.684 -18.141 5.101 1171 HG3 GLU 32 3HG GLU 32 10.846 -16.435 4.701 1172 H ASP 33 H ASP 33 13.772 -16.573 1.380 1173 HA ASP 33 HA ASP 33 14.498 -18.798 -0.253 1174 HB2 ASP 33 2HB ASP 33 14.982 -15.808 -0.511 1175 HB3 ASP 33 3HB ASP 33 15.703 -16.925 -1.662 1176 H ILE 34 H ILE 34 16.418 -16.510 1.626 1177 HA ILE 34 HA ILE 34 18.993 -17.584 0.964 1178 HB ILE 34 HB ILE 34 18.092 -15.725 3.219 1179 HG12 ILE 34 2HG1 ILE 34 19.461 -15.026 0.569 1180 HG13 ILE 34 3HG1 ILE 34 17.733 -14.872 0.864 1181 HG21 ILE 34 1HG2 ILE 34 20.231 -16.783 3.834 1182 HG22 ILE 34 2HG2 ILE 34 20.465 -15.072 3.486 1183 HG23 ILE 34 3HG2 ILE 34 20.943 -16.286 2.297 1184 HD11 ILE 34 1HD1 ILE 34 18.212 -13.216 2.627 1185 HD12 ILE 34 2HD1 ILE 34 18.794 -12.734 1.034 1186 HD13 ILE 34 3HD1 ILE 34 19.931 -13.336 2.238 1187 H GLY 35 H GLY 35 16.549 -18.333 3.323 1188 HA2 GLY 35 2HA GLY 35 16.456 -20.146 4.810 1189 HA3 GLY 35 3HA GLY 35 18.190 -20.404 4.610 1190 H GLU 36 H GLU 36 17.150 -20.442 7.125 1191 HA GLU 36 HA GLU 36 17.056 -17.989 8.515 1192 HB2 GLU 36 2HB GLU 36 17.770 -20.747 9.616 1193 HB3 GLU 36 3HB GLU 36 17.303 -19.344 10.577 1194 HG2 GLU 36 2HG GLU 36 15.087 -19.342 9.468 1195 HG3 GLU 36 3HG GLU 36 15.548 -20.788 8.571 1196 H SER 37 H SER 37 18.702 -16.638 8.141 1197 HA SER 37 HA SER 37 21.476 -17.444 8.827 1198 HB2 SER 37 2HB SER 37 20.606 -15.574 6.570 1199 HB3 SER 37 3HB SER 37 22.271 -15.997 6.980 1200 HG SER 37 HG SER 37 20.250 -17.596 5.837 1201 H ASP 38 H ASP 38 22.488 -16.078 10.225 1202 HA ASP 38 HA ASP 38 21.178 -13.699 11.254 1203 HB2 ASP 38 2HB ASP 38 23.092 -13.524 12.782 1204 HB3 ASP 38 3HB ASP 38 22.491 -15.174 12.765 1205 H SER 39 H SER 39 22.951 -14.354 8.532 1206 HA SER 39 HA SER 39 24.682 -12.326 7.993 1207 HB2 SER 39 2HB SER 39 22.662 -13.581 6.090 1208 HB3 SER 39 3HB SER 39 24.082 -12.662 5.590 1209 HG SER 39 HG SER 39 25.104 -14.385 7.139 1210 HA PRO 40 HA PRO 40 22.117 -8.617 8.337 1211 HB2 PRO 40 2HB PRO 40 23.926 -6.846 7.210 1212 HB3 PRO 40 3HB PRO 40 24.039 -7.435 8.876 1213 HG2 PRO 40 2HG PRO 40 25.492 -8.399 6.434 1214 HG3 PRO 40 3HG PRO 40 26.122 -8.073 8.069 1215 HD2 PRO 40 2HD PRO 40 25.579 -10.584 7.279 1216 HD3 PRO 40 3HD PRO 40 25.259 -10.056 8.945 1217 H ILE 41 H ILE 41 20.479 -7.981 7.029 1218 HA ILE 41 HA ILE 41 20.713 -8.369 4.101 1219 HB ILE 41 HB ILE 41 18.146 -8.142 5.753 1220 HG12 ILE 41 2HG1 ILE 41 19.310 -10.220 6.376 1221 HG13 ILE 41 3HG1 ILE 41 17.897 -10.614 5.407 1222 HG21 ILE 41 1HG2 ILE 41 17.009 -8.974 3.706 1223 HG22 ILE 41 2HG2 ILE 41 18.546 -8.949 2.842 1224 HG23 ILE 41 3HG2 ILE 41 17.834 -7.441 3.415 1225 HD11 ILE 41 1HD1 ILE 41 19.381 -10.945 3.449 1226 HD12 ILE 41 2HD1 ILE 41 19.757 -12.023 4.791 1227 HD13 ILE 41 3HD1 ILE 41 20.774 -10.617 4.482 1228 HA PRO 42 HA PRO 42 20.568 -3.760 4.217 1229 HB2 PRO 42 2HB PRO 42 21.648 -3.958 1.449 1230 HB3 PRO 42 3HB PRO 42 22.361 -3.180 2.878 1231 HG2 PRO 42 2HG PRO 42 23.404 -5.433 1.825 1232 HG3 PRO 42 3HG PRO 42 23.444 -5.102 3.573 1233 HD2 PRO 42 2HD PRO 42 21.535 -6.869 2.035 1234 HD3 PRO 42 3HD PRO 42 22.392 -7.190 3.562 1235 H LEU 43 H LEU 43 19.020 -2.424 3.346 1236 HA LEU 43 HA LEU 43 17.183 -3.478 1.278 1237 HB2 LEU 43 2HB LEU 43 16.550 -1.618 3.616 1238 HB3 LEU 43 3HB LEU 43 15.404 -2.133 2.391 1239 HG LEU 43 HG LEU 43 16.741 -3.970 4.419 1240 HD11 LEU 43 1HD1 LEU 43 14.531 -4.132 5.492 1241 HD12 LEU 43 2HD1 LEU 43 13.888 -2.936 4.365 1242 HD13 LEU 43 3HD1 LEU 43 15.147 -2.480 5.514 1243 HD21 LEU 43 1HD2 LEU 43 14.602 -4.609 2.353 1244 HD22 LEU 43 2HD2 LEU 43 15.140 -5.697 3.637 1245 HD23 LEU 43 3HD2 LEU 43 16.266 -5.206 2.376 1246 HA PRO 44 HA PRO 44 19.244 0.289 -0.466 1247 HB2 PRO 44 2HB PRO 44 19.569 -0.581 -3.003 1248 HB3 PRO 44 3HB PRO 44 20.556 -1.237 -1.681 1249 HG2 PRO 44 2HG PRO 44 18.167 -2.447 -3.023 1250 HG3 PRO 44 3HG PRO 44 19.688 -3.216 -2.520 1251 HD2 PRO 44 2HD PRO 44 17.328 -3.293 -1.046 1252 HD3 PRO 44 3HD PRO 44 18.950 -3.549 -0.367 1253 H ASN 45 H ASN 45 16.802 0.842 0.145 1254 HA ASN 45 HA ASN 45 15.653 2.258 -2.092 1255 HB2 ASN 45 2HB ASN 45 14.579 0.029 -2.401 1256 HB3 ASN 45 3HB ASN 45 13.986 0.080 -0.748 1257 HD21 ASN 45 1HD2 ASN 45 13.605 1.380 -3.972 1258 HD22 ASN 45 2HD2 ASN 45 12.062 2.110 -3.712 1259 H VAL 46 H VAL 46 15.127 1.080 1.228 1260 HA VAL 46 HA VAL 46 13.836 3.595 2.019 1261 HB VAL 46 HB VAL 46 12.725 1.532 2.727 1262 HG11 VAL 46 1HG1 VAL 46 14.645 0.008 2.828 1263 HG12 VAL 46 2HG1 VAL 46 13.703 -0.064 4.317 1264 HG13 VAL 46 3HG1 VAL 46 15.234 0.817 4.283 1265 HG21 VAL 46 1HG2 VAL 46 12.490 3.474 4.203 1266 HG22 VAL 46 2HG2 VAL 46 13.933 3.004 5.105 1267 HG23 VAL 46 3HG2 VAL 46 12.490 1.988 5.155 1268 H THR 47 H THR 47 14.908 5.179 3.066 1269 HA THR 47 HA THR 47 17.756 4.983 3.585 1270 HB THR 47 HB THR 47 17.518 7.419 4.178 1271 HG1 THR 47 HG1 THR 47 14.798 7.147 3.356 1272 HG21 THR 47 1HG2 THR 47 16.236 6.639 1.532 1273 HG22 THR 47 2HG2 THR 47 17.971 6.766 1.834 1274 HG23 THR 47 3HG2 THR 47 16.952 8.205 1.912 1275 H SER 48 H SER 48 18.471 6.289 5.726 1276 HA SER 48 HA SER 48 18.037 4.389 7.784 1277 HB2 SER 48 2HB SER 48 19.532 5.861 9.154 1278 HB3 SER 48 3HB SER 48 20.188 5.471 7.563 1279 HG SER 48 HG SER 48 20.465 7.607 7.702 1280 H THR 49 H THR 49 17.075 7.788 7.491 1281 HA THR 49 HA THR 49 15.922 8.147 10.024 1282 HB THR 49 HB THR 49 14.739 10.095 8.914 1283 HG1 THR 49 HG1 THR 49 15.399 10.406 6.652 1284 HG21 THR 49 1HG2 THR 49 17.691 9.808 8.223 1285 HG22 THR 49 2HG2 THR 49 17.043 10.409 9.751 1286 HG23 THR 49 3HG2 THR 49 16.791 11.324 8.264 1287 H ILE 50 H ILE 50 14.588 6.875 7.026 1288 HA ILE 50 HA ILE 50 11.838 6.887 7.945 1289 HB ILE 50 HB ILE 50 13.061 5.663 5.424 1290 HG12 ILE 50 2HG1 ILE 50 13.424 8.079 5.440 1291 HG13 ILE 50 3HG1 ILE 50 12.139 7.727 4.294 1292 HG21 ILE 50 1HG2 ILE 50 10.142 6.216 6.081 1293 HG22 ILE 50 2HG2 ILE 50 10.895 4.626 5.944 1294 HG23 ILE 50 3HG2 ILE 50 10.757 5.659 4.523 1295 HD11 ILE 50 1HD1 ILE 50 11.810 8.873 7.076 1296 HD12 ILE 50 2HD1 ILE 50 10.478 8.445 6.000 1297 HD13 ILE 50 3HD1 ILE 50 11.604 9.721 5.541 1298 H LEU 51 H LEU 51 14.342 4.421 7.270 1299 HA LEU 51 HA LEU 51 12.835 2.132 7.975 1300 HB2 LEU 51 2HB LEU 51 14.969 2.124 6.611 1301 HB3 LEU 51 3HB LEU 51 15.868 2.404 8.094 1302 HG LEU 51 HG LEU 51 15.080 0.223 8.993 1303 HD11 LEU 51 1HD1 LEU 51 13.706 -0.163 6.310 1304 HD12 LEU 51 2HD1 LEU 51 12.915 0.052 7.872 1305 HD13 LEU 51 3HD1 LEU 51 13.875 -1.391 7.568 1306 HD21 LEU 51 1HD2 LEU 51 17.220 0.280 7.773 1307 HD22 LEU 51 2HD2 LEU 51 16.384 -0.055 6.256 1308 HD23 LEU 51 3HD2 LEU 51 16.402 -1.264 7.541 1309 H GLU 52 H GLU 52 14.738 4.373 9.845 1310 HA GLU 52 HA GLU 52 14.935 3.236 12.366 1311 HB2 GLU 52 2HB GLU 52 15.913 5.406 11.937 1312 HB3 GLU 52 3HB GLU 52 14.368 6.079 11.443 1313 HG2 GLU 52 2HG GLU 52 13.678 5.600 13.956 1314 HG3 GLU 52 3HG GLU 52 15.417 5.578 14.222 1315 H LYS 53 H LYS 53 12.245 5.149 11.013 1316 HA LYS 53 HA LYS 53 10.523 4.740 13.290 1317 HB2 LYS 53 2HB LYS 53 10.317 6.228 10.676 1318 HB3 LYS 53 3HB LYS 53 8.834 5.891 11.560 1319 HG2 LYS 53 2HG LYS 53 9.682 7.106 13.518 1320 HG3 LYS 53 3HG LYS 53 11.221 7.390 12.700 1321 HD2 LYS 53 2HD LYS 53 8.536 8.418 11.676 1322 HD3 LYS 53 3HD LYS 53 9.649 9.369 12.663 1323 HE2 LYS 53 2HE LYS 53 10.246 8.223 9.914 1324 HE3 LYS 53 3HE LYS 53 9.918 9.916 10.285 1325 HZ1 LYS 53 1HZ LYS 53 11.898 10.009 11.615 1326 HZ2 LYS 53 2HZ LYS 53 12.297 9.434 10.077 1327 HZ3 LYS 53 3HZ LYS 53 12.205 8.363 11.382 1328 H VAL 54 H VAL 54 10.831 3.270 10.096 1329 HA VAL 54 HA VAL 54 8.378 1.878 9.982 1330 HB VAL 54 HB VAL 54 11.103 1.242 8.746 1331 HG11 VAL 54 1HG1 VAL 54 9.961 -0.378 7.250 1332 HG12 VAL 54 2HG1 VAL 54 8.478 -0.195 8.189 1333 HG13 VAL 54 3HG1 VAL 54 9.916 -0.889 8.936 1334 HG21 VAL 54 1HG2 VAL 54 8.557 2.356 7.496 1335 HG22 VAL 54 2HG2 VAL 54 10.077 2.049 6.652 1336 HG23 VAL 54 3HG2 VAL 54 10.002 3.285 7.903 1337 H LEU 55 H LEU 55 11.590 0.862 11.124 1338 HA LEU 55 HA LEU 55 10.682 -1.671 12.108 1339 HB2 LEU 55 2HB LEU 55 13.333 -0.228 12.434 1340 HB3 LEU 55 3HB LEU 55 13.021 -1.849 13.029 1341 HG LEU 55 HG LEU 55 13.051 -0.970 10.116 1342 HD11 LEU 55 1HD1 LEU 55 14.959 -2.500 9.896 1343 HD12 LEU 55 2HD1 LEU 55 14.876 -2.866 11.622 1344 HD13 LEU 55 3HD1 LEU 55 15.274 -1.234 11.082 1345 HD21 LEU 55 1HD2 LEU 55 12.621 -3.337 9.517 1346 HD22 LEU 55 2HD2 LEU 55 11.266 -2.623 10.384 1347 HD23 LEU 55 3HD2 LEU 55 12.364 -3.722 11.223 1348 H ASP 56 H ASP 56 11.114 1.524 13.565 1349 HA ASP 56 HA ASP 56 10.990 0.588 16.288 1350 HB2 ASP 56 2HB ASP 56 12.011 2.789 15.628 1351 HB3 ASP 56 3HB ASP 56 10.395 3.405 15.294 1352 H TYR 57 H TYR 57 8.612 1.769 13.949 1353 HA TYR 57 HA TYR 57 6.285 1.633 15.563 1354 HB2 TYR 57 2HB TYR 57 6.123 2.703 13.388 1355 HB3 TYR 57 3HB TYR 57 6.655 1.246 12.556 1356 HD1 TYR 57 HD1 TYR 57 3.804 2.729 14.486 1357 HD2 TYR 57 HD2 TYR 57 5.047 -0.451 11.910 1358 HE1 TYR 57 HE1 TYR 57 1.466 2.010 14.228 1359 HE2 TYR 57 HE2 TYR 57 2.713 -1.160 11.649 1360 HH TYR 57 HH TYR 57 0.072 0.728 12.693 1361 H CYS 58 H CYS 58 8.015 -0.738 13.614 1362 HA CYS 58 HA CYS 58 6.248 -2.915 14.008 1363 HB2 CYS 58 2HB CYS 58 9.155 -2.771 13.140 1364 HB3 CYS 58 3HB CYS 58 8.230 -4.270 13.163 1365 HG CYS 58 HG CYS 58 7.195 -1.555 11.363 1366 H ARG 59 H ARG 59 9.020 -1.703 15.885 1367 HA ARG 59 HA ARG 59 9.234 -3.787 17.809 1368 HB2 ARG 59 2HB ARG 59 9.740 -0.794 18.115 1369 HB3 ARG 59 3HB ARG 59 10.150 -1.982 19.345 1370 HG2 ARG 59 2HG ARG 59 11.792 -3.008 17.852 1371 HG3 ARG 59 3HG ARG 59 11.340 -1.899 16.555 1372 HD2 ARG 59 2HD ARG 59 12.029 0.018 18.053 1373 HD3 ARG 59 3HD ARG 59 12.640 -1.177 19.204 1374 HE ARG 59 HE ARG 59 14.060 -1.949 17.221 1375 HH11 ARG 59 1HH1 ARG 59 13.192 1.427 17.743 1376 HH12 ARG 59 2HH1 ARG 59 14.616 2.027 16.949 1377 HH21 ARG 59 1HH2 ARG 59 15.946 -1.132 16.227 1378 HH22 ARG 59 2HH2 ARG 59 16.174 0.584 16.092 1379 H HIS 60 H HIS 60 7.397 -0.742 17.816 1380 HA HIS 60 HA HIS 60 5.996 -1.014 20.220 1381 HB2 HIS 60 2HB HIS 60 6.050 1.123 19.052 1382 HB3 HIS 60 3HB HIS 60 5.248 0.436 17.643 1383 HD1 HIS 60 HD1 HIS 60 4.504 1.351 21.255 1384 HD2 HIS 60 HD2 HIS 60 2.506 0.604 17.690 1385 HE1 HIS 60 HE1 HIS 60 2.095 1.876 21.707 1386 HE2 HIS 60 HE2 HIS 60 1.012 1.765 19.444 1387 H HIS 61 H HIS 61 5.177 -2.118 16.973 1388 HA HIS 61 HA HIS 61 2.483 -2.879 17.456 1389 HB2 HIS 61 2HB HIS 61 3.412 -2.286 15.220 1390 HB3 HIS 61 3HB HIS 61 4.421 -3.727 15.254 1391 HD1 HIS 61 HD1 HIS 61 3.242 -6.003 14.776 1392 HD2 HIS 61 HD2 HIS 61 0.728 -2.701 14.579 1393 HE1 HIS 61 HE1 HIS 61 1.162 -6.814 13.634 1394 HE2 HIS 61 HE2 HIS 61 -0.411 -4.852 13.693 1395 H HIS 62 H HIS 62 5.580 -4.577 17.602 1396 HA HIS 62 HA HIS 62 4.411 -7.220 17.865 1397 HB2 HIS 62 2HB HIS 62 6.567 -6.866 16.691 1398 HB3 HIS 62 3HB HIS 62 7.297 -6.294 18.187 1399 HD1 HIS 62 HD1 HIS 62 5.942 -9.435 16.588 1400 HD2 HIS 62 HD2 HIS 62 8.246 -8.318 19.863 1401 HE1 HIS 62 HE1 HIS 62 6.882 -11.565 17.518 1402 HE2 HIS 62 HE2 HIS 62 8.244 -10.861 19.508 1403 H GLN 63 H GLN 63 6.136 -4.939 20.000 1404 HA GLN 63 HA GLN 63 6.080 -6.677 22.308 1405 HB2 GLN 63 2HB GLN 63 6.874 -3.742 22.054 1406 HB3 GLN 63 3HB GLN 63 7.089 -4.714 23.506 1407 HG2 GLN 63 2HG GLN 63 8.423 -5.253 20.831 1408 HG3 GLN 63 3HG GLN 63 9.182 -4.455 22.204 1409 HE21 GLN 63 1HE2 GLN 63 10.001 -6.888 20.827 1410 HE22 GLN 63 2HE2 GLN 63 10.036 -8.134 22.019 1411 H HIS 64 H HIS 64 4.125 -4.069 21.071 1412 HA HIS 64 HA HIS 64 2.163 -4.453 23.256 1413 HB2 HIS 64 2HB HIS 64 2.828 -1.839 21.804 1414 HB3 HIS 64 3HB HIS 64 1.456 -2.053 22.887 1415 HD1 HIS 64 HD1 HIS 64 1.878 -1.522 25.290 1416 HD2 HIS 64 HD2 HIS 64 5.424 -2.131 23.208 1417 HE1 HIS 64 HE1 HIS 64 3.712 -0.921 26.891 1418 HE2 HIS 64 HE2 HIS 64 5.830 -1.545 25.696 1419 HA PRO 65 HA PRO 65 0.241 -6.037 19.362 1420 HB2 PRO 65 2HB PRO 65 -1.939 -6.754 21.325 1421 HB3 PRO 65 3HB PRO 65 -1.143 -7.767 20.101 1422 HG2 PRO 65 2HG PRO 65 -0.553 -8.079 22.670 1423 HG3 PRO 65 3HG PRO 65 0.734 -8.159 21.441 1424 HD2 PRO 65 2HD PRO 65 0.032 -5.887 23.297 1425 HD3 PRO 65 3HD PRO 65 1.630 -6.509 22.825 1426 H GLY 66 H GLY 66 -0.214 -4.119 18.340 1427 HA2 GLY 66 2HA GLY 66 -2.839 -3.134 18.194 1428 HA3 GLY 66 3HA GLY 66 -1.911 -2.047 19.228 1429 H GLY 67 H GLY 67 -0.421 -0.651 18.298 1430 HA2 GLY 67 2HA GLY 67 0.652 0.554 16.636 1431 HA3 GLY 67 3HA GLY 67 0.348 -0.761 15.508 1432 H SER 68 H SER 68 -2.511 0.058 16.973 1433 HA SER 68 HA SER 68 -3.387 2.220 15.245 1434 HB2 SER 68 2HB SER 68 -4.642 -0.565 15.014 1435 HB3 SER 68 3HB SER 68 -5.199 0.893 14.185 1436 HG SER 68 HG SER 68 -2.699 0.704 13.531 1437 H GLY 69 H GLY 69 -5.561 2.938 15.869 1438 HA2 GLY 69 2HA GLY 69 -6.788 1.807 18.277 1439 HA3 GLY 69 3HA GLY 69 -6.161 3.452 18.402 1440 H LEU 70 H LEU 70 -8.956 2.256 18.423 1441 HA LEU 70 HA LEU 70 -10.288 3.265 16.051 1442 HB2 LEU 70 2HB LEU 70 -11.463 2.234 18.671 1443 HB3 LEU 70 3HB LEU 70 -12.364 2.516 17.190 1444 HG LEU 70 HG LEU 70 -10.202 0.402 17.565 1445 HD11 LEU 70 1HD1 LEU 70 -12.232 -0.153 18.809 1446 HD12 LEU 70 2HD1 LEU 70 -12.028 -1.241 17.439 1447 HD13 LEU 70 3HD1 LEU 70 -13.213 0.067 17.356 1448 HD21 LEU 70 1HD2 LEU 70 -10.227 1.196 15.246 1449 HD22 LEU 70 2HD2 LEU 70 -11.969 0.929 15.144 1450 HD23 LEU 70 3HD2 LEU 70 -10.873 -0.442 15.339 1451 H ASP 71 H ASP 71 -11.064 3.922 19.470 1452 HA ASP 71 HA ASP 71 -11.079 6.850 18.951 1453 HB2 ASP 71 2HB ASP 71 -13.308 5.870 19.555 1454 HB3 ASP 71 3HB ASP 71 -12.634 5.302 21.077 1455 H ASP 72 H ASP 72 -9.228 4.481 20.158 1456 HA ASP 72 HA ASP 72 -8.174 5.941 22.483 1457 HB2 ASP 72 2HB ASP 72 -7.137 3.783 23.143 1458 HB3 ASP 72 3HB ASP 72 -8.878 3.644 22.988 1459 H ILE 73 H ILE 73 -6.957 7.468 21.421 1460 HA ILE 73 HA ILE 73 -4.924 6.677 19.465 1461 HB ILE 73 HB ILE 73 -5.733 9.442 20.497 1462 HG12 ILE 73 2HG1 ILE 73 -6.407 9.765 18.008 1463 HG13 ILE 73 3HG1 ILE 73 -6.244 8.025 17.831 1464 HG21 ILE 73 1HG2 ILE 73 -4.202 10.399 18.793 1465 HG22 ILE 73 2HG2 ILE 73 -3.630 8.777 18.398 1466 HG23 ILE 73 3HG2 ILE 73 -3.332 9.450 19.999 1467 HD11 ILE 73 1HD1 ILE 73 -8.564 8.699 18.113 1468 HD12 ILE 73 2HD1 ILE 73 -8.184 9.442 19.666 1469 HD13 ILE 73 3HD1 ILE 73 -8.041 7.694 19.463 1470 HA PRO 74 HA PRO 74 -2.091 6.547 23.080 1471 HB2 PRO 74 2HB PRO 74 -0.186 5.131 21.323 1472 HB3 PRO 74 3HB PRO 74 -1.058 4.508 22.736 1473 HG2 PRO 74 2HG PRO 74 -1.575 3.673 20.200 1474 HG3 PRO 74 3HG PRO 74 -2.807 3.700 21.482 1475 HD2 PRO 74 2HD PRO 74 -2.342 5.702 19.272 1476 HD3 PRO 74 3HD PRO 74 -3.871 5.010 19.867 1477 HA PRO 75 HA PRO 75 0.354 10.181 22.213 1478 HB2 PRO 75 2HB PRO 75 2.502 8.876 23.902 1479 HB3 PRO 75 3HB PRO 75 1.774 10.495 24.042 1480 HG2 PRO 75 2HG PRO 75 1.060 8.603 25.735 1481 HG3 PRO 75 3HG PRO 75 -0.179 9.684 25.051 1482 HD2 PRO 75 2HD PRO 75 0.477 6.839 24.289 1483 HD3 PRO 75 3HD PRO 75 -1.111 7.622 24.458 1484 H TYR 76 H TYR 76 2.402 7.211 22.191 1485 HA TYR 76 HA TYR 76 4.440 8.098 20.516 1486 HB2 TYR 76 2HB TYR 76 4.814 6.008 21.641 1487 HB3 TYR 76 3HB TYR 76 3.360 5.281 20.962 1488 HD1 TYR 76 HD1 TYR 76 3.520 3.981 18.950 1489 HD2 TYR 76 HD2 TYR 76 6.742 6.602 19.971 1490 HE1 TYR 76 HE1 TYR 76 4.806 3.140 17.037 1491 HE2 TYR 76 HE2 TYR 76 8.026 5.747 18.062 1492 HH TYR 76 HH TYR 76 8.106 3.759 16.623 1493 H ASP 77 H ASP 77 1.491 6.316 19.612 1494 HA ASP 77 HA ASP 77 2.131 5.946 16.896 1495 HB2 ASP 77 2HB ASP 77 -0.592 5.899 18.269 1496 HB3 ASP 77 3HB ASP 77 -0.273 5.281 16.651 1497 H ARG 78 H ARG 78 0.439 8.555 18.553 1498 HA ARG 78 HA ARG 78 -0.433 9.903 16.153 1499 HB2 ARG 78 2HB ARG 78 -1.558 10.165 18.369 1500 HB3 ARG 78 3HB ARG 78 -0.144 11.021 18.974 1501 HG2 ARG 78 2HG ARG 78 -0.507 12.818 17.333 1502 HG3 ARG 78 3HG ARG 78 -1.879 11.938 16.652 1503 HD2 ARG 78 2HD ARG 78 -3.064 12.139 18.821 1504 HD3 ARG 78 3HD ARG 78 -1.697 13.053 19.474 1505 HE ARG 78 HE ARG 78 -2.591 14.309 17.120 1506 HH11 ARG 78 1HH1 ARG 78 -3.707 13.799 20.421 1507 HH12 ARG 78 2HH1 ARG 78 -4.672 15.240 20.436 1508 HH21 ARG 78 1HH2 ARG 78 -3.862 16.195 17.166 1509 HH22 ARG 78 2HH2 ARG 78 -4.760 16.593 18.602 1510 H ASP 79 H ASP 79 2.281 10.342 18.447 1511 HA ASP 79 HA ASP 79 3.510 12.539 17.108 1512 HB2 ASP 79 2HB ASP 79 4.555 10.585 19.179 1513 HB3 ASP 79 3HB ASP 79 5.614 11.789 18.454 1514 H PHE 80 H PHE 80 3.544 9.163 16.542 1515 HA PHE 80 HA PHE 80 5.879 8.894 14.943 1516 HB2 PHE 80 2HB PHE 80 4.760 6.937 15.937 1517 HB3 PHE 80 3HB PHE 80 3.277 7.283 15.054 1518 HD1 PHE 80 HD1 PHE 80 2.941 6.361 12.870 1519 HD2 PHE 80 HD2 PHE 80 6.851 6.313 14.605 1520 HE1 PHE 80 HE1 PHE 80 3.757 4.970 11.011 1521 HE2 PHE 80 HE2 PHE 80 7.643 4.928 12.755 1522 HZ PHE 80 HZ PHE 80 6.115 4.260 10.951 1523 H CYS 81 H CYS 81 2.489 9.601 14.281 1524 HA CYS 81 HA CYS 81 2.729 9.730 11.419 1525 HB2 CYS 81 2HB CYS 81 0.491 10.642 13.274 1526 HB3 CYS 81 3HB CYS 81 0.359 10.463 11.525 1527 HG CYS 81 HG CYS 81 1.304 7.765 13.342 1528 H LYS 82 H LYS 82 3.414 11.958 13.957 1529 HA LYS 82 HA LYS 82 3.013 14.417 12.484 1530 HB2 LYS 82 2HB LYS 82 4.641 13.860 15.003 1531 HB3 LYS 82 3HB LYS 82 4.317 15.465 14.352 1532 HG2 LYS 82 2HG LYS 82 1.917 15.171 14.760 1533 HG3 LYS 82 3HG LYS 82 2.208 13.531 15.350 1534 HD2 LYS 82 2HD LYS 82 3.657 14.499 17.167 1535 HD3 LYS 82 3HD LYS 82 3.201 16.114 16.618 1536 HE2 LYS 82 2HE LYS 82 0.853 15.664 17.178 1537 HE3 LYS 82 3HE LYS 82 1.263 14.010 17.649 1538 HZ1 LYS 82 1HZ LYS 82 2.661 14.892 19.417 1539 HZ2 LYS 82 2HZ LYS 82 1.079 15.474 19.569 1540 HZ3 LYS 82 3HZ LYS 82 2.290 16.479 18.955 1541 H VAL 83 H VAL 83 4.117 13.714 10.546 1542 HA VAL 83 HA VAL 83 7.012 14.340 10.551 1543 HB VAL 83 HB VAL 83 7.323 12.715 8.649 1544 HG11 VAL 83 1HG1 VAL 83 7.991 12.011 10.907 1545 HG12 VAL 83 2HG1 VAL 83 7.390 10.637 9.982 1546 HG13 VAL 83 3HG1 VAL 83 6.371 11.383 11.215 1547 HG21 VAL 83 1HG2 VAL 83 5.628 10.976 8.188 1548 HG22 VAL 83 2HG2 VAL 83 4.981 12.583 7.872 1549 HG23 VAL 83 3HG2 VAL 83 4.524 11.726 9.346 1550 H ASP 84 H ASP 84 7.724 15.247 8.444 1551 HA ASP 84 HA ASP 84 5.854 17.182 7.430 1552 HB2 ASP 84 2HB ASP 84 8.403 17.471 7.668 1553 HB3 ASP 84 3HB ASP 84 8.569 16.480 6.223 1554 H GLN 85 H GLN 85 5.273 17.353 5.047 1555 HA GLN 85 HA GLN 85 3.842 15.037 4.372 1556 HB2 GLN 85 2HB GLN 85 3.044 17.307 3.833 1557 HB3 GLN 85 3HB GLN 85 4.324 17.501 2.645 1558 HG2 GLN 85 2HG GLN 85 2.136 17.006 1.608 1559 HG3 GLN 85 3HG GLN 85 3.342 15.782 1.233 1560 HE21 GLN 85 1HE2 GLN 85 3.056 13.678 2.014 1561 HE22 GLN 85 2HE2 GLN 85 1.579 13.137 2.699 1562 HA PRO 86 HA PRO 86 7.179 14.191 0.725 1563 HB2 PRO 86 2HB PRO 86 9.510 15.368 2.263 1564 HB3 PRO 86 3HB PRO 86 9.273 15.222 0.505 1565 HG2 PRO 86 2HG PRO 86 8.928 17.564 1.669 1566 HG3 PRO 86 3HG PRO 86 7.789 17.026 0.411 1567 HD2 PRO 86 2HD PRO 86 7.419 17.079 3.400 1568 HD3 PRO 86 3HD PRO 86 6.253 17.454 2.108 1569 H THR 87 H THR 87 8.280 14.398 4.131 1570 HA THR 87 HA THR 87 9.599 11.914 4.334 1571 HB THR 87 HB THR 87 8.208 13.436 6.589 1572 HG1 THR 87 HG1 THR 87 10.732 13.861 5.337 1573 HG21 THR 87 1HG2 THR 87 10.018 12.529 8.019 1574 HG22 THR 87 2HG2 THR 87 10.658 11.627 6.645 1575 HG23 THR 87 3HG2 THR 87 9.067 11.230 7.299 1576 H LEU 88 H LEU 88 6.237 12.802 4.629 1577 HA LEU 88 HA LEU 88 5.232 10.455 5.901 1578 HB2 LEU 88 2HB LEU 88 4.229 12.879 5.691 1579 HB3 LEU 88 3HB LEU 88 3.579 12.333 4.158 1580 HG LEU 88 HG LEU 88 2.952 11.009 6.835 1581 HD11 LEU 88 1HD1 LEU 88 1.300 13.074 5.344 1582 HD12 LEU 88 2HD1 LEU 88 2.139 13.309 6.880 1583 HD13 LEU 88 3HD1 LEU 88 0.791 12.180 6.781 1584 HD21 LEU 88 1HD2 LEU 88 2.604 9.505 4.943 1585 HD22 LEU 88 2HD2 LEU 88 1.598 10.708 4.134 1586 HD23 LEU 88 3HD2 LEU 88 1.058 9.974 5.648 1587 H PHE 89 H PHE 89 5.453 11.582 2.527 1588 HA PHE 89 HA PHE 89 4.294 9.325 1.265 1589 HB2 PHE 89 2HB PHE 89 6.279 11.391 0.240 1590 HB3 PHE 89 3HB PHE 89 5.590 10.140 -0.790 1591 HD1 PHE 89 HD1 PHE 89 5.356 13.404 -0.627 1592 HD2 PHE 89 HD2 PHE 89 2.763 10.091 0.122 1593 HE1 PHE 89 HE1 PHE 89 3.402 14.809 -1.149 1594 HE2 PHE 89 HE2 PHE 89 0.832 11.496 -0.400 1595 HZ PHE 89 HZ PHE 89 1.131 13.856 -1.035 1596 H GLU 90 H GLU 90 7.571 10.015 2.355 1597 HA GLU 90 HA GLU 90 8.905 7.791 1.221 1598 HB2 GLU 90 2HB GLU 90 9.505 9.414 3.719 1599 HB3 GLU 90 3HB GLU 90 10.595 8.196 3.072 1600 HG2 GLU 90 2HG GLU 90 9.692 10.669 1.580 1601 HG3 GLU 90 3HG GLU 90 11.209 10.526 2.463 1602 H LEU 91 H LEU 91 7.127 8.180 4.271 1603 HA LEU 91 HA LEU 91 7.628 5.596 5.360 1604 HB2 LEU 91 2HB LEU 91 5.277 7.478 5.812 1605 HB3 LEU 91 3HB LEU 91 5.582 6.035 6.765 1606 HG LEU 91 HG LEU 91 7.363 8.508 6.665 1607 HD11 LEU 91 1HD1 LEU 91 5.595 7.483 8.918 1608 HD12 LEU 91 2HD1 LEU 91 5.273 8.894 7.908 1609 HD13 LEU 91 3HD1 LEU 91 6.664 8.890 8.988 1610 HD21 LEU 91 1HD2 LEU 91 8.711 6.473 6.974 1611 HD22 LEU 91 2HD2 LEU 91 7.701 5.994 8.340 1612 HD23 LEU 91 3HD2 LEU 91 8.693 7.452 8.440 1613 H ILE 92 H ILE 92 5.150 6.843 3.145 1614 HA ILE 92 HA ILE 92 3.547 4.495 2.944 1615 HB ILE 92 HB ILE 92 3.926 6.722 0.869 1616 HG12 ILE 92 2HG1 ILE 92 1.778 6.406 3.027 1617 HG13 ILE 92 3HG1 ILE 92 3.084 7.582 3.047 1618 HG21 ILE 92 1HG2 ILE 92 1.707 4.640 1.057 1619 HG22 ILE 92 2HG2 ILE 92 2.972 4.698 -0.171 1620 HG23 ILE 92 3HG2 ILE 92 1.763 5.978 -0.095 1621 HD11 ILE 92 1HD1 ILE 92 0.802 7.492 1.078 1622 HD12 ILE 92 2HD1 ILE 92 2.130 8.656 1.054 1623 HD13 ILE 92 3HD1 ILE 92 1.007 8.625 2.414 1624 H LEU 93 H LEU 93 6.334 5.696 1.093 1625 HA LEU 93 HA LEU 93 6.489 3.728 -0.913 1626 HB2 LEU 93 2HB LEU 93 8.647 5.477 0.332 1627 HB3 LEU 93 3HB LEU 93 8.954 4.430 -1.043 1628 HG LEU 93 HG LEU 93 6.986 6.754 -1.043 1629 HD11 LEU 93 1HD1 LEU 93 9.760 6.595 -2.280 1630 HD12 LEU 93 2HD1 LEU 93 9.309 7.544 -0.861 1631 HD13 LEU 93 3HD1 LEU 93 8.626 7.943 -2.433 1632 HD21 LEU 93 1HD2 LEU 93 6.878 6.418 -3.484 1633 HD22 LEU 93 2HD2 LEU 93 6.310 4.997 -2.614 1634 HD23 LEU 93 3HD2 LEU 93 7.917 4.995 -3.341 1635 H ALA 94 H ALA 94 8.070 3.944 2.259 1636 HA ALA 94 HA ALA 94 9.627 1.570 2.075 1637 HB1 ALA 94 1HB ALA 94 8.737 3.116 4.533 1638 HB2 ALA 94 2HB ALA 94 10.191 3.427 3.581 1639 HB3 ALA 94 3HB ALA 94 10.031 1.917 4.480 1640 H ALA 95 H ALA 95 6.406 2.265 3.338 1641 HA ALA 95 HA ALA 95 5.977 -0.251 4.643 1642 HB1 ALA 95 1HB ALA 95 4.797 1.809 5.295 1643 HB2 ALA 95 2HB ALA 95 3.673 0.507 4.908 1644 HB3 ALA 95 3HB ALA 95 3.945 1.813 3.749 1645 H ASN 96 H ASN 96 5.270 1.015 1.406 1646 HA ASN 96 HA ASN 96 3.836 -1.311 0.468 1647 HB2 ASN 96 2HB ASN 96 3.443 0.952 -0.486 1648 HB3 ASN 96 3HB ASN 96 5.107 1.018 -1.054 1649 HD21 ASN 96 1HD2 ASN 96 4.306 1.398 -3.178 1650 HD22 ASN 96 2HD2 ASN 96 3.671 0.110 -4.142 1651 H TYR 97 H TYR 97 7.156 -0.142 0.369 1652 HA TYR 97 HA TYR 97 8.303 -2.034 -1.403 1653 HB2 TYR 97 2HB TYR 97 9.559 -0.030 -0.985 1654 HB3 TYR 97 3HB TYR 97 9.473 -0.242 0.756 1655 HD1 TYR 97 HD1 TYR 97 11.460 -0.940 1.819 1656 HD2 TYR 97 HD2 TYR 97 10.855 -2.092 -2.256 1657 HE1 TYR 97 HE1 TYR 97 13.667 -2.016 1.796 1658 HE2 TYR 97 HE2 TYR 97 13.069 -3.163 -2.272 1659 HH TYR 97 HH TYR 97 14.842 -3.791 0.546 1660 H LEU 98 H LEU 98 7.834 -2.002 2.104 1661 HA LEU 98 HA LEU 98 9.000 -4.683 2.386 1662 HB2 LEU 98 2HB LEU 98 8.108 -2.642 4.448 1663 HB3 LEU 98 3HB LEU 98 8.732 -4.237 4.847 1664 HG LEU 98 HG LEU 98 10.271 -2.004 3.462 1665 HD11 LEU 98 1HD1 LEU 98 11.694 -2.004 5.469 1666 HD12 LEU 98 2HD1 LEU 98 10.652 -3.217 6.218 1667 HD13 LEU 98 3HD1 LEU 98 10.020 -1.610 5.857 1668 HD21 LEU 98 1HD2 LEU 98 10.970 -4.129 2.508 1669 HD22 LEU 98 2HD2 LEU 98 11.195 -4.819 4.115 1670 HD23 LEU 98 3HD2 LEU 98 12.240 -3.510 3.561 1671 H ASP 99 H ASP 99 6.019 -3.314 1.817 1672 HA ASP 99 HA ASP 99 3.882 -4.018 1.731 1673 HB2 ASP 99 2HB ASP 99 5.116 -5.838 0.406 1674 HB3 ASP 99 3HB ASP 99 5.005 -6.850 1.837 1675 H ILE 100 H ILE 100 4.874 -3.392 4.295 1676 HA ILE 100 HA ILE 100 3.781 -5.206 6.280 1677 HB ILE 100 HB ILE 100 4.665 -2.288 6.656 1678 HG12 ILE 100 2HG1 ILE 100 6.306 -4.834 7.073 1679 HG13 ILE 100 3HG1 ILE 100 6.536 -3.671 5.775 1680 HG21 ILE 100 1HG2 ILE 100 4.878 -2.885 9.056 1681 HG22 ILE 100 2HG2 ILE 100 4.294 -4.513 8.705 1682 HG23 ILE 100 3HG2 ILE 100 3.228 -3.127 8.477 1683 HD11 ILE 100 1HD1 ILE 100 6.972 -3.166 8.717 1684 HD12 ILE 100 2HD1 ILE 100 7.161 -1.967 7.435 1685 HD13 ILE 100 3HD1 ILE 100 8.207 -3.384 7.477 1686 H LYS 101 H LYS 101 1.611 -5.415 6.181 1687 HA LYS 101 HA LYS 101 -0.184 -3.610 5.035 1688 HB2 LYS 101 2HB LYS 101 -0.947 -5.766 7.044 1689 HB3 LYS 101 3HB LYS 101 -1.991 -5.039 5.834 1690 HG2 LYS 101 2HG LYS 101 0.367 -6.864 5.327 1691 HG3 LYS 101 3HG LYS 101 -1.337 -7.286 5.175 1692 HD2 LYS 101 2HD LYS 101 -1.522 -5.616 3.305 1693 HD3 LYS 101 3HD LYS 101 0.216 -5.327 3.441 1694 HE2 LYS 101 2HE LYS 101 0.626 -7.736 2.946 1695 HE3 LYS 101 3HE LYS 101 -1.113 -7.963 2.722 1696 HZ1 LYS 101 1HZ LYS 101 -0.089 -7.665 0.614 1697 HZ2 LYS 101 2HZ LYS 101 0.691 -6.248 1.110 1698 HZ3 LYS 101 3HZ LYS 101 -0.994 -6.273 0.938 1699 HA PRO 102 HA PRO 102 -1.550 -2.267 9.627 1700 HB2 PRO 102 2HB PRO 102 0.600 -2.223 11.443 1701 HB3 PRO 102 3HB PRO 102 -0.666 -3.465 11.391 1702 HG2 PRO 102 2HG PRO 102 2.090 -3.535 10.218 1703 HG3 PRO 102 3HG PRO 102 1.189 -4.817 11.061 1704 HD2 PRO 102 2HD PRO 102 1.410 -4.819 8.389 1705 HD3 PRO 102 3HD PRO 102 -0.108 -5.322 9.174 1706 H LEU 103 H LEU 103 1.917 -1.706 8.845 1707 HA LEU 103 HA LEU 103 1.989 1.011 9.628 1708 HB2 LEU 103 2HB LEU 103 4.027 -0.345 9.404 1709 HB3 LEU 103 3HB LEU 103 3.773 -0.490 7.671 1710 HG LEU 103 HG LEU 103 4.148 1.951 7.404 1711 HD11 LEU 103 1HD1 LEU 103 4.990 3.326 9.259 1712 HD12 LEU 103 2HD1 LEU 103 4.715 1.993 10.384 1713 HD13 LEU 103 3HD1 LEU 103 3.352 2.753 9.561 1714 HD21 LEU 103 1HD2 LEU 103 6.055 0.432 7.158 1715 HD22 LEU 103 2HD2 LEU 103 6.408 0.558 8.884 1716 HD23 LEU 103 3HD2 LEU 103 6.570 1.972 7.839 1717 H LEU 104 H LEU 104 1.529 -0.507 6.456 1718 HA LEU 104 HA LEU 104 1.517 1.850 4.894 1719 HB2 LEU 104 2HB LEU 104 1.910 -0.418 3.970 1720 HB3 LEU 104 3HB LEU 104 0.242 -0.854 4.307 1721 HG LEU 104 HG LEU 104 -0.527 0.833 2.634 1722 HD11 LEU 104 1HD1 LEU 104 1.081 1.916 1.104 1723 HD12 LEU 104 2HD1 LEU 104 2.424 1.284 2.058 1724 HD13 LEU 104 3HD1 LEU 104 1.307 2.450 2.768 1725 HD21 LEU 104 1HD2 LEU 104 0.169 -0.403 0.623 1726 HD22 LEU 104 2HD2 LEU 104 -0.185 -1.508 1.945 1727 HD23 LEU 104 3HD2 LEU 104 1.492 -1.155 1.521 1728 H ASP 105 H ASP 105 -1.061 0.004 6.469 1729 HA ASP 105 HA ASP 105 -3.246 1.402 5.312 1730 HB2 ASP 105 2HB ASP 105 -3.441 -0.886 6.285 1731 HB3 ASP 105 3HB ASP 105 -3.204 -0.219 7.900 1732 H VAL 106 H VAL 106 -1.656 1.635 8.509 1733 HA VAL 106 HA VAL 106 -3.216 3.684 9.617 1734 HB VAL 106 HB VAL 106 -0.321 2.901 10.192 1735 HG11 VAL 106 1HG1 VAL 106 -0.594 5.246 10.903 1736 HG12 VAL 106 2HG1 VAL 106 -0.458 4.190 12.304 1737 HG13 VAL 106 3HG1 VAL 106 -2.035 4.823 11.830 1738 HG21 VAL 106 1HG2 VAL 106 -2.879 2.333 11.747 1739 HG22 VAL 106 2HG2 VAL 106 -1.254 1.794 12.180 1740 HG23 VAL 106 3HG2 VAL 106 -2.019 1.184 10.716 1741 H THR 107 H THR 107 -0.197 3.892 7.713 1742 HA THR 107 HA THR 107 0.108 6.714 7.899 1743 HB THR 107 HB THR 107 1.275 4.833 5.793 1744 HG1 THR 107 HG1 THR 107 2.411 4.101 7.415 1745 HG21 THR 107 1HG2 THR 107 1.565 7.222 5.194 1746 HG22 THR 107 2HG2 THR 107 3.108 6.495 5.641 1747 HG23 THR 107 3HG2 THR 107 2.264 7.540 6.785 1748 H CYS 108 H CYS 108 -1.526 4.625 5.527 1749 HA CYS 108 HA CYS 108 -2.238 6.716 3.686 1750 HB2 CYS 108 2HB CYS 108 -3.397 3.923 4.066 1751 HB3 CYS 108 3HB CYS 108 -3.821 5.001 2.736 1752 HG CYS 108 HG CYS 108 -0.581 4.060 3.255 1753 H LYS 109 H LYS 109 -3.684 5.374 6.593 1754 HA LYS 109 HA LYS 109 -6.220 6.718 6.305 1755 HB2 LYS 109 2HB LYS 109 -4.985 4.920 8.347 1756 HB3 LYS 109 3HB LYS 109 -6.137 6.081 8.989 1757 HG2 LYS 109 2HG LYS 109 -7.155 3.874 8.459 1758 HG3 LYS 109 3HG LYS 109 -7.913 5.206 7.586 1759 HD2 LYS 109 2HD LYS 109 -6.636 4.606 5.557 1760 HD3 LYS 109 3HD LYS 109 -5.851 3.286 6.429 1761 HE2 LYS 109 2HE LYS 109 -8.836 3.506 5.894 1762 HE3 LYS 109 3HE LYS 109 -7.707 2.504 4.984 1763 HZ1 LYS 109 1HZ LYS 109 -7.231 1.261 6.995 1764 HZ2 LYS 109 2HZ LYS 109 -8.885 1.215 6.640 1765 HZ3 LYS 109 3HZ LYS 109 -8.316 2.217 7.877 1766 H THR 110 H THR 110 -3.106 7.499 7.750 1767 HA THR 110 HA THR 110 -3.799 9.634 9.417 1768 HB THR 110 HB THR 110 -1.248 9.264 7.776 1769 HG1 THR 110 HG1 THR 110 -1.121 7.662 9.171 1770 HG21 THR 110 1HG2 THR 110 -1.435 11.617 8.553 1771 HG22 THR 110 2HG2 THR 110 -0.165 10.768 9.430 1772 HG23 THR 110 3HG2 THR 110 -1.723 11.053 10.204 1773 H VAL 111 H VAL 111 -2.744 9.719 5.998 1774 HA VAL 111 HA VAL 111 -3.254 12.480 5.571 1775 HB VAL 111 HB VAL 111 -3.133 11.927 3.108 1776 HG11 VAL 111 1HG1 VAL 111 -0.746 11.326 3.113 1777 HG12 VAL 111 2HG1 VAL 111 -0.860 10.835 4.805 1778 HG13 VAL 111 3HG1 VAL 111 -1.111 12.522 4.357 1779 HG21 VAL 111 1HG2 VAL 111 -4.076 9.657 3.135 1780 HG22 VAL 111 2HG2 VAL 111 -2.701 9.066 4.069 1781 HG23 VAL 111 3HG2 VAL 111 -2.466 9.642 2.415 1782 H ALA 112 H ALA 112 -5.270 9.603 5.213 1783 HA ALA 112 HA ALA 112 -7.451 10.719 3.827 1784 HB1 ALA 112 1HB ALA 112 -7.105 8.300 4.083 1785 HB2 ALA 112 2HB ALA 112 -8.717 8.767 4.623 1786 HB3 ALA 112 3HB ALA 112 -7.454 8.421 5.809 1787 H ASN 113 H ASN 113 -6.727 10.556 7.304 1788 HA ASN 113 HA ASN 113 -9.220 11.637 8.207 1789 HB2 ASN 113 2HB ASN 113 -6.534 11.245 9.578 1790 HB3 ASN 113 3HB ASN 113 -7.826 12.113 10.389 1791 HD21 ASN 113 1HD2 ASN 113 -6.573 9.022 9.684 1792 HD22 ASN 113 2HD2 ASN 113 -7.866 8.097 10.351 1793 H MET 114 H MET 114 -6.091 13.050 7.338 1794 HA MET 114 HA MET 114 -6.608 15.650 8.406 1795 HB2 MET 114 2HB MET 114 -4.539 14.721 6.374 1796 HB3 MET 114 3HB MET 114 -4.602 16.354 7.024 1797 HG2 MET 114 2HG MET 114 -4.322 15.357 9.325 1798 HG3 MET 114 3HG MET 114 -4.040 13.803 8.544 1799 HE1 MET 114 1HE MET 114 -0.681 14.573 6.554 1800 HE2 MET 114 2HE MET 114 -2.307 14.789 5.911 1801 HE3 MET 114 3HE MET 114 -1.922 13.360 6.872 1802 H ILE 115 H ILE 115 -7.040 14.228 5.168 1803 HA ILE 115 HA ILE 115 -7.746 16.758 3.929 1804 HB ILE 115 HB ILE 115 -8.226 15.435 1.879 1805 HG12 ILE 115 2HG1 ILE 115 -7.571 13.000 3.616 1806 HG13 ILE 115 3HG1 ILE 115 -9.145 13.380 2.941 1807 HG21 ILE 115 1HG2 ILE 115 -5.583 14.688 3.188 1808 HG22 ILE 115 2HG2 ILE 115 -5.923 16.205 2.354 1809 HG23 ILE 115 3HG2 ILE 115 -5.920 14.690 1.454 1810 HD11 ILE 115 1HD1 ILE 115 -8.036 11.589 1.741 1811 HD12 ILE 115 2HD1 ILE 115 -6.684 12.655 1.363 1812 HD13 ILE 115 3HD1 ILE 115 -8.285 12.991 0.703 1813 H ARG 116 H ARG 116 -9.504 14.099 5.373 1814 HA ARG 116 HA ARG 116 -12.128 15.069 4.465 1815 HB2 ARG 116 2HB ARG 116 -11.277 12.685 6.156 1816 HB3 ARG 116 3HB ARG 116 -12.964 13.082 5.837 1817 HG2 ARG 116 2HG ARG 116 -12.591 12.771 3.423 1818 HG3 ARG 116 3HG ARG 116 -10.894 12.407 3.726 1819 HD2 ARG 116 2HD ARG 116 -11.461 10.372 4.890 1820 HD3 ARG 116 3HD ARG 116 -13.178 10.767 4.881 1821 HE ARG 116 HE ARG 116 -11.562 9.821 2.609 1822 HH11 ARG 116 1HH1 ARG 116 -14.755 10.751 3.809 1823 HH12 ARG 116 2HH1 ARG 116 -15.565 10.028 2.461 1824 HH21 ARG 116 1HH2 ARG 116 -12.663 8.841 0.940 1825 HH22 ARG 116 2HH2 ARG 116 -14.390 8.948 0.840 1826 H GLY 117 H GLY 117 -10.007 15.516 7.122 1827 HA2 GLY 117 2HA GLY 117 -12.153 16.327 8.991 1828 HA3 GLY 117 3HA GLY 117 -10.481 15.986 9.407 Start of MODEL 2 1 H1 SER 2 1H SER 2 -16.293 -14.062 -17.681 2 H2 SER 2 2H SER 2 -16.732 -13.088 -18.984 3 H3 SER 2 3H SER 2 -17.410 -14.624 -18.814 4 HA SER 2 HA SER 2 -18.940 -12.875 -18.195 5 HB2 SER 2 2HB SER 2 -18.060 -14.594 -15.839 6 HB3 SER 2 3HB SER 2 -19.673 -13.920 -16.106 7 HG SER 2 HG SER 2 -19.417 -16.156 -16.755 8 H LEU 3 H LEU 3 -19.501 -11.182 -16.816 9 HA LEU 3 HA LEU 3 -17.267 -9.638 -15.701 10 HB2 LEU 3 2HB LEU 3 -20.170 -8.843 -16.161 11 HB3 LEU 3 3HB LEU 3 -18.870 -7.766 -15.679 12 HG LEU 3 HG LEU 3 -19.102 -9.174 -18.368 13 HD11 LEU 3 1HD1 LEU 3 -19.462 -6.926 -19.290 14 HD12 LEU 3 2HD1 LEU 3 -19.427 -6.239 -17.664 15 HD13 LEU 3 3HD1 LEU 3 -20.717 -7.352 -18.126 16 HD21 LEU 3 1HD2 LEU 3 -16.759 -8.960 -17.758 17 HD22 LEU 3 2HD2 LEU 3 -16.978 -7.250 -17.375 18 HD23 LEU 3 3HD2 LEU 3 -17.150 -7.814 -19.039 19 H VAL 4 H VAL 4 -16.912 -9.653 -13.526 20 HA VAL 4 HA VAL 4 -18.921 -10.547 -11.629 21 HB VAL 4 HB VAL 4 -17.207 -9.952 -9.854 22 HG11 VAL 4 1HG1 VAL 4 -16.253 -11.836 -12.045 23 HG12 VAL 4 2HG1 VAL 4 -17.379 -12.234 -10.747 24 HG13 VAL 4 3HG1 VAL 4 -15.703 -11.843 -10.366 25 HG21 VAL 4 1HG2 VAL 4 -15.402 -9.348 -12.236 26 HG22 VAL 4 2HG2 VAL 4 -14.881 -9.456 -10.552 27 HG23 VAL 4 3HG2 VAL 4 -15.985 -8.175 -11.052 28 H LYS 5 H LYS 5 -20.310 -9.310 -10.592 29 HA LYS 5 HA LYS 5 -20.506 -6.472 -11.219 30 HB2 LYS 5 2HB LYS 5 -22.415 -8.287 -9.679 31 HB3 LYS 5 3HB LYS 5 -22.779 -6.674 -10.290 32 HG2 LYS 5 2HG LYS 5 -22.459 -7.514 -12.613 33 HG3 LYS 5 3HG LYS 5 -22.168 -9.129 -11.973 34 HD2 LYS 5 2HD LYS 5 -24.461 -9.199 -11.067 35 HD3 LYS 5 3HD LYS 5 -24.753 -7.553 -11.642 36 HE2 LYS 5 2HE LYS 5 -24.408 -8.319 -13.980 37 HE3 LYS 5 3HE LYS 5 -24.154 -9.965 -13.393 38 HZ1 LYS 5 1HZ LYS 5 -26.402 -9.982 -12.547 39 HZ2 LYS 5 2HZ LYS 5 -26.403 -9.619 -14.197 40 HZ3 LYS 5 3HZ LYS 5 -26.644 -8.393 -13.064 41 H LEU 6 H LEU 6 -19.175 -5.284 -9.983 42 HA LEU 6 HA LEU 6 -18.961 -5.773 -7.063 43 HB2 LEU 6 2HB LEU 6 -17.025 -4.320 -8.917 44 HB3 LEU 6 3HB LEU 6 -16.773 -4.642 -7.208 45 HG LEU 6 HG LEU 6 -16.962 -6.776 -9.371 46 HD11 LEU 6 1HD1 LEU 6 -14.551 -7.088 -9.060 47 HD12 LEU 6 2HD1 LEU 6 -14.508 -5.734 -7.928 48 HD13 LEU 6 3HD1 LEU 6 -14.922 -5.457 -9.621 49 HD21 LEU 6 1HD2 LEU 6 -16.193 -8.344 -7.620 50 HD22 LEU 6 2HD2 LEU 6 -17.752 -7.629 -7.219 51 HD23 LEU 6 3HD2 LEU 6 -16.288 -7.051 -6.420 52 H GLU 7 H GLU 7 -20.616 -4.494 -6.258 53 HA GLU 7 HA GLU 7 -21.135 -1.837 -7.253 54 HB2 GLU 7 2HB GLU 7 -22.153 -3.161 -4.708 55 HB3 GLU 7 3HB GLU 7 -22.692 -1.599 -5.311 56 HG2 GLU 7 2HG GLU 7 -24.342 -3.243 -5.872 57 HG3 GLU 7 3HG GLU 7 -23.548 -2.713 -7.354 58 H SER 8 H SER 8 -20.784 0.101 -6.188 59 HA SER 8 HA SER 8 -18.462 0.216 -4.391 60 HB2 SER 8 2HB SER 8 -18.632 2.685 -4.961 61 HB3 SER 8 3HB SER 8 -18.386 1.632 -6.355 62 HG SER 8 HG SER 8 -20.337 2.062 -7.063 63 H SER 9 H SER 9 -18.668 2.139 -2.790 64 HA SER 9 HA SER 9 -20.713 1.878 -0.881 65 HB2 SER 9 2HB SER 9 -18.434 2.849 -0.444 66 HB3 SER 9 3HB SER 9 -18.886 4.277 -1.375 67 HG SER 9 HG SER 9 -19.717 3.456 1.168 68 H ASP 10 H ASP 10 -20.450 3.709 -3.807 69 HA ASP 10 HA ASP 10 -22.820 5.371 -3.356 70 HB2 ASP 10 2HB ASP 10 -20.732 6.306 -4.359 71 HB3 ASP 10 3HB ASP 10 -20.898 5.195 -5.710 72 H GLU 11 H GLU 11 -22.418 2.251 -4.105 73 HA GLU 11 HA GLU 11 -23.966 0.678 -4.525 74 HB2 GLU 11 2HB GLU 11 -25.576 2.372 -3.593 75 HB3 GLU 11 3HB GLU 11 -25.879 2.945 -5.228 76 HG2 GLU 11 2HG GLU 11 -26.815 0.737 -5.818 77 HG3 GLU 11 3HG GLU 11 -26.503 0.164 -4.180 78 H LYS 12 H LYS 12 -22.566 2.547 -6.868 79 HA LYS 12 HA LYS 12 -23.963 1.723 -9.226 80 HB2 LYS 12 2HB LYS 12 -21.132 2.772 -8.873 81 HB3 LYS 12 3HB LYS 12 -21.859 2.434 -10.440 82 HG2 LYS 12 2HG LYS 12 -23.674 4.123 -9.823 83 HG3 LYS 12 3HG LYS 12 -22.651 4.577 -8.452 84 HD2 LYS 12 2HD LYS 12 -20.794 5.088 -10.054 85 HD3 LYS 12 3HD LYS 12 -21.870 4.701 -11.397 86 HE2 LYS 12 2HE LYS 12 -23.340 6.569 -10.775 87 HE3 LYS 12 3HE LYS 12 -22.309 6.932 -9.387 88 HZ1 LYS 12 1HZ LYS 12 -21.777 8.392 -11.195 89 HZ2 LYS 12 2HZ LYS 12 -21.537 7.094 -12.244 90 HZ3 LYS 12 3HZ LYS 12 -20.475 7.340 -10.955 91 H VAL 13 H VAL 13 -23.937 -0.189 -10.186 92 HA VAL 13 HA VAL 13 -22.330 -2.414 -9.330 93 HB VAL 13 HB VAL 13 -24.213 -2.186 -11.737 94 HG11 VAL 13 1HG1 VAL 13 -23.232 -4.680 -10.294 95 HG12 VAL 13 2HG1 VAL 13 -22.720 -4.138 -11.892 96 HG13 VAL 13 3HG1 VAL 13 -24.390 -4.641 -11.629 97 HG21 VAL 13 1HG2 VAL 13 -25.388 -1.611 -9.644 98 HG22 VAL 13 2HG2 VAL 13 -24.877 -3.137 -8.922 99 HG23 VAL 13 3HG2 VAL 13 -25.976 -3.138 -10.305 100 H PHE 14 H PHE 14 -20.174 -2.420 -9.922 101 HA PHE 14 HA PHE 14 -19.382 -1.555 -12.639 102 HB2 PHE 14 2HB PHE 14 -17.707 -2.040 -10.136 103 HB3 PHE 14 3HB PHE 14 -17.031 -1.623 -11.712 104 HD1 PHE 14 HD1 PHE 14 -18.131 0.517 -12.857 105 HD2 PHE 14 HD2 PHE 14 -18.135 -0.241 -8.647 106 HE1 PHE 14 HE1 PHE 14 -18.502 2.903 -12.423 107 HE2 PHE 14 HE2 PHE 14 -18.498 2.156 -8.230 108 HZ PHE 14 HZ PHE 14 -18.691 3.726 -10.116 109 H GLU 15 H GLU 15 -19.989 -3.246 -13.834 110 HA GLU 15 HA GLU 15 -19.228 -5.981 -13.268 111 HB2 GLU 15 2HB GLU 15 -20.486 -4.789 -15.769 112 HB3 GLU 15 3HB GLU 15 -20.423 -6.497 -15.337 113 HG2 GLU 15 2HG GLU 15 -21.885 -6.056 -13.400 114 HG3 GLU 15 3HG GLU 15 -21.921 -4.350 -13.823 115 H ILE 16 H ILE 16 -17.010 -6.073 -13.311 116 HA ILE 16 HA ILE 16 -15.589 -5.312 -15.811 117 HB ILE 16 HB ILE 16 -14.799 -4.088 -13.796 118 HG12 ILE 16 2HG1 ILE 16 -12.755 -6.116 -14.825 119 HG13 ILE 16 3HG1 ILE 16 -13.167 -4.591 -15.601 120 HG21 ILE 16 1HG2 ILE 16 -15.372 -5.751 -12.067 121 HG22 ILE 16 2HG2 ILE 16 -13.694 -5.231 -11.914 122 HG23 ILE 16 3HG2 ILE 16 -14.068 -6.799 -12.633 123 HD11 ILE 16 1HD1 ILE 16 -12.256 -3.390 -13.661 124 HD12 ILE 16 2HD1 ILE 16 -11.069 -4.419 -14.456 125 HD13 ILE 16 3HD1 ILE 16 -11.801 -4.937 -12.940 126 H GLU 17 H GLU 17 -13.979 -6.802 -16.585 127 HA GLU 17 HA GLU 17 -14.664 -9.508 -16.697 128 HB2 GLU 17 2HB GLU 17 -11.964 -8.203 -17.256 129 HB3 GLU 17 3HB GLU 17 -12.373 -9.858 -17.690 130 HG2 GLU 17 2HG GLU 17 -12.523 -8.511 -19.663 131 HG3 GLU 17 3HG GLU 17 -14.153 -8.981 -19.200 132 H LYS 18 H LYS 18 -14.220 -11.213 -15.435 133 HA LYS 18 HA LYS 18 -13.520 -10.887 -12.743 134 HB2 LYS 18 2HB LYS 18 -15.000 -12.682 -13.583 135 HB3 LYS 18 3HB LYS 18 -13.635 -13.449 -14.388 136 HG2 LYS 18 2HG LYS 18 -12.577 -13.881 -12.184 137 HG3 LYS 18 3HG LYS 18 -13.936 -13.089 -11.384 138 HD2 LYS 18 2HD LYS 18 -14.200 -15.524 -11.265 139 HD3 LYS 18 3HD LYS 18 -15.475 -14.832 -12.270 140 HE2 LYS 18 2HE LYS 18 -14.222 -15.496 -14.302 141 HE3 LYS 18 3HE LYS 18 -12.949 -16.188 -13.294 142 HZ1 LYS 18 1HZ LYS 18 -14.416 -17.908 -14.044 143 HZ2 LYS 18 2HZ LYS 18 -15.774 -17.098 -13.449 144 HZ3 LYS 18 3HZ LYS 18 -14.623 -17.716 -12.378 145 H GLU 19 H GLU 19 -11.632 -12.020 -15.487 146 HA GLU 19 HA GLU 19 -9.334 -12.993 -14.222 147 HB2 GLU 19 2HB GLU 19 -8.205 -12.597 -16.418 148 HB3 GLU 19 3HB GLU 19 -9.771 -13.381 -16.582 149 HG2 GLU 19 2HG GLU 19 -10.760 -11.110 -17.129 150 HG3 GLU 19 3HG GLU 19 -9.118 -10.476 -17.149 151 H ILE 20 H ILE 20 -10.282 -9.693 -14.957 152 HA ILE 20 HA ILE 20 -7.728 -8.470 -14.326 153 HB ILE 20 HB ILE 20 -10.476 -7.185 -14.714 154 HG12 ILE 20 2HG1 ILE 20 -8.242 -7.641 -16.750 155 HG13 ILE 20 3HG1 ILE 20 -9.785 -8.478 -16.720 156 HG21 ILE 20 1HG2 ILE 20 -9.220 -5.109 -15.153 157 HG22 ILE 20 2HG2 ILE 20 -7.702 -5.939 -14.812 158 HG23 ILE 20 3HG2 ILE 20 -8.895 -5.717 -13.529 159 HD11 ILE 20 1HD1 ILE 20 -9.726 -6.785 -18.439 160 HD12 ILE 20 2HD1 ILE 20 -9.379 -5.543 -17.243 161 HD13 ILE 20 3HD1 ILE 20 -10.929 -6.381 -17.217 162 H ALA 21 H ALA 21 -10.901 -8.878 -12.776 163 HA ALA 21 HA ALA 21 -10.393 -7.438 -10.388 164 HB1 ALA 21 1HB ALA 21 -12.328 -9.728 -10.868 165 HB2 ALA 21 2HB ALA 21 -12.657 -8.017 -11.145 166 HB3 ALA 21 3HB ALA 21 -12.375 -8.603 -9.505 167 H CYS 22 H CYS 22 -9.408 -10.603 -11.434 168 HA CYS 22 HA CYS 22 -8.751 -11.754 -8.922 169 HB2 CYS 22 2HB CYS 22 -7.679 -12.326 -11.705 170 HB3 CYS 22 3HB CYS 22 -7.346 -13.319 -10.286 171 HG CYS 22 HG CYS 22 -10.608 -12.823 -10.762 172 H MET 23 H MET 23 -7.124 -9.360 -10.900 173 HA MET 23 HA MET 23 -4.476 -9.729 -9.871 174 HB2 MET 23 2HB MET 23 -5.653 -7.185 -11.051 175 HB3 MET 23 3HB MET 23 -3.946 -7.558 -10.866 176 HG2 MET 23 2HG MET 23 -4.415 -9.555 -12.449 177 HG3 MET 23 3HG MET 23 -5.921 -8.713 -12.823 178 HE1 MET 23 1HE MET 23 -4.117 -5.176 -13.885 179 HE2 MET 23 2HE MET 23 -4.171 -5.677 -12.197 180 HE3 MET 23 3HE MET 23 -5.610 -5.831 -13.209 181 H SER 24 H SER 24 -7.253 -7.758 -8.881 182 HA SER 24 HA SER 24 -6.107 -6.661 -6.518 183 HB2 SER 24 2HB SER 24 -8.983 -7.490 -7.110 184 HB3 SER 24 3HB SER 24 -8.476 -6.530 -5.720 185 HG SER 24 HG SER 24 -8.467 -4.871 -6.914 186 H VAL 25 H VAL 25 -5.170 -7.927 -5.004 187 HA VAL 25 HA VAL 25 -5.515 -10.707 -4.705 188 HB VAL 25 HB VAL 25 -4.410 -8.707 -2.675 189 HG11 VAL 25 1HG1 VAL 25 -3.169 -10.638 -1.708 190 HG12 VAL 25 2HG1 VAL 25 -4.031 -11.729 -2.799 191 HG13 VAL 25 3HG1 VAL 25 -4.918 -10.832 -1.564 192 HG21 VAL 25 1HG2 VAL 25 -2.186 -9.277 -3.597 193 HG22 VAL 25 2HG2 VAL 25 -3.230 -8.591 -4.842 194 HG23 VAL 25 3HG2 VAL 25 -2.942 -10.332 -4.797 195 H THR 26 H THR 26 -7.155 -7.961 -3.201 196 HA THR 26 HA THR 26 -8.442 -9.371 -1.083 197 HB THR 26 HB THR 26 -9.129 -6.732 -2.440 198 HG1 THR 26 HG1 THR 26 -8.101 -5.918 -0.524 199 HG21 THR 26 1HG2 THR 26 -10.215 -7.830 0.184 200 HG22 THR 26 2HG2 THR 26 -11.151 -7.546 -1.286 201 HG23 THR 26 3HG2 THR 26 -10.446 -6.185 -0.414 202 H ILE 27 H ILE 27 -9.641 -8.361 -4.325 203 HA ILE 27 HA ILE 27 -12.268 -9.426 -4.033 204 HB ILE 27 HB ILE 27 -10.733 -8.836 -6.611 205 HG12 ILE 27 2HG1 ILE 27 -12.735 -7.050 -5.141 206 HG13 ILE 27 3HG1 ILE 27 -10.988 -6.849 -5.069 207 HG21 ILE 27 1HG2 ILE 27 -12.661 -10.313 -7.045 208 HG22 ILE 27 2HG2 ILE 27 -12.954 -8.709 -7.713 209 HG23 ILE 27 3HG2 ILE 27 -13.734 -9.190 -6.205 210 HD11 ILE 27 1HD1 ILE 27 -12.688 -6.602 -7.547 211 HD12 ILE 27 2HD1 ILE 27 -10.937 -6.407 -7.474 212 HD13 ILE 27 3HD1 ILE 27 -11.986 -5.281 -6.616 213 H LYS 28 H LYS 28 -9.290 -10.662 -5.530 214 HA LYS 28 HA LYS 28 -10.161 -13.096 -6.580 215 HB2 LYS 28 2HB LYS 28 -7.925 -12.092 -7.015 216 HB3 LYS 28 3HB LYS 28 -7.450 -12.421 -5.353 217 HG2 LYS 28 2HG LYS 28 -7.742 -14.888 -5.832 218 HG3 LYS 28 3HG LYS 28 -8.046 -14.465 -7.519 219 HD2 LYS 28 2HD LYS 28 -5.716 -15.161 -7.235 220 HD3 LYS 28 3HD LYS 28 -5.784 -13.451 -7.672 221 HE2 LYS 28 2HE LYS 28 -4.119 -13.825 -5.921 222 HE3 LYS 28 3HE LYS 28 -5.438 -12.838 -5.292 223 HZ1 LYS 28 1HZ LYS 28 -6.358 -14.890 -4.300 224 HZ2 LYS 28 2HZ LYS 28 -4.834 -14.494 -3.691 225 HZ3 LYS 28 3HZ LYS 28 -4.995 -15.738 -4.823 226 H ASN 29 H ASN 29 -8.750 -12.391 -3.378 227 HA ASN 29 HA ASN 29 -8.910 -14.997 -2.301 228 HB2 ASN 29 2HB ASN 29 -8.618 -12.259 -1.005 229 HB3 ASN 29 3HB ASN 29 -8.753 -13.720 -0.024 230 HD21 ASN 29 1HD2 ASN 29 -6.655 -13.303 0.809 231 HD22 ASN 29 2HD2 ASN 29 -5.235 -13.641 -0.113 232 H MET 30 H MET 30 -11.295 -12.390 -2.463 233 HA MET 30 HA MET 30 -13.178 -13.545 -0.648 234 HB2 MET 30 2HB MET 30 -13.524 -11.541 -2.918 235 HB3 MET 30 3HB MET 30 -14.879 -12.092 -1.940 236 HG2 MET 30 2HG MET 30 -13.782 -11.210 0.083 237 HG3 MET 30 3HG MET 30 -12.432 -10.642 -0.905 238 HE1 MET 30 1HE MET 30 -12.796 -8.204 0.193 239 HE2 MET 30 2HE MET 30 -14.192 -8.780 1.106 240 HE3 MET 30 3HE MET 30 -14.324 -7.326 0.118 241 H ILE 31 H ILE 31 -12.780 -13.779 -4.190 242 HA ILE 31 HA ILE 31 -15.032 -15.441 -4.704 243 HB ILE 31 HB ILE 31 -12.449 -15.202 -6.334 244 HG12 ILE 31 2HG1 ILE 31 -15.080 -13.671 -6.668 245 HG13 ILE 31 3HG1 ILE 31 -13.611 -13.001 -5.974 246 HG21 ILE 31 1HG2 ILE 31 -13.812 -15.996 -8.259 247 HG22 ILE 31 2HG2 ILE 31 -15.191 -16.230 -7.185 248 HG23 ILE 31 3HG2 ILE 31 -13.735 -17.204 -6.975 249 HD11 ILE 31 1HD1 ILE 31 -13.948 -13.939 -8.821 250 HD12 ILE 31 2HD1 ILE 31 -12.469 -13.276 -8.121 251 HD13 ILE 31 3HD1 ILE 31 -13.910 -12.269 -8.258 252 H GLU 32 H GLU 32 -11.691 -16.127 -3.794 253 HA GLU 32 HA GLU 32 -11.849 -18.976 -4.197 254 HB2 GLU 32 2HB GLU 32 -9.784 -17.266 -2.765 255 HB3 GLU 32 3HB GLU 32 -9.604 -18.991 -3.079 256 HG2 GLU 32 2HG GLU 32 -9.652 -18.598 -5.493 257 HG3 GLU 32 3HG GLU 32 -9.925 -16.877 -5.236 258 H ASP 33 H ASP 33 -12.043 -16.833 -1.343 259 HA ASP 33 HA ASP 33 -11.935 -19.007 0.575 260 HB2 ASP 33 2HB ASP 33 -10.917 -16.797 1.073 261 HB3 ASP 33 3HB ASP 33 -12.499 -16.029 0.996 262 H ILE 34 H ILE 34 -14.425 -16.678 -0.455 263 HA ILE 34 HA ILE 34 -16.552 -17.822 1.122 264 HB ILE 34 HB ILE 34 -16.695 -15.909 -1.269 265 HG12 ILE 34 2HG1 ILE 34 -16.713 -15.254 1.722 266 HG13 ILE 34 3HG1 ILE 34 -15.330 -15.036 0.659 267 HG21 ILE 34 1HG2 ILE 34 -18.940 -15.289 -0.435 268 HG22 ILE 34 2HG2 ILE 34 -18.819 -16.515 0.827 269 HG23 ILE 34 3HG2 ILE 34 -18.868 -16.997 -0.869 270 HD11 ILE 34 1HD1 ILE 34 -16.442 -12.942 1.077 271 HD12 ILE 34 2HD1 ILE 34 -17.962 -13.584 0.459 272 HD13 ILE 34 3HD1 ILE 34 -16.584 -13.376 -0.627 273 H GLY 35 H GLY 35 -15.314 -18.169 -2.134 274 HA2 GLY 35 2HA GLY 35 -15.550 -20.239 -3.352 275 HA3 GLY 35 3HA GLY 35 -17.175 -20.417 -2.696 276 H GLU 36 H GLU 36 -17.198 -20.730 -5.232 277 HA GLU 36 HA GLU 36 -17.277 -18.438 -6.905 278 HB2 GLU 36 2HB GLU 36 -18.565 -21.175 -7.297 279 HB3 GLU 36 3HB GLU 36 -18.409 -19.942 -8.546 280 HG2 GLU 36 2HG GLU 36 -15.938 -20.088 -8.361 281 HG3 GLU 36 3HG GLU 36 -16.121 -21.352 -7.144 282 H SER 37 H SER 37 -18.510 -16.887 -5.922 283 HA SER 37 HA SER 37 -21.326 -17.379 -5.253 284 HB2 SER 37 2HB SER 37 -19.591 -14.902 -4.838 285 HB3 SER 37 3HB SER 37 -21.211 -15.159 -4.179 286 HG SER 37 HG SER 37 -18.927 -16.762 -3.629 287 H ASP 38 H ASP 38 -22.731 -17.165 -6.882 288 HA ASP 38 HA ASP 38 -22.285 -15.545 -9.232 289 HB2 ASP 38 2HB ASP 38 -24.586 -16.269 -9.894 290 HB3 ASP 38 3HB ASP 38 -23.543 -17.620 -9.465 291 H SER 39 H SER 39 -23.700 -15.062 -6.121 292 HA SER 39 HA SER 39 -25.308 -12.787 -6.602 293 HB2 SER 39 2HB SER 39 -23.744 -13.565 -4.094 294 HB3 SER 39 3HB SER 39 -25.040 -12.367 -4.158 295 HG SER 39 HG SER 39 -26.222 -14.321 -5.157 296 HA PRO 40 HA PRO 40 -22.096 -9.725 -7.419 297 HB2 PRO 40 2HB PRO 40 -23.482 -7.414 -7.006 298 HB3 PRO 40 3HB PRO 40 -23.852 -8.489 -8.367 299 HG2 PRO 40 2HG PRO 40 -25.273 -8.237 -5.739 300 HG3 PRO 40 3HG PRO 40 -25.952 -8.358 -7.380 301 HD2 PRO 40 2HD PRO 40 -25.763 -10.507 -5.686 302 HD3 PRO 40 3HD PRO 40 -25.715 -10.657 -7.454 303 H ILE 41 H ILE 41 -20.602 -8.352 -6.300 304 HA ILE 41 HA ILE 41 -20.680 -8.614 -3.352 305 HB ILE 41 HB ILE 41 -18.239 -8.196 -5.151 306 HG12 ILE 41 2HG1 ILE 41 -17.597 -10.561 -4.226 307 HG13 ILE 41 3HG1 ILE 41 -19.291 -10.721 -3.791 308 HG21 ILE 41 1HG2 ILE 41 -16.885 -8.559 -3.099 309 HG22 ILE 41 2HG2 ILE 41 -18.363 -8.628 -2.139 310 HG23 ILE 41 3HG2 ILE 41 -17.917 -7.131 -2.963 311 HD11 ILE 41 1HD1 ILE 41 -18.200 -10.334 -6.582 312 HD12 ILE 41 2HD1 ILE 41 -19.905 -10.512 -6.159 313 HD13 ILE 41 3HD1 ILE 41 -18.785 -11.846 -5.885 314 HA PRO 42 HA PRO 42 -20.926 -4.034 -3.684 315 HB2 PRO 42 2HB PRO 42 -22.515 -3.588 -1.522 316 HB3 PRO 42 3HB PRO 42 -23.174 -4.182 -3.059 317 HG2 PRO 42 2HG PRO 42 -22.639 -5.679 -0.536 318 HG3 PRO 42 3HG PRO 42 -23.952 -5.886 -1.715 319 HD2 PRO 42 2HD PRO 42 -21.611 -7.453 -1.574 320 HD3 PRO 42 3HD PRO 42 -22.731 -7.386 -2.950 321 H LEU 43 H LEU 43 -18.908 -3.355 -3.181 322 HA LEU 43 HA LEU 43 -17.752 -3.598 -0.508 323 HB2 LEU 43 2HB LEU 43 -16.728 -2.097 -2.966 324 HB3 LEU 43 3HB LEU 43 -15.859 -2.256 -1.454 325 HG LEU 43 HG LEU 43 -14.850 -3.784 -2.978 326 HD11 LEU 43 1HD1 LEU 43 -16.632 -5.439 -1.172 327 HD12 LEU 43 2HD1 LEU 43 -15.112 -4.669 -0.712 328 HD13 LEU 43 3HD1 LEU 43 -15.113 -5.958 -1.914 329 HD21 LEU 43 1HD2 LEU 43 -16.047 -5.533 -4.234 330 HD22 LEU 43 2HD2 LEU 43 -16.600 -3.921 -4.682 331 HD23 LEU 43 3HD2 LEU 43 -17.592 -4.929 -3.625 332 HA PRO 44 HA PRO 44 -20.083 0.304 0.248 333 HB2 PRO 44 2HB PRO 44 -20.546 0.005 2.881 334 HB3 PRO 44 3HB PRO 44 -21.337 -1.060 1.700 335 HG2 PRO 44 2HG PRO 44 -18.967 -1.620 3.443 336 HG3 PRO 44 3HG PRO 44 -20.340 -2.672 3.038 337 HD2 PRO 44 2HD PRO 44 -17.837 -2.748 1.783 338 HD3 PRO 44 3HD PRO 44 -19.338 -3.418 1.109 339 H ASN 45 H ASN 45 -16.941 -0.244 0.692 340 HA ASN 45 HA ASN 45 -16.344 1.986 2.522 341 HB2 ASN 45 2HB ASN 45 -15.164 -0.117 2.979 342 HB3 ASN 45 3HB ASN 45 -14.562 -0.183 1.327 343 HD21 ASN 45 1HD2 ASN 45 -14.312 1.515 4.400 344 HD22 ASN 45 2HD2 ASN 45 -12.762 2.214 4.103 345 H VAL 46 H VAL 46 -15.300 0.796 -0.706 346 HA VAL 46 HA VAL 46 -14.035 3.340 -1.333 347 HB VAL 46 HB VAL 46 -12.878 1.289 -1.984 348 HG11 VAL 46 1HG1 VAL 46 -14.794 -0.212 -2.310 349 HG12 VAL 46 2HG1 VAL 46 -13.706 -0.264 -3.696 350 HG13 VAL 46 3HG1 VAL 46 -15.223 0.633 -3.800 351 HG21 VAL 46 1HG2 VAL 46 -12.483 3.266 -3.385 352 HG22 VAL 46 2HG2 VAL 46 -13.824 2.819 -4.440 353 HG23 VAL 46 3HG2 VAL 46 -12.387 1.798 -4.359 354 H THR 47 H THR 47 -14.859 4.936 -2.601 355 HA THR 47 HA THR 47 -17.657 5.004 -3.247 356 HB THR 47 HB THR 47 -17.059 7.298 -4.214 357 HG1 THR 47 HG1 THR 47 -14.879 7.984 -3.731 358 HG21 THR 47 1HG2 THR 47 -16.506 8.323 -2.039 359 HG22 THR 47 2HG2 THR 47 -16.082 6.740 -1.389 360 HG23 THR 47 3HG2 THR 47 -17.751 7.085 -1.851 361 H SER 48 H SER 48 -18.350 5.907 -5.483 362 HA SER 48 HA SER 48 -17.890 3.801 -7.342 363 HB2 SER 48 2HB SER 48 -19.469 5.059 -8.807 364 HB3 SER 48 3HB SER 48 -20.082 4.843 -7.167 365 HG SER 48 HG SER 48 -20.414 6.964 -7.754 366 H THR 49 H THR 49 -17.083 7.258 -7.385 367 HA THR 49 HA THR 49 -16.017 7.479 -9.943 368 HB THR 49 HB THR 49 -14.772 9.480 -9.022 369 HG1 THR 49 HG1 THR 49 -14.369 9.497 -6.947 370 HG21 THR 49 1HG2 THR 49 -16.764 10.762 -8.291 371 HG22 THR 49 2HG2 THR 49 -17.664 9.256 -8.098 372 HG23 THR 49 3HG2 THR 49 -17.132 9.768 -9.702 373 H ILE 50 H ILE 50 -14.438 6.668 -6.885 374 HA ILE 50 HA ILE 50 -11.782 6.591 -7.968 375 HB ILE 50 HB ILE 50 -12.840 5.643 -5.266 376 HG12 ILE 50 2HG1 ILE 50 -13.294 8.025 -5.580 377 HG13 ILE 50 3HG1 ILE 50 -11.967 7.856 -4.438 378 HG21 ILE 50 1HG2 ILE 50 -9.976 6.204 -6.119 379 HG22 ILE 50 2HG2 ILE 50 -10.659 4.620 -5.752 380 HG23 ILE 50 3HG2 ILE 50 -10.503 5.829 -4.478 381 HD11 ILE 50 1HD1 ILE 50 -10.374 8.399 -6.266 382 HD12 ILE 50 2HD1 ILE 50 -11.535 9.685 -5.943 383 HD13 ILE 50 3HD1 ILE 50 -11.747 8.648 -7.351 384 H LEU 51 H LEU 51 -14.180 4.143 -6.951 385 HA LEU 51 HA LEU 51 -12.579 1.860 -7.340 386 HB2 LEU 51 2HB LEU 51 -14.719 1.841 -6.063 387 HB3 LEU 51 3HB LEU 51 -15.611 2.062 -7.559 388 HG LEU 51 HG LEU 51 -14.848 -0.163 -8.361 389 HD11 LEU 51 1HD1 LEU 51 -12.666 -0.283 -7.267 390 HD12 LEU 51 2HD1 LEU 51 -13.627 -1.708 -6.892 391 HD13 LEU 51 3HD1 LEU 51 -13.438 -0.434 -5.686 392 HD21 LEU 51 1HD2 LEU 51 -16.092 -0.309 -5.589 393 HD22 LEU 51 2HD2 LEU 51 -16.143 -1.575 -6.821 394 HD23 LEU 51 3HD2 LEU 51 -16.960 -0.041 -7.104 395 H GLU 52 H GLU 52 -14.717 3.636 -9.551 396 HA GLU 52 HA GLU 52 -14.666 1.894 -11.769 397 HB2 GLU 52 2HB GLU 52 -16.253 3.827 -11.496 398 HB3 GLU 52 3HB GLU 52 -14.925 4.942 -11.795 399 HG2 GLU 52 2HG GLU 52 -14.635 3.992 -14.060 400 HG3 GLU 52 3HG GLU 52 -15.963 2.871 -13.763 401 H LYS 53 H LYS 53 -12.689 4.706 -10.917 402 HA LYS 53 HA LYS 53 -10.997 4.770 -13.152 403 HB2 LYS 53 2HB LYS 53 -10.567 5.753 -10.301 404 HB3 LYS 53 3HB LYS 53 -9.403 6.032 -11.589 405 HG2 LYS 53 2HG LYS 53 -11.178 7.260 -12.870 406 HG3 LYS 53 3HG LYS 53 -12.252 7.062 -11.485 407 HD2 LYS 53 2HD LYS 53 -11.263 9.284 -11.403 408 HD3 LYS 53 3HD LYS 53 -10.614 8.324 -10.070 409 HE2 LYS 53 2HE LYS 53 -8.842 9.639 -11.131 410 HE3 LYS 53 3HE LYS 53 -8.546 7.921 -11.384 411 HZ1 LYS 53 1HZ LYS 53 -9.836 9.702 -13.382 412 HZ2 LYS 53 2HZ LYS 53 -9.334 8.106 -13.618 413 HZ3 LYS 53 3HZ LYS 53 -8.187 9.326 -13.377 414 H VAL 54 H VAL 54 -10.512 3.226 -9.961 415 HA VAL 54 HA VAL 54 -7.874 2.313 -10.482 416 HB VAL 54 HB VAL 54 -9.885 1.469 -8.337 417 HG11 VAL 54 1HG1 VAL 54 -6.907 0.847 -8.443 418 HG12 VAL 54 2HG1 VAL 54 -8.215 -0.324 -8.618 419 HG13 VAL 54 3HG1 VAL 54 -7.983 0.514 -7.083 420 HG21 VAL 54 1HG2 VAL 54 -9.191 3.849 -8.226 421 HG22 VAL 54 2HG2 VAL 54 -7.497 3.360 -8.173 422 HG23 VAL 54 3HG2 VAL 54 -8.581 2.939 -6.844 423 H LEU 55 H LEU 55 -11.067 0.806 -10.899 424 HA LEU 55 HA LEU 55 -10.125 -1.822 -11.549 425 HB2 LEU 55 2HB LEU 55 -12.785 -0.433 -12.047 426 HB3 LEU 55 3HB LEU 55 -12.483 -2.082 -12.568 427 HG LEU 55 HG LEU 55 -12.525 -1.090 -9.689 428 HD11 LEU 55 1HD1 LEU 55 -14.517 -2.500 -9.448 429 HD12 LEU 55 2HD1 LEU 55 -14.426 -2.954 -11.151 430 HD13 LEU 55 3HD1 LEU 55 -14.753 -1.280 -10.698 431 HD21 LEU 55 1HD2 LEU 55 -12.210 -3.441 -9.009 432 HD22 LEU 55 2HD2 LEU 55 -10.821 -2.842 -9.910 433 HD23 LEU 55 3HD2 LEU 55 -11.986 -3.910 -10.698 434 H ASP 56 H ASP 56 -10.933 1.052 -13.479 435 HA ASP 56 HA ASP 56 -10.654 -0.243 -16.033 436 HB2 ASP 56 2HB ASP 56 -12.053 1.837 -15.596 437 HB3 ASP 56 3HB ASP 56 -10.559 2.762 -15.485 438 H TYR 57 H TYR 57 -8.512 1.609 -13.910 439 HA TYR 57 HA TYR 57 -6.219 1.772 -15.539 440 HB2 TYR 57 2HB TYR 57 -6.225 2.986 -13.433 441 HB3 TYR 57 3HB TYR 57 -6.499 1.518 -12.502 442 HD1 TYR 57 HD1 TYR 57 -4.615 -0.050 -12.051 443 HD2 TYR 57 HD2 TYR 57 -3.958 3.540 -14.280 444 HE1 TYR 57 HE1 TYR 57 -2.195 -0.359 -11.813 445 HE2 TYR 57 HE2 TYR 57 -1.530 3.225 -14.032 446 HH TYR 57 HH TYR 57 0.056 2.067 -12.685 447 H CYS 58 H CYS 58 -7.255 -0.671 -13.168 448 HA CYS 58 HA CYS 58 -5.185 -2.513 -13.509 449 HB2 CYS 58 2HB CYS 58 -8.053 -2.917 -12.574 450 HB3 CYS 58 3HB CYS 58 -6.814 -4.175 -12.494 451 HG CYS 58 HG CYS 58 -7.485 -1.885 -10.323 452 H ARG 59 H ARG 59 -8.172 -2.032 -15.352 453 HA ARG 59 HA ARG 59 -8.059 -4.360 -16.932 454 HB2 ARG 59 2HB ARG 59 -10.080 -3.096 -16.965 455 HB3 ARG 59 3HB ARG 59 -9.262 -1.625 -17.475 456 HG2 ARG 59 2HG ARG 59 -9.164 -2.282 -19.711 457 HG3 ARG 59 3HG ARG 59 -9.170 -4.003 -19.321 458 HD2 ARG 59 2HD ARG 59 -11.264 -3.123 -20.437 459 HD3 ARG 59 3HD ARG 59 -11.518 -4.016 -18.939 460 HE ARG 59 HE ARG 59 -11.533 -1.045 -19.050 461 HH11 ARG 59 1HH1 ARG 59 -13.027 -4.069 -18.002 462 HH12 ARG 59 2HH1 ARG 59 -14.281 -3.266 -17.110 463 HH21 ARG 59 1HH2 ARG 59 -13.202 -0.027 -17.901 464 HH22 ARG 59 2HH2 ARG 59 -14.383 -0.980 -17.054 465 H HIS 60 H HIS 60 -6.665 -1.110 -17.518 466 HA HIS 60 HA HIS 60 -5.345 -1.738 -19.946 467 HB2 HIS 60 2HB HIS 60 -5.703 0.600 -19.229 468 HB3 HIS 60 3HB HIS 60 -4.615 0.371 -17.859 469 HD1 HIS 60 HD1 HIS 60 -2.437 1.517 -18.354 470 HD2 HIS 60 HD2 HIS 60 -4.050 -0.253 -21.753 471 HE1 HIS 60 HE1 HIS 60 -0.716 1.796 -20.158 472 HE2 HIS 60 HE2 HIS 60 -1.763 0.828 -22.214 473 H HIS 61 H HIS 61 -4.331 -1.989 -16.569 474 HA HIS 61 HA HIS 61 -1.602 -2.675 -17.025 475 HB2 HIS 61 2HB HIS 61 -2.520 -1.680 -14.890 476 HB3 HIS 61 3HB HIS 61 -3.312 -3.216 -14.551 477 HD1 HIS 61 HD1 HIS 61 -1.739 -5.240 -13.929 478 HD2 HIS 61 HD2 HIS 61 0.201 -1.590 -14.330 479 HE1 HIS 61 HE1 HIS 61 0.549 -5.593 -12.992 480 HE2 HIS 61 HE2 HIS 61 1.776 -3.460 -13.475 481 H HIS 62 H HIS 62 -4.564 -4.505 -16.950 482 HA HIS 62 HA HIS 62 -3.324 -7.105 -16.652 483 HB2 HIS 62 2HB HIS 62 -5.640 -6.661 -15.861 484 HB3 HIS 62 3HB HIS 62 -6.155 -6.353 -17.516 485 HD1 HIS 62 HD1 HIS 62 -5.059 -9.140 -15.233 486 HD2 HIS 62 HD2 HIS 62 -6.704 -8.649 -19.016 487 HE1 HIS 62 HE1 HIS 62 -5.775 -11.427 -15.966 488 HE2 HIS 62 HE2 HIS 62 -6.692 -11.118 -18.279 489 H GLN 63 H GLN 63 -4.574 -5.088 -19.276 490 HA GLN 63 HA GLN 63 -4.227 -6.989 -21.386 491 HB2 GLN 63 2HB GLN 63 -4.451 -3.949 -21.550 492 HB3 GLN 63 3HB GLN 63 -4.584 -5.053 -22.912 493 HG2 GLN 63 2HG GLN 63 -6.511 -4.784 -20.594 494 HG3 GLN 63 3HG GLN 63 -6.792 -4.332 -22.272 495 HE21 GLN 63 1HE2 GLN 63 -7.079 -6.004 -23.822 496 HE22 GLN 63 2HE2 GLN 63 -7.557 -7.595 -23.348 497 H HIS 64 H HIS 64 -2.190 -4.552 -19.905 498 HA HIS 64 HA HIS 64 0.130 -5.561 -21.441 499 HB2 HIS 64 2HB HIS 64 -0.366 -2.676 -20.554 500 HB3 HIS 64 3HB HIS 64 1.144 -3.267 -21.238 501 HD1 HIS 64 HD1 HIS 64 1.270 -3.510 -23.770 502 HD2 HIS 64 HD2 HIS 64 -2.530 -2.475 -22.441 503 HE1 HIS 64 HE1 HIS 64 -0.026 -2.916 -25.831 504 HE2 HIS 64 HE2 HIS 64 -2.350 -2.430 -25.025 505 HA PRO 65 HA PRO 65 0.634 -6.468 -16.895 506 HB2 PRO 65 2HB PRO 65 2.213 -8.792 -17.936 507 HB3 PRO 65 3HB PRO 65 0.838 -8.776 -16.810 508 HG2 PRO 65 2HG PRO 65 0.558 -9.695 -19.308 509 HG3 PRO 65 3HG PRO 65 -0.749 -8.781 -18.515 510 HD2 PRO 65 2HD PRO 65 1.281 -7.805 -20.533 511 HD3 PRO 65 3HD PRO 65 -0.475 -7.516 -20.468 512 H GLY 66 H GLY 66 1.976 -4.703 -16.565 513 HA2 GLY 66 2HA GLY 66 4.789 -5.229 -16.271 514 HA3 GLY 66 3HA GLY 66 4.452 -4.072 -17.560 515 H GLY 67 H GLY 67 5.912 -3.494 -15.198 516 HA2 GLY 67 2HA GLY 67 4.583 -1.099 -14.317 517 HA3 GLY 67 3HA GLY 67 4.625 -2.327 -13.053 518 H SER 68 H SER 68 6.370 -2.362 -11.796 519 HA SER 68 HA SER 68 8.434 -2.078 -10.913 520 HB2 SER 68 2HB SER 68 9.343 -2.179 -13.817 521 HB3 SER 68 3HB SER 68 10.403 -2.348 -12.415 522 HG SER 68 HG SER 68 9.844 -4.351 -12.304 523 H GLY 69 H GLY 69 6.877 0.374 -12.133 524 HA2 GLY 69 2HA GLY 69 7.123 2.630 -12.438 525 HA3 GLY 69 3HA GLY 69 8.435 2.511 -11.274 526 H LEU 70 H LEU 70 8.209 1.079 -14.536 527 HA LEU 70 HA LEU 70 10.804 1.893 -15.345 528 HB2 LEU 70 2HB LEU 70 8.442 1.009 -17.054 529 HB3 LEU 70 3HB LEU 70 10.089 1.180 -17.647 530 HG LEU 70 HG LEU 70 9.129 -0.817 -15.577 531 HD11 LEU 70 1HD1 LEU 70 9.642 -2.536 -17.261 532 HD12 LEU 70 2HD1 LEU 70 10.049 -1.278 -18.431 533 HD13 LEU 70 3HD1 LEU 70 8.398 -1.422 -17.825 534 HD21 LEU 70 1HD2 LEU 70 11.404 -1.777 -15.653 535 HD22 LEU 70 2HD2 LEU 70 11.399 -0.131 -15.027 536 HD23 LEU 70 3HD2 LEU 70 11.928 -0.441 -16.683 537 H ASP 71 H ASP 71 11.475 3.515 -16.720 538 HA ASP 71 HA ASP 71 10.035 5.988 -16.595 539 HB2 ASP 71 2HB ASP 71 12.516 5.842 -16.378 540 HB3 ASP 71 3HB ASP 71 12.630 5.297 -18.047 541 H ASP 72 H ASP 72 8.161 5.214 -17.707 542 HA ASP 72 HA ASP 72 8.171 5.925 -20.554 543 HB2 ASP 72 2HB ASP 72 8.261 3.465 -20.577 544 HB3 ASP 72 3HB ASP 72 6.936 3.366 -19.421 545 H ILE 73 H ILE 73 6.029 4.698 -17.975 546 HA ILE 73 HA ILE 73 3.948 5.207 -17.278 547 HB ILE 73 HB ILE 73 5.041 8.067 -17.339 548 HG12 ILE 73 2HG1 ILE 73 5.287 7.640 -14.780 549 HG13 ILE 73 3HG1 ILE 73 5.078 5.935 -15.147 550 HG21 ILE 73 1HG2 ILE 73 3.284 8.616 -15.673 551 HG22 ILE 73 2HG2 ILE 73 2.625 6.986 -15.831 552 HG23 ILE 73 3HG2 ILE 73 2.583 8.090 -17.205 553 HD11 ILE 73 1HD1 ILE 73 7.305 7.691 -16.178 554 HD12 ILE 73 2HD1 ILE 73 7.121 5.959 -16.467 555 HD13 ILE 73 3HD1 ILE 73 7.416 6.555 -14.835 556 HA PRO 74 HA PRO 74 2.405 5.806 -21.605 557 HB2 PRO 74 2HB PRO 74 0.022 4.325 -20.500 558 HB3 PRO 74 3HB PRO 74 0.988 3.985 -21.954 559 HG2 PRO 74 2HG PRO 74 1.234 2.452 -19.789 560 HG3 PRO 74 3HG PRO 74 2.667 2.890 -20.754 561 HD2 PRO 74 2HD PRO 74 1.722 4.065 -18.138 562 HD3 PRO 74 3HD PRO 74 3.371 3.622 -18.647 563 HA PRO 75 HA PRO 75 0.150 9.624 -21.248 564 HB2 PRO 75 2HB PRO 75 -1.567 8.473 -23.473 565 HB3 PRO 75 3HB PRO 75 -0.822 10.084 -23.343 566 HG2 PRO 75 2HG PRO 75 0.316 8.261 -24.876 567 HG3 PRO 75 3HG PRO 75 1.325 9.291 -23.833 568 HD2 PRO 75 2HD PRO 75 0.567 6.411 -23.475 569 HD3 PRO 75 3HD PRO 75 2.081 7.242 -23.055 570 H TYR 76 H TYR 76 -1.958 6.733 -21.546 571 HA TYR 76 HA TYR 76 -4.311 7.770 -20.440 572 HB2 TYR 76 2HB TYR 76 -4.506 5.605 -21.443 573 HB3 TYR 76 3HB TYR 76 -3.186 4.940 -20.485 574 HD1 TYR 76 HD1 TYR 76 -6.643 6.403 -20.035 575 HD2 TYR 76 HD2 TYR 76 -3.737 3.611 -18.591 576 HE1 TYR 76 HE1 TYR 76 -8.234 5.602 -18.340 577 HE2 TYR 76 HE2 TYR 76 -5.337 2.816 -16.907 578 HH TYR 76 HH TYR 76 -8.595 3.530 -16.952 579 H ASP 77 H ASP 77 -1.661 6.030 -18.842 580 HA ASP 77 HA ASP 77 -2.816 6.118 -16.218 581 HB2 ASP 77 2HB ASP 77 0.076 5.459 -16.959 582 HB3 ASP 77 3HB ASP 77 -0.802 4.940 -15.517 583 H ARG 78 H ARG 78 -0.656 8.119 -18.037 584 HA ARG 78 HA ARG 78 0.586 9.556 -15.927 585 HB2 ARG 78 2HB ARG 78 1.344 9.345 -18.386 586 HB3 ARG 78 3HB ARG 78 0.143 10.573 -18.771 587 HG2 ARG 78 2HG ARG 78 1.292 12.174 -17.293 588 HG3 ARG 78 3HG ARG 78 2.466 10.930 -16.850 589 HD2 ARG 78 2HD ARG 78 2.056 12.110 -19.616 590 HD3 ARG 78 3HD ARG 78 3.406 12.438 -18.531 591 HE ARG 78 HE ARG 78 3.476 9.724 -18.895 592 HH11 ARG 78 1HH1 ARG 78 3.530 12.456 -21.129 593 HH12 ARG 78 2HH1 ARG 78 4.476 11.615 -22.319 594 HH21 ARG 78 1HH2 ARG 78 4.726 8.646 -20.457 595 HH22 ARG 78 2HH2 ARG 78 5.149 9.459 -21.934 596 H ASP 79 H ASP 79 -2.130 10.350 -18.123 597 HA ASP 79 HA ASP 79 -2.932 12.709 -16.660 598 HB2 ASP 79 2HB ASP 79 -4.299 11.187 -18.913 599 HB3 ASP 79 3HB ASP 79 -4.956 12.657 -18.199 600 H PHE 80 H PHE 80 -3.689 9.341 -16.475 601 HA PHE 80 HA PHE 80 -6.155 9.346 -15.121 602 HB2 PHE 80 2HB PHE 80 -5.261 7.268 -15.999 603 HB3 PHE 80 3HB PHE 80 -3.789 7.420 -15.058 604 HD1 PHE 80 HD1 PHE 80 -7.359 6.522 -14.942 605 HD2 PHE 80 HD2 PHE 80 -3.721 6.763 -12.714 606 HE1 PHE 80 HE1 PHE 80 -8.346 5.176 -13.154 607 HE2 PHE 80 HE2 PHE 80 -4.721 5.424 -10.931 608 HZ PHE 80 HZ PHE 80 -7.040 4.622 -11.142 609 H CYS 81 H CYS 81 -2.822 9.410 -13.903 610 HA CYS 81 HA CYS 81 -3.546 9.555 -11.125 611 HB2 CYS 81 2HB CYS 81 -0.878 9.974 -12.524 612 HB3 CYS 81 3HB CYS 81 -1.095 9.823 -10.781 613 HG CYS 81 HG CYS 81 -1.953 7.348 -12.979 614 H LYS 82 H LYS 82 -3.384 11.909 -13.624 615 HA LYS 82 HA LYS 82 -2.890 14.208 -11.943 616 HB2 LYS 82 2HB LYS 82 -4.110 14.023 -14.733 617 HB3 LYS 82 3HB LYS 82 -3.694 15.531 -13.921 618 HG2 LYS 82 2HG LYS 82 -1.319 14.904 -13.930 619 HG3 LYS 82 3HG LYS 82 -1.724 13.357 -14.686 620 HD2 LYS 82 2HD LYS 82 -2.715 14.678 -16.626 621 HD3 LYS 82 3HD LYS 82 -2.030 16.132 -15.896 622 HE2 LYS 82 2HE LYS 82 0.230 15.219 -16.145 623 HE3 LYS 82 3HE LYS 82 -0.429 13.702 -16.771 624 HZ1 LYS 82 1HZ LYS 82 0.305 15.067 -18.580 625 HZ2 LYS 82 2HZ LYS 82 -0.626 16.374 -18.056 626 HZ3 LYS 82 3HZ LYS 82 -1.385 14.978 -18.633 627 H VAL 83 H VAL 83 -4.352 13.733 -10.256 628 HA VAL 83 HA VAL 83 -7.131 14.627 -10.737 629 HB VAL 83 HB VAL 83 -7.891 13.078 -8.894 630 HG11 VAL 83 1HG1 VAL 83 -7.977 11.015 -10.245 631 HG12 VAL 83 2HG1 VAL 83 -6.723 11.651 -11.310 632 HG13 VAL 83 3HG1 VAL 83 -8.296 12.446 -11.230 633 HG21 VAL 83 1HG2 VAL 83 -6.469 11.145 -8.242 634 HG22 VAL 83 2HG2 VAL 83 -5.738 12.680 -7.772 635 HG23 VAL 83 3HG2 VAL 83 -5.134 11.815 -9.186 636 H ASP 84 H ASP 84 -8.113 15.201 -8.469 637 HA ASP 84 HA ASP 84 -6.648 17.419 -7.477 638 HB2 ASP 84 2HB ASP 84 -9.283 16.841 -7.525 639 HB3 ASP 84 3HB ASP 84 -8.964 16.254 -5.900 640 H GLN 85 H GLN 85 -6.109 17.729 -5.094 641 HA GLN 85 HA GLN 85 -4.089 15.894 -4.462 642 HB2 GLN 85 2HB GLN 85 -3.930 18.302 -3.903 643 HB3 GLN 85 3HB GLN 85 -5.197 18.117 -2.694 644 HG2 GLN 85 2HG GLN 85 -2.977 18.186 -1.645 645 HG3 GLN 85 3HG GLN 85 -3.753 16.624 -1.379 646 HE21 GLN 85 1HE2 GLN 85 -1.866 15.501 -1.053 647 HE22 GLN 85 2HE2 GLN 85 -0.691 15.217 -2.274 648 HA PRO 86 HA PRO 86 -6.936 14.183 -0.780 649 HB2 PRO 86 2HB PRO 86 -9.653 14.857 -1.918 650 HB3 PRO 86 3HB PRO 86 -9.107 14.823 -0.224 651 HG2 PRO 86 2HG PRO 86 -9.479 17.147 -1.433 652 HG3 PRO 86 3HG PRO 86 -8.075 16.915 -0.362 653 HD2 PRO 86 2HD PRO 86 -8.175 16.875 -3.379 654 HD3 PRO 86 3HD PRO 86 -6.984 17.638 -2.295 655 H THR 87 H THR 87 -7.998 14.288 -4.156 656 HA THR 87 HA THR 87 -9.225 11.729 -4.287 657 HB THR 87 HB THR 87 -8.084 13.306 -6.636 658 HG1 THR 87 HG1 THR 87 -10.216 13.839 -4.924 659 HG21 THR 87 1HG2 THR 87 -8.952 11.039 -7.203 660 HG22 THR 87 2HG2 THR 87 -9.944 12.319 -7.908 661 HG23 THR 87 3HG2 THR 87 -10.501 11.457 -6.471 662 H LEU 88 H LEU 88 -5.918 12.856 -4.834 663 HA LEU 88 HA LEU 88 -4.678 10.555 -5.845 664 HB2 LEU 88 2HB LEU 88 -3.682 12.704 -3.936 665 HB3 LEU 88 3HB LEU 88 -2.622 11.446 -4.553 666 HG LEU 88 HG LEU 88 -4.112 13.368 -6.388 667 HD11 LEU 88 1HD1 LEU 88 -1.273 13.637 -5.344 668 HD12 LEU 88 2HD1 LEU 88 -2.637 14.677 -4.931 669 HD13 LEU 88 3HD1 LEU 88 -2.027 14.647 -6.582 670 HD21 LEU 88 1HD2 LEU 88 -2.455 12.639 -8.058 671 HD22 LEU 88 2HD2 LEU 88 -3.371 11.267 -7.440 672 HD23 LEU 88 3HD2 LEU 88 -1.721 11.550 -6.878 673 H PHE 89 H PHE 89 -5.322 11.523 -2.487 674 HA PHE 89 HA PHE 89 -4.236 9.205 -1.236 675 HB2 PHE 89 2HB PHE 89 -6.212 11.274 -0.178 676 HB3 PHE 89 3HB PHE 89 -5.447 10.035 0.812 677 HD1 PHE 89 HD1 PHE 89 -2.786 9.973 0.678 678 HD2 PHE 89 HD2 PHE 89 -5.168 13.395 -0.269 679 HE1 PHE 89 HE1 PHE 89 -0.857 11.439 1.086 680 HE2 PHE 89 HE2 PHE 89 -3.231 14.854 0.143 681 HZ PHE 89 HZ PHE 89 -1.075 13.877 0.818 682 H GLU 90 H GLU 90 -7.428 9.996 -2.500 683 HA GLU 90 HA GLU 90 -8.893 7.824 -1.441 684 HB2 GLU 90 2HB GLU 90 -9.262 9.307 -4.075 685 HB3 GLU 90 3HB GLU 90 -10.436 8.191 -3.395 686 HG2 GLU 90 2HG GLU 90 -9.539 10.784 -2.122 687 HG3 GLU 90 3HG GLU 90 -11.036 10.548 -3.016 688 H LEU 91 H LEU 91 -6.955 8.145 -4.412 689 HA LEU 91 HA LEU 91 -7.404 5.542 -5.461 690 HB2 LEU 91 2HB LEU 91 -5.030 7.411 -5.864 691 HB3 LEU 91 3HB LEU 91 -5.345 5.980 -6.830 692 HG LEU 91 HG LEU 91 -7.099 8.475 -6.737 693 HD11 LEU 91 1HD1 LEU 91 -5.298 7.475 -8.971 694 HD12 LEU 91 2HD1 LEU 91 -4.989 8.871 -7.934 695 HD13 LEU 91 3HD1 LEU 91 -6.360 8.886 -9.039 696 HD21 LEU 91 1HD2 LEU 91 -8.459 6.463 -7.101 697 HD22 LEU 91 2HD2 LEU 91 -7.425 5.992 -8.451 698 HD23 LEU 91 3HD2 LEU 91 -8.400 7.460 -8.553 699 H ILE 92 H ILE 92 -5.025 6.856 -3.192 700 HA ILE 92 HA ILE 92 -3.421 4.535 -2.838 701 HB ILE 92 HB ILE 92 -3.910 6.913 -0.973 702 HG12 ILE 92 2HG1 ILE 92 -1.570 6.323 -2.856 703 HG13 ILE 92 3HG1 ILE 92 -2.850 7.490 -3.162 704 HG21 ILE 92 1HG2 ILE 92 -1.750 4.784 -0.727 705 HG22 ILE 92 2HG2 ILE 92 -3.112 5.012 0.370 706 HG23 ILE 92 3HG2 ILE 92 -1.861 6.248 0.252 707 HD11 ILE 92 1HD1 ILE 92 -0.840 8.604 -2.443 708 HD12 ILE 92 2HD1 ILE 92 -0.789 7.646 -0.965 709 HD13 ILE 92 3HD1 ILE 92 -2.097 8.802 -1.225 710 H LEU 93 H LEU 93 -6.362 5.722 -1.203 711 HA LEU 93 HA LEU 93 -6.504 3.796 0.875 712 HB2 LEU 93 2HB LEU 93 -8.645 5.543 -0.410 713 HB3 LEU 93 3HB LEU 93 -9.006 4.462 0.924 714 HG LEU 93 HG LEU 93 -7.089 6.832 1.040 715 HD11 LEU 93 1HD1 LEU 93 -9.839 6.504 2.292 716 HD12 LEU 93 2HD1 LEU 93 -9.428 7.558 0.937 717 HD13 LEU 93 3HD1 LEU 93 -8.746 7.872 2.534 718 HD21 LEU 93 1HD2 LEU 93 -6.335 5.030 2.524 719 HD22 LEU 93 2HD2 LEU 93 -7.932 4.954 3.270 720 HD23 LEU 93 3HD2 LEU 93 -6.939 6.402 3.452 721 H ALA 94 H ALA 94 -7.975 3.926 -2.364 722 HA ALA 94 HA ALA 94 -9.456 1.495 -2.207 723 HB1 ALA 94 1HB ALA 94 -10.021 3.294 -3.788 724 HB2 ALA 94 2HB ALA 94 -9.755 1.772 -4.638 725 HB3 ALA 94 3HB ALA 94 -8.511 3.027 -4.661 726 H ALA 95 H ALA 95 -6.199 2.293 -3.325 727 HA ALA 95 HA ALA 95 -5.565 -0.221 -4.517 728 HB1 ALA 95 1HB ALA 95 -4.365 1.874 -5.028 729 HB2 ALA 95 2HB ALA 95 -3.270 0.578 -4.549 730 HB3 ALA 95 3HB ALA 95 -3.672 1.869 -3.409 731 H ASN 96 H ASN 96 -5.105 1.129 -1.261 732 HA ASN 96 HA ASN 96 -3.682 -1.107 -0.154 733 HB2 ASN 96 2HB ASN 96 -3.528 1.156 0.838 734 HB3 ASN 96 3HB ASN 96 -5.250 1.151 1.193 735 HD21 ASN 96 1HD2 ASN 96 -4.850 1.519 3.401 736 HD22 ASN 96 2HD2 ASN 96 -4.241 0.294 4.452 737 H TYR 97 H TYR 97 -7.050 -0.182 -0.468 738 HA TYR 97 HA TYR 97 -8.203 -2.063 1.335 739 HB2 TYR 97 2HB TYR 97 -9.340 0.033 0.699 740 HB3 TYR 97 3HB TYR 97 -9.454 -0.506 -0.970 741 HD1 TYR 97 HD1 TYR 97 -11.574 -1.321 -1.625 742 HD2 TYR 97 HD2 TYR 97 -10.403 -1.759 2.464 743 HE1 TYR 97 HE1 TYR 97 -13.758 -2.320 -1.112 744 HE2 TYR 97 HE2 TYR 97 -12.587 -2.759 2.975 745 HH TYR 97 HH TYR 97 -14.848 -2.812 2.104 746 H LEU 98 H LEU 98 -7.607 -2.090 -2.169 747 HA LEU 98 HA LEU 98 -8.731 -4.804 -2.434 748 HB2 LEU 98 2HB LEU 98 -7.862 -2.813 -4.561 749 HB3 LEU 98 3HB LEU 98 -8.552 -4.396 -4.887 750 HG LEU 98 HG LEU 98 -9.993 -2.087 -3.520 751 HD11 LEU 98 1HD1 LEU 98 -9.685 -1.679 -5.910 752 HD12 LEU 98 2HD1 LEU 98 -11.379 -1.997 -5.550 753 HD13 LEU 98 3HD1 LEU 98 -10.389 -3.252 -6.297 754 HD21 LEU 98 1HD2 LEU 98 -11.047 -4.844 -4.240 755 HD22 LEU 98 2HD2 LEU 98 -12.019 -3.497 -3.640 756 HD23 LEU 98 3HD2 LEU 98 -10.782 -4.214 -2.611 757 H ASP 99 H ASP 99 -5.850 -3.471 -1.693 758 HA ASP 99 HA ASP 99 -3.670 -3.946 -1.760 759 HB2 ASP 99 2HB ASP 99 -4.603 -6.008 -0.590 760 HB3 ASP 99 3HB ASP 99 -4.499 -6.854 -2.132 761 H ILE 100 H ILE 100 -4.647 -3.061 -4.175 762 HA ILE 100 HA ILE 100 -3.252 -4.494 -6.310 763 HB ILE 100 HB ILE 100 -4.581 -1.746 -6.473 764 HG12 ILE 100 2HG1 ILE 100 -5.801 -4.464 -7.154 765 HG13 ILE 100 3HG1 ILE 100 -6.207 -3.498 -5.741 766 HG21 ILE 100 1HG2 ILE 100 -4.620 -2.161 -8.914 767 HG22 ILE 100 2HG2 ILE 100 -3.836 -3.723 -8.672 768 HG23 ILE 100 3HG2 ILE 100 -2.968 -2.236 -8.295 769 HD11 ILE 100 1HD1 ILE 100 -6.691 -2.714 -8.607 770 HD12 ILE 100 2HD1 ILE 100 -7.091 -1.747 -7.187 771 HD13 ILE 100 3HD1 ILE 100 -7.889 -3.292 -7.453 772 H LYS 101 H LYS 101 -1.199 -4.442 -5.424 773 HA LYS 101 HA LYS 101 0.264 -2.214 -4.580 774 HB2 LYS 101 2HB LYS 101 1.480 -4.669 -5.917 775 HB3 LYS 101 3HB LYS 101 2.252 -3.591 -4.759 776 HG2 LYS 101 2HG LYS 101 0.609 -4.365 -3.022 777 HG3 LYS 101 3HG LYS 101 -0.025 -5.518 -4.199 778 HD2 LYS 101 2HD LYS 101 2.392 -6.426 -4.373 779 HD3 LYS 101 3HD LYS 101 2.739 -5.466 -2.935 780 HE2 LYS 101 2HE LYS 101 0.744 -7.738 -3.165 781 HE3 LYS 101 3HE LYS 101 2.270 -7.756 -2.287 782 HZ1 LYS 101 1HZ LYS 101 1.311 -5.911 -0.922 783 HZ2 LYS 101 2HZ LYS 101 0.606 -7.430 -0.712 784 HZ3 LYS 101 3HZ LYS 101 -0.187 -6.255 -1.632 785 HA PRO 102 HA PRO 102 1.696 -1.890 -9.484 786 HB2 PRO 102 2HB PRO 102 -1.209 -2.328 -10.274 787 HB3 PRO 102 3HB PRO 102 0.267 -2.550 -11.248 788 HG2 PRO 102 2HG PRO 102 -0.920 -4.662 -10.197 789 HG3 PRO 102 3HG PRO 102 0.855 -4.531 -10.162 790 HD2 PRO 102 2HD PRO 102 -1.109 -4.180 -7.930 791 HD3 PRO 102 3HD PRO 102 0.555 -4.805 -7.884 792 H LEU 103 H LEU 103 -1.680 -1.023 -8.573 793 HA LEU 103 HA LEU 103 -1.553 1.589 -9.714 794 HB2 LEU 103 2HB LEU 103 -3.661 0.275 -9.461 795 HB3 LEU 103 3HB LEU 103 -3.579 0.464 -7.724 796 HG LEU 103 HG LEU 103 -5.216 1.985 -9.134 797 HD11 LEU 103 1HD1 LEU 103 -5.056 3.861 -7.562 798 HD12 LEU 103 2HD1 LEU 103 -3.486 3.273 -7.007 799 HD13 LEU 103 3HD1 LEU 103 -4.936 2.305 -6.741 800 HD21 LEU 103 1HD2 LEU 103 -4.282 4.118 -9.895 801 HD22 LEU 103 2HD2 LEU 103 -3.595 2.771 -10.792 802 HD23 LEU 103 3HD2 LEU 103 -2.650 3.560 -9.527 803 H LEU 104 H LEU 104 -1.255 0.296 -6.441 804 HA LEU 104 HA LEU 104 -1.149 2.672 -4.972 805 HB2 LEU 104 2HB LEU 104 -1.405 0.397 -4.001 806 HB3 LEU 104 3HB LEU 104 0.263 0.034 -4.413 807 HG LEU 104 HG LEU 104 1.028 1.800 -2.815 808 HD11 LEU 104 1HD1 LEU 104 -0.901 3.306 -2.900 809 HD12 LEU 104 2HD1 LEU 104 -0.561 2.830 -1.240 810 HD13 LEU 104 3HD1 LEU 104 -1.913 2.094 -2.106 811 HD21 LEU 104 1HD2 LEU 104 0.849 -0.538 -2.075 812 HD22 LEU 104 2HD2 LEU 104 -0.821 -0.264 -1.568 813 HD23 LEU 104 3HD2 LEU 104 0.501 0.578 -0.757 814 H ASP 105 H ASP 105 1.394 0.822 -6.588 815 HA ASP 105 HA ASP 105 3.619 2.288 -5.582 816 HB2 ASP 105 2HB ASP 105 3.749 -0.073 -6.416 817 HB3 ASP 105 3HB ASP 105 3.468 0.502 -8.059 818 H VAL 106 H VAL 106 1.788 2.397 -8.640 819 HA VAL 106 HA VAL 106 3.405 4.387 -9.901 820 HB VAL 106 HB VAL 106 0.588 3.393 -10.521 821 HG11 VAL 106 1HG1 VAL 106 0.798 5.666 -11.455 822 HG12 VAL 106 2HG1 VAL 106 0.790 4.466 -12.745 823 HG13 VAL 106 3HG1 VAL 106 2.309 5.222 -12.255 824 HG21 VAL 106 1HG2 VAL 106 2.367 1.709 -10.777 825 HG22 VAL 106 2HG2 VAL 106 3.260 2.787 -11.852 826 HG23 VAL 106 3HG2 VAL 106 1.689 2.153 -12.344 827 H THR 107 H THR 107 0.443 4.558 -7.922 828 HA THR 107 HA THR 107 0.024 7.377 -8.223 829 HB THR 107 HB THR 107 -0.939 5.532 -5.974 830 HG1 THR 107 HG1 THR 107 -1.602 5.065 -8.230 831 HG21 THR 107 1HG2 THR 107 -1.978 8.267 -6.842 832 HG22 THR 107 2HG2 THR 107 -1.123 7.925 -5.338 833 HG23 THR 107 3HG2 THR 107 -2.717 7.228 -5.622 834 H CYS 108 H CYS 108 1.808 5.354 -5.930 835 HA CYS 108 HA CYS 108 2.677 7.422 -4.172 836 HB2 CYS 108 2HB CYS 108 3.784 4.634 -4.686 837 HB3 CYS 108 3HB CYS 108 4.392 5.708 -3.426 838 HG CYS 108 HG CYS 108 1.084 4.911 -3.482 839 H LYS 109 H LYS 109 3.908 6.123 -7.221 840 HA LYS 109 HA LYS 109 6.422 7.480 -7.206 841 HB2 LYS 109 2HB LYS 109 4.901 5.848 -9.160 842 HB3 LYS 109 3HB LYS 109 5.720 7.189 -9.940 843 HG2 LYS 109 2HG LYS 109 7.158 5.296 -10.072 844 HG3 LYS 109 3HG LYS 109 7.873 6.401 -8.897 845 HD2 LYS 109 2HD LYS 109 6.963 5.002 -7.054 846 HD3 LYS 109 3HD LYS 109 6.255 3.909 -8.247 847 HE2 LYS 109 2HE LYS 109 8.558 3.433 -9.112 848 HE3 LYS 109 3HE LYS 109 9.213 4.438 -7.815 849 HZ1 LYS 109 1HZ LYS 109 7.588 1.978 -7.447 850 HZ2 LYS 109 2HZ LYS 109 8.223 2.927 -6.204 851 HZ3 LYS 109 3HZ LYS 109 9.261 2.093 -7.243 852 H THR 110 H THR 110 3.215 8.242 -8.596 853 HA THR 110 HA THR 110 3.848 10.620 -9.922 854 HB THR 110 HB THR 110 1.189 9.821 -8.650 855 HG1 THR 110 HG1 THR 110 1.237 8.404 -10.213 856 HG21 THR 110 1HG2 THR 110 0.129 11.355 -10.283 857 HG22 THR 110 2HG2 THR 110 1.715 11.874 -10.849 858 HG23 THR 110 3HG2 THR 110 1.202 12.250 -9.204 859 H VAL 111 H VAL 111 2.501 10.196 -6.620 860 HA VAL 111 HA VAL 111 2.432 12.954 -5.976 861 HB VAL 111 HB VAL 111 2.086 12.267 -3.619 862 HG11 VAL 111 1HG1 VAL 111 0.151 12.299 -5.140 863 HG12 VAL 111 2HG1 VAL 111 -0.029 11.033 -3.928 864 HG13 VAL 111 3HG1 VAL 111 0.441 10.612 -5.577 865 HG21 VAL 111 1HG2 VAL 111 1.988 9.860 -2.999 866 HG22 VAL 111 2HG2 VAL 111 3.613 10.356 -3.473 867 HG23 VAL 111 3HG2 VAL 111 2.613 9.433 -4.595 868 H ALA 112 H ALA 112 4.916 10.467 -5.594 869 HA ALA 112 HA ALA 112 6.780 11.997 -4.085 870 HB1 ALA 112 1HB ALA 112 6.943 9.551 -4.262 871 HB2 ALA 112 2HB ALA 112 8.441 10.320 -4.788 872 HB3 ALA 112 3HB ALA 112 7.304 9.685 -5.982 873 H ASN 113 H ASN 113 6.155 11.663 -7.571 874 HA ASN 113 HA ASN 113 8.527 13.003 -8.456 875 HB2 ASN 113 2HB ASN 113 5.916 12.419 -9.936 876 HB3 ASN 113 3HB ASN 113 7.340 13.126 -10.700 877 HD21 ASN 113 1HD2 ASN 113 5.985 10.611 -11.307 878 HD22 ASN 113 2HD2 ASN 113 7.175 9.373 -11.134 879 H MET 114 H MET 114 5.377 14.122 -7.430 880 HA MET 114 HA MET 114 5.545 16.748 -8.618 881 HB2 MET 114 2HB MET 114 3.803 15.807 -6.296 882 HB3 MET 114 3HB MET 114 3.609 17.318 -7.172 883 HG2 MET 114 2HG MET 114 3.154 15.960 -9.246 884 HG3 MET 114 3HG MET 114 3.157 14.524 -8.226 885 HE1 MET 114 1HE MET 114 1.387 14.384 -5.989 886 HE2 MET 114 2HE MET 114 0.126 15.587 -5.754 887 HE3 MET 114 3HE MET 114 1.816 16.036 -5.546 888 H ILE 115 H ILE 115 6.095 15.416 -5.351 889 HA ILE 115 HA ILE 115 6.800 17.979 -4.203 890 HB ILE 115 HB ILE 115 7.236 16.689 -2.104 891 HG12 ILE 115 2HG1 ILE 115 6.613 14.266 -3.857 892 HG13 ILE 115 3HG1 ILE 115 8.128 14.601 -3.033 893 HG21 ILE 115 1HG2 ILE 115 4.948 17.487 -2.610 894 HG22 ILE 115 2HG2 ILE 115 4.907 15.973 -1.709 895 HG23 ILE 115 3HG2 ILE 115 4.598 15.970 -3.446 896 HD11 ILE 115 1HD1 ILE 115 6.868 12.863 -1.932 897 HD12 ILE 115 2HD1 ILE 115 5.505 13.957 -1.705 898 HD13 ILE 115 3HD1 ILE 115 7.036 14.272 -0.890 899 H ARG 116 H ARG 116 8.584 15.221 -5.471 900 HA ARG 116 HA ARG 116 11.200 16.252 -4.638 901 HB2 ARG 116 2HB ARG 116 10.442 13.831 -6.343 902 HB3 ARG 116 3HB ARG 116 12.089 14.255 -5.887 903 HG2 ARG 116 2HG ARG 116 11.533 13.890 -3.508 904 HG3 ARG 116 3HG ARG 116 9.874 13.487 -3.959 905 HD2 ARG 116 2HD ARG 116 10.619 11.520 -5.175 906 HD3 ARG 116 3HD ARG 116 12.312 11.961 -4.945 907 HE ARG 116 HE ARG 116 10.537 11.216 -2.692 908 HH11 ARG 116 1HH1 ARG 116 13.606 10.862 -4.394 909 HH12 ARG 116 2HH1 ARG 116 14.265 9.791 -3.197 910 HH21 ARG 116 1HH2 ARG 116 11.437 9.770 -1.171 911 HH22 ARG 116 2HH2 ARG 116 13.052 9.179 -1.392 912 H GLY 117 H GLY 117 9.024 16.657 -7.243 913 HA2 GLY 117 2HA GLY 117 10.903 17.103 -9.373 914 HA3 GLY 117 3HA GLY 117 9.190 17.494 -9.378 915 H1 SER 2 1H SER 2 16.736 -13.839 17.527 916 H2 SER 2 2H SER 2 17.192 -12.837 18.803 917 H3 SER 2 3H SER 2 17.889 -14.367 18.638 918 HA SER 2 HA SER 2 19.376 -12.611 17.951 919 HB2 SER 2 2HB SER 2 18.459 -14.358 15.634 920 HB3 SER 2 3HB SER 2 20.065 -13.661 15.857 921 HG SER 2 HG SER 2 19.725 -15.936 16.522 922 H LEU 3 H LEU 3 19.869 -10.911 16.567 923 HA LEU 3 HA LEU 3 17.588 -9.401 15.504 924 HB2 LEU 3 2HB LEU 3 20.481 -8.563 15.921 925 HB3 LEU 3 3HB LEU 3 19.159 -7.501 15.460 926 HG LEU 3 HG LEU 3 19.458 -8.917 18.136 927 HD11 LEU 3 1HD1 LEU 3 19.793 -6.669 19.056 928 HD12 LEU 3 2HD1 LEU 3 19.717 -5.978 17.432 929 HD13 LEU 3 3HD1 LEU 3 21.035 -7.072 17.870 930 HD21 LEU 3 1HD2 LEU 3 17.097 -8.745 17.574 931 HD22 LEU 3 2HD2 LEU 3 17.276 -7.030 17.197 932 HD23 LEU 3 3HD2 LEU 3 17.493 -7.600 18.854 933 H VAL 4 H VAL 4 17.186 -9.454 13.341 934 HA VAL 4 HA VAL 4 19.171 -10.287 11.398 935 HB VAL 4 HB VAL 4 17.408 -9.710 9.663 936 HG11 VAL 4 1HG1 VAL 4 16.530 -11.622 11.861 937 HG12 VAL 4 2HG1 VAL 4 17.641 -11.994 10.541 938 HG13 VAL 4 3HG1 VAL 4 15.950 -11.630 10.193 939 HG21 VAL 4 1HG2 VAL 4 15.641 -9.148 12.084 940 HG22 VAL 4 2HG2 VAL 4 15.088 -9.258 10.411 941 HG23 VAL 4 3HG2 VAL 4 16.179 -7.960 10.893 942 H LYS 5 H LYS 5 20.521 -9.022 10.345 943 HA LYS 5 HA LYS 5 20.679 -6.184 10.974 944 HB2 LYS 5 2HB LYS 5 22.584 -7.959 9.387 945 HB3 LYS 5 3HB LYS 5 22.933 -6.342 9.997 946 HG2 LYS 5 2HG LYS 5 22.685 -7.196 12.321 947 HG3 LYS 5 3HG LYS 5 22.404 -8.814 11.684 948 HD2 LYS 5 2HD LYS 5 24.675 -8.830 10.707 949 HD3 LYS 5 3HD LYS 5 24.952 -7.188 11.304 950 HE2 LYS 5 2HE LYS 5 24.658 -8.017 13.635 951 HE3 LYS 5 3HE LYS 5 24.463 -9.657 13.010 952 HZ1 LYS 5 1HZ LYS 5 26.700 -9.543 12.114 953 HZ2 LYS 5 2HZ LYS 5 26.712 -9.234 13.779 954 HZ3 LYS 5 3HZ LYS 5 26.874 -7.960 12.683 955 H LEU 6 H LEU 6 19.304 -5.017 9.767 956 HA LEU 6 HA LEU 6 19.041 -5.511 6.852 957 HB2 LEU 6 2HB LEU 6 17.114 -4.092 8.746 958 HB3 LEU 6 3HB LEU 6 16.836 -4.417 7.041 959 HG LEU 6 HG LEU 6 17.101 -6.553 9.196 960 HD11 LEU 6 1HD1 LEU 6 14.689 -6.903 8.934 961 HD12 LEU 6 2HD1 LEU 6 14.600 -5.548 7.806 962 HD13 LEU 6 3HD1 LEU 6 15.043 -5.267 9.491 963 HD21 LEU 6 1HD2 LEU 6 16.324 -8.129 7.455 964 HD22 LEU 6 2HD2 LEU 6 17.861 -7.383 7.026 965 HD23 LEU 6 3HD2 LEU 6 16.371 -6.829 6.258 966 H GLU 7 H GLU 7 20.665 -4.196 6.021 967 HA GLU 7 HA GLU 7 21.149 -1.532 7.010 968 HB2 GLU 7 2HB GLU 7 22.147 -2.830 4.445 969 HB3 GLU 7 3HB GLU 7 22.662 -1.258 5.037 970 HG2 GLU 7 2HG GLU 7 24.363 -2.853 5.574 971 HG3 GLU 7 3HG GLU 7 23.573 -2.360 7.070 972 H SER 8 H SER 8 20.709 0.405 5.991 973 HA SER 8 HA SER 8 18.370 0.479 4.218 974 HB2 SER 8 2HB SER 8 18.503 2.952 4.778 975 HB3 SER 8 3HB SER 8 18.306 1.899 6.181 976 HG SER 8 HG SER 8 20.273 2.359 6.841 977 H SER 9 H SER 9 18.500 2.394 2.603 978 HA SER 9 HA SER 9 20.503 2.182 0.653 979 HB2 SER 9 2HB SER 9 18.224 3.151 0.255 980 HB3 SER 9 3HB SER 9 18.669 4.563 1.213 981 HG SER 9 HG SER 9 19.496 3.800 -1.355 982 H ASP 10 H ASP 10 20.287 4.014 3.590 983 HA ASP 10 HA ASP 10 22.607 5.714 3.060 984 HB2 ASP 10 2HB ASP 10 20.515 6.618 4.104 985 HB3 ASP 10 3HB ASP 10 20.746 5.533 5.465 986 H GLU 11 H GLU 11 22.279 2.592 3.872 987 HA GLU 11 HA GLU 11 23.878 1.055 4.244 988 HB2 GLU 11 2HB GLU 11 25.437 2.768 3.275 989 HB3 GLU 11 3HB GLU 11 25.740 3.385 4.892 990 HG2 GLU 11 2HG GLU 11 26.755 1.209 5.512 991 HG3 GLU 11 3HG GLU 11 26.459 0.615 3.881 992 H LYS 12 H LYS 12 22.490 2.891 6.621 993 HA LYS 12 HA LYS 12 23.948 2.085 8.952 994 HB2 LYS 12 2HB LYS 12 21.081 3.066 8.669 995 HB3 LYS 12 3HB LYS 12 21.859 2.747 10.215 996 HG2 LYS 12 2HG LYS 12 23.603 4.485 9.565 997 HG3 LYS 12 3HG LYS 12 22.550 4.905 8.206 998 HD2 LYS 12 2HD LYS 12 20.704 5.381 9.836 999 HD3 LYS 12 3HD LYS 12 21.814 5.034 11.160 1000 HE2 LYS 12 2HE LYS 12 23.230 6.928 10.485 1001 HE3 LYS 12 3HE LYS 12 22.155 7.261 9.122 1002 HZ1 LYS 12 1HZ LYS 12 21.642 8.724 10.933 1003 HZ2 LYS 12 2HZ LYS 12 21.463 7.431 12.005 1004 HZ3 LYS 12 3HZ LYS 12 20.356 7.640 10.744 1005 H VAL 13 H VAL 13 23.974 0.165 9.895 1006 HA VAL 13 HA VAL 13 22.377 -2.072 9.057 1007 HB VAL 13 HB VAL 13 24.301 -1.831 11.427 1008 HG11 VAL 13 1HG1 VAL 13 23.321 -4.335 10.005 1009 HG12 VAL 13 2HG1 VAL 13 22.828 -3.797 11.611 1010 HG13 VAL 13 3HG1 VAL 13 24.497 -4.279 11.322 1011 HG21 VAL 13 1HG2 VAL 13 25.417 -1.240 9.303 1012 HG22 VAL 13 2HG2 VAL 13 24.914 -2.779 8.599 1013 HG23 VAL 13 3HG2 VAL 13 26.044 -2.755 9.956 1014 H PHE 14 H PHE 14 20.246 -2.155 9.700 1015 HA PHE 14 HA PHE 14 19.480 -1.291 12.425 1016 HB2 PHE 14 2HB PHE 14 17.776 -1.803 9.951 1017 HB3 PHE 14 3HB PHE 14 17.119 -1.398 11.538 1018 HD1 PHE 14 HD1 PHE 14 18.234 0.749 12.668 1019 HD2 PHE 14 HD2 PHE 14 18.119 0.006 8.458 1020 HE1 PHE 14 HE1 PHE 14 18.557 3.142 12.233 1021 HE2 PHE 14 HE2 PHE 14 18.430 2.408 8.039 1022 HZ PHE 14 HZ PHE 14 18.659 3.975 9.924 1023 H GLU 15 H GLU 15 20.153 -2.967 13.598 1024 HA GLU 15 HA GLU 15 19.433 -5.718 13.060 1025 HB2 GLU 15 2HB GLU 15 20.738 -4.479 15.520 1026 HB3 GLU 15 3HB GLU 15 20.680 -6.193 15.119 1027 HG2 GLU 15 2HG GLU 15 22.059 -5.747 13.108 1028 HG3 GLU 15 3HG GLU 15 22.123 -4.049 13.554 1029 H ILE 16 H ILE 16 17.214 -5.830 13.136 1030 HA ILE 16 HA ILE 16 15.831 -5.108 15.670 1031 HB ILE 16 HB ILE 16 14.979 -3.891 13.675 1032 HG12 ILE 16 2HG1 ILE 16 12.999 -5.963 14.739 1033 HG13 ILE 16 3HG1 ILE 16 13.391 -4.431 15.506 1034 HG21 ILE 16 1HG2 ILE 16 15.550 -5.534 11.927 1035 HG22 ILE 16 2HG2 ILE 16 13.860 -5.046 11.808 1036 HG23 ILE 16 3HG2 ILE 16 14.277 -6.610 12.510 1037 HD11 ILE 16 1HD1 ILE 16 12.413 -3.253 13.586 1038 HD12 ILE 16 2HD1 ILE 16 11.266 -4.309 14.402 1039 HD13 ILE 16 3HD1 ILE 16 11.982 -4.809 12.871 1040 H GLU 17 H GLU 17 14.243 -6.636 16.457 1041 HA GLU 17 HA GLU 17 14.998 -9.328 16.555 1042 HB2 GLU 17 2HB GLU 17 12.279 -8.090 17.170 1043 HB3 GLU 17 3HB GLU 17 12.741 -9.730 17.602 1044 HG2 GLU 17 2HG GLU 17 12.889 -8.371 19.565 1045 HG3 GLU 17 3HG GLU 17 14.523 -8.799 19.079 1046 H LYS 18 H LYS 18 14.565 -11.032 15.286 1047 HA LYS 18 HA LYS 18 13.797 -10.708 12.616 1048 HB2 LYS 18 2HB LYS 18 15.320 -12.481 13.424 1049 HB3 LYS 18 3HB LYS 18 13.981 -13.270 14.251 1050 HG2 LYS 18 2HG LYS 18 12.889 -13.710 12.069 1051 HG3 LYS 18 3HG LYS 18 14.221 -12.895 11.244 1052 HD2 LYS 18 2HD LYS 18 14.526 -15.320 11.106 1053 HD3 LYS 18 3HD LYS 18 15.799 -14.618 12.106 1054 HE2 LYS 18 2HE LYS 18 14.564 -15.312 14.142 1055 HE3 LYS 18 3HE LYS 18 13.307 -16.026 13.135 1056 HZ1 LYS 18 1HZ LYS 18 14.841 -17.697 13.915 1057 HZ2 LYS 18 2HZ LYS 18 16.153 -16.878 13.235 1058 HZ3 LYS 18 3HZ LYS 18 14.966 -17.548 12.237 1059 H GLU 19 H GLU 19 11.976 -11.862 15.394 1060 HA GLU 19 HA GLU 19 9.678 -12.893 14.174 1061 HB2 GLU 19 2HB GLU 19 8.598 -12.542 16.394 1062 HB3 GLU 19 3HB GLU 19 10.194 -13.273 16.533 1063 HG2 GLU 19 2HG GLU 19 11.111 -10.970 17.046 1064 HG3 GLU 19 3HG GLU 19 9.452 -10.386 17.097 1065 H ILE 20 H ILE 20 10.575 -9.583 14.892 1066 HA ILE 20 HA ILE 20 7.993 -8.399 14.313 1067 HB ILE 20 HB ILE 20 10.721 -7.065 14.646 1068 HG12 ILE 20 2HG1 ILE 20 8.544 -7.563 16.730 1069 HG13 ILE 20 3HG1 ILE 20 10.099 -8.376 16.664 1070 HG21 ILE 20 1HG2 ILE 20 9.433 -5.013 15.120 1071 HG22 ILE 20 2HG2 ILE 20 7.927 -5.877 14.805 1072 HG23 ILE 20 3HG2 ILE 20 9.089 -5.625 13.501 1073 HD11 ILE 20 1HD1 ILE 20 10.054 -6.681 18.381 1074 HD12 ILE 20 2HD1 ILE 20 9.660 -5.446 17.191 1075 HD13 ILE 20 3HD1 ILE 20 11.221 -6.263 17.130 1076 H ALA 21 H ALA 21 11.138 -8.760 12.705 1077 HA ALA 21 HA ALA 21 10.565 -7.333 10.323 1078 HB1 ALA 21 1HB ALA 21 12.544 -9.590 10.776 1079 HB2 ALA 21 2HB ALA 21 12.851 -7.875 11.046 1080 HB3 ALA 21 3HB ALA 21 12.552 -8.466 9.412 1081 H CYS 22 H CYS 22 9.653 -10.507 11.396 1082 HA CYS 22 HA CYS 22 8.984 -11.681 8.897 1083 HB2 CYS 22 2HB CYS 22 7.964 -12.271 11.700 1084 HB3 CYS 22 3HB CYS 22 7.655 -13.284 10.289 1085 HG CYS 22 HG CYS 22 10.904 -12.697 10.687 1086 H MET 23 H MET 23 7.341 -9.330 10.919 1087 HA MET 23 HA MET 23 4.679 -9.729 9.941 1088 HB2 MET 23 2HB MET 23 5.834 -7.145 11.058 1089 HB3 MET 23 3HB MET 23 4.132 -7.566 10.930 1090 HG2 MET 23 2HG MET 23 4.717 -9.521 12.530 1091 HG3 MET 23 3HG MET 23 6.192 -8.616 12.855 1092 HE1 MET 23 1HE MET 23 4.326 -5.143 13.932 1093 HE2 MET 23 2HE MET 23 4.339 -5.641 12.240 1094 HE3 MET 23 3HE MET 23 5.807 -5.772 13.212 1095 H SER 24 H SER 24 7.408 -7.723 8.888 1096 HA SER 24 HA SER 24 6.192 -6.627 6.560 1097 HB2 SER 24 2HB SER 24 9.096 -7.404 7.088 1098 HB3 SER 24 3HB SER 24 8.544 -6.448 5.712 1099 HG SER 24 HG SER 24 8.509 -4.793 6.914 1100 H VAL 25 H VAL 25 5.239 -7.903 5.062 1101 HA VAL 25 HA VAL 25 5.625 -10.674 4.746 1102 HB VAL 25 HB VAL 25 4.438 -8.689 2.745 1103 HG11 VAL 25 1HG1 VAL 25 3.224 -10.644 1.791 1104 HG12 VAL 25 2HG1 VAL 25 4.131 -11.718 2.860 1105 HG13 VAL 25 3HG1 VAL 25 4.974 -10.797 1.615 1106 HG21 VAL 25 1HG2 VAL 25 2.242 -9.317 3.701 1107 HG22 VAL 25 2HG2 VAL 25 3.292 -8.610 4.932 1108 HG23 VAL 25 3HG2 VAL 25 3.046 -10.356 4.885 1109 H THR 26 H THR 26 7.195 -7.899 3.224 1110 HA THR 26 HA THR 26 8.460 -9.281 1.070 1111 HB THR 26 HB THR 26 9.134 -6.640 2.428 1112 HG1 THR 26 HG1 THR 26 8.068 -5.834 0.520 1113 HG21 THR 26 1HG2 THR 26 10.182 -7.702 -0.224 1114 HG22 THR 26 2HG2 THR 26 11.144 -7.421 1.231 1115 HG23 THR 26 3HG2 THR 26 10.404 -6.060 0.386 1116 H ILE 27 H ILE 27 9.716 -8.248 4.285 1117 HA ILE 27 HA ILE 27 12.350 -9.272 3.939 1118 HB ILE 27 HB ILE 27 10.859 -8.700 6.547 1119 HG12 ILE 27 2HG1 ILE 27 12.803 -6.891 5.029 1120 HG13 ILE 27 3HG1 ILE 27 11.053 -6.714 4.998 1121 HG21 ILE 27 1HG2 ILE 27 12.815 -10.152 6.945 1122 HG22 ILE 27 2HG2 ILE 27 13.094 -8.541 7.608 1123 HG23 ILE 27 3HG2 ILE 27 13.855 -9.011 6.086 1124 HD11 ILE 27 1HD1 ILE 27 12.810 -6.432 7.432 1125 HD12 ILE 27 2HD1 ILE 27 11.055 -6.255 7.399 1126 HD13 ILE 27 3HD1 ILE 27 12.072 -5.122 6.511 1127 H LYS 28 H LYS 28 9.420 -10.559 5.482 1128 HA LYS 28 HA LYS 28 10.355 -12.979 6.518 1129 HB2 LYS 28 2HB LYS 28 8.115 -12.014 7.003 1130 HB3 LYS 28 3HB LYS 28 7.608 -12.345 5.351 1131 HG2 LYS 28 2HG LYS 28 7.944 -14.807 5.816 1132 HG3 LYS 28 3HG LYS 28 8.283 -14.385 7.497 1133 HD2 LYS 28 2HD LYS 28 5.959 -15.111 7.269 1134 HD3 LYS 28 3HD LYS 28 6.013 -13.403 7.706 1135 HE2 LYS 28 2HE LYS 28 4.310 -13.800 5.995 1136 HE3 LYS 28 3HE LYS 28 5.598 -12.792 5.334 1137 HZ1 LYS 28 1HZ LYS 28 6.536 -14.830 4.324 1138 HZ2 LYS 28 2HZ LYS 28 4.995 -14.457 3.744 1139 HZ3 LYS 28 3HZ LYS 28 5.194 -15.698 4.878 1140 H ASN 29 H ASN 29 8.880 -12.283 3.346 1141 HA ASN 29 HA ASN 29 9.050 -14.887 2.256 1142 HB2 ASN 29 2HB ASN 29 8.681 -12.145 0.994 1143 HB3 ASN 29 3HB ASN 29 8.836 -13.585 -0.010 1144 HD21 ASN 29 1HD2 ASN 29 6.731 -13.221 -0.814 1145 HD22 ASN 29 2HD2 ASN 29 5.323 -13.599 0.116 1146 H MET 30 H MET 30 11.395 -12.248 2.380 1147 HA MET 30 HA MET 30 13.266 -13.367 0.530 1148 HB2 MET 30 2HB MET 30 13.610 -11.361 2.799 1149 HB3 MET 30 3HB MET 30 14.958 -11.882 1.794 1150 HG2 MET 30 2HG MET 30 13.807 -11.016 -0.204 1151 HG3 MET 30 3HG MET 30 12.464 -10.481 0.808 1152 HE1 MET 30 1HE MET 30 12.762 -8.027 -0.298 1153 HE2 MET 30 2HE MET 30 14.153 -8.582 -1.233 1154 HE3 MET 30 3HE MET 30 14.276 -7.124 -0.248 1155 H ILE 31 H ILE 31 12.943 -13.599 4.084 1156 HA ILE 31 HA ILE 31 15.224 -15.229 4.552 1157 HB ILE 31 HB ILE 31 12.669 -15.035 6.233 1158 HG12 ILE 31 2HG1 ILE 31 15.286 -13.476 6.524 1159 HG13 ILE 31 3HG1 ILE 31 13.799 -12.820 5.856 1160 HG21 ILE 31 1HG2 ILE 31 14.076 -15.816 8.131 1161 HG22 ILE 31 2HG2 ILE 31 15.438 -16.029 7.030 1162 HG23 ILE 31 3HG2 ILE 31 13.993 -17.024 6.845 1163 HD11 ILE 31 1HD1 ILE 31 14.198 -13.760 8.694 1164 HD12 ILE 31 2HD1 ILE 31 12.696 -13.117 8.023 1165 HD13 ILE 31 3HD1 ILE 31 14.125 -12.090 8.134 1166 H GLU 32 H GLU 32 11.878 -15.986 3.700 1167 HA GLU 32 HA GLU 32 12.092 -18.834 4.094 1168 HB2 GLU 32 2HB GLU 32 9.972 -17.159 2.689 1169 HB3 GLU 32 3HB GLU 32 9.825 -18.887 3.014 1170 HG2 GLU 32 2HG GLU 32 9.912 -18.480 5.424 1171 HG3 GLU 32 3HG GLU 32 10.158 -16.756 5.154 1172 H ASP 33 H ASP 33 12.173 -16.683 1.231 1173 HA ASP 33 HA ASP 33 12.089 -18.865 -0.673 1174 HB2 ASP 33 2HB ASP 33 11.017 -16.669 -1.152 1175 HB3 ASP 33 3HB ASP 33 12.588 -15.879 -1.121 1176 H ILE 34 H ILE 34 14.554 -16.486 0.324 1177 HA ILE 34 HA ILE 34 16.663 -17.572 -1.321 1178 HB ILE 34 HB ILE 34 16.830 -15.657 1.072 1179 HG12 ILE 34 2HG1 ILE 34 16.781 -14.999 -1.920 1180 HG13 ILE 34 3HG1 ILE 34 15.414 -14.803 -0.832 1181 HG21 ILE 34 1HG2 ILE 34 19.045 -14.996 0.189 1182 HG22 ILE 34 2HG2 ILE 34 18.920 -16.220 -1.073 1183 HG23 ILE 34 3HG2 ILE 34 19.017 -16.707 0.620 1184 HD11 ILE 34 1HD1 ILE 34 16.486 -12.686 -1.256 1185 HD12 ILE 34 2HD1 ILE 34 18.030 -13.312 -0.680 1186 HD13 ILE 34 3HD1 ILE 34 16.677 -13.129 0.440 1187 H GLY 35 H GLY 35 15.528 -17.976 1.971 1188 HA2 GLY 35 2HA GLY 35 15.870 -20.065 3.144 1189 HA3 GLY 35 3HA GLY 35 17.489 -20.159 2.454 1190 H GLU 36 H GLU 36 17.544 -20.495 4.999 1191 HA GLU 36 HA GLU 36 17.580 -18.202 6.676 1192 HB2 GLU 36 2HB GLU 36 18.927 -20.916 7.037 1193 HB3 GLU 36 3HB GLU 36 18.770 -19.691 8.295 1194 HG2 GLU 36 2HG GLU 36 16.303 -19.876 8.163 1195 HG3 GLU 36 3HG GLU 36 16.470 -21.114 6.917 1196 H SER 37 H SER 37 18.764 -16.625 5.672 1197 HA SER 37 HA SER 37 21.576 -17.044 4.949 1198 HB2 SER 37 2HB SER 37 19.773 -14.604 4.590 1199 HB3 SER 37 3HB SER 37 21.385 -14.815 3.892 1200 HG SER 37 HG SER 37 19.142 -16.490 3.389 1201 H ASP 38 H ASP 38 23.007 -16.821 6.562 1202 HA ASP 38 HA ASP 38 22.574 -15.225 8.934 1203 HB2 ASP 38 2HB ASP 38 24.890 -15.933 9.551 1204 HB3 ASP 38 3HB ASP 38 23.862 -17.293 9.117 1205 H SER 39 H SER 39 23.892 -14.698 5.799 1206 HA SER 39 HA SER 39 25.500 -12.407 6.267 1207 HB2 SER 39 2HB SER 39 23.921 -13.189 3.772 1208 HB3 SER 39 3HB SER 39 25.218 -11.988 3.830 1209 HG SER 39 HG SER 39 26.454 -13.911 4.764 1210 HA PRO 40 HA PRO 40 22.243 -9.407 7.132 1211 HB2 PRO 40 2HB PRO 40 23.565 -7.067 6.693 1212 HB3 PRO 40 3HB PRO 40 23.986 -8.130 8.048 1213 HG2 PRO 40 2HG PRO 40 25.352 -7.844 5.392 1214 HG3 PRO 40 3HG PRO 40 26.063 -7.950 7.021 1215 HD2 PRO 40 2HD PRO 40 25.894 -10.104 5.328 1216 HD3 PRO 40 3HD PRO 40 25.883 -10.256 7.099 1217 H ILE 41 H ILE 41 20.705 -8.042 6.042 1218 HA ILE 41 HA ILE 41 20.739 -8.301 3.093 1219 HB ILE 41 HB ILE 41 18.316 -7.933 4.928 1220 HG12 ILE 41 2HG1 ILE 41 17.705 -10.306 4.004 1221 HG13 ILE 41 3HG1 ILE 41 19.393 -10.433 3.542 1222 HG21 ILE 41 1HG2 ILE 41 16.940 -8.320 2.895 1223 HG22 ILE 41 2HG2 ILE 41 18.405 -8.356 1.912 1224 HG23 ILE 41 3HG2 ILE 41 17.938 -6.872 2.746 1225 HD11 ILE 41 1HD1 ILE 41 18.342 -10.082 6.354 1226 HD12 ILE 41 2HD1 ILE 41 20.041 -10.226 5.903 1227 HD13 ILE 41 3HD1 ILE 41 18.943 -11.577 5.638 1228 HA PRO 42 HA PRO 42 20.916 -3.717 3.445 1229 HB2 PRO 42 2HB PRO 42 22.476 -3.233 1.269 1230 HB3 PRO 42 3HB PRO 42 23.160 -3.838 2.792 1231 HG2 PRO 42 2HG PRO 42 22.610 -5.313 0.258 1232 HG3 PRO 42 3HG PRO 42 23.941 -5.518 1.418 1233 HD2 PRO 42 2HD PRO 42 21.613 -7.110 1.293 1234 HD3 PRO 42 3HD PRO 42 22.753 -7.045 2.653 1235 H LEU 43 H LEU 43 18.858 -3.107 2.981 1236 HA LEU 43 HA LEU 43 17.671 -3.348 0.326 1237 HB2 LEU 43 2HB LEU 43 16.668 -1.868 2.802 1238 HB3 LEU 43 3HB LEU 43 15.774 -2.032 1.306 1239 HG LEU 43 HG LEU 43 14.808 -3.582 2.830 1240 HD11 LEU 43 1HD1 LEU 43 16.606 -5.210 1.012 1241 HD12 LEU 43 2HD1 LEU 43 15.066 -4.473 0.567 1242 HD13 LEU 43 3HD1 LEU 43 15.108 -5.757 1.772 1243 HD21 LEU 43 1HD2 LEU 43 16.042 -5.305 4.084 1244 HD22 LEU 43 2HD2 LEU 43 16.570 -3.682 4.524 1245 HD23 LEU 43 3HD2 LEU 43 17.572 -4.676 3.462 1246 HA PRO 44 HA PRO 44 19.912 0.596 -0.482 1247 HB2 PRO 44 2HB PRO 44 20.325 0.307 -3.127 1248 HB3 PRO 44 3HB PRO 44 21.157 -0.746 -1.963 1249 HG2 PRO 44 2HG PRO 44 18.768 -1.346 -3.668 1250 HG3 PRO 44 3HG PRO 44 20.155 -2.382 -3.273 1251 HD2 PRO 44 2HD PRO 44 17.661 -2.464 -1.987 1252 HD3 PRO 44 3HD PRO 44 19.170 -3.141 -1.341 1253 H ASN 45 H ASN 45 16.770 -0.003 -0.875 1254 HA ASN 45 HA ASN 45 16.098 2.240 -2.662 1255 HB2 ASN 45 2HB ASN 45 14.929 0.125 -3.099 1256 HB3 ASN 45 3HB ASN 45 14.375 0.043 -1.430 1257 HD21 ASN 45 1HD2 ASN 45 14.008 1.740 -4.487 1258 HD22 ASN 45 2HD2 ASN 45 12.460 2.421 -4.141 1259 H VAL 46 H VAL 46 15.082 1.005 0.560 1260 HA VAL 46 HA VAL 46 13.827 3.526 1.242 1261 HB VAL 46 HB VAL 46 12.721 1.454 1.907 1262 HG11 VAL 46 1HG1 VAL 46 14.671 -0.013 2.189 1263 HG12 VAL 46 2HG1 VAL 46 13.612 -0.087 3.598 1264 HG13 VAL 46 3HG1 VAL 46 15.114 0.838 3.673 1265 HG21 VAL 46 1HG2 VAL 46 12.318 3.420 3.323 1266 HG22 VAL 46 2HG2 VAL 46 13.689 2.994 4.348 1267 HG23 VAL 46 3HG2 VAL 46 12.269 1.947 4.295 1268 H THR 47 H THR 47 14.642 5.121 2.500 1269 HA THR 47 HA THR 47 17.453 5.247 3.078 1270 HB THR 47 HB THR 47 16.825 7.531 4.030 1271 HG1 THR 47 HG1 THR 47 14.624 8.166 3.627 1272 HG21 THR 47 1HG2 THR 47 16.180 8.527 1.866 1273 HG22 THR 47 2HG2 THR 47 15.774 6.930 1.239 1274 HG23 THR 47 3HG2 THR 47 17.448 7.314 1.650 1275 H SER 48 H SER 48 18.157 6.191 5.314 1276 HA SER 48 HA SER 48 17.782 4.049 7.161 1277 HB2 SER 48 2HB SER 48 19.391 5.299 8.594 1278 HB3 SER 48 3HB SER 48 19.963 5.099 6.943 1279 HG SER 48 HG SER 48 20.299 7.222 7.632 1280 H THR 49 H THR 49 16.917 7.490 7.245 1281 HA THR 49 HA THR 49 15.917 7.677 9.844 1282 HB THR 49 HB THR 49 14.625 9.665 8.961 1283 HG1 THR 49 HG1 THR 49 14.146 9.633 6.910 1284 HG21 THR 49 1HG2 THR 49 16.573 10.980 8.172 1285 HG22 THR 49 2HG2 THR 49 17.490 9.490 7.947 1286 HG23 THR 49 3HG2 THR 49 17.006 9.990 9.569 1287 H ILE 50 H ILE 50 14.296 6.844 6.807 1288 HA ILE 50 HA ILE 50 11.656 6.726 7.930 1289 HB ILE 50 HB ILE 50 12.676 5.803 5.203 1290 HG12 ILE 50 2HG1 ILE 50 13.105 8.190 5.514 1291 HG13 ILE 50 3HG1 ILE 50 11.756 8.008 4.401 1292 HG21 ILE 50 1HG2 ILE 50 9.818 6.320 6.114 1293 HG22 ILE 50 2HG2 ILE 50 10.519 4.747 5.728 1294 HG23 ILE 50 3HG2 ILE 50 10.319 5.957 4.461 1295 HD11 ILE 50 1HD1 ILE 50 10.197 8.529 6.263 1296 HD12 ILE 50 2HD1 ILE 50 11.336 9.828 5.921 1297 HD13 ILE 50 3HD1 ILE 50 11.589 8.788 7.319 1298 H LEU 51 H LEU 51 14.067 4.317 6.849 1299 HA LEU 51 HA LEU 51 12.511 2.006 7.263 1300 HB2 LEU 51 2HB LEU 51 14.628 2.026 5.946 1301 HB3 LEU 51 3HB LEU 51 15.543 2.263 7.426 1302 HG LEU 51 HG LEU 51 14.845 0.021 8.238 1303 HD11 LEU 51 1HD1 LEU 51 12.646 -0.155 7.187 1304 HD12 LEU 51 2HD1 LEU 51 13.635 -1.554 6.787 1305 HD13 LEU 51 3HD1 LEU 51 13.389 -0.279 5.590 1306 HD21 LEU 51 1HD2 LEU 51 16.041 -0.093 5.443 1307 HD22 LEU 51 2HD2 LEU 51 16.141 -1.359 6.671 1308 HD23 LEU 51 3HD2 LEU 51 16.929 0.192 6.943 1309 H GLU 52 H GLU 52 14.674 3.804 9.432 1310 HA GLU 52 HA GLU 52 14.696 2.063 11.649 1311 HB2 GLU 52 2HB GLU 52 16.237 4.021 11.321 1312 HB3 GLU 52 3HB GLU 52 14.903 5.115 11.669 1313 HG2 GLU 52 2HG GLU 52 14.722 4.159 13.941 1314 HG3 GLU 52 3HG GLU 52 16.059 3.066 13.593 1315 H LYS 53 H LYS 53 12.655 4.845 10.838 1316 HA LYS 53 HA LYS 53 11.015 4.871 13.111 1317 HB2 LYS 53 2HB LYS 53 10.516 5.866 10.281 1318 HB3 LYS 53 3HB LYS 53 9.363 6.108 11.586 1319 HG2 LYS 53 2HG LYS 53 11.126 7.361 12.855 1320 HG3 LYS 53 3HG LYS 53 12.192 7.195 11.457 1321 HD2 LYS 53 2HD LYS 53 11.149 9.399 11.400 1322 HD3 LYS 53 3HD LYS 53 10.516 8.431 10.066 1323 HE2 LYS 53 2HE LYS 53 8.725 9.708 11.168 1324 HE3 LYS 53 3HE LYS 53 8.462 7.977 11.367 1325 HZ1 LYS 53 1HZ LYS 53 9.713 9.730 13.413 1326 HZ2 LYS 53 2HZ LYS 53 9.278 8.115 13.604 1327 HZ3 LYS 53 3HZ LYS 53 8.084 9.292 13.408 1328 H VAL 54 H VAL 54 10.486 3.323 9.934 1329 HA VAL 54 HA VAL 54 7.869 2.372 10.510 1330 HB VAL 54 HB VAL 54 9.852 1.567 8.323 1331 HG11 VAL 54 1HG1 VAL 54 6.888 0.893 8.487 1332 HG12 VAL 54 2HG1 VAL 54 8.221 -0.254 8.632 1333 HG13 VAL 54 3HG1 VAL 54 7.943 0.582 7.106 1334 HG21 VAL 54 1HG2 VAL 54 9.119 3.935 8.233 1335 HG22 VAL 54 2HG2 VAL 54 7.431 3.420 8.210 1336 HG23 VAL 54 3HG2 VAL 54 8.496 3.019 6.859 1337 H LEU 55 H LEU 55 11.095 0.915 10.848 1338 HA LEU 55 HA LEU 55 10.213 -1.726 11.519 1339 HB2 LEU 55 2HB LEU 55 12.857 -0.294 11.970 1340 HB3 LEU 55 3HB LEU 55 12.592 -1.949 12.489 1341 HG LEU 55 HG LEU 55 12.561 -0.948 9.612 1342 HD11 LEU 55 1HD1 LEU 55 14.576 -2.318 9.332 1343 HD12 LEU 55 2HD1 LEU 55 14.526 -2.778 11.036 1344 HD13 LEU 55 3HD1 LEU 55 14.811 -1.096 10.581 1345 HD21 LEU 55 1HD2 LEU 55 12.280 -3.304 8.934 1346 HD22 LEU 55 2HD2 LEU 55 10.896 -2.735 9.862 1347 HD23 LEU 55 3HD2 LEU 55 12.097 -3.780 10.625 1348 H ASP 56 H ASP 56 10.998 1.159 13.448 1349 HA ASP 56 HA ASP 56 10.808 -0.149 16.007 1350 HB2 ASP 56 2HB ASP 56 12.171 1.948 15.540 1351 HB3 ASP 56 3HB ASP 56 10.663 2.848 15.453 1352 H TYR 57 H TYR 57 8.595 1.653 13.929 1353 HA TYR 57 HA TYR 57 6.329 1.792 15.602 1354 HB2 TYR 57 2HB TYR 57 6.279 3.010 13.498 1355 HB3 TYR 57 3HB TYR 57 6.564 1.550 12.559 1356 HD1 TYR 57 HD1 TYR 57 4.693 -0.050 12.131 1357 HD2 TYR 57 HD2 TYR 57 4.011 3.523 14.385 1358 HE1 TYR 57 HE1 TYR 57 2.275 -0.404 11.939 1359 HE2 TYR 57 HE2 TYR 57 1.586 3.164 14.180 1360 HH TYR 57 HH TYR 57 -0.005 1.978 12.860 1361 H CYS 58 H CYS 58 7.356 -0.623 13.198 1362 HA CYS 58 HA CYS 58 5.329 -2.502 13.571 1363 HB2 CYS 58 2HB CYS 58 8.185 -2.847 12.583 1364 HB3 CYS 58 3HB CYS 58 6.975 -4.133 12.530 1365 HG CYS 58 HG CYS 58 7.546 -1.829 10.345 1366 H ARG 59 H ARG 59 8.336 -1.974 15.359 1367 HA ARG 59 HA ARG 59 8.291 -4.305 16.936 1368 HB2 ARG 59 2HB ARG 59 10.281 -2.998 16.923 1369 HB3 ARG 59 3HB ARG 59 9.446 -1.548 17.467 1370 HG2 ARG 59 2HG ARG 59 9.414 -2.232 19.694 1371 HG3 ARG 59 3HG ARG 59 9.443 -3.948 19.283 1372 HD2 ARG 59 2HD ARG 59 11.547 -3.044 20.360 1373 HD3 ARG 59 3HD ARG 59 11.778 -3.915 18.844 1374 HE ARG 59 HE ARG 59 11.736 -0.945 18.978 1375 HH11 ARG 59 1HH1 ARG 59 13.268 -3.935 17.920 1376 HH12 ARG 59 2HH1 ARG 59 14.503 -3.119 17.008 1377 HH21 ARG 59 1HH2 ARG 59 13.367 0.116 17.794 1378 HH22 ARG 59 2HH2 ARG 59 14.558 -0.813 16.936 1379 H HIS 60 H HIS 60 6.855 -1.076 17.566 1380 HA HIS 60 HA HIS 60 5.585 -1.738 20.012 1381 HB2 HIS 60 2HB HIS 60 5.890 0.606 19.282 1382 HB3 HIS 60 3HB HIS 60 4.772 0.355 17.943 1383 HD1 HIS 60 HD1 HIS 60 2.575 1.452 18.488 1384 HD2 HIS 60 HD2 HIS 60 4.339 -0.245 21.854 1385 HE1 HIS 60 HE1 HIS 60 0.909 1.721 20.348 1386 HE2 HIS 60 HE2 HIS 60 2.073 0.863 22.397 1387 H HIS 61 H HIS 61 4.523 -2.001 16.651 1388 HA HIS 61 HA HIS 61 1.813 -2.732 17.160 1389 HB2 HIS 61 2HB HIS 61 2.652 -1.700 15.015 1390 HB3 HIS 61 3HB HIS 61 3.478 -3.212 14.644 1391 HD1 HIS 61 HD1 HIS 61 1.932 -5.286 14.072 1392 HD2 HIS 61 HD2 HIS 61 -0.072 -1.672 14.487 1393 HE1 HIS 61 HE1 HIS 61 -0.364 -5.688 13.155 1394 HE2 HIS 61 HE2 HIS 61 -1.615 -3.556 13.606 1395 H HIS 62 H HIS 62 4.815 -4.511 16.992 1396 HA HIS 62 HA HIS 62 3.612 -7.130 16.712 1397 HB2 HIS 62 2HB HIS 62 5.910 -6.665 15.889 1398 HB3 HIS 62 3HB HIS 62 6.446 -6.345 17.534 1399 HD1 HIS 62 HD1 HIS 62 5.345 -9.158 15.277 1400 HD2 HIS 62 HD2 HIS 62 7.065 -8.632 19.025 1401 HE1 HIS 62 HE1 HIS 62 6.099 -11.438 16.004 1402 HE2 HIS 62 HE2 HIS 62 7.009 -11.112 18.322 1403 H GLN 63 H GLN 63 4.885 -5.102 19.318 1404 HA GLN 63 HA GLN 63 4.629 -7.026 21.410 1405 HB2 GLN 63 2HB GLN 63 4.800 -3.982 21.583 1406 HB3 GLN 63 3HB GLN 63 4.961 -5.083 22.944 1407 HG2 GLN 63 2HG GLN 63 6.855 -4.795 20.604 1408 HG3 GLN 63 3HG GLN 63 7.154 -4.340 22.276 1409 HE21 GLN 63 1HE2 GLN 63 7.496 -6.012 23.815 1410 HE22 GLN 63 2HE2 GLN 63 7.991 -7.591 23.329 1411 H HIS 64 H HIS 64 2.507 -4.583 20.042 1412 HA HIS 64 HA HIS 64 0.239 -5.662 21.612 1413 HB2 HIS 64 2HB HIS 64 0.662 -2.773 20.706 1414 HB3 HIS 64 3HB HIS 64 -0.829 -3.389 21.412 1415 HD1 HIS 64 HD1 HIS 64 -0.924 -3.620 23.944 1416 HD2 HIS 64 HD2 HIS 64 2.843 -2.514 22.569 1417 HE1 HIS 64 HE1 HIS 64 0.377 -2.974 25.986 1418 HE2 HIS 64 HE2 HIS 64 2.685 -2.445 25.147 1419 HA PRO 65 HA PRO 65 -0.349 -6.563 17.078 1420 HB2 PRO 65 2HB PRO 65 -1.867 -8.924 18.116 1421 HB3 PRO 65 3HB PRO 65 -0.499 -8.871 16.985 1422 HG2 PRO 65 2HG PRO 65 -0.188 -9.803 19.475 1423 HG3 PRO 65 3HG PRO 65 1.098 -8.862 18.680 1424 HD2 PRO 65 2HD PRO 65 -0.935 -7.927 20.717 1425 HD3 PRO 65 3HD PRO 65 0.817 -7.612 20.641 1426 H GLY 66 H GLY 66 -1.727 -4.829 16.770 1427 HA2 GLY 66 2HA GLY 66 -4.541 -5.398 16.540 1428 HA3 GLY 66 3HA GLY 66 -4.185 -4.226 17.812 1429 H GLY 67 H GLY 67 -5.717 -3.652 15.521 1430 HA2 GLY 67 2HA GLY 67 -4.463 -1.248 14.592 1431 HA3 GLY 67 3HA GLY 67 -4.508 -2.478 13.330 1432 H SER 68 H SER 68 -6.288 -2.622 12.141 1433 HA SER 68 HA SER 68 -8.355 -2.344 11.269 1434 HB2 SER 68 2HB SER 68 -9.231 -2.446 14.187 1435 HB3 SER 68 3HB SER 68 -10.315 -2.604 12.805 1436 HG SER 68 HG SER 68 -9.657 -4.588 12.500 1437 H GLY 69 H GLY 69 -6.808 0.133 12.430 1438 HA2 GLY 69 2HA GLY 69 -7.064 2.383 12.745 1439 HA3 GLY 69 3HA GLY 69 -8.407 2.257 11.620 1440 H LEU 70 H LEU 70 -8.092 0.815 14.874 1441 HA LEU 70 HA LEU 70 -10.674 1.586 15.732 1442 HB2 LEU 70 2HB LEU 70 -8.262 0.755 17.392 1443 HB3 LEU 70 3HB LEU 70 -9.896 0.903 18.026 1444 HG LEU 70 HG LEU 70 -8.953 -1.086 15.941 1445 HD11 LEU 70 1HD1 LEU 70 -9.414 -2.806 17.632 1446 HD12 LEU 70 2HD1 LEU 70 -9.822 -1.554 18.807 1447 HD13 LEU 70 3HD1 LEU 70 -8.177 -1.675 18.177 1448 HD21 LEU 70 1HD2 LEU 70 -11.207 -2.075 16.057 1449 HD22 LEU 70 2HD2 LEU 70 -11.238 -0.430 15.432 1450 HD23 LEU 70 3HD2 LEU 70 -11.732 -0.747 17.098 1451 H ASP 71 H ASP 71 -11.378 3.222 17.069 1452 HA ASP 71 HA ASP 71 -9.961 5.706 16.994 1453 HB2 ASP 71 2HB ASP 71 -12.436 5.563 16.807 1454 HB3 ASP 71 3HB ASP 71 -12.532 4.961 18.459 1455 H ASP 72 H ASP 72 -8.065 4.949 18.067 1456 HA ASP 72 HA ASP 72 -8.046 5.623 20.920 1457 HB2 ASP 72 2HB ASP 72 -8.077 3.150 20.885 1458 HB3 ASP 72 3HB ASP 72 -6.743 3.117 19.737 1459 H ILE 73 H ILE 73 -5.914 4.470 18.305 1460 HA ILE 73 HA ILE 73 -3.874 5.042 17.552 1461 HB ILE 73 HB ILE 73 -5.024 7.881 17.659 1462 HG12 ILE 73 2HG1 ILE 73 -5.320 7.458 15.104 1463 HG13 ILE 73 3HG1 ILE 73 -5.073 5.756 15.458 1464 HG21 ILE 73 1HG2 ILE 73 -3.308 8.462 15.957 1465 HG22 ILE 73 2HG2 ILE 73 -2.621 6.844 16.095 1466 HG23 ILE 73 3HG2 ILE 73 -2.570 7.943 17.473 1467 HD11 ILE 73 1HD1 ILE 73 -7.305 7.471 16.551 1468 HD12 ILE 73 2HD1 ILE 73 -7.085 5.740 16.824 1469 HD13 ILE 73 3HD1 ILE 73 -7.427 6.339 15.205 1470 HA PRO 74 HA PRO 74 -2.235 5.662 21.832 1471 HB2 PRO 74 2HB PRO 74 0.138 4.210 20.679 1472 HB3 PRO 74 3HB PRO 74 -0.795 3.859 22.151 1473 HG2 PRO 74 2HG PRO 74 -1.063 2.324 19.990 1474 HG3 PRO 74 3HG PRO 74 -2.479 2.741 20.986 1475 HD2 PRO 74 2HD PRO 74 -1.611 3.930 18.351 1476 HD3 PRO 74 3HD PRO 74 -3.241 3.462 18.898 1477 HA PRO 75 HA PRO 75 -0.063 9.510 21.412 1478 HB2 PRO 75 2HB PRO 75 1.707 8.440 23.630 1479 HB3 PRO 75 3HB PRO 75 0.900 10.020 23.495 1480 HG2 PRO 75 2HG PRO 75 -0.145 8.166 25.059 1481 HG3 PRO 75 3HG PRO 75 -1.205 9.152 24.025 1482 HD2 PRO 75 2HD PRO 75 -0.343 6.297 23.667 1483 HD3 PRO 75 3HD PRO 75 -1.898 7.067 23.278 1484 H TYR 76 H TYR 76 2.074 6.640 21.680 1485 HA TYR 76 HA TYR 76 4.399 7.723 20.541 1486 HB2 TYR 76 2HB TYR 76 4.648 5.559 21.525 1487 HB3 TYR 76 3HB TYR 76 3.324 4.883 20.584 1488 HD1 TYR 76 HD1 TYR 76 6.741 6.422 20.073 1489 HD2 TYR 76 HD2 TYR 76 3.863 3.573 18.688 1490 HE1 TYR 76 HE1 TYR 76 8.311 5.659 18.336 1491 HE2 TYR 76 HE2 TYR 76 5.432 2.817 16.966 1492 HH TYR 76 HH TYR 76 8.678 3.566 16.966 1493 H ASP 77 H ASP 77 1.754 5.948 18.985 1494 HA ASP 77 HA ASP 77 2.861 6.049 16.346 1495 HB2 ASP 77 2HB ASP 77 -0.005 5.337 17.134 1496 HB3 ASP 77 3HB ASP 77 0.860 4.832 15.680 1497 H ARG 78 H ARG 78 0.710 8.026 18.198 1498 HA ARG 78 HA ARG 78 -0.601 9.443 16.109 1499 HB2 ARG 78 2HB ARG 78 -1.318 9.217 18.578 1500 HB3 ARG 78 3HB ARG 78 -0.121 10.451 18.956 1501 HG2 ARG 78 2HG ARG 78 -1.309 12.058 17.515 1502 HG3 ARG 78 3HG ARG 78 -2.479 10.812 17.072 1503 HD2 ARG 78 2HD ARG 78 -2.049 11.985 19.840 1504 HD3 ARG 78 3HD ARG 78 -3.421 12.286 18.774 1505 HE ARG 78 HE ARG 78 -3.454 9.577 19.133 1506 HH11 ARG 78 1HH1 ARG 78 -3.458 12.293 21.392 1507 HH12 ARG 78 2HH1 ARG 78 -4.356 11.418 22.596 1508 HH21 ARG 78 1HH2 ARG 78 -4.657 8.489 20.707 1509 HH22 ARG 78 2HH2 ARG 78 -5.031 9.278 22.211 1510 H ASP 79 H ASP 79 2.142 10.284 18.267 1511 HA ASP 79 HA ASP 79 2.869 12.660 16.799 1512 HB2 ASP 79 2HB ASP 79 4.300 11.145 19.007 1513 HB3 ASP 79 3HB ASP 79 4.944 12.616 18.280 1514 H PHE 80 H PHE 80 3.679 9.318 16.582 1515 HA PHE 80 HA PHE 80 6.104 9.364 15.173 1516 HB2 PHE 80 2HB PHE 80 5.270 7.276 16.078 1517 HB3 PHE 80 3HB PHE 80 3.777 7.396 15.164 1518 HD1 PHE 80 HD1 PHE 80 7.361 6.563 14.981 1519 HD2 PHE 80 HD2 PHE 80 3.677 6.732 12.821 1520 HE1 PHE 80 HE1 PHE 80 8.341 5.241 13.170 1521 HE2 PHE 80 HE2 PHE 80 4.674 5.419 11.020 1522 HZ PHE 80 HZ PHE 80 7.010 4.664 11.183 1523 H CYS 81 H CYS 81 2.755 9.380 14.030 1524 HA CYS 81 HA CYS 81 3.414 9.539 11.238 1525 HB2 CYS 81 2HB CYS 81 0.773 9.920 12.697 1526 HB3 CYS 81 3HB CYS 81 0.952 9.768 10.951 1527 HG CYS 81 HG CYS 81 1.931 7.310 13.115 1528 H LYS 82 H LYS 82 3.268 11.883 13.745 1529 HA LYS 82 HA LYS 82 2.694 14.182 12.079 1530 HB2 LYS 82 2HB LYS 82 3.967 14.031 14.844 1531 HB3 LYS 82 3HB LYS 82 3.485 15.524 14.040 1532 HG2 LYS 82 2HG LYS 82 1.133 14.834 14.118 1533 HG3 LYS 82 3HG LYS 82 1.600 13.291 14.847 1534 HD2 LYS 82 2HD LYS 82 2.611 14.625 16.773 1535 HD3 LYS 82 3HD LYS 82 1.858 16.063 16.076 1536 HE2 LYS 82 2HE LYS 82 -0.362 15.078 16.385 1537 HE3 LYS 82 3HE LYS 82 0.362 13.577 16.974 1538 HZ1 LYS 82 1HZ LYS 82 -0.372 14.907 18.815 1539 HZ2 LYS 82 2HZ LYS 82 0.514 16.242 18.280 1540 HZ3 LYS 82 3HZ LYS 82 1.321 14.859 18.829 1541 H VAL 83 H VAL 83 4.138 13.723 10.379 1542 HA VAL 83 HA VAL 83 6.903 14.681 10.821 1543 HB VAL 83 HB VAL 83 7.659 13.157 8.955 1544 HG11 VAL 83 1HG1 VAL 83 7.811 11.087 10.288 1545 HG12 VAL 83 2HG1 VAL 83 6.565 11.691 11.382 1546 HG13 VAL 83 3HG1 VAL 83 8.120 12.517 11.276 1547 HG21 VAL 83 1HG2 VAL 83 6.265 11.201 8.310 1548 HG22 VAL 83 2HG2 VAL 83 5.501 12.726 7.861 1549 HG23 VAL 83 3HG2 VAL 83 4.929 11.842 9.276 1550 H ASP 84 H ASP 84 7.829 15.260 8.521 1551 HA ASP 84 HA ASP 84 6.315 17.464 7.564 1552 HB2 ASP 84 2HB ASP 84 8.956 16.933 7.588 1553 HB3 ASP 84 3HB ASP 84 8.635 16.326 5.971 1554 H GLN 85 H GLN 85 5.717 17.779 5.208 1555 HA GLN 85 HA GLN 85 3.726 15.898 4.595 1556 HB2 GLN 85 2HB GLN 85 3.510 18.311 4.055 1557 HB3 GLN 85 3HB GLN 85 4.739 18.148 2.806 1558 HG2 GLN 85 2HG GLN 85 2.493 18.179 1.824 1559 HG3 GLN 85 3HG GLN 85 3.281 16.629 1.539 1560 HE21 GLN 85 1HE2 GLN 85 1.407 15.458 1.273 1561 HE22 GLN 85 2HE2 GLN 85 0.275 15.155 2.536 1562 HA PRO 86 HA PRO 86 6.556 14.260 0.871 1563 HB2 PRO 86 2HB PRO 86 9.269 15.003 1.974 1564 HB3 PRO 86 3HB PRO 86 8.708 14.934 0.286 1565 HG2 PRO 86 2HG PRO 86 9.025 17.282 1.462 1566 HG3 PRO 86 3HG PRO 86 7.614 17.000 0.413 1567 HD2 PRO 86 2HD PRO 86 7.759 16.993 3.430 1568 HD3 PRO 86 3HD PRO 86 6.531 17.712 2.358 1569 H THR 87 H THR 87 7.655 14.371 4.232 1570 HA THR 87 HA THR 87 8.935 11.834 4.329 1571 HB THR 87 HB THR 87 7.787 13.355 6.712 1572 HG1 THR 87 HG1 THR 87 9.834 14.017 4.968 1573 HG21 THR 87 1HG2 THR 87 8.728 11.112 7.240 1574 HG22 THR 87 2HG2 THR 87 9.705 12.409 7.933 1575 HG23 THR 87 3HG2 THR 87 10.249 11.571 6.476 1576 H LEU 88 H LEU 88 5.610 12.891 4.909 1577 HA LEU 88 HA LEU 88 4.439 10.562 5.955 1578 HB2 LEU 88 2HB LEU 88 3.362 12.687 4.065 1579 HB3 LEU 88 3HB LEU 88 2.341 11.407 4.699 1580 HG LEU 88 HG LEU 88 3.819 13.369 6.503 1581 HD11 LEU 88 1HD1 LEU 88 0.956 13.545 5.508 1582 HD12 LEU 88 2HD1 LEU 88 2.283 14.624 5.066 1583 HD13 LEU 88 3HD1 LEU 88 1.701 14.584 6.728 1584 HD21 LEU 88 1HD2 LEU 88 2.218 12.607 8.211 1585 HD22 LEU 88 2HD2 LEU 88 3.152 11.252 7.581 1586 HD23 LEU 88 3HD2 LEU 88 1.484 11.494 7.051 1587 H PHE 89 H PHE 89 4.980 11.551 2.586 1588 HA PHE 89 HA PHE 89 3.945 9.206 1.359 1589 HB2 PHE 89 2HB PHE 89 5.853 11.314 0.257 1590 HB3 PHE 89 3HB PHE 89 5.088 10.055 -0.713 1591 HD1 PHE 89 HD1 PHE 89 2.429 9.940 -0.517 1592 HD2 PHE 89 HD2 PHE 89 4.764 13.406 0.385 1593 HE1 PHE 89 HE1 PHE 89 0.461 11.373 -0.873 1594 HE2 PHE 89 HE2 PHE 89 2.792 14.824 0.026 1595 HZ PHE 89 HZ PHE 89 0.639 13.812 -0.602 1596 H GLU 90 H GLU 90 7.134 10.050 2.571 1597 HA GLU 90 HA GLU 90 8.622 7.908 1.490 1598 HB2 GLU 90 2HB GLU 90 8.974 9.393 4.124 1599 HB3 GLU 90 3HB GLU 90 10.166 8.296 3.444 1600 HG2 GLU 90 2HG GLU 90 9.224 10.880 2.187 1601 HG3 GLU 90 3HG GLU 90 10.740 10.643 3.050 1602 H LEU 91 H LEU 91 6.713 8.190 4.482 1603 HA LEU 91 HA LEU 91 7.231 5.596 5.517 1604 HB2 LEU 91 2HB LEU 91 4.834 7.422 5.969 1605 HB3 LEU 91 3HB LEU 91 5.200 5.998 6.930 1606 HG LEU 91 HG LEU 91 6.905 8.524 6.789 1607 HD11 LEU 91 1HD1 LEU 91 5.171 7.486 9.058 1608 HD12 LEU 91 2HD1 LEU 91 4.815 8.877 8.030 1609 HD13 LEU 91 3HD1 LEU 91 6.207 8.917 9.109 1610 HD21 LEU 91 1HD2 LEU 91 8.314 6.536 7.129 1611 HD22 LEU 91 2HD2 LEU 91 7.317 6.047 8.499 1612 HD23 LEU 91 3HD2 LEU 91 8.264 7.533 8.582 1613 H ILE 92 H ILE 92 4.800 6.876 3.287 1614 HA ILE 92 HA ILE 92 3.224 4.530 2.959 1615 HB ILE 92 HB ILE 92 3.637 6.919 1.090 1616 HG12 ILE 92 2HG1 ILE 92 1.348 6.285 3.020 1617 HG13 ILE 92 3HG1 ILE 92 2.612 7.475 3.300 1618 HG21 ILE 92 1HG2 ILE 92 1.507 4.754 0.885 1619 HG22 ILE 92 2HG2 ILE 92 2.843 5.007 -0.240 1620 HG23 ILE 92 3HG2 ILE 92 1.575 6.223 -0.094 1621 HD11 ILE 92 1HD1 ILE 92 0.567 8.553 2.625 1622 HD12 ILE 92 2HD1 ILE 92 0.503 7.594 1.147 1623 HD13 ILE 92 3HD1 ILE 92 1.796 8.774 1.380 1624 H LEU 93 H LEU 93 6.114 5.767 1.270 1625 HA LEU 93 HA LEU 93 6.249 3.849 -0.815 1626 HB2 LEU 93 2HB LEU 93 8.381 5.625 0.443 1627 HB3 LEU 93 3HB LEU 93 8.741 4.552 -0.897 1628 HG LEU 93 HG LEU 93 6.771 6.879 -0.991 1629 HD11 LEU 93 1HD1 LEU 93 9.525 6.633 -2.251 1630 HD12 LEU 93 2HD1 LEU 93 9.097 7.655 -0.877 1631 HD13 LEU 93 3HD1 LEU 93 8.399 7.980 -2.462 1632 HD21 LEU 93 1HD2 LEU 93 6.067 5.062 -2.480 1633 HD22 LEU 93 2HD2 LEU 93 7.663 5.032 -3.231 1634 HD23 LEU 93 3HD2 LEU 93 6.628 6.453 -3.403 1635 H ALA 94 H ALA 94 7.794 4.003 2.388 1636 HA ALA 94 HA ALA 94 9.305 1.599 2.204 1637 HB1 ALA 94 1HB ALA 94 9.866 3.405 3.776 1638 HB2 ALA 94 2HB ALA 94 9.646 1.877 4.628 1639 HB3 ALA 94 3HB ALA 94 8.378 3.108 4.677 1640 H ALA 95 H ALA 95 6.055 2.335 3.380 1641 HA ALA 95 HA ALA 95 5.491 -0.192 4.581 1642 HB1 ALA 95 1HB ALA 95 4.264 1.880 5.121 1643 HB2 ALA 95 2HB ALA 95 3.183 0.565 4.662 1644 HB3 ALA 95 3HB ALA 95 3.537 1.865 3.517 1645 H ASN 96 H ASN 96 4.945 1.153 1.337 1646 HA ASN 96 HA ASN 96 3.540 -1.109 0.255 1647 HB2 ASN 96 2HB ASN 96 3.326 1.151 -0.732 1648 HB3 ASN 96 3HB ASN 96 5.042 1.178 -1.119 1649 HD21 ASN 96 1HD2 ASN 96 4.605 1.528 -3.318 1650 HD22 ASN 96 2HD2 ASN 96 3.990 0.295 -4.355 1651 H TYR 97 H TYR 97 6.895 -0.118 0.492 1652 HA TYR 97 HA TYR 97 8.046 -1.977 -1.336 1653 HB2 TYR 97 2HB TYR 97 9.153 0.142 -0.731 1654 HB3 TYR 97 3HB TYR 97 9.311 -0.385 0.940 1655 HD1 TYR 97 HD1 TYR 97 11.449 -1.177 1.565 1656 HD2 TYR 97 HD2 TYR 97 10.235 -1.616 -2.511 1657 HE1 TYR 97 HE1 TYR 97 13.646 -2.134 1.017 1658 HE2 TYR 97 HE2 TYR 97 12.431 -2.574 -3.060 1659 HH TYR 97 HH TYR 97 14.705 -2.596 -2.209 1660 H LEU 98 H LEU 98 7.530 -2.011 2.182 1661 HA LEU 98 HA LEU 98 8.707 -4.705 2.424 1662 HB2 LEU 98 2HB LEU 98 7.843 -2.735 4.573 1663 HB3 LEU 98 3HB LEU 98 8.566 -4.306 4.880 1664 HG LEU 98 HG LEU 98 9.942 -1.969 3.493 1665 HD11 LEU 98 1HD1 LEU 98 9.663 -1.573 5.890 1666 HD12 LEU 98 2HD1 LEU 98 11.356 -1.856 5.501 1667 HD13 LEU 98 3HD1 LEU 98 10.404 -3.133 6.260 1668 HD21 LEU 98 1HD2 LEU 98 11.054 -4.709 4.193 1669 HD22 LEU 98 2HD2 LEU 98 11.993 -3.347 3.573 1670 HD23 LEU 98 3HD2 LEU 98 10.747 -4.084 2.569 1671 H ASP 99 H ASP 99 5.791 -3.409 1.758 1672 HA ASP 99 HA ASP 99 3.623 -3.929 1.857 1673 HB2 ASP 99 2HB ASP 99 4.585 -5.961 0.659 1674 HB3 ASP 99 3HB ASP 99 4.530 -6.816 2.201 1675 H ILE 100 H ILE 100 4.627 -3.039 4.254 1676 HA ILE 100 HA ILE 100 3.294 -4.505 6.407 1677 HB ILE 100 HB ILE 100 4.575 -1.736 6.556 1678 HG12 ILE 100 2HG1 ILE 100 5.859 -4.434 7.203 1679 HG13 ILE 100 3HG1 ILE 100 6.217 -3.458 5.785 1680 HG21 ILE 100 1HG2 ILE 100 4.667 -2.157 8.994 1681 HG22 ILE 100 2HG2 ILE 100 3.907 -3.732 8.765 1682 HG23 ILE 100 3HG2 ILE 100 3.005 -2.261 8.407 1683 HD11 ILE 100 1HD1 ILE 100 6.741 -2.668 8.641 1684 HD12 ILE 100 2HD1 ILE 100 7.092 -1.691 7.216 1685 HD13 ILE 100 3HD1 ILE 100 7.928 -3.218 7.463 1686 H LYS 101 H LYS 101 1.228 -4.488 5.558 1687 HA LYS 101 HA LYS 101 -0.295 -2.288 4.751 1688 HB2 LYS 101 2HB LYS 101 -1.437 -4.766 6.114 1689 HB3 LYS 101 3HB LYS 101 -2.252 -3.702 4.971 1690 HG2 LYS 101 2HG LYS 101 -0.637 -4.442 3.200 1691 HG3 LYS 101 3HG LYS 101 0.048 -5.581 4.363 1692 HD2 LYS 101 2HD LYS 101 -2.337 -6.542 4.596 1693 HD3 LYS 101 3HD LYS 101 -2.745 -5.585 3.170 1694 HE2 LYS 101 2HE LYS 101 -0.681 -7.804 3.332 1695 HE3 LYS 101 3HE LYS 101 -2.239 -7.868 2.509 1696 HZ1 LYS 101 1HZ LYS 101 -1.390 -5.991 1.112 1697 HZ2 LYS 101 2HZ LYS 101 -0.649 -7.489 0.876 1698 HZ3 LYS 101 3HZ LYS 101 0.145 -6.289 1.769 1699 HA PRO 102 HA PRO 102 -1.633 -1.991 9.689 1700 HB2 PRO 102 2HB PRO 102 1.297 -2.369 10.419 1701 HB3 PRO 102 3HB PRO 102 -0.153 -2.627 11.420 1702 HG2 PRO 102 2HG PRO 102 1.062 -4.709 10.338 1703 HG3 PRO 102 3HG PRO 102 -0.716 -4.620 10.349 1704 HD2 PRO 102 2HD PRO 102 1.181 -4.223 8.069 1705 HD3 PRO 102 3HD PRO 102 -0.470 -4.882 8.064 1706 H LEU 103 H LEU 103 1.703 -1.062 8.708 1707 HA LEU 103 HA LEU 103 1.553 1.544 9.857 1708 HB2 LEU 103 2HB LEU 103 3.678 0.267 9.565 1709 HB3 LEU 103 3HB LEU 103 3.560 0.456 7.828 1710 HG LEU 103 HG LEU 103 5.196 2.003 9.210 1711 HD11 LEU 103 1HD1 LEU 103 4.970 3.879 7.645 1712 HD12 LEU 103 2HD1 LEU 103 3.401 3.262 7.120 1713 HD13 LEU 103 3HD1 LEU 103 4.863 2.323 6.823 1714 HD21 LEU 103 1HD2 LEU 103 4.240 4.117 9.994 1715 HD22 LEU 103 2HD2 LEU 103 3.595 2.757 10.901 1716 HD23 LEU 103 3HD2 LEU 103 2.610 3.533 9.656 1717 H LEU 104 H LEU 104 1.213 0.250 6.588 1718 HA LEU 104 HA LEU 104 1.034 2.625 5.125 1719 HB2 LEU 104 2HB LEU 104 1.310 0.354 4.149 1720 HB3 LEU 104 3HB LEU 104 -0.342 -0.037 4.595 1721 HG LEU 104 HG LEU 104 -1.169 1.715 3.013 1722 HD11 LEU 104 1HD1 LEU 104 0.738 3.253 3.056 1723 HD12 LEU 104 2HD1 LEU 104 0.367 2.771 1.404 1724 HD13 LEU 104 3HD1 LEU 104 1.751 2.058 2.238 1725 HD21 LEU 104 1HD2 LEU 104 -0.968 -0.622 2.271 1726 HD22 LEU 104 2HD2 LEU 104 0.687 -0.319 1.728 1727 HD23 LEU 104 3HD2 LEU 104 -0.666 0.500 0.945 1728 H ASP 105 H ASP 105 -1.437 0.733 6.802 1729 HA ASP 105 HA ASP 105 -3.713 2.152 5.834 1730 HB2 ASP 105 2HB ASP 105 -3.770 -0.212 6.670 1731 HB3 ASP 105 3HB ASP 105 -3.461 0.370 8.305 1732 H VAL 106 H VAL 106 -1.822 2.289 8.854 1733 HA VAL 106 HA VAL 106 -3.450 4.243 10.150 1734 HB VAL 106 HB VAL 106 -0.602 3.302 10.719 1735 HG11 VAL 106 1HG1 VAL 106 -0.840 5.568 11.660 1736 HG12 VAL 106 2HG1 VAL 106 -0.788 4.368 12.948 1737 HG13 VAL 106 3HG1 VAL 106 -2.328 5.094 12.485 1738 HG21 VAL 106 1HG2 VAL 106 -2.348 1.584 10.999 1739 HG22 VAL 106 2HG2 VAL 106 -3.239 2.644 12.096 1740 HG23 VAL 106 3HG2 VAL 106 -1.647 2.033 12.555 1741 H THR 107 H THR 107 -0.535 4.476 8.114 1742 HA THR 107 HA THR 107 -0.166 7.302 8.409 1743 HB THR 107 HB THR 107 0.789 5.476 6.142 1744 HG1 THR 107 HG1 THR 107 1.505 5.003 8.369 1745 HG21 THR 107 1HG2 THR 107 1.796 8.227 6.997 1746 HG22 THR 107 2HG2 THR 107 0.920 7.874 5.505 1747 HG23 THR 107 3HG2 THR 107 2.531 7.203 5.760 1748 H CYS 108 H CYS 108 -1.958 5.247 6.143 1749 HA CYS 108 HA CYS 108 -2.902 7.305 4.412 1750 HB2 CYS 108 2HB CYS 108 -3.945 4.493 4.930 1751 HB3 CYS 108 3HB CYS 108 -4.607 5.564 3.696 1752 HG CYS 108 HG CYS 108 -1.284 4.820 3.670 1753 H LYS 109 H LYS 109 -4.044 5.977 7.479 1754 HA LYS 109 HA LYS 109 -6.576 7.299 7.509 1755 HB2 LYS 109 2HB LYS 109 -5.011 5.673 9.431 1756 HB3 LYS 109 3HB LYS 109 -5.843 6.997 10.227 1757 HG2 LYS 109 2HG LYS 109 -7.281 5.114 10.356 1758 HG3 LYS 109 3HG LYS 109 -7.988 6.192 9.148 1759 HD2 LYS 109 2HD LYS 109 -7.070 4.773 7.347 1760 HD3 LYS 109 3HD LYS 109 -6.318 3.720 8.550 1761 HE2 LYS 109 2HE LYS 109 -8.587 3.182 9.445 1762 HE3 LYS 109 3HE LYS 109 -9.296 4.166 8.161 1763 HZ1 LYS 109 1HZ LYS 109 -7.623 1.750 7.761 1764 HZ2 LYS 109 2HZ LYS 109 -8.309 2.684 6.535 1765 HZ3 LYS 109 3HZ LYS 109 -9.306 1.823 7.596 1766 H THR 110 H THR 110 -3.355 8.102 8.839 1767 HA THR 110 HA THR 110 -4.006 10.460 10.194 1768 HB THR 110 HB THR 110 -1.359 9.728 8.860 1769 HG1 THR 110 HG1 THR 110 -1.376 8.281 10.395 1770 HG21 THR 110 1HG2 THR 110 -0.304 11.264 10.497 1771 HG22 THR 110 2HG2 THR 110 -1.894 11.749 11.084 1772 HG23 THR 110 3HG2 THR 110 -1.406 12.144 9.435 1773 H VAL 111 H VAL 111 -2.723 10.072 6.865 1774 HA VAL 111 HA VAL 111 -2.713 12.834 6.229 1775 HB VAL 111 HB VAL 111 -2.398 12.165 3.864 1776 HG11 VAL 111 1HG1 VAL 111 -0.438 12.216 5.350 1777 HG12 VAL 111 2HG1 VAL 111 -0.259 10.958 4.128 1778 HG13 VAL 111 3HG1 VAL 111 -0.696 10.523 5.784 1779 HG21 VAL 111 1HG2 VAL 111 -2.281 9.765 3.223 1780 HG22 VAL 111 2HG2 VAL 111 -3.902 10.232 3.736 1781 HG23 VAL 111 3HG2 VAL 111 -2.864 9.315 4.829 1782 H ALA 112 H ALA 112 -5.163 10.306 5.891 1783 HA ALA 112 HA ALA 112 -7.083 11.798 4.421 1784 HB1 ALA 112 1HB ALA 112 -7.208 9.354 4.624 1785 HB2 ALA 112 2HB ALA 112 -8.704 10.106 5.183 1786 HB3 ALA 112 3HB ALA 112 -7.527 9.496 6.354 1787 H ASN 113 H ASN 113 -6.407 11.463 7.893 1788 HA ASN 113 HA ASN 113 -8.753 12.793 8.839 1789 HB2 ASN 113 2HB ASN 113 -6.096 12.234 10.240 1790 HB3 ASN 113 3HB ASN 113 -7.505 12.914 11.051 1791 HD21 ASN 113 1HD2 ASN 113 -6.111 10.446 11.621 1792 HD22 ASN 113 2HD2 ASN 113 -7.266 9.178 11.461 1793 H MET 114 H MET 114 -5.639 13.952 7.746 1794 HA MET 114 HA MET 114 -5.822 16.577 8.932 1795 HB2 MET 114 2HB MET 114 -4.117 15.662 6.574 1796 HB3 MET 114 3HB MET 114 -3.928 17.173 7.454 1797 HG2 MET 114 2HG MET 114 -3.423 15.820 9.513 1798 HG3 MET 114 3HG MET 114 -3.419 14.384 8.491 1799 HE1 MET 114 1HE MET 114 -1.687 14.284 6.220 1800 HE2 MET 114 2HE MET 114 -0.445 15.507 5.972 1801 HE3 MET 114 3HE MET 114 -2.143 15.932 5.792 1802 H ILE 115 H ILE 115 -6.428 15.226 5.677 1803 HA ILE 115 HA ILE 115 -7.182 17.784 4.545 1804 HB ILE 115 HB ILE 115 -7.651 16.502 2.453 1805 HG12 ILE 115 2HG1 ILE 115 -6.953 14.055 4.147 1806 HG13 ILE 115 3HG1 ILE 115 -8.504 14.390 3.390 1807 HG21 ILE 115 1HG2 ILE 115 -5.365 17.313 2.915 1808 HG22 ILE 115 2HG2 ILE 115 -5.321 15.801 2.011 1809 HG23 ILE 115 3HG2 ILE 115 -4.983 15.800 3.743 1810 HD11 ILE 115 1HD1 ILE 115 -7.266 12.683 2.200 1811 HD12 ILE 115 2HD1 ILE 115 -5.925 13.796 1.946 1812 HD13 ILE 115 3HD1 ILE 115 -7.488 14.109 1.188 1813 H ARG 116 H ARG 116 -8.896 14.996 5.836 1814 HA ARG 116 HA ARG 116 -11.531 15.996 5.057 1815 HB2 ARG 116 2HB ARG 116 -10.704 13.565 6.711 1816 HB3 ARG 116 3HB ARG 116 -12.368 13.967 6.301 1817 HG2 ARG 116 2HG ARG 116 -11.873 13.644 3.901 1818 HG3 ARG 116 3HG ARG 116 -10.189 13.276 4.295 1819 HD2 ARG 116 2HD ARG 116 -10.857 11.285 5.525 1820 HD3 ARG 116 3HD ARG 116 -12.566 11.683 5.324 1821 HE ARG 116 HE ARG 116 -10.814 11.035 3.017 1822 HH11 ARG 116 1HH1 ARG 116 -13.770 10.501 4.843 1823 HH12 ARG 116 2HH1 ARG 116 -14.432 9.397 3.681 1824 HH21 ARG 116 1HH2 ARG 116 -11.680 9.554 1.507 1825 HH22 ARG 116 2HH2 ARG 116 -13.244 8.859 1.791 1826 H GLY 117 H GLY 117 -9.341 16.423 7.641 1827 HA2 GLY 117 2HA GLY 117 -11.208 16.740 9.819 1828 HA3 GLY 117 3HA GLY 117 -9.494 17.134 9.823 Start of MODEL 3 1 H1 SER 2 1H SER 2 -17.312 -15.078 -18.420 2 H2 SER 2 2H SER 2 -16.144 -14.370 -17.432 3 H3 SER 2 3H SER 2 -16.785 -13.505 -18.730 4 HA SER 2 HA SER 2 -18.932 -13.462 -17.717 5 HB2 SER 2 2HB SER 2 -19.163 -14.285 -15.348 6 HB3 SER 2 3HB SER 2 -18.846 -15.578 -16.506 7 HG SER 2 HG SER 2 -17.573 -15.496 -14.447 8 H LEU 3 H LEU 3 -19.523 -11.744 -16.322 9 HA LEU 3 HA LEU 3 -17.332 -9.969 -15.436 10 HB2 LEU 3 2HB LEU 3 -20.296 -9.367 -15.840 11 HB3 LEU 3 3HB LEU 3 -19.062 -8.193 -15.403 12 HG LEU 3 HG LEU 3 -19.202 -9.688 -18.053 13 HD11 LEU 3 1HD1 LEU 3 -19.906 -6.806 -17.428 14 HD12 LEU 3 2HD1 LEU 3 -21.036 -8.099 -17.844 15 HD13 LEU 3 3HD1 LEU 3 -19.861 -7.545 -19.034 16 HD21 LEU 3 1HD2 LEU 3 -16.892 -9.147 -17.466 17 HD22 LEU 3 2HD2 LEU 3 -17.329 -7.461 -17.172 18 HD23 LEU 3 3HD2 LEU 3 -17.438 -8.136 -18.801 19 H VAL 4 H VAL 4 -17.167 -9.392 -13.297 20 HA VAL 4 HA VAL 4 -19.099 -10.479 -11.332 21 HB VAL 4 HB VAL 4 -17.261 -10.043 -9.610 22 HG11 VAL 4 1HG1 VAL 4 -17.711 -12.311 -10.430 23 HG12 VAL 4 2HG1 VAL 4 -15.981 -12.093 -10.149 24 HG13 VAL 4 3HG1 VAL 4 -16.620 -12.058 -11.796 25 HG21 VAL 4 1HG2 VAL 4 -14.924 -9.824 -10.411 26 HG22 VAL 4 2HG2 VAL 4 -15.898 -8.435 -10.894 27 HG23 VAL 4 3HG2 VAL 4 -15.503 -9.685 -12.076 28 H LYS 5 H LYS 5 -20.081 -9.122 -9.926 29 HA LYS 5 HA LYS 5 -20.188 -6.284 -10.679 30 HB2 LYS 5 2HB LYS 5 -22.013 -7.969 -8.909 31 HB3 LYS 5 3HB LYS 5 -22.320 -6.304 -9.398 32 HG2 LYS 5 2HG LYS 5 -22.541 -7.011 -11.732 33 HG3 LYS 5 3HG LYS 5 -22.138 -8.674 -11.293 34 HD2 LYS 5 2HD LYS 5 -24.179 -8.841 -9.947 35 HD3 LYS 5 3HD LYS 5 -24.565 -7.147 -10.263 36 HE2 LYS 5 2HE LYS 5 -25.897 -8.685 -11.674 37 HE3 LYS 5 3HE LYS 5 -24.860 -7.638 -12.646 38 HZ1 LYS 5 1HZ LYS 5 -24.780 -9.896 -13.441 39 HZ2 LYS 5 2HZ LYS 5 -24.301 -10.459 -11.926 40 HZ3 LYS 5 3HZ LYS 5 -23.274 -9.463 -12.816 41 H LEU 6 H LEU 6 -19.000 -4.895 -9.495 42 HA LEU 6 HA LEU 6 -18.717 -5.284 -6.562 43 HB2 LEU 6 2HB LEU 6 -16.819 -3.758 -8.416 44 HB3 LEU 6 3HB LEU 6 -16.679 -3.854 -6.673 45 HG LEU 6 HG LEU 6 -15.022 -5.313 -7.519 46 HD11 LEU 6 1HD1 LEU 6 -17.336 -7.103 -6.740 47 HD12 LEU 6 2HD1 LEU 6 -16.235 -6.276 -5.635 48 HD13 LEU 6 3HD1 LEU 6 -15.622 -7.530 -6.710 49 HD21 LEU 6 1HD2 LEU 6 -15.779 -5.477 -9.835 50 HD22 LEU 6 2HD2 LEU 6 -17.059 -6.595 -9.359 51 HD23 LEU 6 3HD2 LEU 6 -15.365 -7.065 -9.190 52 H GLU 7 H GLU 7 -20.433 -4.061 -5.802 53 HA GLU 7 HA GLU 7 -21.159 -1.507 -6.885 54 HB2 GLU 7 2HB GLU 7 -21.791 -2.729 -4.156 55 HB3 GLU 7 3HB GLU 7 -22.444 -1.196 -4.718 56 HG2 GLU 7 2HG GLU 7 -24.147 -2.812 -5.046 57 HG3 GLU 7 3HG GLU 7 -23.502 -2.437 -6.640 58 H SER 8 H SER 8 -20.542 0.501 -6.226 59 HA SER 8 HA SER 8 -18.228 0.797 -4.474 60 HB2 SER 8 2HB SER 8 -18.429 3.216 -5.209 61 HB3 SER 8 3HB SER 8 -18.214 2.075 -6.539 62 HG SER 8 HG SER 8 -20.248 2.371 -7.169 63 H SER 9 H SER 9 -18.386 2.661 -2.871 64 HA SER 9 HA SER 9 -20.465 2.470 -0.995 65 HB2 SER 9 2HB SER 9 -18.168 3.369 -0.522 66 HB3 SER 9 3HB SER 9 -18.573 4.828 -1.426 67 HG SER 9 HG SER 9 -19.748 3.872 0.978 68 H ASP 10 H ASP 10 -20.180 4.217 -3.935 69 HA ASP 10 HA ASP 10 -22.305 6.154 -3.488 70 HB2 ASP 10 2HB ASP 10 -20.169 6.626 -4.756 71 HB3 ASP 10 3HB ASP 10 -20.675 5.474 -5.978 72 H GLU 11 H GLU 11 -22.403 2.921 -3.998 73 HA GLU 11 HA GLU 11 -24.055 1.468 -4.432 74 HB2 GLU 11 2HB GLU 11 -25.746 3.919 -5.054 75 HB3 GLU 11 3HB GLU 11 -26.386 2.277 -4.998 76 HG2 GLU 11 2HG GLU 11 -25.119 3.765 -2.664 77 HG3 GLU 11 3HG GLU 11 -26.848 3.545 -2.931 78 H LYS 12 H LYS 12 -22.427 3.005 -6.734 79 HA LYS 12 HA LYS 12 -23.907 2.096 -9.076 80 HB2 LYS 12 2HB LYS 12 -21.228 3.492 -8.736 81 HB3 LYS 12 3HB LYS 12 -21.762 2.875 -10.301 82 HG2 LYS 12 2HG LYS 12 -23.796 4.306 -10.130 83 HG3 LYS 12 3HG LYS 12 -23.168 4.980 -8.621 84 HD2 LYS 12 2HD LYS 12 -21.269 5.952 -9.781 85 HD3 LYS 12 3HD LYS 12 -21.702 5.137 -11.287 86 HE2 LYS 12 2HE LYS 12 -22.331 7.525 -11.324 87 HE3 LYS 12 3HE LYS 12 -23.750 6.487 -11.448 88 HZ1 LYS 12 1HZ LYS 12 -24.086 8.351 -9.931 89 HZ2 LYS 12 2HZ LYS 12 -22.813 7.807 -8.959 90 HZ3 LYS 12 3HZ LYS 12 -24.208 6.871 -9.123 91 H VAL 13 H VAL 13 -23.757 0.162 -9.923 92 HA VAL 13 HA VAL 13 -21.988 -1.886 -8.879 93 HB VAL 13 HB VAL 13 -24.082 -2.054 -11.108 94 HG11 VAL 13 1HG1 VAL 13 -22.463 -3.902 -11.232 95 HG12 VAL 13 2HG1 VAL 13 -24.043 -4.499 -10.718 96 HG13 VAL 13 3HG1 VAL 13 -22.749 -4.293 -9.534 97 HG21 VAL 13 1HG2 VAL 13 -24.410 -2.752 -8.163 98 HG22 VAL 13 2HG2 VAL 13 -25.628 -2.960 -9.423 99 HG23 VAL 13 3HG2 VAL 13 -25.099 -1.339 -8.965 100 H PHE 14 H PHE 14 -19.990 -2.162 -9.715 101 HA PHE 14 HA PHE 14 -19.413 -1.418 -12.516 102 HB2 PHE 14 2HB PHE 14 -17.591 -1.616 -10.078 103 HB3 PHE 14 3HB PHE 14 -16.985 -1.402 -11.724 104 HD1 PHE 14 HD1 PHE 14 -17.727 0.633 -13.054 105 HD2 PHE 14 HD2 PHE 14 -18.397 0.286 -8.842 106 HE1 PHE 14 HE1 PHE 14 -18.132 3.051 -12.911 107 HE2 PHE 14 HE2 PHE 14 -18.795 2.702 -8.718 108 HZ PHE 14 HZ PHE 14 -18.669 4.083 -10.748 109 H GLU 15 H GLU 15 -19.793 -3.137 -13.709 110 HA GLU 15 HA GLU 15 -19.069 -5.848 -12.884 111 HB2 GLU 15 2HB GLU 15 -20.442 -4.886 -15.432 112 HB3 GLU 15 3HB GLU 15 -20.327 -6.553 -14.867 113 HG2 GLU 15 2HG GLU 15 -21.714 -5.989 -12.910 114 HG3 GLU 15 3HG GLU 15 -21.821 -4.316 -13.452 115 H ILE 16 H ILE 16 -16.858 -5.858 -12.981 116 HA ILE 16 HA ILE 16 -15.476 -5.275 -15.535 117 HB ILE 16 HB ILE 16 -14.505 -4.285 -13.457 118 HG12 ILE 16 2HG1 ILE 16 -12.751 -6.395 -14.801 119 HG13 ILE 16 3HG1 ILE 16 -12.972 -4.725 -15.317 120 HG21 ILE 16 1HG2 ILE 16 -14.004 -7.139 -12.529 121 HG22 ILE 16 2HG2 ILE 16 -15.189 -6.026 -11.846 122 HG23 ILE 16 3HG2 ILE 16 -13.468 -5.665 -11.710 123 HD11 ILE 16 1HD1 ILE 16 -10.848 -4.984 -14.260 124 HD12 ILE 16 2HD1 ILE 16 -11.586 -5.667 -12.816 125 HD13 ILE 16 3HD1 ILE 16 -11.875 -3.983 -13.246 126 H GLU 17 H GLU 17 -14.026 -6.914 -16.415 127 HA GLU 17 HA GLU 17 -15.023 -9.528 -16.563 128 HB2 GLU 17 2HB GLU 17 -12.228 -8.514 -17.277 129 HB3 GLU 17 3HB GLU 17 -12.862 -10.090 -17.731 130 HG2 GLU 17 2HG GLU 17 -13.098 -8.788 -19.674 131 HG3 GLU 17 3HG GLU 17 -14.715 -8.829 -18.987 132 H LYS 18 H LYS 18 -14.569 -11.355 -15.497 133 HA LYS 18 HA LYS 18 -13.902 -11.181 -12.778 134 HB2 LYS 18 2HB LYS 18 -15.539 -12.762 -13.682 135 HB3 LYS 18 3HB LYS 18 -14.283 -13.598 -14.592 136 HG2 LYS 18 2HG LYS 18 -13.274 -14.426 -12.539 137 HG3 LYS 18 3HG LYS 18 -14.392 -13.467 -11.560 138 HD2 LYS 18 2HD LYS 18 -16.286 -14.794 -12.306 139 HD3 LYS 18 3HD LYS 18 -15.286 -15.656 -13.481 140 HE2 LYS 18 2HE LYS 18 -14.926 -15.789 -10.466 141 HE3 LYS 18 3HE LYS 18 -15.757 -17.005 -11.441 142 HZ1 LYS 18 1HZ LYS 18 -13.714 -17.422 -12.631 143 HZ2 LYS 18 2HZ LYS 18 -13.462 -17.610 -10.977 144 HZ3 LYS 18 3HZ LYS 18 -12.911 -16.223 -11.755 145 H GLU 19 H GLU 19 -12.005 -12.188 -15.577 146 HA GLU 19 HA GLU 19 -9.815 -13.362 -14.208 147 HB2 GLU 19 2HB GLU 19 -8.595 -13.161 -16.331 148 HB3 GLU 19 3HB GLU 19 -10.222 -13.777 -16.596 149 HG2 GLU 19 2HG GLU 19 -10.965 -11.616 -17.436 150 HG3 GLU 19 3HG GLU 19 -9.411 -10.884 -17.034 151 H ILE 20 H ILE 20 -10.592 -10.034 -15.071 152 HA ILE 20 HA ILE 20 -7.954 -8.967 -14.482 153 HB ILE 20 HB ILE 20 -10.552 -7.436 -14.990 154 HG12 ILE 20 2HG1 ILE 20 -8.399 -8.317 -16.974 155 HG13 ILE 20 3HG1 ILE 20 -10.050 -8.913 -16.909 156 HG21 ILE 20 1HG2 ILE 20 -7.651 -6.521 -15.178 157 HG22 ILE 20 2HG2 ILE 20 -8.793 -6.080 -13.906 158 HG23 ILE 20 3HG2 ILE 20 -9.071 -5.541 -15.559 159 HD11 ILE 20 1HD1 ILE 20 -9.208 -6.106 -17.629 160 HD12 ILE 20 2HD1 ILE 20 -10.868 -6.701 -17.562 161 HD13 ILE 20 3HD1 ILE 20 -9.739 -7.367 -18.740 162 H ALA 21 H ALA 21 -11.058 -9.323 -12.855 163 HA ALA 21 HA ALA 21 -10.649 -7.687 -10.591 164 HB1 ALA 21 1HB ALA 21 -12.840 -8.608 -11.210 165 HB2 ALA 21 2HB ALA 21 -12.431 -9.024 -9.545 166 HB3 ALA 21 3HB ALA 21 -12.280 -10.237 -10.824 167 H CYS 22 H CYS 22 -9.277 -10.738 -11.462 168 HA CYS 22 HA CYS 22 -8.473 -11.697 -8.916 169 HB2 CYS 22 2HB CYS 22 -7.233 -12.243 -11.634 170 HB3 CYS 22 3HB CYS 22 -7.040 -13.229 -10.178 171 HG CYS 22 HG CYS 22 -10.243 -12.838 -10.865 172 H MET 23 H MET 23 -7.182 -9.219 -10.997 173 HA MET 23 HA MET 23 -4.466 -9.188 -10.133 174 HB2 MET 23 2HB MET 23 -6.175 -6.943 -11.273 175 HB3 MET 23 3HB MET 23 -4.423 -6.886 -11.095 176 HG2 MET 23 2HG MET 23 -4.191 -8.748 -12.675 177 HG3 MET 23 3HG MET 23 -5.949 -8.833 -12.839 178 HE1 MET 23 1HE MET 23 -3.456 -5.189 -14.200 179 HE2 MET 23 2HE MET 23 -2.747 -6.606 -13.423 180 HE3 MET 23 3HE MET 23 -3.784 -5.517 -12.502 181 H SER 24 H SER 24 -7.388 -7.625 -8.947 182 HA SER 24 HA SER 24 -6.160 -6.293 -6.709 183 HB2 SER 24 2HB SER 24 -8.351 -5.522 -7.534 184 HB3 SER 24 3HB SER 24 -9.053 -7.116 -7.255 185 HG SER 24 HG SER 24 -7.865 -5.656 -5.157 186 H VAL 25 H VAL 25 -5.170 -7.469 -5.145 187 HA VAL 25 HA VAL 25 -5.343 -10.258 -4.870 188 HB VAL 25 HB VAL 25 -4.254 -8.196 -2.891 189 HG11 VAL 25 1HG1 VAL 25 -4.718 -10.287 -1.678 190 HG12 VAL 25 2HG1 VAL 25 -2.977 -10.058 -1.848 191 HG13 VAL 25 3HG1 VAL 25 -3.818 -11.213 -2.885 192 HG21 VAL 25 1HG2 VAL 25 -3.107 -8.171 -5.079 193 HG22 VAL 25 2HG2 VAL 25 -2.806 -9.906 -4.958 194 HG23 VAL 25 3HG2 VAL 25 -2.033 -8.796 -3.823 195 H THR 26 H THR 26 -6.868 -7.647 -2.964 196 HA THR 26 HA THR 26 -8.110 -9.210 -0.998 197 HB THR 26 HB THR 26 -8.958 -6.515 -2.126 198 HG1 THR 26 HG1 THR 26 -7.846 -5.829 -0.135 199 HG21 THR 26 1HG2 THR 26 -9.790 -7.828 0.494 200 HG22 THR 26 2HG2 THR 26 -10.850 -7.497 -0.878 201 HG23 THR 26 3HG2 THR 26 -10.139 -6.162 0.033 202 H ILE 27 H ILE 27 -9.518 -7.955 -4.087 203 HA ILE 27 HA ILE 27 -12.082 -9.103 -3.782 204 HB ILE 27 HB ILE 27 -10.622 -8.304 -6.340 205 HG12 ILE 27 2HG1 ILE 27 -12.750 -6.831 -4.703 206 HG13 ILE 27 3HG1 ILE 27 -11.040 -6.417 -4.783 207 HG21 ILE 27 1HG2 ILE 27 -13.577 -8.980 -6.027 208 HG22 ILE 27 2HG2 ILE 27 -12.384 -9.938 -6.904 209 HG23 ILE 27 3HG2 ILE 27 -12.820 -8.334 -7.488 210 HD11 ILE 27 1HD1 ILE 27 -11.300 -5.894 -7.174 211 HD12 ILE 27 2HD1 ILE 27 -12.339 -4.912 -6.144 212 HD13 ILE 27 3HD1 ILE 27 -13.025 -6.258 -7.055 213 H LYS 28 H LYS 28 -9.169 -10.266 -5.429 214 HA LYS 28 HA LYS 28 -10.066 -12.644 -6.563 215 HB2 LYS 28 2HB LYS 28 -7.844 -11.601 -6.986 216 HB3 LYS 28 3HB LYS 28 -7.332 -12.042 -5.360 217 HG2 LYS 28 2HG LYS 28 -7.676 -14.476 -6.022 218 HG3 LYS 28 3HG LYS 28 -7.948 -13.913 -7.672 219 HD2 LYS 28 2HD LYS 28 -5.628 -14.679 -7.365 220 HD3 LYS 28 3HD LYS 28 -5.677 -12.953 -7.734 221 HE2 LYS 28 2HE LYS 28 -4.050 -13.439 -5.942 222 HE3 LYS 28 3HE LYS 28 -5.363 -12.429 -5.333 223 HZ1 LYS 28 1HZ LYS 28 -6.399 -14.517 -4.482 224 HZ2 LYS 28 2HZ LYS 28 -4.933 -14.122 -3.749 225 HZ3 LYS 28 3HZ LYS 28 -4.988 -15.340 -4.913 226 H ASN 29 H ASN 29 -8.537 -12.117 -3.359 227 HA ASN 29 HA ASN 29 -8.531 -14.785 -2.476 228 HB2 ASN 29 2HB ASN 29 -8.526 -12.212 -0.842 229 HB3 ASN 29 3HB ASN 29 -8.303 -13.809 -0.134 230 HD21 ASN 29 1HD2 ASN 29 -6.486 -11.653 0.034 231 HD22 ASN 29 2HD2 ASN 29 -5.022 -12.146 -0.741 232 H MET 30 H MET 30 -10.985 -12.229 -2.157 233 HA MET 30 HA MET 30 -12.653 -13.613 -0.305 234 HB2 MET 30 2HB MET 30 -13.250 -11.276 -2.163 235 HB3 MET 30 3HB MET 30 -14.420 -11.914 -1.012 236 HG2 MET 30 2HG MET 30 -12.826 -11.400 0.833 237 HG3 MET 30 3HG MET 30 -11.747 -10.651 -0.345 238 HE1 MET 30 1HE MET 30 -13.965 -7.584 -1.545 239 HE2 MET 30 2HE MET 30 -13.893 -9.171 -2.309 240 HE3 MET 30 3HE MET 30 -12.412 -8.401 -1.732 241 H ILE 31 H ILE 31 -12.632 -13.411 -3.864 242 HA ILE 31 HA ILE 31 -15.016 -14.892 -4.353 243 HB ILE 31 HB ILE 31 -12.544 -14.560 -6.128 244 HG12 ILE 31 2HG1 ILE 31 -15.208 -13.054 -6.186 245 HG13 ILE 31 3HG1 ILE 31 -13.699 -12.412 -5.550 246 HG21 ILE 31 1HG2 ILE 31 -13.834 -16.529 -6.857 247 HG22 ILE 31 2HG2 ILE 31 -13.998 -15.226 -8.033 248 HG23 ILE 31 3HG2 ILE 31 -15.314 -15.567 -6.907 249 HD11 ILE 31 1HD1 ILE 31 -14.230 -13.165 -8.425 250 HD12 ILE 31 2HD1 ILE 31 -12.708 -12.536 -7.789 251 HD13 ILE 31 3HD1 ILE 31 -14.157 -11.534 -7.756 252 H GLU 32 H GLU 32 -11.605 -15.800 -3.948 253 HA GLU 32 HA GLU 32 -11.889 -18.593 -4.524 254 HB2 GLU 32 2HB GLU 32 -9.659 -17.096 -3.079 255 HB3 GLU 32 3HB GLU 32 -9.560 -18.769 -3.627 256 HG2 GLU 32 2HG GLU 32 -9.736 -18.068 -5.951 257 HG3 GLU 32 3HG GLU 32 -9.984 -16.393 -5.467 258 H ASP 33 H ASP 33 -12.089 -16.637 -1.634 259 HA ASP 33 HA ASP 33 -11.848 -18.673 0.348 260 HB2 ASP 33 2HB ASP 33 -11.414 -16.297 0.860 261 HB3 ASP 33 3HB ASP 33 -13.079 -15.878 0.479 262 H ILE 34 H ILE 34 -14.544 -17.161 -1.333 263 HA ILE 34 HA ILE 34 -16.611 -18.752 -0.062 264 HB ILE 34 HB ILE 34 -16.704 -16.929 -2.525 265 HG12 ILE 34 2HG1 ILE 34 -17.547 -16.371 0.368 266 HG13 ILE 34 3HG1 ILE 34 -16.091 -15.752 -0.399 267 HG21 ILE 34 1HG2 ILE 34 -19.027 -18.099 -0.941 268 HG22 ILE 34 2HG2 ILE 34 -18.553 -18.570 -2.575 269 HG23 ILE 34 3HG2 ILE 34 -19.166 -16.944 -2.269 270 HD11 ILE 34 1HD1 ILE 34 -18.935 -15.058 -1.128 271 HD12 ILE 34 2HD1 ILE 34 -17.497 -14.485 -1.979 272 HD13 ILE 34 3HD1 ILE 34 -17.762 -14.037 -0.294 273 H GLY 35 H GLY 35 -14.529 -18.966 -2.844 274 HA2 GLY 35 2HA GLY 35 -14.089 -21.193 -3.779 275 HA3 GLY 35 3HA GLY 35 -15.827 -21.483 -3.774 276 H GLU 36 H GLU 36 -17.078 -19.653 -4.889 277 HA GLU 36 HA GLU 36 -15.833 -18.078 -6.918 278 HB2 GLU 36 2HB GLU 36 -15.892 -20.283 -8.106 279 HB3 GLU 36 3HB GLU 36 -17.631 -20.381 -7.839 280 HG2 GLU 36 2HG GLU 36 -17.961 -18.366 -9.239 281 HG3 GLU 36 3HG GLU 36 -16.221 -18.250 -9.482 282 H SER 37 H SER 37 -16.884 -16.331 -6.103 283 HA SER 37 HA SER 37 -19.651 -16.400 -5.266 284 HB2 SER 37 2HB SER 37 -17.966 -15.028 -4.058 285 HB3 SER 37 3HB SER 37 -17.728 -14.037 -5.500 286 HG SER 37 HG SER 37 -19.710 -13.167 -5.242 287 H ASP 38 H ASP 38 -21.025 -16.703 -6.968 288 HA ASP 38 HA ASP 38 -21.020 -15.181 -9.415 289 HB2 ASP 38 2HB ASP 38 -23.189 -16.202 -9.849 290 HB3 ASP 38 3HB ASP 38 -22.144 -17.438 -9.162 291 H SER 39 H SER 39 -22.203 -14.797 -6.201 292 HA SER 39 HA SER 39 -24.127 -12.728 -6.577 293 HB2 SER 39 2HB SER 39 -22.568 -13.557 -4.082 294 HB3 SER 39 3HB SER 39 -24.043 -12.586 -4.101 295 HG SER 39 HG SER 39 -23.864 -15.222 -5.151 296 HA PRO 40 HA PRO 40 -21.344 -9.189 -6.917 297 HB2 PRO 40 2HB PRO 40 -22.919 -7.170 -5.956 298 HB3 PRO 40 3HB PRO 40 -23.258 -7.974 -7.499 299 HG2 PRO 40 2HG PRO 40 -24.500 -8.486 -4.808 300 HG3 PRO 40 3HG PRO 40 -25.296 -8.271 -6.386 301 HD2 PRO 40 2HD PRO 40 -24.850 -10.734 -5.357 302 HD3 PRO 40 3HD PRO 40 -24.763 -10.429 -7.108 303 H ILE 41 H ILE 41 -19.792 -8.129 -5.698 304 HA ILE 41 HA ILE 41 -19.900 -8.378 -2.747 305 HB ILE 41 HB ILE 41 -17.408 -8.014 -4.484 306 HG12 ILE 41 2HG1 ILE 41 -16.826 -10.388 -3.498 307 HG13 ILE 41 3HG1 ILE 41 -18.546 -10.523 -3.164 308 HG21 ILE 41 1HG2 ILE 41 -16.129 -8.366 -2.379 309 HG22 ILE 41 2HG2 ILE 41 -17.644 -8.408 -1.476 310 HG23 ILE 41 3HG2 ILE 41 -17.152 -6.928 -2.304 311 HD11 ILE 41 1HD1 ILE 41 -19.015 -10.309 -5.567 312 HD12 ILE 41 2HD1 ILE 41 -17.939 -11.661 -5.221 313 HD13 ILE 41 3HD1 ILE 41 -17.284 -10.164 -5.888 314 HA PRO 42 HA PRO 42 -20.390 -3.816 -3.252 315 HB2 PRO 42 2HB PRO 42 -21.339 -3.926 -0.434 316 HB3 PRO 42 3HB PRO 42 -22.198 -3.361 -1.882 317 HG2 PRO 42 2HG PRO 42 -22.896 -5.639 -0.632 318 HG3 PRO 42 3HG PRO 42 -23.019 -5.458 -2.398 319 HD2 PRO 42 2HD PRO 42 -20.854 -6.830 -0.798 320 HD3 PRO 42 3HD PRO 42 -21.693 -7.387 -2.268 321 H LEU 43 H LEU 43 -18.541 -2.757 -3.092 322 HA LEU 43 HA LEU 43 -16.713 -3.004 -0.811 323 HB2 LEU 43 2HB LEU 43 -16.352 -1.619 -3.494 324 HB3 LEU 43 3HB LEU 43 -15.097 -1.876 -2.292 325 HG LEU 43 HG LEU 43 -16.506 -4.078 -3.867 326 HD11 LEU 43 1HD1 LEU 43 -15.073 -2.748 -5.309 327 HD12 LEU 43 2HD1 LEU 43 -14.389 -4.354 -5.067 328 HD13 LEU 43 3HD1 LEU 43 -13.708 -2.967 -4.208 329 HD21 LEU 43 1HD2 LEU 43 -15.817 -4.903 -1.669 330 HD22 LEU 43 2HD2 LEU 43 -14.178 -4.294 -1.916 331 HD23 LEU 43 3HD2 LEU 43 -14.796 -5.606 -2.925 332 HA PRO 44 HA PRO 44 -19.051 0.866 0.163 333 HB2 PRO 44 2HB PRO 44 -19.217 0.630 2.836 334 HB3 PRO 44 3HB PRO 44 -20.095 -0.501 1.778 335 HG2 PRO 44 2HG PRO 44 -17.482 -0.918 3.212 336 HG3 PRO 44 3HG PRO 44 -18.882 -2.009 3.093 337 HD2 PRO 44 2HD PRO 44 -16.642 -2.199 1.464 338 HD3 PRO 44 3HD PRO 44 -18.248 -2.807 1.016 339 H ASN 45 H ASN 45 -15.784 0.215 0.717 340 HA ASN 45 HA ASN 45 -15.187 2.663 2.217 341 HB2 ASN 45 2HB ASN 45 -13.890 0.560 2.652 342 HB3 ASN 45 3HB ASN 45 -13.272 0.617 1.004 343 HD21 ASN 45 1HD2 ASN 45 -11.128 0.843 1.571 344 HD22 ASN 45 2HD2 ASN 45 -10.479 2.241 2.321 345 H VAL 46 H VAL 46 -14.901 1.385 -1.070 346 HA VAL 46 HA VAL 46 -13.421 3.734 -2.010 347 HB VAL 46 HB VAL 46 -12.648 1.478 -2.703 348 HG11 VAL 46 1HG1 VAL 46 -13.905 0.085 -4.283 349 HG12 VAL 46 2HG1 VAL 46 -15.259 1.218 -4.233 350 HG13 VAL 46 3HG1 VAL 46 -14.818 0.308 -2.786 351 HG21 VAL 46 1HG2 VAL 46 -12.122 3.381 -4.146 352 HG22 VAL 46 2HG2 VAL 46 -13.641 3.173 -5.022 353 HG23 VAL 46 3HG2 VAL 46 -12.384 1.937 -5.126 354 H THR 47 H THR 47 -14.298 5.302 -3.292 355 HA THR 47 HA THR 47 -17.177 5.473 -3.651 356 HB THR 47 HB THR 47 -16.601 7.750 -4.617 357 HG1 THR 47 HG1 THR 47 -14.091 7.969 -3.761 358 HG21 THR 47 1HG2 THR 47 -15.385 7.147 -1.890 359 HG22 THR 47 2HG2 THR 47 -17.084 7.516 -2.202 360 HG23 THR 47 3HG2 THR 47 -15.851 8.747 -2.482 361 H SER 48 H SER 48 -17.972 6.297 -5.907 362 HA SER 48 HA SER 48 -17.631 4.067 -7.642 363 HB2 SER 48 2HB SER 48 -19.252 5.269 -9.140 364 HB3 SER 48 3HB SER 48 -19.804 5.130 -7.473 365 HG SER 48 HG SER 48 -20.119 7.227 -8.348 366 H THR 49 H THR 49 -16.676 7.467 -7.904 367 HA THR 49 HA THR 49 -15.632 7.525 -10.485 368 HB THR 49 HB THR 49 -14.709 9.091 -8.032 369 HG1 THR 49 HG1 THR 49 -16.928 9.267 -9.716 370 HG21 THR 49 1HG2 THR 49 -14.456 9.839 -10.974 371 HG22 THR 49 2HG2 THR 49 -13.115 9.346 -9.931 372 HG23 THR 49 3HG2 THR 49 -13.992 10.849 -9.614 373 H ILE 50 H ILE 50 -14.149 6.567 -7.429 374 HA ILE 50 HA ILE 50 -11.483 6.289 -8.483 375 HB ILE 50 HB ILE 50 -12.658 5.494 -5.787 376 HG12 ILE 50 2HG1 ILE 50 -12.747 7.926 -6.228 377 HG13 ILE 50 3HG1 ILE 50 -11.577 7.573 -4.967 378 HG21 ILE 50 1HG2 ILE 50 -10.309 5.376 -4.976 379 HG22 ILE 50 2HG2 ILE 50 -9.738 5.624 -6.628 380 HG23 ILE 50 3HG2 ILE 50 -10.638 4.165 -6.218 381 HD11 ILE 50 1HD1 ILE 50 -10.952 8.215 -7.851 382 HD12 ILE 50 2HD1 ILE 50 -9.757 7.828 -6.606 383 HD13 ILE 50 3HD1 ILE 50 -10.751 9.274 -6.457 384 H LEU 51 H LEU 51 -14.102 4.056 -7.520 385 HA LEU 51 HA LEU 51 -12.645 1.650 -7.880 386 HB2 LEU 51 2HB LEU 51 -14.782 1.842 -6.571 387 HB3 LEU 51 3HB LEU 51 -15.661 2.043 -8.078 388 HG LEU 51 HG LEU 51 -15.052 -0.252 -8.779 389 HD11 LEU 51 1HD1 LEU 51 -12.860 -0.461 -7.730 390 HD12 LEU 51 2HD1 LEU 51 -13.896 -1.806 -7.265 391 HD13 LEU 51 3HD1 LEU 51 -13.597 -0.489 -6.125 392 HD21 LEU 51 1HD2 LEU 51 -17.123 0.033 -7.500 393 HD22 LEU 51 2HD2 LEU 51 -16.245 -0.205 -5.986 394 HD23 LEU 51 3HD2 LEU 51 -16.377 -1.527 -7.151 395 H GLU 52 H GLU 52 -14.602 3.631 -10.016 396 HA GLU 52 HA GLU 52 -14.852 2.065 -12.309 397 HB2 GLU 52 2HB GLU 52 -16.029 4.215 -11.939 398 HB3 GLU 52 3HB GLU 52 -14.499 5.079 -12.007 399 HG2 GLU 52 2HG GLU 52 -14.259 4.331 -14.404 400 HG3 GLU 52 3HG GLU 52 -15.887 3.652 -14.299 401 H LYS 53 H LYS 53 -12.359 4.457 -11.493 402 HA LYS 53 HA LYS 53 -10.942 4.105 -13.968 403 HB2 LYS 53 2HB LYS 53 -9.478 5.886 -13.141 404 HB3 LYS 53 3HB LYS 53 -11.172 6.310 -12.905 405 HG2 LYS 53 2HG LYS 53 -10.929 5.568 -10.493 406 HG3 LYS 53 3HG LYS 53 -9.199 5.403 -10.782 407 HD2 LYS 53 2HD LYS 53 -10.848 7.960 -10.887 408 HD3 LYS 53 3HD LYS 53 -9.642 7.517 -9.681 409 HE2 LYS 53 2HE LYS 53 -8.437 8.993 -11.009 410 HE3 LYS 53 3HE LYS 53 -7.997 7.460 -11.753 411 HZ1 LYS 53 1HZ LYS 53 -9.728 7.870 -13.430 412 HZ2 LYS 53 2HZ LYS 53 -8.558 9.083 -13.419 413 HZ3 LYS 53 3HZ LYS 53 -10.063 9.363 -12.715 414 H VAL 54 H VAL 54 -10.535 2.970 -10.657 415 HA VAL 54 HA VAL 54 -7.841 2.033 -10.882 416 HB VAL 54 HB VAL 54 -10.080 1.417 -8.894 417 HG11 VAL 54 1HG1 VAL 54 -8.742 -0.644 -9.002 418 HG12 VAL 54 2HG1 VAL 54 -8.426 0.194 -7.480 419 HG13 VAL 54 3HG1 VAL 54 -7.255 0.284 -8.798 420 HG21 VAL 54 1HG2 VAL 54 -7.443 2.917 -8.607 421 HG22 VAL 54 2HG2 VAL 54 -8.624 2.680 -7.314 422 HG23 VAL 54 3HG2 VAL 54 -9.045 3.649 -8.731 423 H LEU 55 H LEU 55 -11.029 0.455 -11.230 424 HA LEU 55 HA LEU 55 -10.076 -2.139 -11.855 425 HB2 LEU 55 2HB LEU 55 -12.716 -0.772 -12.484 426 HB3 LEU 55 3HB LEU 55 -12.407 -2.457 -12.864 427 HG LEU 55 HG LEU 55 -12.534 -1.228 -10.079 428 HD11 LEU 55 1HD1 LEU 55 -14.513 -2.639 -9.771 429 HD12 LEU 55 2HD1 LEU 55 -14.378 -3.217 -11.435 430 HD13 LEU 55 3HD1 LEU 55 -14.726 -1.515 -11.113 431 HD21 LEU 55 1HD2 LEU 55 -11.938 -4.116 -10.822 432 HD22 LEU 55 2HD2 LEU 55 -12.226 -3.507 -9.188 433 HD23 LEU 55 3HD2 LEU 55 -10.811 -2.968 -10.089 434 H ASP 56 H ASP 56 -10.737 0.715 -13.846 435 HA ASP 56 HA ASP 56 -10.424 -0.608 -16.380 436 HB2 ASP 56 2HB ASP 56 -11.811 1.485 -16.006 437 HB3 ASP 56 3HB ASP 56 -10.306 2.391 -15.855 438 H TYR 57 H TYR 57 -8.258 1.198 -14.233 439 HA TYR 57 HA TYR 57 -5.988 1.335 -15.923 440 HB2 TYR 57 2HB TYR 57 -6.037 2.659 -13.859 441 HB3 TYR 57 3HB TYR 57 -6.191 1.210 -12.876 442 HD1 TYR 57 HD1 TYR 57 -4.210 -0.217 -12.406 443 HD2 TYR 57 HD2 TYR 57 -3.832 3.290 -14.831 444 HE1 TYR 57 HE1 TYR 57 -1.765 -0.366 -12.234 445 HE2 TYR 57 HE2 TYR 57 -1.382 3.135 -14.652 446 HH TYR 57 HH TYR 57 0.320 2.143 -13.253 447 H CYS 58 H CYS 58 -7.039 -1.029 -13.479 448 HA CYS 58 HA CYS 58 -4.991 -2.922 -13.759 449 HB2 CYS 58 2HB CYS 58 -7.883 -3.284 -12.871 450 HB3 CYS 58 3HB CYS 58 -6.637 -4.525 -12.706 451 HG CYS 58 HG CYS 58 -7.357 -2.034 -10.720 452 H ARG 59 H ARG 59 -8.006 -2.442 -15.576 453 HA ARG 59 HA ARG 59 -8.038 -4.762 -17.139 454 HB2 ARG 59 2HB ARG 59 -9.970 -3.347 -17.199 455 HB3 ARG 59 3HB ARG 59 -9.032 -1.955 -17.722 456 HG2 ARG 59 2HG ARG 59 -8.688 -2.965 -19.938 457 HG3 ARG 59 3HG ARG 59 -9.519 -4.434 -19.419 458 HD2 ARG 59 2HD ARG 59 -10.816 -1.689 -19.535 459 HD3 ARG 59 3HD ARG 59 -10.921 -2.898 -20.821 460 HE ARG 59 HE ARG 59 -12.052 -4.366 -19.231 461 HH11 ARG 59 1HH1 ARG 59 -11.997 -0.947 -18.418 462 HH12 ARG 59 2HH1 ARG 59 -13.410 -1.050 -17.416 463 HH21 ARG 59 1HH2 ARG 59 -13.899 -4.506 -17.968 464 HH22 ARG 59 2HH2 ARG 59 -14.501 -3.087 -17.156 465 H HIS 60 H HIS 60 -6.560 -1.582 -17.863 466 HA HIS 60 HA HIS 60 -5.377 -2.278 -20.316 467 HB2 HIS 60 2HB HIS 60 -5.601 0.067 -19.724 468 HB3 HIS 60 3HB HIS 60 -4.595 -0.137 -18.290 469 HD1 HIS 60 HD1 HIS 60 -2.143 0.284 -18.593 470 HD2 HIS 60 HD2 HIS 60 -4.087 -0.286 -22.221 471 HE1 HIS 60 HE1 HIS 60 -0.387 0.579 -20.351 472 HE2 HIS 60 HE2 HIS 60 -1.649 0.468 -22.524 473 H HIS 61 H HIS 61 -4.165 -2.501 -16.993 474 HA HIS 61 HA HIS 61 -1.463 -3.168 -17.686 475 HB2 HIS 61 2HB HIS 61 -2.305 -2.060 -15.502 476 HB3 HIS 61 3HB HIS 61 -2.793 -3.670 -14.986 477 HD1 HIS 61 HD1 HIS 61 -0.730 -5.466 -14.817 478 HD2 HIS 61 HD2 HIS 61 0.295 -1.439 -15.017 479 HE1 HIS 61 HE1 HIS 61 1.651 -5.331 -14.036 480 HE2 HIS 61 HE2 HIS 61 2.303 -2.929 -14.399 481 H HIS 62 H HIS 62 -4.404 -4.955 -17.260 482 HA HIS 62 HA HIS 62 -3.277 -7.586 -16.946 483 HB2 HIS 62 2HB HIS 62 -5.590 -6.928 -16.191 484 HB3 HIS 62 3HB HIS 62 -6.069 -6.771 -17.872 485 HD1 HIS 62 HD1 HIS 62 -5.333 -9.267 -15.216 486 HD2 HIS 62 HD2 HIS 62 -6.511 -9.240 -19.196 487 HE1 HIS 62 HE1 HIS 62 -6.177 -11.577 -15.689 488 HE2 HIS 62 HE2 HIS 62 -6.698 -11.581 -18.141 489 H GLN 63 H GLN 63 -4.659 -5.691 -19.594 490 HA GLN 63 HA GLN 63 -4.467 -7.652 -21.657 491 HB2 GLN 63 2HB GLN 63 -4.710 -4.609 -21.768 492 HB3 GLN 63 3HB GLN 63 -4.890 -5.668 -23.166 493 HG2 GLN 63 2HG GLN 63 -6.916 -6.618 -22.307 494 HG3 GLN 63 3HG GLN 63 -6.671 -5.884 -20.721 495 HE21 GLN 63 1HE2 GLN 63 -8.952 -5.645 -22.583 496 HE22 GLN 63 2HE2 GLN 63 -9.143 -3.949 -22.859 497 H HIS 64 H HIS 64 -2.390 -5.050 -20.514 498 HA HIS 64 HA HIS 64 -0.177 -5.972 -22.249 499 HB2 HIS 64 2HB HIS 64 -0.886 -3.095 -21.511 500 HB3 HIS 64 3HB HIS 64 0.641 -3.571 -22.247 501 HD1 HIS 64 HD1 HIS 64 0.649 -4.099 -24.747 502 HD2 HIS 64 HD2 HIS 64 -3.145 -3.232 -23.274 503 HE1 HIS 64 HE1 HIS 64 -0.816 -3.815 -26.764 504 HE2 HIS 64 HE2 HIS 64 -3.132 -3.461 -25.842 505 HA PRO 65 HA PRO 65 1.176 -6.626 -17.838 506 HB2 PRO 65 2HB PRO 65 2.906 -8.635 -19.258 507 HB3 PRO 65 3HB PRO 65 1.882 -8.845 -17.821 508 HG2 PRO 65 2HG PRO 65 1.133 -9.886 -20.151 509 HG3 PRO 65 3HG PRO 65 -0.067 -9.130 -19.075 510 HD2 PRO 65 2HD PRO 65 1.245 -7.968 -21.535 511 HD3 PRO 65 3HD PRO 65 -0.468 -7.933 -21.051 512 H GLY 66 H GLY 66 2.856 -5.933 -20.820 513 HA2 GLY 66 2HA GLY 66 5.435 -5.274 -19.779 514 HA3 GLY 66 3HA GLY 66 4.782 -4.818 -21.341 515 H GLY 67 H GLY 67 2.459 -3.721 -19.371 516 HA2 GLY 67 2HA GLY 67 3.228 -0.980 -19.356 517 HA3 GLY 67 3HA GLY 67 1.832 -1.681 -18.558 518 H SER 68 H SER 68 5.328 -1.212 -18.237 519 HA SER 68 HA SER 68 5.379 -1.821 -15.394 520 HB2 SER 68 2HB SER 68 7.605 -0.767 -17.195 521 HB3 SER 68 3HB SER 68 7.802 -1.464 -15.584 522 HG SER 68 HG SER 68 7.786 -2.731 -17.899 523 H GLY 69 H GLY 69 4.523 0.877 -17.174 524 HA2 GLY 69 2HA GLY 69 3.945 3.003 -16.528 525 HA3 GLY 69 3HA GLY 69 4.508 2.646 -14.900 526 H LEU 70 H LEU 70 6.832 2.788 -14.478 527 HA LEU 70 HA LEU 70 8.013 5.101 -15.725 528 HB2 LEU 70 2HB LEU 70 8.155 4.751 -13.274 529 HB3 LEU 70 3HB LEU 70 9.068 3.273 -13.529 530 HG LEU 70 HG LEU 70 10.874 4.658 -14.630 531 HD11 LEU 70 1HD1 LEU 70 10.935 7.090 -14.243 532 HD12 LEU 70 2HD1 LEU 70 9.299 7.023 -13.579 533 HD13 LEU 70 3HD1 LEU 70 9.586 6.611 -15.272 534 HD21 LEU 70 1HD2 LEU 70 11.133 3.906 -12.321 535 HD22 LEU 70 2HD2 LEU 70 10.303 5.352 -11.736 536 HD23 LEU 70 3HD2 LEU 70 11.863 5.494 -12.553 537 H ASP 71 H ASP 71 8.323 4.365 -17.814 538 HA ASP 71 HA ASP 71 10.863 3.719 -18.650 539 HB2 ASP 71 2HB ASP 71 10.480 1.372 -17.870 540 HB3 ASP 71 3HB ASP 71 9.024 1.265 -18.854 541 H ASP 72 H ASP 72 7.585 2.767 -19.458 542 HA ASP 72 HA ASP 72 7.538 4.437 -21.902 543 HB2 ASP 72 2HB ASP 72 7.796 2.043 -22.530 544 HB3 ASP 72 3HB ASP 72 6.429 1.607 -21.515 545 H ILE 73 H ILE 73 6.122 6.026 -21.365 546 HA ILE 73 HA ILE 73 4.109 5.623 -19.302 547 HB ILE 73 HB ILE 73 4.841 8.130 -20.879 548 HG12 ILE 73 2HG1 ILE 73 6.678 7.304 -19.390 549 HG13 ILE 73 3HG1 ILE 73 6.046 8.851 -18.847 550 HG21 ILE 73 1HG2 ILE 73 3.551 9.374 -19.158 551 HG22 ILE 73 2HG2 ILE 73 3.035 7.842 -18.447 552 HG23 ILE 73 3HG2 ILE 73 2.526 8.274 -20.080 553 HD11 ILE 73 1HD1 ILE 73 5.426 6.153 -17.636 554 HD12 ILE 73 2HD1 ILE 73 4.781 7.699 -17.078 555 HD13 ILE 73 3HD1 ILE 73 6.512 7.377 -16.983 556 HA PRO 74 HA PRO 74 1.141 4.717 -22.679 557 HB2 PRO 74 2HB PRO 74 -0.686 3.757 -20.571 558 HB3 PRO 74 3HB PRO 74 0.142 2.815 -21.825 559 HG2 PRO 74 2HG PRO 74 0.766 2.575 -19.201 560 HG3 PRO 74 3HG PRO 74 1.973 2.369 -20.492 561 HD2 PRO 74 2HD PRO 74 1.440 4.816 -18.796 562 HD3 PRO 74 3HD PRO 74 2.995 4.040 -19.189 563 HA PRO 75 HA PRO 75 -1.255 8.418 -22.655 564 HB2 PRO 75 2HB PRO 75 -3.624 7.668 -23.937 565 HB3 PRO 75 3HB PRO 75 -2.084 7.977 -24.765 566 HG2 PRO 75 2HG PRO 75 -3.286 5.349 -23.950 567 HG3 PRO 75 3HG PRO 75 -2.451 5.787 -25.458 568 HD2 PRO 75 2HD PRO 75 -1.187 4.403 -23.519 569 HD3 PRO 75 3HD PRO 75 -0.322 5.613 -24.494 570 H TYR 76 H TYR 76 -3.665 5.825 -21.957 571 HA TYR 76 HA TYR 76 -5.381 7.412 -20.390 572 HB2 TYR 76 2HB TYR 76 -6.241 5.355 -21.363 573 HB3 TYR 76 3HB TYR 76 -5.046 4.383 -20.514 574 HD1 TYR 76 HD1 TYR 76 -8.047 6.552 -19.973 575 HD2 TYR 76 HD2 TYR 76 -5.538 3.508 -18.302 576 HE1 TYR 76 HE1 TYR 76 -9.620 6.276 -18.103 577 HE2 TYR 76 HE2 TYR 76 -7.120 3.235 -16.437 578 HH TYR 76 HH TYR 76 -10.235 4.442 -16.475 579 H ASP 77 H ASP 77 -2.687 5.305 -19.513 580 HA ASP 77 HA ASP 77 -3.155 5.232 -16.713 581 HB2 ASP 77 2HB ASP 77 -0.620 4.638 -18.306 582 HB3 ASP 77 3HB ASP 77 -0.843 4.260 -16.598 583 H ARG 78 H ARG 78 -1.346 7.421 -18.797 584 HA ARG 78 HA ARG 78 -0.014 8.897 -16.742 585 HB2 ARG 78 2HB ARG 78 0.675 8.965 -19.161 586 HB3 ARG 78 3HB ARG 78 -0.801 9.846 -19.536 587 HG2 ARG 78 2HG ARG 78 -0.051 11.714 -18.093 588 HG3 ARG 78 3HG ARG 78 1.419 10.822 -17.701 589 HD2 ARG 78 2HD ARG 78 2.034 10.878 -20.131 590 HD3 ARG 78 3HD ARG 78 0.614 11.892 -20.430 591 HE ARG 78 HE ARG 78 2.412 12.897 -18.389 592 HH11 ARG 78 1HH1 ARG 78 1.684 12.975 -21.836 593 HH12 ARG 78 2HH1 ARG 78 2.518 14.470 -22.093 594 HH21 ARG 78 1HH2 ARG 78 3.519 14.844 -18.765 595 HH22 ARG 78 2HH2 ARG 78 3.556 15.525 -20.358 596 H ASP 79 H ASP 79 -3.058 9.299 -18.531 597 HA ASP 79 HA ASP 79 -3.900 11.707 -17.238 598 HB2 ASP 79 2HB ASP 79 -5.451 9.654 -18.865 599 HB3 ASP 79 3HB ASP 79 -6.168 11.145 -18.263 600 H PHE 80 H PHE 80 -4.102 8.351 -16.411 601 HA PHE 80 HA PHE 80 -6.168 8.370 -14.478 602 HB2 PHE 80 2HB PHE 80 -5.352 6.255 -15.405 603 HB3 PHE 80 3HB PHE 80 -3.723 6.566 -14.823 604 HD1 PHE 80 HD1 PHE 80 -3.087 5.986 -12.552 605 HD2 PHE 80 HD2 PHE 80 -7.185 5.727 -13.766 606 HE1 PHE 80 HE1 PHE 80 -3.637 4.819 -10.464 607 HE2 PHE 80 HE2 PHE 80 -7.712 4.559 -11.675 608 HZ PHE 80 HZ PHE 80 -5.951 4.111 -10.024 609 H CYS 81 H CYS 81 -2.684 8.966 -14.308 610 HA CYS 81 HA CYS 81 -2.484 9.326 -11.483 611 HB2 CYS 81 2HB CYS 81 -0.643 10.310 -13.698 612 HB3 CYS 81 3HB CYS 81 -0.225 10.174 -11.988 613 HG CYS 81 HG CYS 81 -1.290 7.347 -13.496 614 H LYS 82 H LYS 82 -3.433 11.398 -14.131 615 HA LYS 82 HA LYS 82 -3.124 13.918 -12.757 616 HB2 LYS 82 2HB LYS 82 -4.785 13.265 -15.231 617 HB3 LYS 82 3HB LYS 82 -4.353 14.882 -14.669 618 HG2 LYS 82 2HG LYS 82 -1.991 14.443 -15.129 619 HG3 LYS 82 3HG LYS 82 -2.371 12.777 -15.595 620 HD2 LYS 82 2HD LYS 82 -3.845 13.729 -17.438 621 HD3 LYS 82 3HD LYS 82 -3.212 15.330 -17.037 622 HE2 LYS 82 2HE LYS 82 -0.954 14.597 -17.621 623 HE3 LYS 82 3HE LYS 82 -1.532 12.957 -17.919 624 HZ1 LYS 82 1HZ LYS 82 -1.264 14.181 -19.970 625 HZ2 LYS 82 2HZ LYS 82 -2.332 15.378 -19.436 626 HZ3 LYS 82 3HZ LYS 82 -2.895 13.810 -19.717 627 H VAL 83 H VAL 83 -4.208 13.536 -10.797 628 HA VAL 83 HA VAL 83 -7.168 13.703 -10.905 629 HB VAL 83 HB VAL 83 -7.227 12.351 -8.736 630 HG11 VAL 83 1HG1 VAL 83 -6.255 10.856 -11.200 631 HG12 VAL 83 2HG1 VAL 83 -7.923 11.323 -10.856 632 HG13 VAL 83 3HG1 VAL 83 -7.107 10.142 -9.827 633 HG21 VAL 83 1HG2 VAL 83 -4.851 12.577 -8.113 634 HG22 VAL 83 2HG2 VAL 83 -4.373 11.620 -9.518 635 HG23 VAL 83 3HG2 VAL 83 -5.309 10.876 -8.216 636 H ASP 84 H ASP 84 -8.096 14.590 -8.936 637 HA ASP 84 HA ASP 84 -6.864 17.036 -8.126 638 HB2 ASP 84 2HB ASP 84 -9.451 16.244 -8.322 639 HB3 ASP 84 3HB ASP 84 -9.229 15.859 -6.624 640 H GLN 85 H GLN 85 -6.512 17.603 -5.755 641 HA GLN 85 HA GLN 85 -4.569 15.940 -4.606 642 HB2 GLN 85 2HB GLN 85 -4.648 18.403 -4.295 643 HB3 GLN 85 3HB GLN 85 -6.065 18.231 -3.271 644 HG2 GLN 85 2HG GLN 85 -4.054 18.617 -1.940 645 HG3 GLN 85 3HG GLN 85 -4.745 17.029 -1.595 646 HE21 GLN 85 1HE2 GLN 85 -2.741 16.357 -0.761 647 HE22 GLN 85 2HE2 GLN 85 -1.410 15.954 -1.781 648 HA PRO 86 HA PRO 86 -7.874 14.383 -1.284 649 HB2 PRO 86 2HB PRO 86 -10.542 14.491 -2.063 650 HB3 PRO 86 3HB PRO 86 -9.764 15.727 -1.051 651 HG2 PRO 86 2HG PRO 86 -10.261 15.764 -4.014 652 HG3 PRO 86 3HG PRO 86 -10.526 17.052 -2.812 653 HD2 PRO 86 2HD PRO 86 -8.339 17.071 -4.372 654 HD3 PRO 86 3HD PRO 86 -8.248 17.593 -2.681 655 H THR 87 H THR 87 -8.763 14.228 -4.725 656 HA THR 87 HA THR 87 -9.763 11.600 -4.844 657 HB THR 87 HB THR 87 -8.468 13.190 -7.110 658 HG1 THR 87 HG1 THR 87 -11.078 13.344 -5.978 659 HG21 THR 87 1HG2 THR 87 -9.035 10.848 -7.722 660 HG22 THR 87 2HG2 THR 87 -10.075 12.001 -8.560 661 HG23 THR 87 3HG2 THR 87 -10.694 11.110 -7.169 662 H LEU 88 H LEU 88 -6.503 12.872 -4.992 663 HA LEU 88 HA LEU 88 -5.138 10.619 -6.054 664 HB2 LEU 88 2HB LEU 88 -4.438 13.193 -5.626 665 HB3 LEU 88 3HB LEU 88 -3.756 12.522 -4.161 666 HG LEU 88 HG LEU 88 -3.023 11.683 -6.997 667 HD11 LEU 88 1HD1 LEU 88 -2.256 13.932 -6.528 668 HD12 LEU 88 2HD1 LEU 88 -0.893 12.821 -6.608 669 HD13 LEU 88 3HD1 LEU 88 -1.474 13.391 -5.038 670 HD21 LEU 88 1HD2 LEU 88 -1.154 10.436 -5.979 671 HD22 LEU 88 2HD2 LEU 88 -2.719 9.811 -5.464 672 HD23 LEU 88 3HD2 LEU 88 -1.775 10.820 -4.369 673 H PHE 89 H PHE 89 -5.799 11.757 -2.753 674 HA PHE 89 HA PHE 89 -4.518 9.572 -1.427 675 HB2 PHE 89 2HB PHE 89 -6.500 11.648 -0.405 676 HB3 PHE 89 3HB PHE 89 -5.672 10.478 0.627 677 HD1 PHE 89 HD1 PHE 89 -2.934 10.536 -0.724 678 HD2 PHE 89 HD2 PHE 89 -5.557 13.703 0.456 679 HE1 PHE 89 HE1 PHE 89 -1.011 12.040 -0.479 680 HE2 PHE 89 HE2 PHE 89 -3.626 15.198 0.700 681 HZ PHE 89 HZ PHE 89 -1.353 14.373 0.234 682 H GLU 90 H GLU 90 -7.795 10.162 -2.590 683 HA GLU 90 HA GLU 90 -9.143 7.960 -1.488 684 HB2 GLU 90 2HB GLU 90 -9.489 9.370 -4.162 685 HB3 GLU 90 3HB GLU 90 -10.593 8.123 -3.591 686 HG2 GLU 90 2HG GLU 90 -10.057 10.690 -2.079 687 HG3 GLU 90 3HG GLU 90 -11.342 10.516 -3.269 688 H LEU 91 H LEU 91 -7.091 8.230 -4.396 689 HA LEU 91 HA LEU 91 -7.363 5.582 -5.358 690 HB2 LEU 91 2HB LEU 91 -5.100 7.585 -5.677 691 HB3 LEU 91 3HB LEU 91 -5.113 6.029 -6.491 692 HG LEU 91 HG LEU 91 -7.126 8.275 -6.934 693 HD11 LEU 91 1HD1 LEU 91 -6.084 8.500 -9.147 694 HD12 LEU 91 2HD1 LEU 91 -4.896 7.261 -8.731 695 HD13 LEU 91 3HD1 LEU 91 -4.914 8.799 -7.860 696 HD21 LEU 91 1HD2 LEU 91 -6.888 5.587 -8.335 697 HD22 LEU 91 2HD2 LEU 91 -7.994 6.892 -8.772 698 HD23 LEU 91 3HD2 LEU 91 -8.174 6.070 -7.226 699 H ILE 92 H ILE 92 -5.133 7.035 -2.983 700 HA ILE 92 HA ILE 92 -3.458 4.763 -2.591 701 HB ILE 92 HB ILE 92 -4.011 7.057 -0.637 702 HG12 ILE 92 2HG1 ILE 92 -1.845 6.750 -2.772 703 HG13 ILE 92 3HG1 ILE 92 -3.141 7.940 -2.758 704 HG21 ILE 92 1HG2 ILE 92 -1.682 5.095 -0.686 705 HG22 ILE 92 2HG2 ILE 92 -2.993 5.111 0.496 706 HG23 ILE 92 3HG2 ILE 92 -1.859 6.460 0.425 707 HD11 ILE 92 1HD1 ILE 92 -2.113 8.944 -0.730 708 HD12 ILE 92 2HD1 ILE 92 -1.085 8.996 -2.159 709 HD13 ILE 92 3HD1 ILE 92 -0.770 7.808 -0.895 710 H LEU 93 H LEU 93 -6.411 5.926 -0.975 711 HA LEU 93 HA LEU 93 -6.593 3.990 1.080 712 HB2 LEU 93 2HB LEU 93 -8.765 5.636 -0.281 713 HB3 LEU 93 3HB LEU 93 -9.048 4.646 1.144 714 HG LEU 93 HG LEU 93 -7.188 7.061 1.022 715 HD11 LEU 93 1HD1 LEU 93 -8.854 8.200 2.418 716 HD12 LEU 93 2HD1 LEU 93 -9.921 6.797 2.312 717 HD13 LEU 93 3HD1 LEU 93 -9.535 7.727 0.861 718 HD21 LEU 93 1HD2 LEU 93 -7.014 6.834 3.470 719 HD22 LEU 93 2HD2 LEU 93 -6.386 5.408 2.650 720 HD23 LEU 93 3HD2 LEU 93 -7.978 5.353 3.412 721 H ALA 94 H ALA 94 -7.789 4.050 -2.261 722 HA ALA 94 HA ALA 94 -9.299 1.604 -2.118 723 HB1 ALA 94 1HB ALA 94 -9.873 3.380 -3.719 724 HB2 ALA 94 2HB ALA 94 -9.534 1.862 -4.553 725 HB3 ALA 94 3HB ALA 94 -8.329 3.153 -4.543 726 H ALA 95 H ALA 95 -6.025 2.479 -3.094 727 HA ALA 95 HA ALA 95 -5.341 -0.006 -4.349 728 HB1 ALA 95 1HB ALA 95 -4.199 2.117 -4.878 729 HB2 ALA 95 2HB ALA 95 -3.061 0.869 -4.374 730 HB3 ALA 95 3HB ALA 95 -3.516 2.156 -3.251 731 H ASN 96 H ASN 96 -5.130 1.274 -1.089 732 HA ASN 96 HA ASN 96 -3.676 -0.915 0.080 733 HB2 ASN 96 2HB ASN 96 -3.657 1.292 1.149 734 HB3 ASN 96 3HB ASN 96 -5.407 1.283 1.303 735 HD21 ASN 96 1HD2 ASN 96 -5.177 1.650 3.555 736 HD22 ASN 96 2HD2 ASN 96 -4.732 0.394 4.646 737 H TYR 97 H TYR 97 -7.090 0.066 -0.066 738 HA TYR 97 HA TYR 97 -8.247 -1.949 1.505 739 HB2 TYR 97 2HB TYR 97 -9.407 0.131 0.943 740 HB3 TYR 97 3HB TYR 97 -9.409 -0.281 -0.767 741 HD1 TYR 97 HD1 TYR 97 -11.424 -1.138 -1.648 742 HD2 TYR 97 HD2 TYR 97 -10.621 -1.700 2.518 743 HE1 TYR 97 HE1 TYR 97 -13.634 -2.156 -1.355 744 HE2 TYR 97 HE2 TYR 97 -12.839 -2.724 2.801 745 HH TYR 97 HH TYR 97 -14.739 -3.756 0.248 746 H LEU 98 H LEU 98 -7.622 -1.840 -1.970 747 HA LEU 98 HA LEU 98 -8.797 -4.496 -2.428 748 HB2 LEU 98 2HB LEU 98 -7.733 -2.407 -4.375 749 HB3 LEU 98 3HB LEU 98 -8.440 -3.944 -4.852 750 HG LEU 98 HG LEU 98 -9.892 -1.656 -3.456 751 HD11 LEU 98 1HD1 LEU 98 -10.188 -2.746 -6.276 752 HD12 LEU 98 2HD1 LEU 98 -9.460 -1.203 -5.823 753 HD13 LEU 98 3HD1 LEU 98 -11.180 -1.476 -5.546 754 HD21 LEU 98 1HD2 LEU 98 -10.757 -3.794 -2.642 755 HD22 LEU 98 2HD2 LEU 98 -10.966 -4.375 -4.297 756 HD23 LEU 98 3HD2 LEU 98 -11.937 -3.027 -3.702 757 H ASP 99 H ASP 99 -5.829 -3.093 -1.740 758 HA ASP 99 HA ASP 99 -3.661 -3.593 -1.854 759 HB2 ASP 99 2HB ASP 99 -4.489 -5.374 -0.297 760 HB3 ASP 99 3HB ASP 99 -4.610 -6.479 -1.665 761 H ILE 100 H ILE 100 -3.630 -2.772 -4.046 762 HA ILE 100 HA ILE 100 -2.939 -4.822 -6.081 763 HB ILE 100 HB ILE 100 -3.977 -2.004 -6.649 764 HG12 ILE 100 2HG1 ILE 100 -5.562 -4.613 -6.742 765 HG13 ILE 100 3HG1 ILE 100 -5.759 -3.348 -5.535 766 HG21 ILE 100 1HG2 ILE 100 -4.277 -2.827 -8.964 767 HG22 ILE 100 2HG2 ILE 100 -3.620 -4.397 -8.498 768 HG23 ILE 100 3HG2 ILE 100 -2.593 -2.960 -8.451 769 HD11 ILE 100 1HD1 ILE 100 -6.348 -3.091 -8.486 770 HD12 ILE 100 2HD1 ILE 100 -6.522 -1.810 -7.281 771 HD13 ILE 100 3HD1 ILE 100 -7.523 -3.259 -7.180 772 H LYS 101 H LYS 101 -0.752 -4.883 -6.133 773 HA LYS 101 HA LYS 101 0.987 -2.912 -5.201 774 HB2 LYS 101 2HB LYS 101 1.337 -5.476 -6.704 775 HB3 LYS 101 3HB LYS 101 2.690 -4.363 -6.747 776 HG2 LYS 101 2HG LYS 101 2.935 -6.038 -4.968 777 HG3 LYS 101 3HG LYS 101 2.887 -4.390 -4.340 778 HD2 LYS 101 2HD LYS 101 0.518 -4.724 -3.646 779 HD3 LYS 101 3HD LYS 101 0.561 -6.369 -4.291 780 HE2 LYS 101 2HE LYS 101 2.306 -6.972 -2.658 781 HE3 LYS 101 3HE LYS 101 2.312 -5.321 -2.039 782 HZ1 LYS 101 1HZ LYS 101 0.075 -5.598 -1.290 783 HZ2 LYS 101 2HZ LYS 101 1.027 -6.842 -0.664 784 HZ3 LYS 101 3HZ LYS 101 -0.026 -7.147 -1.955 785 HA PRO 102 HA PRO 102 1.742 -1.527 -9.966 786 HB2 PRO 102 2HB PRO 102 -1.075 -2.085 -10.938 787 HB3 PRO 102 3HB PRO 102 0.461 -2.143 -11.832 788 HG2 PRO 102 2HG PRO 102 -0.697 -4.405 -11.098 789 HG3 PRO 102 3HG PRO 102 1.065 -4.219 -10.956 790 HD2 PRO 102 2HD PRO 102 -1.014 -4.085 -8.783 791 HD3 PRO 102 3HD PRO 102 0.593 -4.834 -8.758 792 H LEU 103 H LEU 103 -1.545 -1.262 -8.571 793 HA LEU 103 HA LEU 103 -2.068 1.420 -9.387 794 HB2 LEU 103 2HB LEU 103 -3.655 -0.554 -8.455 795 HB3 LEU 103 3HB LEU 103 -3.380 0.232 -6.923 796 HG LEU 103 HG LEU 103 -5.505 0.956 -7.840 797 HD11 LEU 103 1HD1 LEU 103 -5.305 3.399 -7.891 798 HD12 LEU 103 2HD1 LEU 103 -3.554 3.264 -8.065 799 HD13 LEU 103 3HD1 LEU 103 -4.339 2.701 -6.590 800 HD21 LEU 103 1HD2 LEU 103 -4.010 1.874 -10.307 801 HD22 LEU 103 2HD2 LEU 103 -5.737 2.074 -9.994 802 HD23 LEU 103 3HD2 LEU 103 -5.060 0.460 -10.190 803 H LEU 104 H LEU 104 -1.077 -0.022 -6.291 804 HA LEU 104 HA LEU 104 -1.058 2.282 -4.705 805 HB2 LEU 104 2HB LEU 104 -1.104 -0.054 -3.846 806 HB3 LEU 104 3HB LEU 104 0.553 -0.274 -4.358 807 HG LEU 104 HG LEU 104 1.282 1.461 -2.708 808 HD11 LEU 104 1HD1 LEU 104 -0.280 2.281 -0.990 809 HD12 LEU 104 2HD1 LEU 104 -1.625 1.503 -1.830 810 HD13 LEU 104 3HD1 LEU 104 -0.741 2.823 -2.603 811 HD21 LEU 104 1HD2 LEU 104 -0.325 -0.805 -1.483 812 HD22 LEU 104 2HD2 LEU 104 0.966 0.103 -0.690 813 HD23 LEU 104 3HD2 LEU 104 1.332 -0.909 -2.087 814 H ASP 105 H ASP 105 1.563 0.624 -6.446 815 HA ASP 105 HA ASP 105 3.707 2.165 -5.472 816 HB2 ASP 105 2HB ASP 105 3.956 -0.092 -6.550 817 HB3 ASP 105 3HB ASP 105 3.595 0.633 -8.114 818 H VAL 106 H VAL 106 1.930 2.352 -8.564 819 HA VAL 106 HA VAL 106 3.257 4.551 -9.689 820 HB VAL 106 HB VAL 106 0.449 3.441 -10.095 821 HG11 VAL 106 1HG1 VAL 106 1.734 5.644 -11.759 822 HG12 VAL 106 2HG1 VAL 106 0.327 5.826 -10.707 823 HG13 VAL 106 3HG1 VAL 106 0.226 4.806 -12.142 824 HG21 VAL 106 1HG2 VAL 106 1.412 2.583 -12.221 825 HG22 VAL 106 2HG2 VAL 106 2.311 1.999 -10.819 826 HG23 VAL 106 3HG2 VAL 106 2.968 3.308 -11.805 827 H THR 107 H THR 107 0.413 4.449 -7.549 828 HA THR 107 HA THR 107 -0.136 7.260 -7.626 829 HB THR 107 HB THR 107 -1.085 5.150 -5.635 830 HG1 THR 107 HG1 THR 107 -1.554 4.834 -7.954 831 HG21 THR 107 1HG2 THR 107 -3.004 6.644 -5.254 832 HG22 THR 107 2HG2 THR 107 -2.300 7.845 -6.339 833 HG23 THR 107 3HG2 THR 107 -1.497 7.454 -4.817 834 H CYS 108 H CYS 108 1.825 5.194 -5.540 835 HA CYS 108 HA CYS 108 2.386 7.133 -3.495 836 HB2 CYS 108 2HB CYS 108 3.846 4.567 -4.247 837 HB3 CYS 108 3HB CYS 108 4.187 5.530 -2.808 838 HG CYS 108 HG CYS 108 1.003 4.510 -3.210 839 H LYS 109 H LYS 109 3.826 6.211 -6.567 840 HA LYS 109 HA LYS 109 6.179 7.843 -6.323 841 HB2 LYS 109 2HB LYS 109 4.981 6.141 -8.498 842 HB3 LYS 109 3HB LYS 109 6.072 7.420 -9.011 843 HG2 LYS 109 2HG LYS 109 7.190 5.194 -8.701 844 HG3 LYS 109 3HG LYS 109 7.902 6.507 -7.760 845 HD2 LYS 109 2HD LYS 109 6.708 5.695 -5.728 846 HD3 LYS 109 3HD LYS 109 6.002 4.384 -6.676 847 HE2 LYS 109 2HE LYS 109 8.981 4.770 -6.246 848 HE3 LYS 109 3HE LYS 109 7.968 3.680 -5.298 849 HZ1 LYS 109 1HZ LYS 109 9.160 2.553 -7.089 850 HZ2 LYS 109 2HZ LYS 109 8.358 3.504 -8.231 851 HZ3 LYS 109 3HZ LYS 109 7.486 2.424 -7.274 852 H THR 110 H THR 110 2.900 8.321 -7.519 853 HA THR 110 HA THR 110 3.244 10.726 -8.934 854 HB THR 110 HB THR 110 0.781 9.862 -7.340 855 HG1 THR 110 HG1 THR 110 1.853 8.595 -9.280 856 HG21 THR 110 1HG2 THR 110 1.021 11.815 -9.668 857 HG22 THR 110 2HG2 THR 110 0.645 12.241 -7.997 858 HG23 THR 110 3HG2 THR 110 -0.494 11.277 -8.939 859 H VAL 111 H VAL 111 2.306 10.242 -5.473 860 HA VAL 111 HA VAL 111 2.381 12.976 -4.752 861 HB VAL 111 HB VAL 111 2.459 12.221 -2.363 862 HG11 VAL 111 1HG1 VAL 111 0.263 11.104 -2.329 863 HG12 VAL 111 2HG1 VAL 111 0.411 10.746 -4.052 864 HG13 VAL 111 3HG1 VAL 111 0.295 12.422 -3.507 865 HG21 VAL 111 1HG2 VAL 111 2.347 9.813 -1.807 866 HG22 VAL 111 2HG2 VAL 111 3.871 10.218 -2.601 867 HG23 VAL 111 3HG2 VAL 111 2.597 9.406 -3.511 868 H ALA 112 H ALA 112 4.879 10.511 -4.843 869 HA ALA 112 HA ALA 112 6.924 11.937 -3.476 870 HB1 ALA 112 1HB ALA 112 7.179 9.731 -5.551 871 HB2 ALA 112 2HB ALA 112 7.001 9.494 -3.809 872 HB3 ALA 112 3HB ALA 112 8.451 10.271 -4.449 873 H ASN 113 H ASN 113 5.866 11.849 -6.860 874 HA ASN 113 HA ASN 113 8.083 13.314 -7.948 875 HB2 ASN 113 2HB ASN 113 5.345 12.629 -9.093 876 HB3 ASN 113 3HB ASN 113 6.542 13.553 -9.998 877 HD21 ASN 113 1HD2 ASN 113 5.371 10.924 -10.564 878 HD22 ASN 113 2HD2 ASN 113 6.701 9.836 -10.712 879 H MET 114 H MET 114 4.949 14.199 -6.604 880 HA MET 114 HA MET 114 4.844 16.881 -7.550 881 HB2 MET 114 2HB MET 114 3.557 15.704 -5.045 882 HB3 MET 114 3HB MET 114 3.160 17.266 -5.754 883 HG2 MET 114 2HG MET 114 2.483 16.012 -7.855 884 HG3 MET 114 3HG MET 114 2.628 14.526 -6.913 885 HE1 MET 114 1HE MET 114 1.605 15.785 -4.004 886 HE2 MET 114 2HE MET 114 1.118 14.182 -4.562 887 HE3 MET 114 3HE MET 114 -0.103 15.349 -4.067 888 H ILE 115 H ILE 115 6.233 15.407 -4.635 889 HA ILE 115 HA ILE 115 7.158 17.986 -3.590 890 HB ILE 115 HB ILE 115 8.020 16.704 -1.657 891 HG12 ILE 115 2HG1 ILE 115 6.916 14.194 -3.020 892 HG13 ILE 115 3HG1 ILE 115 8.624 14.600 -2.938 893 HG21 ILE 115 1HG2 ILE 115 5.155 15.960 -2.354 894 HG22 ILE 115 2HG2 ILE 115 5.687 17.472 -1.614 895 HG23 ILE 115 3HG2 ILE 115 5.856 15.955 -0.731 896 HD11 ILE 115 1HD1 ILE 115 7.948 12.923 -1.289 897 HD12 ILE 115 2HD1 ILE 115 6.873 14.100 -0.538 898 HD13 ILE 115 3HD1 ILE 115 8.616 14.372 -0.548 899 H ARG 116 H ARG 116 8.339 15.771 -5.842 900 HA ARG 116 HA ARG 116 11.147 15.909 -5.090 901 HB2 ARG 116 2HB ARG 116 10.007 13.894 -6.240 902 HB3 ARG 116 3HB ARG 116 10.049 14.840 -7.723 903 HG2 ARG 116 2HG ARG 116 11.938 13.290 -7.649 904 HG3 ARG 116 3HG ARG 116 12.533 14.954 -7.563 905 HD2 ARG 116 2HD ARG 116 12.821 14.753 -5.140 906 HD3 ARG 116 3HD ARG 116 12.108 13.139 -5.165 907 HE ARG 116 HE ARG 116 14.492 13.460 -6.786 908 HH11 ARG 116 1HH1 ARG 116 13.238 12.588 -3.606 909 HH12 ARG 116 2HH1 ARG 116 14.644 11.677 -3.166 910 HH21 ARG 116 1HH2 ARG 116 16.333 12.257 -6.189 911 HH22 ARG 116 2HH2 ARG 116 16.402 11.489 -4.637 912 H GLY 117 H GLY 117 11.481 18.175 -5.136 913 HA2 GLY 117 2HA GLY 117 12.751 19.227 -7.335 914 HA3 GLY 117 3HA GLY 117 11.084 19.783 -7.489 915 H1 SER 2 1H SER 2 17.673 -14.890 18.170 916 H2 SER 2 2H SER 2 16.490 -14.217 17.180 917 H3 SER 2 3H SER 2 17.107 -13.330 18.474 918 HA SER 2 HA SER 2 19.265 -13.265 17.455 919 HB2 SER 2 2HB SER 2 19.477 -14.072 15.075 920 HB3 SER 2 3HB SER 2 19.174 -15.376 16.225 921 HG SER 2 HG SER 2 17.889 -15.237 14.152 922 H LEU 3 H LEU 3 19.817 -11.540 16.009 923 HA LEU 3 HA LEU 3 17.574 -9.785 15.209 924 HB2 LEU 3 2HB LEU 3 20.530 -9.120 15.577 925 HB3 LEU 3 3HB LEU 3 19.265 -7.969 15.168 926 HG LEU 3 HG LEU 3 19.477 -9.483 17.807 927 HD11 LEU 3 1HD1 LEU 3 20.100 -6.580 17.182 928 HD12 LEU 3 2HD1 LEU 3 21.268 -7.844 17.575 929 HD13 LEU 3 3HD1 LEU 3 20.102 -7.323 18.788 930 HD21 LEU 3 1HD2 LEU 3 17.144 -8.984 17.249 931 HD22 LEU 3 2HD2 LEU 3 17.547 -7.287 16.968 932 HD23 LEU 3 3HD2 LEU 3 17.688 -7.977 18.588 933 H VAL 4 H VAL 4 17.356 -9.188 13.085 934 HA VAL 4 HA VAL 4 19.271 -10.213 11.074 935 HB VAL 4 HB VAL 4 17.402 -9.791 9.391 936 HG11 VAL 4 1HG1 VAL 4 17.900 -12.060 10.184 937 HG12 VAL 4 2HG1 VAL 4 16.163 -11.867 9.930 938 HG13 VAL 4 3HG1 VAL 4 16.826 -11.835 11.567 939 HG21 VAL 4 1HG2 VAL 4 15.075 -9.614 10.227 940 HG22 VAL 4 2HG2 VAL 4 16.035 -8.214 10.708 941 HG23 VAL 4 3HG2 VAL 4 15.677 -9.480 11.883 942 H LYS 5 H LYS 5 20.221 -8.834 9.676 943 HA LYS 5 HA LYS 5 20.306 -6.006 10.451 944 HB2 LYS 5 2HB LYS 5 22.120 -7.643 8.627 945 HB3 LYS 5 3HB LYS 5 22.419 -5.985 9.144 946 HG2 LYS 5 2HG LYS 5 22.689 -6.727 11.457 947 HG3 LYS 5 3HG LYS 5 22.278 -8.384 11.004 948 HD2 LYS 5 2HD LYS 5 24.302 -8.547 9.635 949 HD3 LYS 5 3HD LYS 5 24.683 -6.848 9.935 950 HE2 LYS 5 2HE LYS 5 26.055 -8.363 11.329 951 HE3 LYS 5 3HE LYS 5 25.030 -7.318 12.313 952 HZ1 LYS 5 1HZ LYS 5 24.994 -9.550 13.152 953 HZ2 LYS 5 2HZ LYS 5 24.513 -10.163 11.656 954 HZ3 LYS 5 3HZ LYS 5 23.469 -9.172 12.531 955 H LEU 6 H LEU 6 19.075 -4.619 9.306 956 HA LEU 6 HA LEU 6 18.760 -4.981 6.372 957 HB2 LEU 6 2HB LEU 6 16.867 -3.500 8.267 958 HB3 LEU 6 3HB LEU 6 16.703 -3.582 6.525 959 HG LEU 6 HG LEU 6 15.081 -5.073 7.379 960 HD11 LEU 6 1HD1 LEU 6 17.405 -6.826 6.547 961 HD12 LEU 6 2HD1 LEU 6 16.275 -6.003 5.469 962 HD13 LEU 6 3HD1 LEU 6 15.695 -7.274 6.540 963 HD21 LEU 6 1HD2 LEU 6 15.872 -5.251 9.682 964 HD22 LEU 6 2HD2 LEU 6 17.160 -6.348 9.178 965 HD23 LEU 6 3HD2 LEU 6 15.469 -6.837 9.028 966 H GLU 7 H GLU 7 20.442 -3.730 5.593 967 HA GLU 7 HA GLU 7 21.149 -1.177 6.687 968 HB2 GLU 7 2HB GLU 7 21.762 -2.351 3.936 969 HB3 GLU 7 3HB GLU 7 22.406 -0.825 4.525 970 HG2 GLU 7 2HG GLU 7 24.122 -2.445 4.793 971 HG3 GLU 7 3HG GLU 7 23.505 -2.081 6.403 972 H SER 8 H SER 8 20.517 0.830 6.033 973 HA SER 8 HA SER 8 18.164 1.101 4.323 974 HB2 SER 8 2HB SER 8 18.324 3.514 5.081 975 HB3 SER 8 3HB SER 8 18.148 2.356 6.402 976 HG SER 8 HG SER 8 20.202 2.665 6.992 977 H SER 9 H SER 9 18.273 3.001 2.750 978 HA SER 9 HA SER 9 20.314 2.851 0.830 979 HB2 SER 9 2HB SER 9 17.998 3.727 0.412 980 HB3 SER 9 3HB SER 9 18.395 5.176 1.334 981 HG SER 9 HG SER 9 19.612 4.277 -1.070 982 H ASP 10 H ASP 10 20.064 4.554 3.799 983 HA ASP 10 HA ASP 10 22.146 6.532 3.346 984 HB2 ASP 10 2HB ASP 10 20.045 6.988 4.659 985 HB3 ASP 10 3HB ASP 10 20.554 5.804 5.850 986 H GLU 11 H GLU 11 22.295 3.297 3.819 987 HA GLU 11 HA GLU 11 23.955 1.850 4.228 988 HB2 GLU 11 2HB GLU 11 25.661 4.300 4.806 989 HB3 GLU 11 3HB GLU 11 26.295 2.658 4.713 990 HG2 GLU 11 2HG GLU 11 24.982 4.203 2.450 991 HG3 GLU 11 3HG GLU 11 26.712 3.920 2.649 992 H LYS 12 H LYS 12 22.335 3.316 6.536 993 HA LYS 12 HA LYS 12 23.881 2.455 8.860 994 HB2 LYS 12 2HB LYS 12 21.186 3.835 8.571 995 HB3 LYS 12 3HB LYS 12 21.746 3.208 10.122 996 HG2 LYS 12 2HG LYS 12 23.765 4.657 9.946 997 HG3 LYS 12 3HG LYS 12 23.121 5.339 8.447 998 HD2 LYS 12 2HD LYS 12 21.217 6.279 9.627 999 HD3 LYS 12 3HD LYS 12 21.660 5.448 11.119 1000 HE2 LYS 12 2HE LYS 12 22.252 7.839 11.207 1001 HE3 LYS 12 3HE LYS 12 23.693 6.826 11.294 1002 HZ1 LYS 12 1HZ LYS 12 23.971 8.729 9.810 1003 HZ2 LYS 12 2HZ LYS 12 22.697 8.180 8.843 1004 HZ3 LYS 12 3HZ LYS 12 24.113 7.270 8.970 1005 H VAL 13 H VAL 13 23.777 0.514 9.703 1006 HA VAL 13 HA VAL 13 22.016 -1.555 8.682 1007 HB VAL 13 HB VAL 13 24.136 -1.711 10.886 1008 HG11 VAL 13 1HG1 VAL 13 22.539 -3.577 11.014 1009 HG12 VAL 13 2HG1 VAL 13 24.115 -4.154 10.471 1010 HG13 VAL 13 3HG1 VAL 13 22.804 -3.947 9.305 1011 HG21 VAL 13 1HG2 VAL 13 24.435 -2.392 7.931 1012 HG22 VAL 13 2HG2 VAL 13 25.671 -2.594 9.174 1013 HG23 VAL 13 3HG2 VAL 13 25.123 -0.975 8.731 1014 H PHE 14 H PHE 14 20.027 -1.875 9.546 1015 HA PHE 14 HA PHE 14 19.480 -1.155 12.364 1016 HB2 PHE 14 2HB PHE 14 17.629 -1.348 9.949 1017 HB3 PHE 14 3HB PHE 14 17.042 -1.153 11.604 1018 HD1 PHE 14 HD1 PHE 14 17.814 0.865 12.946 1019 HD2 PHE 14 HD2 PHE 14 18.383 0.571 8.718 1020 HE1 PHE 14 HE1 PHE 14 18.193 3.287 12.825 1021 HE2 PHE 14 HE2 PHE 14 18.754 2.992 8.612 1022 HZ PHE 14 HZ PHE 14 18.665 4.352 10.661 1023 H GLU 15 H GLU 15 19.901 -2.888 13.528 1024 HA GLU 15 HA GLU 15 19.207 -5.597 12.676 1025 HB2 GLU 15 2HB GLU 15 20.600 -4.645 15.217 1026 HB3 GLU 15 3HB GLU 15 20.493 -6.310 14.642 1027 HG2 GLU 15 2HG GLU 15 21.868 -5.744 12.690 1028 HG3 GLU 15 3HG GLU 15 21.940 -4.060 13.202 1029 H ILE 16 H ILE 16 17.002 -5.645 12.807 1030 HA ILE 16 HA ILE 16 15.648 -5.099 15.384 1031 HB ILE 16 HB ILE 16 14.633 -4.106 13.329 1032 HG12 ILE 16 2HG1 ILE 16 12.931 -6.252 14.680 1033 HG13 ILE 16 3HG1 ILE 16 13.136 -4.585 15.206 1034 HG21 ILE 16 1HG2 ILE 16 14.159 -6.959 12.383 1035 HG22 ILE 16 2HG2 ILE 16 15.317 -5.823 11.691 1036 HG23 ILE 16 3HG2 ILE 16 13.588 -5.487 11.586 1037 HD11 ILE 16 1HD1 ILE 16 10.999 -4.869 14.183 1038 HD12 ILE 16 2HD1 ILE 16 11.724 -5.527 12.720 1039 HD13 ILE 16 3HD1 ILE 16 11.992 -3.841 13.161 1040 H GLU 17 H GLU 17 14.231 -6.767 16.268 1041 HA GLU 17 HA GLU 17 15.275 -9.366 16.369 1042 HB2 GLU 17 2HB GLU 17 12.471 -8.430 17.141 1043 HB3 GLU 17 3HB GLU 17 13.166 -9.986 17.577 1044 HG2 GLU 17 2HG GLU 17 13.402 -8.681 19.516 1045 HG3 GLU 17 3HG GLU 17 15.004 -8.679 18.793 1046 H LYS 18 H LYS 18 14.822 -11.194 15.312 1047 HA LYS 18 HA LYS 18 14.133 -11.000 12.600 1048 HB2 LYS 18 2HB LYS 18 15.793 -12.576 13.478 1049 HB3 LYS 18 3HB LYS 18 14.549 -13.433 14.385 1050 HG2 LYS 18 2HG LYS 18 13.528 -14.232 12.331 1051 HG3 LYS 18 3HG LYS 18 14.629 -13.257 11.353 1052 HD2 LYS 18 2HD LYS 18 16.534 -14.596 12.051 1053 HD3 LYS 18 3HD LYS 18 15.549 -15.480 13.223 1054 HE2 LYS 18 2HE LYS 18 15.148 -15.560 10.208 1055 HE3 LYS 18 3HE LYS 18 15.997 -16.789 11.148 1056 HZ1 LYS 18 1HZ LYS 18 13.966 -17.246 12.351 1057 HZ2 LYS 18 2HZ LYS 18 13.694 -17.400 10.694 1058 HZ3 LYS 18 3HZ LYS 18 13.143 -16.033 11.511 1059 H GLU 19 H GLU 19 12.281 -12.085 15.411 1060 HA GLU 19 HA GLU 19 10.068 -13.239 14.072 1061 HB2 GLU 19 2HB GLU 19 8.869 -13.035 16.223 1062 HB3 GLU 19 3HB GLU 19 10.490 -13.678 16.454 1063 HG2 GLU 19 2HG GLU 19 11.279 -11.523 17.275 1064 HG3 GLU 19 3HG GLU 19 9.721 -10.780 16.934 1065 H ILE 20 H ILE 20 10.831 -9.910 14.955 1066 HA ILE 20 HA ILE 20 8.170 -8.881 14.404 1067 HB ILE 20 HB ILE 20 10.748 -7.313 14.879 1068 HG12 ILE 20 2HG1 ILE 20 8.650 -8.248 16.896 1069 HG13 ILE 20 3HG1 ILE 20 10.311 -8.818 16.793 1070 HG21 ILE 20 1HG2 ILE 20 7.837 -6.456 15.135 1071 HG22 ILE 20 2HG2 ILE 20 8.944 -5.981 13.845 1072 HG23 ILE 20 3HG2 ILE 20 9.245 -5.453 15.498 1073 HD11 ILE 20 1HD1 ILE 20 9.439 -6.027 17.531 1074 HD12 ILE 20 2HD1 ILE 20 11.106 -6.598 17.425 1075 HD13 ILE 20 3HD1 ILE 20 10.015 -7.278 18.630 1076 H ALA 21 H ALA 21 11.256 -9.181 12.730 1077 HA ALA 21 HA ALA 21 10.788 -7.541 10.480 1078 HB1 ALA 21 1HB ALA 21 13.004 -8.431 11.054 1079 HB2 ALA 21 2HB ALA 21 12.571 -8.845 9.393 1080 HB3 ALA 21 3HB ALA 21 12.461 -10.066 10.668 1081 H CYS 22 H CYS 22 9.472 -10.623 11.354 1082 HA CYS 22 HA CYS 22 8.645 -11.569 8.813 1083 HB2 CYS 22 2HB CYS 22 7.440 -12.150 11.541 1084 HB3 CYS 22 3HB CYS 22 7.237 -13.125 10.079 1085 HG CYS 22 HG CYS 22 10.446 -12.724 10.707 1086 H MET 23 H MET 23 7.337 -9.132 10.943 1087 HA MET 23 HA MET 23 4.613 -9.130 10.121 1088 HB2 MET 23 2HB MET 23 6.306 -6.865 11.243 1089 HB3 MET 23 3HB MET 23 4.549 -6.835 11.100 1090 HG2 MET 23 2HG MET 23 4.380 -8.705 12.674 1091 HG3 MET 23 3HG MET 23 6.141 -8.768 12.802 1092 HE1 MET 23 1HE MET 23 3.621 -5.174 14.233 1093 HE2 MET 23 2HE MET 23 2.919 -6.604 13.473 1094 HE3 MET 23 3HE MET 23 3.908 -5.491 12.526 1095 H SER 24 H SER 24 7.483 -7.506 8.901 1096 HA SER 24 HA SER 24 6.207 -6.173 6.692 1097 HB2 SER 24 2HB SER 24 8.402 -5.378 7.486 1098 HB3 SER 24 3HB SER 24 9.122 -6.961 7.184 1099 HG SER 24 HG SER 24 7.877 -5.490 5.125 1100 H VAL 25 H VAL 25 5.224 -7.340 5.125 1101 HA VAL 25 HA VAL 25 5.424 -10.128 4.830 1102 HB VAL 25 HB VAL 25 4.278 -8.061 2.889 1103 HG11 VAL 25 1HG1 VAL 25 4.746 -10.132 1.646 1104 HG12 VAL 25 2HG1 VAL 25 3.005 -9.929 1.848 1105 HG13 VAL 25 3HG1 VAL 25 3.883 -11.084 2.857 1106 HG21 VAL 25 1HG2 VAL 25 3.167 -8.073 5.096 1107 HG22 VAL 25 2HG2 VAL 25 2.888 -9.810 4.962 1108 HG23 VAL 25 3HG2 VAL 25 2.080 -8.699 3.851 1109 H THR 26 H THR 26 6.887 -7.480 2.925 1110 HA THR 26 HA THR 26 8.113 -9.018 0.924 1111 HB THR 26 HB THR 26 8.948 -6.320 2.057 1112 HG1 THR 26 HG1 THR 26 7.814 -5.621 0.100 1113 HG21 THR 26 1HG2 THR 26 9.765 -7.611 -0.579 1114 HG22 THR 26 2HG2 THR 26 10.835 -7.293 0.790 1115 HG23 THR 26 3HG2 THR 26 10.114 -5.949 -0.099 1116 H ILE 27 H ILE 27 9.553 -7.765 3.999 1117 HA ILE 27 HA ILE 27 12.127 -8.878 3.649 1118 HB ILE 27 HB ILE 27 10.699 -8.118 6.238 1119 HG12 ILE 27 2HG1 ILE 27 12.779 -6.604 4.579 1120 HG13 ILE 27 3HG1 ILE 27 11.066 -6.213 4.688 1121 HG21 ILE 27 1HG2 ILE 27 13.657 -8.751 5.868 1122 HG22 ILE 27 2HG2 ILE 27 12.492 -9.734 6.756 1123 HG23 ILE 27 3HG2 ILE 27 12.915 -8.128 7.348 1124 HD11 ILE 27 1HD1 ILE 27 11.357 -5.707 7.081 1125 HD12 ILE 27 2HD1 ILE 27 12.365 -4.702 6.041 1126 HD13 ILE 27 3HD1 ILE 27 13.084 -6.046 6.928 1127 H LYS 28 H LYS 28 9.253 -10.093 5.336 1128 HA LYS 28 HA LYS 28 10.201 -12.470 6.428 1129 HB2 LYS 28 2HB LYS 28 7.969 -11.468 6.902 1130 HB3 LYS 28 3HB LYS 28 7.438 -11.894 5.279 1131 HG2 LYS 28 2HG LYS 28 7.827 -14.329 5.898 1132 HG3 LYS 28 3HG LYS 28 8.119 -13.790 7.553 1133 HD2 LYS 28 2HD LYS 28 5.808 -14.586 7.278 1134 HD3 LYS 28 3HD LYS 28 5.833 -12.863 7.665 1135 HE2 LYS 28 2HE LYS 28 4.182 -13.360 5.897 1136 HE3 LYS 28 3HE LYS 28 5.463 -12.321 5.274 1137 HZ1 LYS 28 1HZ LYS 28 6.522 -14.387 4.392 1138 HZ2 LYS 28 2HZ LYS 28 5.041 -13.996 3.682 1139 HZ3 LYS 28 3HZ LYS 28 5.122 -15.232 4.829 1140 H ASN 29 H ASN 29 8.619 -11.924 3.254 1141 HA ASN 29 HA ASN 29 8.627 -14.578 2.333 1142 HB2 ASN 29 2HB ASN 29 8.601 -11.994 0.712 1143 HB3 ASN 29 3HB ASN 29 8.351 -13.591 0.010 1144 HD21 ASN 29 1HD2 ASN 29 6.543 -11.468 -0.174 1145 HD22 ASN 29 2HD2 ASN 29 5.097 -11.917 0.656 1146 H MET 30 H MET 30 11.050 -11.997 2.019 1147 HA MET 30 HA MET 30 12.712 -13.340 0.127 1148 HB2 MET 30 2HB MET 30 13.298 -11.016 2.005 1149 HB3 MET 30 3HB MET 30 14.460 -11.622 0.829 1150 HG2 MET 30 2HG MET 30 12.832 -11.109 -0.986 1151 HG3 MET 30 3HG MET 30 11.762 -10.385 0.217 1152 HE1 MET 30 1HE MET 30 13.969 -7.317 1.427 1153 HE2 MET 30 2HE MET 30 13.927 -8.917 2.166 1154 HE3 MET 30 3HE MET 30 12.429 -8.151 1.629 1155 H ILE 31 H ILE 31 12.751 -13.158 3.692 1156 HA ILE 31 HA ILE 31 15.154 -14.614 4.132 1157 HB ILE 31 HB ILE 31 12.702 -14.337 5.944 1158 HG12 ILE 31 2HG1 ILE 31 15.352 -12.804 5.988 1159 HG13 ILE 31 3HG1 ILE 31 13.831 -12.171 5.372 1160 HG21 ILE 31 1HG2 ILE 31 14.023 -16.303 6.635 1161 HG22 ILE 31 2HG2 ILE 31 14.186 -15.012 7.825 1162 HG23 ILE 31 3HG2 ILE 31 15.492 -15.325 6.678 1163 HD11 ILE 31 1HD1 ILE 31 14.402 -12.942 8.234 1164 HD12 ILE 31 2HD1 ILE 31 12.864 -12.329 7.621 1165 HD13 ILE 31 3HD1 ILE 31 14.299 -11.307 7.580 1166 H GLU 32 H GLU 32 11.753 -15.586 3.782 1167 HA GLU 32 HA GLU 32 12.103 -18.380 4.321 1168 HB2 GLU 32 2HB GLU 32 9.816 -16.896 2.946 1169 HB3 GLU 32 3HB GLU 32 9.754 -18.580 3.476 1170 HG2 GLU 32 2HG GLU 32 9.957 -17.913 5.805 1171 HG3 GLU 32 3HG GLU 32 10.208 -16.231 5.343 1172 H ASP 33 H ASP 33 12.220 -16.392 1.448 1173 HA ASP 33 HA ASP 33 11.964 -18.418 -0.555 1174 HB2 ASP 33 2HB ASP 33 11.475 -16.048 -1.026 1175 HB3 ASP 33 3HB ASP 33 13.140 -15.604 -0.675 1176 H ILE 34 H ILE 34 14.661 -16.871 1.082 1177 HA ILE 34 HA ILE 34 16.733 -18.415 -0.233 1178 HB ILE 34 HB ILE 34 16.821 -16.604 2.238 1179 HG12 ILE 34 2HG1 ILE 34 17.614 -16.012 -0.662 1180 HG13 ILE 34 3HG1 ILE 34 16.154 -15.428 0.128 1181 HG21 ILE 34 1HG2 ILE 34 19.145 -17.704 0.613 1182 HG22 ILE 34 2HG2 ILE 34 18.708 -18.193 2.250 1183 HG23 ILE 34 3HG2 ILE 34 19.274 -16.551 1.943 1184 HD11 ILE 34 1HD1 ILE 34 18.992 -14.696 0.835 1185 HD12 ILE 34 2HD1 ILE 34 17.555 -14.154 1.706 1186 HD13 ILE 34 3HD1 ILE 34 17.797 -13.682 0.026 1187 H GLY 35 H GLY 35 14.687 -18.691 2.573 1188 HA2 GLY 35 2HA GLY 35 14.298 -20.923 3.506 1189 HA3 GLY 35 3HA GLY 35 16.039 -21.191 3.469 1190 H GLU 36 H GLU 36 17.300 -19.380 4.605 1191 HA GLU 36 HA GLU 36 16.051 -17.828 6.659 1192 HB2 GLU 36 2HB GLU 36 16.161 -20.053 7.807 1193 HB3 GLU 36 3HB GLU 36 17.901 -20.108 7.531 1194 HG2 GLU 36 2HG GLU 36 18.199 -18.118 8.959 1195 HG3 GLU 36 3HG GLU 36 16.457 -18.028 9.207 1196 H SER 37 H SER 37 17.075 -16.059 5.809 1197 HA SER 37 HA SER 37 19.823 -16.077 4.942 1198 HB2 SER 37 2HB SER 37 18.101 -14.715 3.787 1199 HB3 SER 37 3HB SER 37 17.868 -13.759 5.250 1200 HG SER 37 HG SER 37 19.831 -12.851 4.989 1201 H ASP 38 H ASP 38 21.245 -16.382 6.616 1202 HA ASP 38 HA ASP 38 21.268 -14.878 9.075 1203 HB2 ASP 38 2HB ASP 38 23.449 -15.870 9.472 1204 HB3 ASP 38 3HB ASP 38 22.413 -17.114 8.792 1205 H SER 39 H SER 39 22.364 -14.433 5.842 1206 HA SER 39 HA SER 39 24.271 -12.342 6.227 1207 HB2 SER 39 2HB SER 39 22.713 -13.177 3.731 1208 HB3 SER 39 3HB SER 39 24.156 -12.153 3.754 1209 HG SER 39 HG SER 39 24.016 -14.856 4.652 1210 HA PRO 40 HA PRO 40 21.447 -8.855 6.671 1211 HB2 PRO 40 2HB PRO 40 22.984 -6.805 5.700 1212 HB3 PRO 40 3HB PRO 40 23.355 -7.621 7.229 1213 HG2 PRO 40 2HG PRO 40 24.562 -8.096 4.514 1214 HG3 PRO 40 3HG PRO 40 25.378 -7.882 6.082 1215 HD2 PRO 40 2HD PRO 40 24.957 -10.338 5.049 1216 HD3 PRO 40 3HD PRO 40 24.874 -10.045 6.803 1217 H ILE 41 H ILE 41 19.841 -7.814 5.480 1218 HA ILE 41 HA ILE 41 19.919 -8.035 2.526 1219 HB ILE 41 HB ILE 41 17.445 -7.716 4.296 1220 HG12 ILE 41 2HG1 ILE 41 16.875 -10.085 3.300 1221 HG13 ILE 41 3HG1 ILE 41 18.590 -10.194 2.930 1222 HG21 ILE 41 1HG2 ILE 41 16.138 -8.068 2.212 1223 HG22 ILE 41 2HG2 ILE 41 17.638 -8.082 1.284 1224 HG23 ILE 41 3HG2 ILE 41 17.139 -6.616 2.131 1225 HD11 ILE 41 1HD1 ILE 41 19.104 -9.997 5.324 1226 HD12 ILE 41 2HD1 ILE 41 18.040 -11.361 4.985 1227 HD13 ILE 41 3HD1 ILE 41 17.377 -9.882 5.679 1228 HA PRO 42 HA PRO 42 20.369 -3.468 3.044 1229 HB2 PRO 42 2HB PRO 42 21.269 -3.557 0.211 1230 HB3 PRO 42 3HB PRO 42 22.149 -2.992 1.646 1231 HG2 PRO 42 2HG PRO 42 22.848 -5.258 0.373 1232 HG3 PRO 42 3HG PRO 42 22.998 -5.085 2.137 1233 HD2 PRO 42 2HD PRO 42 20.820 -6.469 0.567 1234 HD3 PRO 42 3HD PRO 42 21.688 -7.025 2.019 1235 H LEU 43 H LEU 43 18.491 -2.442 2.928 1236 HA LEU 43 HA LEU 43 16.634 -2.694 0.673 1237 HB2 LEU 43 2HB LEU 43 16.299 -1.336 3.374 1238 HB3 LEU 43 3HB LEU 43 15.026 -1.598 2.191 1239 HG LEU 43 HG LEU 43 16.489 -3.795 3.726 1240 HD11 LEU 43 1HD1 LEU 43 15.055 -2.498 5.199 1241 HD12 LEU 43 2HD1 LEU 43 14.389 -4.110 4.951 1242 HD13 LEU 43 3HD1 LEU 43 13.680 -2.724 4.112 1243 HD21 LEU 43 1HD2 LEU 43 15.780 -4.608 1.530 1244 HD22 LEU 43 2HD2 LEU 43 14.138 -4.022 1.804 1245 HD23 LEU 43 3HD2 LEU 43 14.788 -5.335 2.792 1246 HA PRO 44 HA PRO 44 18.899 1.220 -0.297 1247 HB2 PRO 44 2HB PRO 44 19.032 1.016 -2.976 1248 HB3 PRO 44 3HB PRO 44 19.952 -0.103 -1.943 1249 HG2 PRO 44 2HG PRO 44 17.330 -0.570 -3.348 1250 HG3 PRO 44 3HG PRO 44 18.755 -1.632 -3.248 1251 HD2 PRO 44 2HD PRO 44 16.533 -1.877 -1.601 1252 HD3 PRO 44 3HD PRO 44 18.156 -2.456 -1.174 1253 H ASN 45 H ASN 45 15.636 0.517 -0.819 1254 HA ASN 45 HA ASN 45 14.991 2.969 -2.291 1255 HB2 ASN 45 2HB ASN 45 13.716 0.855 -2.728 1256 HB3 ASN 45 3HB ASN 45 13.101 0.903 -1.078 1257 HD21 ASN 45 1HD2 ASN 45 10.936 1.140 -1.632 1258 HD22 ASN 45 2HD2 ASN 45 10.290 2.531 -2.413 1259 H VAL 46 H VAL 46 14.784 1.671 0.994 1260 HA VAL 46 HA VAL 46 13.273 3.992 1.967 1261 HB VAL 46 HB VAL 46 12.542 1.721 2.660 1262 HG11 VAL 46 1HG1 VAL 46 13.844 0.334 4.209 1263 HG12 VAL 46 2HG1 VAL 46 15.175 1.493 4.153 1264 HG13 VAL 46 3HG1 VAL 46 14.735 0.589 2.702 1265 HG21 VAL 46 1HG2 VAL 46 12.012 3.607 4.131 1266 HG22 VAL 46 2HG2 VAL 46 13.546 3.408 4.981 1267 HG23 VAL 46 3HG2 VAL 46 12.307 2.154 5.091 1268 H THR 47 H THR 47 14.149 5.574 3.259 1269 HA THR 47 HA THR 47 17.034 5.770 3.582 1270 HB THR 47 HB THR 47 16.449 8.031 4.598 1271 HG1 THR 47 HG1 THR 47 13.936 8.240 3.757 1272 HG21 THR 47 1HG2 THR 47 15.229 7.462 1.864 1273 HG22 THR 47 2HG2 THR 47 16.926 7.841 2.176 1274 HG23 THR 47 3HG2 THR 47 15.682 9.054 2.481 1275 H SER 48 H SER 48 17.867 6.563 5.832 1276 HA SER 48 HA SER 48 17.559 4.326 7.560 1277 HB2 SER 48 2HB SER 48 19.187 5.497 9.055 1278 HB3 SER 48 3HB SER 48 19.725 5.441 7.376 1279 HG SER 48 HG SER 48 20.037 7.490 8.300 1280 H THR 49 H THR 49 16.575 7.712 7.860 1281 HA THR 49 HA THR 49 15.565 7.767 10.449 1282 HB THR 49 HB THR 49 14.528 9.270 8.004 1283 HG1 THR 49 HG1 THR 49 16.827 9.527 9.566 1284 HG21 THR 49 1HG2 THR 49 14.401 10.036 10.947 1285 HG22 THR 49 2HG2 THR 49 13.024 9.554 9.951 1286 HG23 THR 49 3HG2 THR 49 13.890 11.054 9.602 1287 H ILE 50 H ILE 50 14.037 6.791 7.417 1288 HA ILE 50 HA ILE 50 11.393 6.464 8.506 1289 HB ILE 50 HB ILE 50 12.541 5.710 5.785 1290 HG12 ILE 50 2HG1 ILE 50 12.606 8.141 6.243 1291 HG13 ILE 50 3HG1 ILE 50 11.421 7.782 4.996 1292 HG21 ILE 50 1HG2 ILE 50 10.182 5.571 5.005 1293 HG22 ILE 50 2HG2 ILE 50 9.631 5.797 6.666 1294 HG23 ILE 50 3HG2 ILE 50 10.545 4.353 6.232 1295 HD11 ILE 50 1HD1 ILE 50 10.828 8.389 7.895 1296 HD12 ILE 50 2HD1 ILE 50 9.623 7.996 6.662 1297 HD13 ILE 50 3HD1 ILE 50 10.594 9.459 6.515 1298 H LEU 51 H LEU 51 14.028 4.278 7.481 1299 HA LEU 51 HA LEU 51 12.613 1.849 7.849 1300 HB2 LEU 51 2HB LEU 51 14.723 2.083 6.503 1301 HB3 LEU 51 3HB LEU 51 15.625 2.284 7.996 1302 HG LEU 51 HG LEU 51 15.055 -0.025 8.691 1303 HD11 LEU 51 1HD1 LEU 51 12.851 -0.254 7.672 1304 HD12 LEU 51 2HD1 LEU 51 13.898 -1.580 7.177 1305 HD13 LEU 51 3HD1 LEU 51 13.564 -0.257 6.056 1306 HD21 LEU 51 1HD2 LEU 51 17.103 0.302 7.387 1307 HD22 LEU 51 2HD2 LEU 51 16.209 0.066 5.882 1308 HD23 LEU 51 3HD2 LEU 51 16.375 -1.265 7.030 1309 H GLU 52 H GLU 52 14.556 3.856 9.972 1310 HA GLU 52 HA GLU 52 14.873 2.250 12.235 1311 HB2 GLU 52 2HB GLU 52 16.028 4.410 11.875 1312 HB3 GLU 52 3HB GLU 52 14.499 5.267 12.000 1313 HG2 GLU 52 2HG GLU 52 14.318 4.505 14.379 1314 HG3 GLU 52 3HG GLU 52 15.915 3.770 14.229 1315 H LYS 53 H LYS 53 12.348 4.626 11.478 1316 HA LYS 53 HA LYS 53 10.967 4.239 13.970 1317 HB2 LYS 53 2HB LYS 53 9.470 6.003 13.170 1318 HB3 LYS 53 3HB LYS 53 11.153 6.453 12.918 1319 HG2 LYS 53 2HG LYS 53 10.888 5.727 10.505 1320 HG3 LYS 53 3HG LYS 53 9.166 5.533 10.818 1321 HD2 LYS 53 2HD LYS 53 10.774 8.116 10.930 1322 HD3 LYS 53 3HD LYS 53 9.575 7.661 9.723 1323 HE2 LYS 53 2HE LYS 53 8.345 9.105 11.060 1324 HE3 LYS 53 3HE LYS 53 7.936 7.562 11.798 1325 HZ1 LYS 53 1HZ LYS 53 9.668 7.998 13.465 1326 HZ2 LYS 53 2HZ LYS 53 8.463 9.172 13.474 1327 HZ3 LYS 53 3HZ LYS 53 9.957 9.508 12.769 1328 H VAL 54 H VAL 54 10.530 3.115 10.655 1329 HA VAL 54 HA VAL 54 7.851 2.143 10.914 1330 HB VAL 54 HB VAL 54 10.065 1.575 8.887 1331 HG11 VAL 54 1HG1 VAL 54 8.759 -0.506 8.994 1332 HG12 VAL 54 2HG1 VAL 54 8.408 0.342 7.487 1333 HG13 VAL 54 3HG1 VAL 54 7.256 0.401 8.823 1334 HG21 VAL 54 1HG2 VAL 54 7.402 3.040 8.657 1335 HG22 VAL 54 2HG2 VAL 54 8.568 2.834 7.343 1336 HG23 VAL 54 3HG2 VAL 54 8.996 3.794 8.763 1337 H LEU 55 H LEU 55 11.063 0.600 11.192 1338 HA LEU 55 HA LEU 55 10.146 -2.009 11.812 1339 HB2 LEU 55 2HB LEU 55 12.781 -0.623 12.412 1340 HB3 LEU 55 3HB LEU 55 12.491 -2.317 12.775 1341 HG LEU 55 HG LEU 55 12.560 -1.053 10.005 1342 HD11 LEU 55 1HD1 LEU 55 14.557 -2.430 9.656 1343 HD12 LEU 55 2HD1 LEU 55 14.456 -3.023 11.316 1344 HD13 LEU 55 3HD1 LEU 55 14.771 -1.312 11.005 1345 HD21 LEU 55 1HD2 LEU 55 12.019 -3.956 10.730 1346 HD22 LEU 55 2HD2 LEU 55 12.275 -3.328 9.098 1347 HD23 LEU 55 3HD2 LEU 55 10.865 -2.819 10.024 1348 H ASP 56 H ASP 56 10.807 0.836 13.814 1349 HA ASP 56 HA ASP 56 10.560 -0.521 16.340 1350 HB2 ASP 56 2HB ASP 56 11.912 1.599 15.960 1351 HB3 ASP 56 3HB ASP 56 10.388 2.482 15.862 1352 H TYR 57 H TYR 57 8.336 1.283 14.246 1353 HA TYR 57 HA TYR 57 6.090 1.374 15.974 1354 HB2 TYR 57 2HB TYR 57 6.082 2.717 13.922 1355 HB3 TYR 57 3HB TYR 57 6.243 1.280 12.923 1356 HD1 TYR 57 HD1 TYR 57 4.268 -0.179 12.476 1357 HD2 TYR 57 HD2 TYR 57 3.882 3.309 14.930 1358 HE1 TYR 57 HE1 TYR 57 1.824 -0.357 12.339 1359 HE2 TYR 57 HE2 TYR 57 1.434 3.124 14.786 1360 HH TYR 57 HH TYR 57 -0.277 2.121 13.396 1361 H CYS 58 H CYS 58 7.132 -0.953 13.491 1362 HA CYS 58 HA CYS 58 5.116 -2.875 13.789 1363 HB2 CYS 58 2HB CYS 58 7.997 -3.195 12.851 1364 HB3 CYS 58 3HB CYS 58 6.762 -4.448 12.696 1365 HG CYS 58 HG CYS 58 7.415 -1.927 10.722 1366 H ARG 59 H ARG 59 8.154 -2.375 15.563 1367 HA ARG 59 HA ARG 59 8.226 -4.706 17.106 1368 HB2 ARG 59 2HB ARG 59 10.144 -3.270 17.152 1369 HB3 ARG 59 3HB ARG 59 9.199 -1.897 17.709 1370 HG2 ARG 59 2HG ARG 59 8.904 -2.935 19.914 1371 HG3 ARG 59 3HG ARG 59 9.737 -4.393 19.367 1372 HD2 ARG 59 2HD ARG 59 11.014 -1.636 19.499 1373 HD3 ARG 59 3HD ARG 59 11.151 -2.860 20.764 1374 HE ARG 59 HE ARG 59 12.284 -4.285 19.155 1375 HH11 ARG 59 1HH1 ARG 59 12.146 -0.873 18.311 1376 HH12 ARG 59 2HH1 ARG 59 13.531 -0.967 17.270 1377 HH21 ARG 59 1HH2 ARG 59 14.088 -4.391 17.832 1378 HH22 ARG 59 2HH2 ARG 59 14.634 -2.965 16.999 1379 H HIS 60 H HIS 60 6.725 -1.549 17.894 1380 HA HIS 60 HA HIS 60 5.586 -2.297 20.356 1381 HB2 HIS 60 2HB HIS 60 5.791 0.059 19.802 1382 HB3 HIS 60 3HB HIS 60 4.764 -0.129 18.379 1383 HD1 HIS 60 HD1 HIS 60 2.317 0.228 18.703 1384 HD2 HIS 60 HD2 HIS 60 4.289 -0.287 22.326 1385 HE1 HIS 60 HE1 HIS 60 0.565 0.497 20.470 1386 HE2 HIS 60 HE2 HIS 60 1.790 0.230 22.649 1387 H HIS 61 H HIS 61 4.320 -2.470 17.049 1388 HA HIS 61 HA HIS 61 1.643 -3.204 17.767 1389 HB2 HIS 61 2HB HIS 61 2.445 -2.060 15.584 1390 HB3 HIS 61 3HB HIS 61 2.944 -3.658 15.047 1391 HD1 HIS 61 HD1 HIS 61 0.904 -5.474 14.869 1392 HD2 HIS 61 HD2 HIS 61 -0.174 -1.466 15.151 1393 HE1 HIS 61 HE1 HIS 61 -1.498 -5.364 14.146 1394 HE2 HIS 61 HE2 HIS 61 -2.181 -2.982 14.587 1395 H HIS 62 H HIS 62 4.611 -4.941 17.293 1396 HA HIS 62 HA HIS 62 3.509 -7.587 16.964 1397 HB2 HIS 62 2HB HIS 62 5.803 -6.885 16.171 1398 HB3 HIS 62 3HB HIS 62 6.311 -6.749 17.844 1399 HD1 HIS 62 HD1 HIS 62 5.531 -9.230 15.173 1400 HD2 HIS 62 HD2 HIS 62 6.834 -9.211 19.116 1401 HE1 HIS 62 HE1 HIS 62 6.408 -11.540 15.614 1402 HE2 HIS 62 HE2 HIS 62 7.010 -11.544 18.050 1403 H GLN 63 H GLN 63 4.872 -5.674 19.601 1404 HA GLN 63 HA GLN 63 4.763 -7.671 21.647 1405 HB2 GLN 63 2HB GLN 63 4.969 -4.629 21.793 1406 HB3 GLN 63 3HB GLN 63 5.203 -5.709 23.167 1407 HG2 GLN 63 2HG GLN 63 7.202 -6.630 22.229 1408 HG3 GLN 63 3HG GLN 63 6.901 -5.876 20.664 1409 HE21 GLN 63 1HE2 GLN 63 9.222 -5.679 22.507 1410 HE22 GLN 63 2HE2 GLN 63 9.437 -3.984 22.787 1411 H HIS 64 H HIS 64 2.620 -5.119 20.548 1412 HA HIS 64 HA HIS 64 0.453 -6.089 22.311 1413 HB2 HIS 64 2HB HIS 64 1.113 -3.195 21.609 1414 HB3 HIS 64 3HB HIS 64 -0.403 -3.699 22.350 1415 HD1 HIS 64 HD1 HIS 64 -0.388 -4.236 24.841 1416 HD2 HIS 64 HD2 HIS 64 3.388 -3.375 23.338 1417 HE1 HIS 64 HE1 HIS 64 1.095 -3.959 26.849 1418 HE2 HIS 64 HE2 HIS 64 3.392 -3.545 25.909 1419 HA PRO 65 HA PRO 65 -0.953 -6.705 17.925 1420 HB2 PRO 65 2HB PRO 65 -2.652 -8.717 19.380 1421 HB3 PRO 65 3HB PRO 65 -1.669 -8.919 17.914 1422 HG2 PRO 65 2HG PRO 65 -0.848 -9.974 20.205 1423 HG3 PRO 65 3HG PRO 65 0.318 -9.196 19.109 1424 HD2 PRO 65 2HD PRO 65 -0.940 -8.075 21.616 1425 HD3 PRO 65 3HD PRO 65 0.760 -8.022 21.087 1426 H GLY 66 H GLY 66 -2.587 -6.057 20.941 1427 HA2 GLY 66 2HA GLY 66 -5.182 -5.390 19.965 1428 HA3 GLY 66 3HA GLY 66 -4.502 -4.955 21.520 1429 H GLY 67 H GLY 67 -2.243 -3.791 19.499 1430 HA2 GLY 67 2HA GLY 67 -3.090 -1.060 19.533 1431 HA3 GLY 67 3HA GLY 67 -1.674 -1.718 18.723 1432 H SER 68 H SER 68 -5.184 -1.365 18.430 1433 HA SER 68 HA SER 68 -5.227 -1.939 15.581 1434 HB2 SER 68 2HB SER 68 -7.451 -0.986 17.440 1435 HB3 SER 68 3HB SER 68 -7.668 -1.593 15.793 1436 HG SER 68 HG SER 68 -7.516 -2.980 18.059 1437 H GLY 69 H GLY 69 -4.438 0.760 17.395 1438 HA2 GLY 69 2HA GLY 69 -3.863 2.885 16.743 1439 HA3 GLY 69 3HA GLY 69 -4.449 2.540 15.121 1440 H LEU 70 H LEU 70 -6.780 2.655 14.747 1441 HA LEU 70 HA LEU 70 -7.973 4.948 16.023 1442 HB2 LEU 70 2HB LEU 70 -8.125 4.600 13.570 1443 HB3 LEU 70 3HB LEU 70 -9.026 3.115 13.829 1444 HG LEU 70 HG LEU 70 -10.835 4.483 14.939 1445 HD11 LEU 70 1HD1 LEU 70 -10.907 6.913 14.568 1446 HD12 LEU 70 2HD1 LEU 70 -9.278 6.856 13.885 1447 HD13 LEU 70 3HD1 LEU 70 -9.544 6.435 15.580 1448 HD21 LEU 70 1HD2 LEU 70 -11.088 3.739 12.627 1449 HD22 LEU 70 2HD2 LEU 70 -10.275 5.196 12.049 1450 HD23 LEU 70 3HD2 LEU 70 -11.835 5.318 12.868 1451 H ASP 71 H ASP 71 -8.193 4.125 18.119 1452 HA ASP 71 HA ASP 71 -10.743 3.491 18.982 1453 HB2 ASP 71 2HB ASP 71 -10.411 1.145 18.210 1454 HB3 ASP 71 3HB ASP 71 -8.887 1.047 19.088 1455 H ASP 72 H ASP 72 -7.429 2.598 19.715 1456 HA ASP 72 HA ASP 72 -7.367 4.218 22.192 1457 HB2 ASP 72 2HB ASP 72 -7.668 1.827 22.800 1458 HB3 ASP 72 3HB ASP 72 -6.307 1.373 21.788 1459 H ILE 73 H ILE 73 -5.996 5.797 21.614 1460 HA ILE 73 HA ILE 73 -3.999 5.449 19.541 1461 HB ILE 73 HB ILE 73 -4.769 7.929 21.151 1462 HG12 ILE 73 2HG1 ILE 73 -6.609 7.093 19.678 1463 HG13 ILE 73 3HG1 ILE 73 -6.002 8.651 19.137 1464 HG21 ILE 73 1HG2 ILE 73 -3.529 9.225 19.433 1465 HG22 ILE 73 2HG2 ILE 73 -2.989 7.718 18.691 1466 HG23 ILE 73 3HG2 ILE 73 -2.466 8.135 20.324 1467 HD11 ILE 73 1HD1 ILE 73 -5.358 5.973 17.904 1468 HD12 ILE 73 2HD1 ILE 73 -4.748 7.535 17.348 1469 HD13 ILE 73 3HD1 ILE 73 -6.473 7.183 17.275 1470 HA PRO 74 HA PRO 74 -0.971 4.589 22.875 1471 HB2 PRO 74 2HB PRO 74 0.840 3.660 20.738 1472 HB3 PRO 74 3HB PRO 74 0.043 2.708 22.003 1473 HG2 PRO 74 2HG PRO 74 -0.617 2.460 19.386 1474 HG3 PRO 74 3HG PRO 74 -1.799 2.233 20.697 1475 HD2 PRO 74 2HD PRO 74 -1.338 4.692 18.996 1476 HD3 PRO 74 3HD PRO 74 -2.873 3.889 19.417 1477 HA PRO 75 HA PRO 75 1.356 8.307 22.845 1478 HB2 PRO 75 2HB PRO 75 3.746 7.613 24.110 1479 HB3 PRO 75 3HB PRO 75 2.197 7.836 24.947 1480 HG2 PRO 75 2HG PRO 75 3.504 5.282 24.064 1481 HG3 PRO 75 3HG PRO 75 2.659 5.650 25.586 1482 HD2 PRO 75 2HD PRO 75 1.439 4.268 23.613 1483 HD3 PRO 75 3HD PRO 75 0.542 5.409 24.638 1484 H TYR 76 H TYR 76 3.815 5.784 22.097 1485 HA TYR 76 HA TYR 76 5.478 7.392 20.513 1486 HB2 TYR 76 2HB TYR 76 6.352 5.332 21.462 1487 HB3 TYR 76 3HB TYR 76 5.153 4.363 20.613 1488 HD1 TYR 76 HD1 TYR 76 8.161 6.520 20.096 1489 HD2 TYR 76 HD2 TYR 76 5.611 3.543 18.369 1490 HE1 TYR 76 HE1 TYR 76 9.717 6.267 18.209 1491 HE2 TYR 76 HE2 TYR 76 7.175 3.296 16.485 1492 HH TYR 76 HH TYR 76 10.296 4.452 16.524 1493 H ASP 77 H ASP 77 2.787 5.279 19.649 1494 HA ASP 77 HA ASP 77 3.217 5.231 16.844 1495 HB2 ASP 77 2HB ASP 77 0.712 4.600 18.474 1496 HB3 ASP 77 3HB ASP 77 0.923 4.218 16.764 1497 H ARG 78 H ARG 78 1.400 7.371 18.970 1498 HA ARG 78 HA ARG 78 0.012 8.847 16.959 1499 HB2 ARG 78 2HB ARG 78 -0.621 8.859 19.390 1500 HB3 ARG 78 3HB ARG 78 0.846 9.766 19.748 1501 HG2 ARG 78 2HG ARG 78 0.031 11.641 18.360 1502 HG3 ARG 78 3HG ARG 78 -1.425 10.724 17.971 1503 HD2 ARG 78 2HD ARG 78 -2.031 10.730 20.393 1504 HD3 ARG 78 3HD ARG 78 -0.608 11.730 20.722 1505 HE ARG 78 HE ARG 78 -2.403 12.792 18.712 1506 HH11 ARG 78 1HH1 ARG 78 -1.671 12.778 22.156 1507 HH12 ARG 78 2HH1 ARG 78 -2.498 14.274 22.451 1508 HH21 ARG 78 1HH2 ARG 78 -3.496 14.719 19.116 1509 HH22 ARG 78 2HH2 ARG 78 -3.533 15.373 20.723 1510 H ASP 79 H ASP 79 3.077 9.299 18.702 1511 HA ASP 79 HA ASP 79 3.866 11.711 17.389 1512 HB2 ASP 79 2HB ASP 79 5.417 9.690 19.051 1513 HB3 ASP 79 3HB ASP 79 6.166 11.141 18.385 1514 H PHE 80 H PHE 80 4.103 8.361 16.557 1515 HA PHE 80 HA PHE 80 6.140 8.424 14.595 1516 HB2 PHE 80 2HB PHE 80 5.378 6.291 15.516 1517 HB3 PHE 80 3HB PHE 80 3.734 6.576 14.965 1518 HD1 PHE 80 HD1 PHE 80 3.068 6.014 12.699 1519 HD2 PHE 80 HD2 PHE 80 7.188 5.800 13.847 1520 HE1 PHE 80 HE1 PHE 80 3.602 4.877 10.589 1521 HE2 PHE 80 HE2 PHE 80 7.699 4.663 11.735 1522 HZ PHE 80 HZ PHE 80 5.919 4.207 10.106 1523 H CYS 81 H CYS 81 2.645 8.962 14.480 1524 HA CYS 81 HA CYS 81 2.398 9.344 11.662 1525 HB2 CYS 81 2HB CYS 81 0.568 10.287 13.903 1526 HB3 CYS 81 3HB CYS 81 0.135 10.151 12.197 1527 HG CYS 81 HG CYS 81 1.264 7.331 13.654 1528 H LYS 82 H LYS 82 3.346 11.407 14.316 1529 HA LYS 82 HA LYS 82 2.999 13.931 12.955 1530 HB2 LYS 82 2HB LYS 82 4.699 13.290 15.404 1531 HB3 LYS 82 3HB LYS 82 4.231 14.901 14.852 1532 HG2 LYS 82 2HG LYS 82 1.886 14.426 15.349 1533 HG3 LYS 82 3HG LYS 82 2.294 12.760 15.790 1534 HD2 LYS 82 2HD LYS 82 3.788 13.710 17.613 1535 HD3 LYS 82 3HD LYS 82 3.129 15.307 17.242 1536 HE2 LYS 82 2HE LYS 82 0.891 14.551 17.871 1537 HE3 LYS 82 3HE LYS 82 1.490 12.907 18.127 1538 HZ1 LYS 82 1HZ LYS 82 1.286 14.078 20.204 1539 HZ2 LYS 82 2HZ LYS 82 2.304 15.310 19.659 1540 HZ3 LYS 82 3HZ LYS 82 2.911 13.750 19.885 1541 H VAL 83 H VAL 83 4.058 13.579 10.987 1542 HA VAL 83 HA VAL 83 7.015 13.794 11.062 1543 HB VAL 83 HB VAL 83 7.063 12.482 8.867 1544 HG11 VAL 83 1HG1 VAL 83 6.161 10.937 11.326 1545 HG12 VAL 83 2HG1 VAL 83 7.815 11.437 10.956 1546 HG13 VAL 83 3HG1 VAL 83 7.002 10.255 9.928 1547 HG21 VAL 83 1HG2 VAL 83 4.674 12.666 8.279 1548 HG22 VAL 83 2HG2 VAL 83 4.234 11.690 9.682 1549 HG23 VAL 83 3HG2 VAL 83 5.164 10.973 8.362 1550 H ASP 84 H ASP 84 7.889 14.688 9.041 1551 HA ASP 84 HA ASP 84 6.615 17.142 8.299 1552 HB2 ASP 84 2HB ASP 84 9.213 16.383 8.421 1553 HB3 ASP 84 3HB ASP 84 8.952 16.010 6.727 1554 H GLN 85 H GLN 85 6.216 17.729 5.957 1555 HA GLN 85 HA GLN 85 4.284 16.072 4.805 1556 HB2 GLN 85 2HB GLN 85 4.359 18.551 4.538 1557 HB3 GLN 85 3HB GLN 85 5.745 18.388 3.471 1558 HG2 GLN 85 2HG GLN 85 3.710 18.779 2.184 1559 HG3 GLN 85 3HG GLN 85 4.378 17.182 1.830 1560 HE21 GLN 85 1HE2 GLN 85 2.374 16.482 1.064 1561 HE22 GLN 85 2HE2 GLN 85 1.053 16.110 2.101 1562 HA PRO 86 HA PRO 86 7.549 14.588 1.445 1563 HB2 PRO 86 2HB PRO 86 10.231 14.740 2.141 1564 HB3 PRO 86 3HB PRO 86 9.402 15.981 1.175 1565 HG2 PRO 86 2HG PRO 86 9.979 15.968 4.128 1566 HG3 PRO 86 3HG PRO 86 10.196 17.284 2.946 1567 HD2 PRO 86 2HD PRO 86 8.048 17.235 4.561 1568 HD3 PRO 86 3HD PRO 86 7.910 17.797 2.884 1569 H THR 87 H THR 87 8.499 14.407 4.868 1570 HA THR 87 HA THR 87 9.540 11.792 4.936 1571 HB THR 87 HB THR 87 8.254 13.326 7.242 1572 HG1 THR 87 HG1 THR 87 10.815 13.555 6.038 1573 HG21 THR 87 1HG2 THR 87 8.874 10.989 7.824 1574 HG22 THR 87 2HG2 THR 87 9.899 12.155 8.659 1575 HG23 THR 87 3HG2 THR 87 10.526 11.295 7.253 1576 H LEU 88 H LEU 88 6.264 13.008 5.143 1577 HA LEU 88 HA LEU 88 4.951 10.724 6.203 1578 HB2 LEU 88 2HB LEU 88 4.210 13.294 5.810 1579 HB3 LEU 88 3HB LEU 88 3.514 12.629 4.350 1580 HG LEU 88 HG LEU 88 2.835 11.759 7.190 1581 HD11 LEU 88 1HD1 LEU 88 2.033 14.002 6.750 1582 HD12 LEU 88 2HD1 LEU 88 0.685 12.873 6.841 1583 HD13 LEU 88 3HD1 LEU 88 1.235 13.462 5.269 1584 HD21 LEU 88 1HD2 LEU 88 0.966 10.496 6.194 1585 HD22 LEU 88 2HD2 LEU 88 2.530 9.894 5.650 1586 HD23 LEU 88 3HD2 LEU 88 1.556 10.898 4.576 1587 H PHE 89 H PHE 89 5.538 11.910 2.906 1588 HA PHE 89 HA PHE 89 4.276 9.717 1.579 1589 HB2 PHE 89 2HB PHE 89 6.205 11.836 0.547 1590 HB3 PHE 89 3HB PHE 89 5.383 10.660 -0.484 1591 HD1 PHE 89 HD1 PHE 89 2.663 10.662 0.922 1592 HD2 PHE 89 HD2 PHE 89 5.209 13.871 -0.289 1593 HE1 PHE 89 HE1 PHE 89 0.711 12.141 0.721 1594 HE2 PHE 89 HE2 PHE 89 3.257 15.337 -0.488 1595 HZ PHE 89 HZ PHE 89 1.007 14.483 0.016 1596 H GLU 90 H GLU 90 7.557 10.343 2.694 1597 HA GLU 90 HA GLU 90 8.926 8.169 1.562 1598 HB2 GLU 90 2HB GLU 90 9.266 9.583 4.231 1599 HB3 GLU 90 3HB GLU 90 10.385 8.352 3.657 1600 HG2 GLU 90 2HG GLU 90 9.793 10.897 2.128 1601 HG3 GLU 90 3HG GLU 90 11.087 10.759 3.319 1602 H LEU 91 H LEU 91 6.909 8.383 4.500 1603 HA LEU 91 HA LEU 91 7.239 5.734 5.432 1604 HB2 LEU 91 2HB LEU 91 4.955 7.702 5.802 1605 HB3 LEU 91 3HB LEU 91 5.000 6.140 6.603 1606 HG LEU 91 HG LEU 91 6.992 8.406 7.032 1607 HD11 LEU 91 1HD1 LEU 91 5.978 8.596 9.262 1608 HD12 LEU 91 2HD1 LEU 91 4.801 7.343 8.849 1609 HD13 LEU 91 3HD1 LEU 91 4.787 8.889 7.993 1610 HD21 LEU 91 1HD2 LEU 91 6.810 5.703 8.414 1611 HD22 LEU 91 2HD2 LEU 91 7.906 7.019 8.846 1612 HD23 LEU 91 3HD2 LEU 91 8.075 6.213 7.290 1613 H ILE 92 H ILE 92 4.953 7.176 3.106 1614 HA ILE 92 HA ILE 92 3.303 4.885 2.716 1615 HB ILE 92 HB ILE 92 3.794 7.203 0.773 1616 HG12 ILE 92 2HG1 ILE 92 1.667 6.846 2.938 1617 HG13 ILE 92 3HG1 ILE 92 2.945 8.053 2.916 1618 HG21 ILE 92 1HG2 ILE 92 1.493 5.209 0.839 1619 HG22 ILE 92 2HG2 ILE 92 2.784 5.254 -0.361 1620 HG23 ILE 92 3HG2 ILE 92 1.634 6.585 -0.260 1621 HD11 ILE 92 1HD1 ILE 92 1.872 9.062 0.915 1622 HD12 ILE 92 2HD1 ILE 92 0.867 9.087 2.361 1623 HD13 ILE 92 3HD1 ILE 92 0.547 7.906 1.090 1624 H LEU 93 H LEU 93 6.218 6.099 1.074 1625 HA LEU 93 HA LEU 93 6.396 4.185 -1.003 1626 HB2 LEU 93 2HB LEU 93 8.560 5.854 0.343 1627 HB3 LEU 93 3HB LEU 93 8.843 4.875 -1.092 1628 HG LEU 93 HG LEU 93 6.935 7.250 -0.939 1629 HD11 LEU 93 1HD1 LEU 93 8.564 8.441 -2.329 1630 HD12 LEU 93 2HD1 LEU 93 9.665 7.063 -2.250 1631 HD13 LEU 93 3HD1 LEU 93 9.271 7.966 -0.784 1632 HD21 LEU 93 1HD2 LEU 93 6.765 7.032 -3.388 1633 HD22 LEU 93 2HD2 LEU 93 6.166 5.594 -2.571 1634 HD23 LEU 93 3HD2 LEU 93 7.757 5.571 -3.337 1635 H ALA 94 H ALA 94 7.636 4.231 2.318 1636 HA ALA 94 HA ALA 94 9.179 1.811 2.128 1637 HB1 ALA 94 1HB ALA 94 9.752 3.577 3.736 1638 HB2 ALA 94 2HB ALA 94 9.448 2.047 4.561 1639 HB3 ALA 94 3HB ALA 94 8.224 3.322 4.582 1640 H ALA 95 H ALA 95 5.911 2.631 3.167 1641 HA ALA 95 HA ALA 95 5.278 0.130 4.406 1642 HB1 ALA 95 1HB ALA 95 4.116 2.233 4.967 1643 HB2 ALA 95 2HB ALA 95 2.985 0.975 4.473 1644 HB3 ALA 95 3HB ALA 95 3.407 2.276 3.352 1645 H ASN 96 H ASN 96 5.003 1.420 1.155 1646 HA ASN 96 HA ASN 96 3.557 -0.785 -0.004 1647 HB2 ASN 96 2HB ASN 96 3.468 1.416 -1.061 1648 HB3 ASN 96 3HB ASN 96 5.219 1.464 -1.221 1649 HD21 ASN 96 1HD2 ASN 96 5.022 1.816 -3.458 1650 HD22 ASN 96 2HD2 ASN 96 4.601 0.559 -4.555 1651 H TYR 97 H TYR 97 6.949 0.247 0.107 1652 HA TYR 97 HA TYR 97 8.127 -1.720 -1.517 1653 HB2 TYR 97 2HB TYR 97 9.254 0.380 -0.937 1654 HB3 TYR 97 3HB TYR 97 9.282 -0.057 0.766 1655 HD1 TYR 97 HD1 TYR 97 11.320 -0.896 1.615 1656 HD2 TYR 97 HD2 TYR 97 10.487 -1.395 -2.550 1657 HE1 TYR 97 HE1 TYR 97 13.542 -1.873 1.281 1658 HE2 TYR 97 HE2 TYR 97 12.715 -2.375 -2.872 1659 HH TYR 97 HH TYR 97 14.636 -3.451 -0.377 1660 H LEU 98 H LEU 98 7.560 -1.648 1.972 1661 HA LEU 98 HA LEU 98 8.769 -4.293 2.380 1662 HB2 LEU 98 2HB LEU 98 7.702 -2.245 4.368 1663 HB3 LEU 98 3HB LEU 98 8.434 -3.779 4.815 1664 HG LEU 98 HG LEU 98 9.836 -1.458 3.425 1665 HD11 LEU 98 1HD1 LEU 98 10.193 -2.568 6.228 1666 HD12 LEU 98 2HD1 LEU 98 9.436 -1.031 5.800 1667 HD13 LEU 98 3HD1 LEU 98 11.154 -1.279 5.492 1668 HD21 LEU 98 1HD2 LEU 98 10.725 -3.572 2.579 1669 HD22 LEU 98 2HD2 LEU 98 10.964 -4.164 4.225 1670 HD23 LEU 98 3HD2 LEU 98 11.905 -2.795 3.631 1671 H ASP 99 H ASP 99 5.766 -2.923 1.759 1672 HA ASP 99 HA ASP 99 3.605 -3.457 1.913 1673 HB2 ASP 99 2HB ASP 99 4.415 -5.216 0.319 1674 HB3 ASP 99 3HB ASP 99 4.586 -6.330 1.673 1675 H ILE 100 H ILE 100 3.584 -2.662 4.100 1676 HA ILE 100 HA ILE 100 2.966 -4.739 6.129 1677 HB ILE 100 HB ILE 100 3.974 -1.913 6.709 1678 HG12 ILE 100 2HG1 ILE 100 5.599 -4.498 6.754 1679 HG13 ILE 100 3HG1 ILE 100 5.757 -3.221 5.554 1680 HG21 ILE 100 1HG2 ILE 100 4.322 -2.753 9.009 1681 HG22 ILE 100 2HG2 ILE 100 3.677 -4.327 8.541 1682 HG23 ILE 100 3HG2 ILE 100 2.633 -2.904 8.521 1683 HD11 ILE 100 1HD1 ILE 100 6.390 -2.979 8.497 1684 HD12 ILE 100 2HD1 ILE 100 6.528 -1.686 7.302 1685 HD13 ILE 100 3HD1 ILE 100 7.547 -3.120 7.172 1686 H LYS 101 H LYS 101 0.786 -4.827 6.196 1687 HA LYS 101 HA LYS 101 -0.997 -2.880 5.315 1688 HB2 LYS 101 2HB LYS 101 -1.265 -5.460 6.809 1689 HB3 LYS 101 3HB LYS 101 -2.642 -4.377 6.882 1690 HG2 LYS 101 2HG LYS 101 -2.886 -6.042 5.105 1691 HG3 LYS 101 3HG LYS 101 -2.873 -4.393 4.480 1692 HD2 LYS 101 2HD LYS 101 -0.525 -4.690 3.727 1693 HD3 LYS 101 3HD LYS 101 -0.514 -6.330 4.384 1694 HE2 LYS 101 2HE LYS 101 -2.282 -6.986 2.796 1695 HE3 LYS 101 3HE LYS 101 -2.350 -5.336 2.176 1696 HZ1 LYS 101 1HZ LYS 101 -0.125 -5.550 1.371 1697 HZ2 LYS 101 2HZ LYS 101 -1.065 -6.813 0.767 1698 HZ3 LYS 101 3HZ LYS 101 0.031 -7.103 2.022 1699 HA PRO 102 HA PRO 102 -1.695 -1.545 10.106 1700 HB2 PRO 102 2HB PRO 102 1.143 -2.081 11.028 1701 HB3 PRO 102 3HB PRO 102 -0.380 -2.161 11.946 1702 HG2 PRO 102 2HG PRO 102 0.788 -4.406 11.176 1703 HG3 PRO 102 3HG PRO 102 -0.980 -4.234 11.063 1704 HD2 PRO 102 2HD PRO 102 1.065 -4.066 8.860 1705 HD3 PRO 102 3HD PRO 102 -0.537 -4.825 8.851 1706 H LEU 103 H LEU 103 1.563 -1.218 8.658 1707 HA LEU 103 HA LEU 103 2.062 1.460 9.497 1708 HB2 LEU 103 2HB LEU 103 3.662 -0.483 8.526 1709 HB3 LEU 103 3HB LEU 103 3.355 0.315 7.006 1710 HG LEU 103 HG LEU 103 5.483 1.057 7.899 1711 HD11 LEU 103 1HD1 LEU 103 5.254 3.496 7.979 1712 HD12 LEU 103 2HD1 LEU 103 3.506 3.338 8.174 1713 HD13 LEU 103 3HD1 LEU 103 4.278 2.798 6.685 1714 HD21 LEU 103 1HD2 LEU 103 4.014 1.932 10.398 1715 HD22 LEU 103 2HD2 LEU 103 5.733 2.159 10.060 1716 HD23 LEU 103 3HD2 LEU 103 5.082 0.533 10.252 1717 H LEU 104 H LEU 104 1.028 0.033 6.409 1718 HA LEU 104 HA LEU 104 0.963 2.352 4.840 1719 HB2 LEU 104 2HB LEU 104 1.018 0.019 3.963 1720 HB3 LEU 104 3HB LEU 104 -0.632 -0.216 4.497 1721 HG LEU 104 HG LEU 104 -1.396 1.522 2.866 1722 HD11 LEU 104 1HD1 LEU 104 0.135 2.375 1.137 1723 HD12 LEU 104 2HD1 LEU 104 1.499 1.601 1.951 1724 HD13 LEU 104 3HD1 LEU 104 0.615 2.904 2.749 1725 HD21 LEU 104 1HD2 LEU 104 0.225 -0.713 1.604 1726 HD22 LEU 104 2HD2 LEU 104 -1.093 0.179 0.837 1727 HD23 LEU 104 3HD2 LEU 104 -1.421 -0.849 2.230 1728 H ASP 105 H ASP 105 -1.619 0.636 6.584 1729 HA ASP 105 HA ASP 105 -3.796 2.163 5.673 1730 HB2 ASP 105 2HB ASP 105 -3.979 -0.116 6.730 1731 HB3 ASP 105 3HB ASP 105 -3.616 0.600 8.295 1732 H VAL 106 H VAL 106 -1.966 2.347 8.744 1733 HA VAL 106 HA VAL 106 -3.300 4.522 9.909 1734 HB VAL 106 HB VAL 106 -0.475 3.442 10.263 1735 HG11 VAL 106 1HG1 VAL 106 -1.758 5.610 11.972 1736 HG12 VAL 106 2HG1 VAL 106 -0.369 5.821 10.903 1737 HG13 VAL 106 3HG1 VAL 106 -0.236 4.784 12.323 1738 HG21 VAL 106 1HG2 VAL 106 -1.398 2.548 12.392 1739 HG22 VAL 106 2HG2 VAL 106 -2.308 1.970 10.994 1740 HG23 VAL 106 3HG2 VAL 106 -2.969 3.260 12.004 1741 H THR 107 H THR 107 -0.490 4.479 7.723 1742 HA THR 107 HA THR 107 0.024 7.297 7.815 1743 HB THR 107 HB THR 107 0.968 5.215 5.792 1744 HG1 THR 107 HG1 THR 107 1.470 4.889 8.109 1745 HG21 THR 107 1HG2 THR 107 2.868 6.733 5.401 1746 HG22 THR 107 2HG2 THR 107 2.164 7.916 6.507 1747 HG23 THR 107 3HG2 THR 107 1.345 7.532 4.992 1748 H CYS 108 H CYS 108 -1.948 5.223 5.752 1749 HA CYS 108 HA CYS 108 -2.566 7.165 3.722 1750 HB2 CYS 108 2HB CYS 108 -3.980 4.577 4.488 1751 HB3 CYS 108 3HB CYS 108 -4.356 5.542 3.059 1752 HG CYS 108 HG CYS 108 -1.151 4.568 3.399 1753 H LYS 109 H LYS 109 -3.936 6.204 6.812 1754 HA LYS 109 HA LYS 109 -6.317 7.806 6.620 1755 HB2 LYS 109 2HB LYS 109 -5.058 6.101 8.759 1756 HB3 LYS 109 3HB LYS 109 -6.152 7.364 9.304 1757 HG2 LYS 109 2HG LYS 109 -7.252 5.134 9.005 1758 HG3 LYS 109 3HG LYS 109 -7.997 6.441 8.080 1759 HD2 LYS 109 2HD LYS 109 -6.833 5.646 6.028 1760 HD3 LYS 109 3HD LYS 109 -6.085 4.349 6.960 1761 HE2 LYS 109 2HE LYS 109 -9.075 4.681 6.582 1762 HE3 LYS 109 3HE LYS 109 -8.052 3.616 5.617 1763 HZ1 LYS 109 1HZ LYS 109 -9.187 2.448 7.403 1764 HZ2 LYS 109 2HZ LYS 109 -8.416 3.417 8.555 1765 HZ3 LYS 109 3HZ LYS 109 -7.510 2.372 7.584 1766 H THR 110 H THR 110 -3.022 8.306 7.779 1767 HA THR 110 HA THR 110 -3.373 10.692 9.215 1768 HB THR 110 HB THR 110 -0.926 9.873 7.576 1769 HG1 THR 110 HG1 THR 110 -1.968 8.633 9.601 1770 HG21 THR 110 1HG2 THR 110 -1.157 11.808 9.918 1771 HG22 THR 110 2HG2 THR 110 -0.821 12.255 8.246 1772 HG23 THR 110 3HG2 THR 110 0.355 11.303 9.150 1773 H VAL 111 H VAL 111 -2.495 10.251 5.737 1774 HA VAL 111 HA VAL 111 -2.612 12.993 5.047 1775 HB VAL 111 HB VAL 111 -2.724 12.262 2.652 1776 HG11 VAL 111 1HG1 VAL 111 -0.513 11.179 2.569 1777 HG12 VAL 111 2HG1 VAL 111 -0.625 10.803 4.292 1778 HG13 VAL 111 3HG1 VAL 111 -0.544 12.484 3.759 1779 HG21 VAL 111 1HG2 VAL 111 -2.589 9.863 2.069 1780 HG22 VAL 111 2HG2 VAL 111 -4.106 10.240 2.889 1781 HG23 VAL 111 3HG2 VAL 111 -2.806 9.434 3.771 1782 H ALA 112 H ALA 112 -5.087 10.497 5.157 1783 HA ALA 112 HA ALA 112 -7.161 11.913 3.822 1784 HB1 ALA 112 1HB ALA 112 -7.375 9.682 5.873 1785 HB2 ALA 112 2HB ALA 112 -7.217 9.469 4.128 1786 HB3 ALA 112 3HB ALA 112 -8.666 10.224 4.795 1787 H ASN 113 H ASN 113 -6.054 11.811 7.186 1788 HA ASN 113 HA ASN 113 -8.268 13.238 8.323 1789 HB2 ASN 113 2HB ASN 113 -5.491 12.603 9.411 1790 HB3 ASN 113 3HB ASN 113 -6.696 13.487 10.346 1791 HD21 ASN 113 1HD2 ASN 113 -5.440 10.872 10.843 1792 HD22 ASN 113 2HD2 ASN 113 -6.744 9.753 11.009 1793 H MET 114 H MET 114 -5.173 14.177 6.930 1794 HA MET 114 HA MET 114 -5.084 16.849 7.903 1795 HB2 MET 114 2HB MET 114 -3.821 15.704 5.372 1796 HB3 MET 114 3HB MET 114 -3.430 17.266 6.083 1797 HG2 MET 114 2HG MET 114 -2.699 16.003 8.163 1798 HG3 MET 114 3HG MET 114 -2.842 14.525 7.211 1799 HE1 MET 114 1HE MET 114 -1.892 15.879 4.293 1800 HE2 MET 114 2HE MET 114 -1.389 14.261 4.788 1801 HE3 MET 114 3HE MET 114 -0.182 15.450 4.306 1802 H ILE 115 H ILE 115 -6.487 15.381 4.991 1803 HA ILE 115 HA ILE 115 -7.465 17.953 3.984 1804 HB ILE 115 HB ILE 115 -8.321 16.684 2.047 1805 HG12 ILE 115 2HG1 ILE 115 -7.190 14.164 3.365 1806 HG13 ILE 115 3HG1 ILE 115 -8.902 14.563 3.326 1807 HG21 ILE 115 1HG2 ILE 115 -5.446 15.949 2.724 1808 HG22 ILE 115 2HG2 ILE 115 -5.986 17.463 1.996 1809 HG23 ILE 115 3HG2 ILE 115 -6.154 15.949 1.105 1810 HD11 ILE 115 1HD1 ILE 115 -8.262 12.909 1.639 1811 HD12 ILE 115 2HD1 ILE 115 -7.196 14.094 0.884 1812 HD13 ILE 115 3HD1 ILE 115 -8.938 14.371 0.925 1813 H ARG 116 H ARG 116 -8.588 15.694 6.233 1814 HA ARG 116 HA ARG 116 -11.411 15.806 5.539 1815 HB2 ARG 116 2HB ARG 116 -10.219 13.799 6.672 1816 HB3 ARG 116 3HB ARG 116 -10.264 14.742 8.155 1817 HG2 ARG 116 2HG ARG 116 -12.125 13.158 8.094 1818 HG3 ARG 116 3HG ARG 116 -12.746 14.811 8.023 1819 HD2 ARG 116 2HD ARG 116 -13.062 14.618 5.603 1820 HD3 ARG 116 3HD ARG 116 -12.331 13.010 5.612 1821 HE ARG 116 HE ARG 116 -14.692 13.305 7.278 1822 HH11 ARG 116 1HH1 ARG 116 -13.486 12.451 4.081 1823 HH12 ARG 116 2HH1 ARG 116 -14.893 11.522 3.660 1824 HH21 ARG 116 1HH2 ARG 116 -16.542 12.105 6.711 1825 HH22 ARG 116 2HH2 ARG 116 -16.626 11.329 5.158 1826 H GLY 117 H GLY 117 -11.797 18.046 5.600 1827 HA2 GLY 117 2HA GLY 117 -13.037 19.090 7.806 1828 HA3 GLY 117 3HA GLY 117 -11.373 19.662 7.949 Start of MODEL 4 1 H1 SER 2 1H SER 2 -14.788 -16.213 -16.398 2 H2 SER 2 2H SER 2 -14.038 -15.319 -15.181 3 H3 SER 2 3H SER 2 -14.263 -14.641 -16.707 4 HA SER 2 HA SER 2 -16.613 -14.666 -16.456 5 HB2 SER 2 2HB SER 2 -16.073 -15.786 -13.670 6 HB3 SER 2 3HB SER 2 -17.659 -15.378 -14.338 7 HG SER 2 HG SER 2 -17.038 -16.955 -16.066 8 H LEU 3 H LEU 3 -17.681 -12.826 -15.626 9 HA LEU 3 HA LEU 3 -15.964 -10.716 -14.597 10 HB2 LEU 3 2HB LEU 3 -18.945 -10.682 -15.236 11 HB3 LEU 3 3HB LEU 3 -17.962 -9.268 -14.876 12 HG LEU 3 HG LEU 3 -17.654 -11.060 -17.319 13 HD11 LEU 3 1HD1 LEU 3 -18.509 -9.152 -18.602 14 HD12 LEU 3 2HD1 LEU 3 -18.783 -8.251 -17.107 15 HD13 LEU 3 3HD1 LEU 3 -19.695 -9.729 -17.432 16 HD21 LEU 3 1HD2 LEU 3 -15.491 -10.143 -16.656 17 HD22 LEU 3 2HD2 LEU 3 -16.165 -8.513 -16.588 18 HD23 LEU 3 3HD2 LEU 3 -16.053 -9.362 -18.132 19 H VAL 4 H VAL 4 -15.603 -10.566 -12.442 20 HA VAL 4 HA VAL 4 -17.612 -11.304 -10.470 21 HB VAL 4 HB VAL 4 -15.933 -10.508 -8.756 22 HG11 VAL 4 1HG1 VAL 4 -14.384 -12.415 -9.044 23 HG12 VAL 4 2HG1 VAL 4 -14.900 -12.586 -10.723 24 HG13 VAL 4 3HG1 VAL 4 -16.048 -12.878 -9.416 25 HG21 VAL 4 1HG2 VAL 4 -14.707 -8.836 -10.094 26 HG22 VAL 4 2HG2 VAL 4 -14.094 -10.105 -11.156 27 HG23 VAL 4 3HG2 VAL 4 -13.590 -10.052 -9.463 28 H LYS 5 H LYS 5 -19.097 -9.991 -9.778 29 HA LYS 5 HA LYS 5 -19.281 -7.251 -10.721 30 HB2 LYS 5 2HB LYS 5 -21.237 -8.896 -9.054 31 HB3 LYS 5 3HB LYS 5 -21.594 -7.395 -9.907 32 HG2 LYS 5 2HG LYS 5 -21.222 -8.518 -12.065 33 HG3 LYS 5 3HG LYS 5 -20.798 -10.014 -11.230 34 HD2 LYS 5 2HD LYS 5 -23.107 -10.103 -10.282 35 HD3 LYS 5 3HD LYS 5 -23.515 -8.633 -11.174 36 HE2 LYS 5 2HE LYS 5 -23.104 -9.803 -13.301 37 HE3 LYS 5 3HE LYS 5 -22.649 -11.265 -12.423 38 HZ1 LYS 5 1HZ LYS 5 -24.934 -11.309 -13.254 39 HZ2 LYS 5 2HZ LYS 5 -25.313 -9.975 -12.290 40 HZ3 LYS 5 3HZ LYS 5 -24.863 -11.433 -11.570 41 H LEU 6 H LEU 6 -18.659 -5.559 -9.497 42 HA LEU 6 HA LEU 6 -18.256 -5.924 -6.574 43 HB2 LEU 6 2HB LEU 6 -16.638 -4.177 -8.482 44 HB3 LEU 6 3HB LEU 6 -16.355 -4.358 -6.755 45 HG LEU 6 HG LEU 6 -16.016 -6.555 -8.843 46 HD11 LEU 6 1HD1 LEU 6 -13.615 -6.352 -8.412 47 HD12 LEU 6 2HD1 LEU 6 -13.910 -4.986 -7.330 48 HD13 LEU 6 3HD1 LEU 6 -14.292 -4.854 -9.050 49 HD21 LEU 6 1HD2 LEU 6 -15.015 -7.897 -7.033 50 HD22 LEU 6 2HD2 LEU 6 -16.700 -7.511 -6.694 51 HD23 LEU 6 3HD2 LEU 6 -15.413 -6.634 -5.862 52 H GLU 7 H GLU 7 -20.109 -4.951 -5.778 53 HA GLU 7 HA GLU 7 -21.011 -2.368 -6.654 54 HB2 GLU 7 2HB GLU 7 -21.573 -3.903 -4.081 55 HB3 GLU 7 3HB GLU 7 -22.260 -2.315 -4.423 56 HG2 GLU 7 2HG GLU 7 -23.962 -3.810 -4.991 57 HG3 GLU 7 3HG GLU 7 -23.238 -3.385 -6.542 58 H SER 8 H SER 8 -20.571 -0.409 -5.809 59 HA SER 8 HA SER 8 -18.180 -0.062 -4.155 60 HB2 SER 8 2HB SER 8 -18.547 2.365 -4.835 61 HB3 SER 8 3HB SER 8 -18.302 1.252 -6.183 62 HG SER 8 HG SER 8 -20.383 1.414 -6.738 63 H SER 9 H SER 9 -18.455 1.982 -2.624 64 HA SER 9 HA SER 9 -20.450 1.593 -0.645 65 HB2 SER 9 2HB SER 9 -19.618 3.816 0.224 66 HB3 SER 9 3HB SER 9 -18.328 2.656 -0.080 67 HG SER 9 HG SER 9 -18.101 4.926 -0.880 68 H ASP 10 H ASP 10 -20.302 3.414 -3.599 69 HA ASP 10 HA ASP 10 -22.734 4.963 -3.218 70 HB2 ASP 10 2HB ASP 10 -20.780 5.804 -4.533 71 HB3 ASP 10 3HB ASP 10 -20.970 4.483 -5.673 72 H GLU 11 H GLU 11 -22.041 1.757 -3.954 73 HA GLU 11 HA GLU 11 -23.335 -0.045 -4.226 74 HB2 GLU 11 2HB GLU 11 -25.646 1.906 -4.449 75 HB3 GLU 11 3HB GLU 11 -25.849 0.157 -4.439 76 HG2 GLU 11 2HG GLU 11 -24.957 0.030 -2.166 77 HG3 GLU 11 3HG GLU 11 -24.599 1.758 -2.176 78 H LYS 12 H LYS 12 -22.707 2.101 -6.701 79 HA LYS 12 HA LYS 12 -24.085 0.736 -8.825 80 HB2 LYS 12 2HB LYS 12 -21.779 2.721 -8.863 81 HB3 LYS 12 3HB LYS 12 -22.284 1.883 -10.326 82 HG2 LYS 12 2HG LYS 12 -24.678 2.802 -9.718 83 HG3 LYS 12 3HG LYS 12 -23.793 3.962 -8.725 84 HD2 LYS 12 2HD LYS 12 -23.258 3.534 -11.698 85 HD3 LYS 12 3HD LYS 12 -24.402 4.729 -11.087 86 HE2 LYS 12 2HE LYS 12 -21.455 4.700 -10.358 87 HE3 LYS 12 3HE LYS 12 -22.131 5.643 -11.685 88 HZ1 LYS 12 1HZ LYS 12 -21.846 6.923 -9.614 89 HZ2 LYS 12 2HZ LYS 12 -22.975 5.918 -8.851 90 HZ3 LYS 12 3HZ LYS 12 -23.454 6.885 -10.145 91 H VAL 13 H VAL 13 -23.479 -0.954 -10.017 92 HA VAL 13 HA VAL 13 -21.509 -2.780 -8.906 93 HB VAL 13 HB VAL 13 -23.447 -3.208 -11.235 94 HG11 VAL 13 1HG1 VAL 13 -23.141 -5.620 -10.804 95 HG12 VAL 13 2HG1 VAL 13 -21.979 -5.256 -9.528 96 HG13 VAL 13 3HG1 VAL 13 -21.604 -4.848 -11.205 97 HG21 VAL 13 1HG2 VAL 13 -24.970 -4.293 -9.623 98 HG22 VAL 13 2HG2 VAL 13 -24.693 -2.605 -9.186 99 HG23 VAL 13 3HG2 VAL 13 -23.873 -3.891 -8.298 100 H PHE 14 H PHE 14 -19.634 -3.439 -9.922 101 HA PHE 14 HA PHE 14 -19.023 -2.513 -12.663 102 HB2 PHE 14 2HB PHE 14 -17.189 -2.353 -10.224 103 HB3 PHE 14 3HB PHE 14 -16.633 -2.135 -11.886 104 HD1 PHE 14 HD1 PHE 14 -17.511 -0.210 -13.258 105 HD2 PHE 14 HD2 PHE 14 -18.338 -0.540 -9.067 106 HE1 PHE 14 HE1 PHE 14 -18.213 2.143 -13.199 107 HE2 PHE 14 HE2 PHE 14 -19.024 1.812 -9.028 108 HZ PHE 14 HZ PHE 14 -18.970 3.153 -11.090 109 H GLU 15 H GLU 15 -19.150 -4.335 -13.732 110 HA GLU 15 HA GLU 15 -18.373 -6.918 -12.631 111 HB2 GLU 15 2HB GLU 15 -19.474 -6.294 -15.402 112 HB3 GLU 15 3HB GLU 15 -19.487 -7.849 -14.568 113 HG2 GLU 15 2HG GLU 15 -21.084 -6.956 -12.917 114 HG3 GLU 15 3HG GLU 15 -21.053 -5.387 -13.720 115 H ILE 16 H ILE 16 -16.122 -6.660 -12.517 116 HA ILE 16 HA ILE 16 -14.594 -6.241 -15.017 117 HB ILE 16 HB ILE 16 -13.973 -4.844 -13.048 118 HG12 ILE 16 2HG1 ILE 16 -11.799 -6.848 -13.821 119 HG13 ILE 16 3HG1 ILE 16 -12.219 -5.390 -14.712 120 HG21 ILE 16 1HG2 ILE 16 -12.941 -5.802 -11.036 121 HG22 ILE 16 2HG2 ILE 16 -13.207 -7.432 -11.654 122 HG23 ILE 16 3HG2 ILE 16 -14.587 -6.412 -11.243 123 HD11 ILE 16 1HD1 ILE 16 -11.000 -5.524 -11.961 124 HD12 ILE 16 2HD1 ILE 16 -11.498 -4.043 -12.781 125 HD13 ILE 16 3HD1 ILE 16 -10.214 -5.033 -13.461 126 H GLU 17 H GLU 17 -12.983 -7.764 -15.633 127 HA GLU 17 HA GLU 17 -13.544 -10.510 -15.405 128 HB2 GLU 17 2HB GLU 17 -11.022 -9.041 -16.275 129 HB3 GLU 17 3HB GLU 17 -11.215 -10.774 -16.415 130 HG2 GLU 17 2HG GLU 17 -11.598 -9.874 -18.568 131 HG3 GLU 17 3HG GLU 17 -13.167 -10.371 -17.943 132 H LYS 18 H LYS 18 -12.744 -12.102 -14.052 133 HA LYS 18 HA LYS 18 -12.044 -11.342 -11.416 134 HB2 LYS 18 2HB LYS 18 -13.364 -13.384 -11.985 135 HB3 LYS 18 3HB LYS 18 -11.912 -14.120 -12.659 136 HG2 LYS 18 2HG LYS 18 -10.839 -13.993 -10.397 137 HG3 LYS 18 3HG LYS 18 -12.346 -13.342 -9.750 138 HD2 LYS 18 2HD LYS 18 -12.227 -15.721 -9.245 139 HD3 LYS 18 3HD LYS 18 -13.511 -15.453 -10.427 140 HE2 LYS 18 2HE LYS 18 -12.008 -16.204 -12.240 141 HE3 LYS 18 3HE LYS 18 -10.704 -16.433 -11.073 142 HZ1 LYS 18 1HZ LYS 18 -11.770 -18.516 -11.587 143 HZ2 LYS 18 2HZ LYS 18 -13.277 -17.915 -11.119 144 HZ3 LYS 18 3HZ LYS 18 -12.054 -18.116 -9.972 145 H GLU 19 H GLU 19 -10.151 -12.862 -14.014 146 HA GLU 19 HA GLU 19 -7.716 -13.263 -12.725 147 HB2 GLU 19 2HB GLU 19 -6.669 -13.226 -14.980 148 HB3 GLU 19 3HB GLU 19 -8.106 -14.230 -14.919 149 HG2 GLU 19 2HG GLU 19 -8.476 -11.406 -15.873 150 HG3 GLU 19 3HG GLU 19 -7.589 -12.494 -16.934 151 H ILE 20 H ILE 20 -9.073 -10.303 -14.032 152 HA ILE 20 HA ILE 20 -6.675 -8.707 -13.796 153 HB ILE 20 HB ILE 20 -9.588 -7.815 -14.086 154 HG12 ILE 20 2HG1 ILE 20 -7.432 -8.293 -16.195 155 HG13 ILE 20 3HG1 ILE 20 -8.929 -9.188 -16.007 156 HG21 ILE 20 1HG2 ILE 20 -8.157 -6.027 -13.173 157 HG22 ILE 20 2HG2 ILE 20 -8.668 -5.646 -14.815 158 HG23 ILE 20 3HG2 ILE 20 -7.029 -6.226 -14.520 159 HD11 ILE 20 1HD1 ILE 20 -9.032 -7.697 -17.899 160 HD12 ILE 20 2HD1 ILE 20 -8.673 -6.312 -16.874 161 HD13 ILE 20 3HD1 ILE 20 -10.188 -7.193 -16.669 162 H ALA 21 H ALA 21 -9.614 -9.262 -11.896 163 HA ALA 21 HA ALA 21 -9.084 -7.390 -9.801 164 HB1 ALA 21 1HB ALA 21 -11.362 -8.117 -10.382 165 HB2 ALA 21 2HB ALA 21 -11.012 -8.441 -8.681 166 HB3 ALA 21 3HB ALA 21 -10.981 -9.760 -9.858 167 H CYS 22 H CYS 22 -7.547 -10.292 -10.486 168 HA CYS 22 HA CYS 22 -7.057 -11.282 -7.850 169 HB2 CYS 22 2HB CYS 22 -5.599 -11.754 -10.470 170 HB3 CYS 22 3HB CYS 22 -5.290 -12.647 -8.979 171 HG CYS 22 HG CYS 22 -8.513 -12.724 -9.627 172 H MET 23 H MET 23 -5.573 -8.723 -9.783 173 HA MET 23 HA MET 23 -3.181 -8.450 -8.218 174 HB2 MET 23 2HB MET 23 -4.614 -6.488 -10.041 175 HB3 MET 23 3HB MET 23 -3.139 -6.064 -9.179 176 HG2 MET 23 2HG MET 23 -1.993 -7.971 -10.319 177 HG3 MET 23 3HG MET 23 -3.455 -8.224 -11.275 178 HE1 MET 23 1HE MET 23 -4.412 -5.168 -11.773 179 HE2 MET 23 2HE MET 23 -4.402 -6.420 -13.015 180 HE3 MET 23 3HE MET 23 -3.628 -4.864 -13.321 181 H SER 24 H SER 24 -6.467 -7.368 -7.819 182 HA SER 24 HA SER 24 -6.011 -5.830 -5.425 183 HB2 SER 24 2HB SER 24 -8.090 -5.535 -6.764 184 HB3 SER 24 3HB SER 24 -8.540 -7.211 -6.452 185 HG SER 24 HG SER 24 -8.026 -5.452 -4.326 186 H VAL 25 H VAL 25 -4.853 -6.956 -3.904 187 HA VAL 25 HA VAL 25 -4.899 -9.767 -3.573 188 HB VAL 25 HB VAL 25 -3.874 -7.681 -1.590 189 HG11 VAL 25 1HG1 VAL 25 -4.120 -9.889 -0.517 190 HG12 VAL 25 2HG1 VAL 25 -2.415 -9.474 -0.702 191 HG13 VAL 25 3HG1 VAL 25 -3.164 -10.634 -1.803 192 HG21 VAL 25 1HG2 VAL 25 -1.656 -8.014 -2.637 193 HG22 VAL 25 2HG2 VAL 25 -2.829 -7.414 -3.811 194 HG23 VAL 25 3HG2 VAL 25 -2.374 -9.119 -3.816 195 H THR 26 H THR 26 -6.647 -7.155 -1.928 196 HA THR 26 HA THR 26 -7.786 -8.576 0.205 197 HB THR 26 HB THR 26 -8.932 -6.203 -1.332 198 HG1 THR 26 HG1 THR 26 -7.747 -4.991 0.067 199 HG21 THR 26 1HG2 THR 26 -9.586 -7.145 1.494 200 HG22 THR 26 2HG2 THR 26 -10.678 -7.233 0.110 201 HG23 THR 26 3HG2 THR 26 -10.174 -5.664 0.740 202 H ILE 27 H ILE 27 -9.191 -7.882 -3.031 203 HA ILE 27 HA ILE 27 -11.574 -9.402 -2.680 204 HB ILE 27 HB ILE 27 -10.210 -8.477 -5.255 205 HG12 ILE 27 2HG1 ILE 27 -12.522 -7.216 -3.694 206 HG13 ILE 27 3HG1 ILE 27 -10.865 -6.620 -3.713 207 HG21 ILE 27 1HG2 ILE 27 -11.768 -10.332 -5.747 208 HG22 ILE 27 2HG2 ILE 27 -12.392 -8.812 -6.388 209 HG23 ILE 27 3HG2 ILE 27 -13.064 -9.486 -4.901 210 HD11 ILE 27 1HD1 ILE 27 -11.073 -6.176 -6.120 211 HD12 ILE 27 2HD1 ILE 27 -12.256 -5.293 -5.157 212 HD13 ILE 27 3HD1 ILE 27 -12.752 -6.723 -6.063 213 H LYS 28 H LYS 28 -8.401 -10.113 -4.080 214 HA LYS 28 HA LYS 28 -8.824 -12.624 -5.232 215 HB2 LYS 28 2HB LYS 28 -6.755 -11.290 -5.548 216 HB3 LYS 28 3HB LYS 28 -6.315 -11.551 -3.864 217 HG2 LYS 28 2HG LYS 28 -6.184 -14.034 -4.374 218 HG3 LYS 28 3HG LYS 28 -6.439 -13.633 -6.073 219 HD2 LYS 28 2HD LYS 28 -4.052 -13.956 -5.626 220 HD3 LYS 28 3HD LYS 28 -4.366 -12.276 -6.068 221 HE2 LYS 28 2HE LYS 28 -2.777 -12.392 -4.204 222 HE3 LYS 28 3HE LYS 28 -4.278 -11.641 -3.661 223 HZ1 LYS 28 1HZ LYS 28 -3.471 -14.466 -3.200 224 HZ2 LYS 28 2HZ LYS 28 -4.921 -13.773 -2.675 225 HZ3 LYS 28 3HZ LYS 28 -3.447 -13.230 -2.050 226 H ASN 29 H ASN 29 -7.781 -11.789 -1.907 227 HA ASN 29 HA ASN 29 -7.489 -14.434 -0.934 228 HB2 ASN 29 2HB ASN 29 -7.923 -11.823 0.589 229 HB3 ASN 29 3HB ASN 29 -7.543 -13.359 1.368 230 HD21 ASN 29 1HD2 ASN 29 -6.003 -10.945 1.500 231 HD22 ASN 29 2HD2 ASN 29 -4.450 -11.295 0.835 232 H MET 30 H MET 30 -10.227 -12.183 -0.968 233 HA MET 30 HA MET 30 -12.032 -13.643 0.657 234 HB2 MET 30 2HB MET 30 -12.552 -11.659 -1.596 235 HB3 MET 30 3HB MET 30 -13.828 -12.316 -0.580 236 HG2 MET 30 2HG MET 30 -12.832 -11.277 1.388 237 HG3 MET 30 3HG MET 30 -11.497 -10.662 0.407 238 HE1 MET 30 1HE MET 30 -12.061 -8.191 1.400 239 HE2 MET 30 2HE MET 30 -13.429 -8.843 2.303 240 HE3 MET 30 3HE MET 30 -13.651 -7.443 1.256 241 H ILE 31 H ILE 31 -11.402 -13.691 -2.837 242 HA ILE 31 HA ILE 31 -13.471 -15.503 -3.559 243 HB ILE 31 HB ILE 31 -10.911 -14.748 -5.044 244 HG12 ILE 31 2HG1 ILE 31 -13.794 -13.789 -5.415 245 HG13 ILE 31 3HG1 ILE 31 -12.513 -12.863 -4.644 246 HG21 ILE 31 1HG2 ILE 31 -13.338 -16.234 -6.125 247 HG22 ILE 31 2HG2 ILE 31 -11.749 -16.942 -5.843 248 HG23 ILE 31 3HG2 ILE 31 -11.954 -15.699 -7.077 249 HD11 ILE 31 1HD1 ILE 31 -11.292 -12.818 -6.777 250 HD12 ILE 31 2HD1 ILE 31 -12.890 -12.082 -6.885 251 HD13 ILE 31 3HD1 ILE 31 -12.621 -13.698 -7.537 252 H GLU 32 H GLU 32 -9.974 -15.940 -2.934 253 HA GLU 32 HA GLU 32 -9.752 -18.706 -3.420 254 HB2 GLU 32 2HB GLU 32 -8.119 -16.924 -1.563 255 HB3 GLU 32 3HB GLU 32 -7.663 -18.568 -2.009 256 HG2 GLU 32 2HG GLU 32 -7.399 -17.916 -4.338 257 HG3 GLU 32 3HG GLU 32 -7.985 -16.287 -3.988 258 H ASP 33 H ASP 33 -10.619 -16.898 -0.544 259 HA ASP 33 HA ASP 33 -10.570 -18.892 1.426 260 HB2 ASP 33 2HB ASP 33 -10.746 -16.500 1.945 261 HB3 ASP 33 3HB ASP 33 -12.304 -16.399 1.142 262 H ILE 34 H ILE 34 -13.131 -17.837 -0.757 263 HA ILE 34 HA ILE 34 -15.078 -19.792 0.214 264 HB ILE 34 HB ILE 34 -15.279 -17.614 -1.933 265 HG12 ILE 34 2HG1 ILE 34 -16.210 -17.604 0.985 266 HG13 ILE 34 3HG1 ILE 34 -14.825 -16.721 0.356 267 HG21 ILE 34 1HG2 ILE 34 -16.980 -19.369 -2.302 268 HG22 ILE 34 2HG2 ILE 34 -17.732 -17.865 -1.770 269 HG23 ILE 34 3HG2 ILE 34 -17.529 -19.200 -0.634 270 HD11 ILE 34 1HD1 ILE 34 -16.668 -15.235 0.693 271 HD12 ILE 34 2HD1 ILE 34 -17.723 -16.230 -0.308 272 HD13 ILE 34 3HD1 ILE 34 -16.355 -15.381 -1.036 273 H GLY 35 H GLY 35 -12.592 -19.728 -2.068 274 HA2 GLY 35 2HA GLY 35 -12.008 -21.534 -3.504 275 HA3 GLY 35 3HA GLY 35 -13.710 -21.962 -3.662 276 H GLU 36 H GLU 36 -15.104 -20.453 -4.829 277 HA GLU 36 HA GLU 36 -13.872 -18.321 -6.423 278 HB2 GLU 36 2HB GLU 36 -15.476 -20.621 -7.640 279 HB3 GLU 36 3HB GLU 36 -15.270 -19.075 -8.461 280 HG2 GLU 36 2HG GLU 36 -12.834 -19.398 -8.489 281 HG3 GLU 36 3HG GLU 36 -13.013 -20.927 -7.632 282 H SER 37 H SER 37 -14.924 -16.681 -5.457 283 HA SER 37 HA SER 37 -17.580 -16.710 -4.477 284 HB2 SER 37 2HB SER 37 -15.770 -14.345 -5.139 285 HB3 SER 37 3HB SER 37 -17.238 -14.269 -4.159 286 HG SER 37 HG SER 37 -16.114 -14.915 -2.532 287 H ASP 38 H ASP 38 -19.193 -17.116 -5.924 288 HA ASP 38 HA ASP 38 -19.280 -15.951 -8.591 289 HB2 ASP 38 2HB ASP 38 -21.191 -17.349 -8.992 290 HB3 ASP 38 3HB ASP 38 -20.055 -18.321 -8.068 291 H SER 39 H SER 39 -20.771 -15.482 -5.458 292 HA SER 39 HA SER 39 -22.825 -13.664 -6.251 293 HB2 SER 39 2HB SER 39 -23.044 -13.232 -3.787 294 HB3 SER 39 3HB SER 39 -23.030 -14.953 -4.157 295 HG SER 39 HG SER 39 -21.050 -13.371 -2.939 296 HA PRO 40 HA PRO 40 -20.386 -9.916 -6.819 297 HB2 PRO 40 2HB PRO 40 -22.767 -8.541 -5.586 298 HB3 PRO 40 3HB PRO 40 -21.952 -8.220 -7.131 299 HG2 PRO 40 2HG PRO 40 -24.303 -9.418 -7.083 300 HG3 PRO 40 3HG PRO 40 -23.048 -9.944 -8.231 301 HD2 PRO 40 2HD PRO 40 -23.919 -11.250 -5.666 302 HD3 PRO 40 3HD PRO 40 -23.453 -11.998 -7.213 303 H ILE 41 H ILE 41 -19.020 -8.655 -5.606 304 HA ILE 41 HA ILE 41 -19.059 -8.966 -2.678 305 HB ILE 41 HB ILE 41 -16.774 -8.033 -4.482 306 HG12 ILE 41 2HG1 ILE 41 -15.682 -10.278 -3.672 307 HG13 ILE 41 3HG1 ILE 41 -17.311 -10.768 -3.231 308 HG21 ILE 41 1HG2 ILE 41 -16.750 -8.606 -1.497 309 HG22 ILE 41 2HG2 ILE 41 -16.623 -7.017 -2.255 310 HG23 ILE 41 3HG2 ILE 41 -15.335 -8.203 -2.473 311 HD11 ILE 41 1HD1 ILE 41 -16.628 -11.685 -5.383 312 HD12 ILE 41 2HD1 ILE 41 -16.366 -10.058 -6.012 313 HD13 ILE 41 3HD1 ILE 41 -17.994 -10.585 -5.579 314 HA PRO 42 HA PRO 42 -20.311 -4.517 -2.818 315 HB2 PRO 42 2HB PRO 42 -21.272 -4.945 -0.053 316 HB3 PRO 42 3HB PRO 42 -22.213 -4.546 -1.503 317 HG2 PRO 42 2HG PRO 42 -22.413 -6.958 -0.285 318 HG3 PRO 42 3HG PRO 42 -22.606 -6.759 -2.043 319 HD2 PRO 42 2HD PRO 42 -20.154 -7.663 -0.516 320 HD3 PRO 42 3HD PRO 42 -20.898 -8.375 -1.970 321 H LEU 43 H LEU 43 -18.871 -2.949 -2.342 322 HA LEU 43 HA LEU 43 -16.840 -3.361 -0.217 323 HB2 LEU 43 2HB LEU 43 -16.628 -1.845 -2.849 324 HB3 LEU 43 3HB LEU 43 -15.352 -1.944 -1.643 325 HG LEU 43 HG LEU 43 -16.469 -4.353 -3.147 326 HD11 LEU 43 1HD1 LEU 43 -15.350 -2.861 -4.716 327 HD12 LEU 43 2HD1 LEU 43 -14.407 -4.329 -4.474 328 HD13 LEU 43 3HD1 LEU 43 -13.907 -2.824 -3.696 329 HD21 LEU 43 1HD2 LEU 43 -14.480 -5.544 -2.274 330 HD22 LEU 43 2HD2 LEU 43 -15.526 -4.974 -0.977 331 HD23 LEU 43 3HD2 LEU 43 -14.028 -4.112 -1.341 332 HA PRO 44 HA PRO 44 -19.133 0.415 1.173 333 HB2 PRO 44 2HB PRO 44 -19.195 -0.110 3.825 334 HB3 PRO 44 3HB PRO 44 -20.209 -1.035 2.694 335 HG2 PRO 44 2HG PRO 44 -17.620 -1.833 3.987 336 HG3 PRO 44 3HG PRO 44 -19.087 -2.799 3.712 337 HD2 PRO 44 2HD PRO 44 -16.827 -2.852 2.068 338 HD3 PRO 44 3HD PRO 44 -18.450 -3.377 1.578 339 H ASN 45 H ASN 45 -16.949 1.237 0.289 340 HA ASN 45 HA ASN 45 -15.827 3.049 2.192 341 HB2 ASN 45 2HB ASN 45 -14.414 1.121 2.819 342 HB3 ASN 45 3HB ASN 45 -13.995 0.834 1.138 343 HD21 ASN 45 1HD2 ASN 45 -13.450 2.887 3.919 344 HD22 ASN 45 2HD2 ASN 45 -12.035 3.668 3.310 345 H VAL 46 H VAL 46 -14.739 1.423 -0.797 346 HA VAL 46 HA VAL 46 -13.898 3.879 -2.019 347 HB VAL 46 HB VAL 46 -12.641 1.828 -2.438 348 HG11 VAL 46 1HG1 VAL 46 -13.499 -0.064 -3.765 349 HG12 VAL 46 2HG1 VAL 46 -15.092 0.692 -3.831 350 HG13 VAL 46 3HG1 VAL 46 -14.437 0.153 -2.284 351 HG21 VAL 46 1HG2 VAL 46 -12.442 1.938 -4.903 352 HG22 VAL 46 2HG2 VAL 46 -12.567 3.544 -4.183 353 HG23 VAL 46 3HG2 VAL 46 -13.966 2.826 -4.985 354 H THR 47 H THR 47 -15.099 5.243 -3.223 355 HA THR 47 HA THR 47 -17.903 4.851 -3.708 356 HB THR 47 HB THR 47 -17.812 7.079 -4.813 357 HG1 THR 47 HG1 THR 47 -15.535 8.050 -4.625 358 HG21 THR 47 1HG2 THR 47 -16.151 6.991 -2.261 359 HG22 THR 47 2HG2 THR 47 -17.914 7.021 -2.337 360 HG23 THR 47 3HG2 THR 47 -16.985 8.409 -2.906 361 H SER 48 H SER 48 -18.829 5.314 -5.963 362 HA SER 48 HA SER 48 -18.041 3.203 -7.690 363 HB2 SER 48 2HB SER 48 -19.835 4.089 -9.196 364 HB3 SER 48 3HB SER 48 -20.381 3.903 -7.526 365 HG SER 48 HG SER 48 -21.006 5.895 -7.882 366 H THR 49 H THR 49 -17.576 6.705 -7.788 367 HA THR 49 HA THR 49 -16.594 6.981 -10.411 368 HB THR 49 HB THR 49 -15.876 8.719 -8.007 369 HG1 THR 49 HG1 THR 49 -17.811 9.699 -8.241 370 HG21 THR 49 1HG2 THR 49 -15.768 10.554 -9.659 371 HG22 THR 49 2HG2 THR 49 -16.131 9.418 -10.960 372 HG23 THR 49 3HG2 THR 49 -14.615 9.280 -10.065 373 H ILE 50 H ILE 50 -14.925 6.586 -7.288 374 HA ILE 50 HA ILE 50 -12.268 6.646 -8.340 375 HB ILE 50 HB ILE 50 -13.307 5.689 -5.637 376 HG12 ILE 50 2HG1 ILE 50 -13.751 8.083 -6.048 377 HG13 ILE 50 3HG1 ILE 50 -12.530 7.900 -4.797 378 HG21 ILE 50 1HG2 ILE 50 -10.431 6.239 -6.453 379 HG22 ILE 50 2HG2 ILE 50 -11.118 4.665 -6.053 380 HG23 ILE 50 3HG2 ILE 50 -10.977 5.906 -4.809 381 HD11 ILE 50 1HD1 ILE 50 -11.974 9.725 -6.260 382 HD12 ILE 50 2HD1 ILE 50 -12.047 8.679 -7.675 383 HD13 ILE 50 3HD1 ILE 50 -10.785 8.440 -6.463 384 H LEU 51 H LEU 51 -14.442 4.020 -7.266 385 HA LEU 51 HA LEU 51 -12.723 1.830 -7.607 386 HB2 LEU 51 2HB LEU 51 -14.915 1.745 -6.385 387 HB3 LEU 51 3HB LEU 51 -15.758 1.851 -7.920 388 HG LEU 51 HG LEU 51 -14.792 -0.357 -8.594 389 HD11 LEU 51 1HD1 LEU 51 -13.634 -1.778 -6.958 390 HD12 LEU 51 2HD1 LEU 51 -13.607 -0.444 -5.801 391 HD13 LEU 51 3HD1 LEU 51 -12.711 -0.319 -7.318 392 HD21 LEU 51 1HD2 LEU 51 -17.007 -0.296 -7.543 393 HD22 LEU 51 2HD2 LEU 51 -16.272 -0.451 -5.944 394 HD23 LEU 51 3HD2 LEU 51 -16.142 -1.771 -7.109 395 H GLU 52 H GLU 52 -14.874 3.490 -9.866 396 HA GLU 52 HA GLU 52 -14.755 1.772 -12.073 397 HB2 GLU 52 2HB GLU 52 -16.315 3.719 -11.879 398 HB3 GLU 52 3HB GLU 52 -14.957 4.818 -12.101 399 HG2 GLU 52 2HG GLU 52 -14.584 3.934 -14.367 400 HG3 GLU 52 3HG GLU 52 -15.895 2.775 -14.147 401 H LYS 53 H LYS 53 -12.738 4.585 -11.226 402 HA LYS 53 HA LYS 53 -11.022 4.478 -13.473 403 HB2 LYS 53 2HB LYS 53 -10.680 5.780 -10.746 404 HB3 LYS 53 3HB LYS 53 -9.537 5.984 -12.072 405 HG2 LYS 53 2HG LYS 53 -11.416 6.933 -13.462 406 HG3 LYS 53 3HG LYS 53 -12.438 6.872 -12.020 407 HD2 LYS 53 2HD LYS 53 -11.519 9.124 -12.297 408 HD3 LYS 53 3HD LYS 53 -10.860 8.373 -10.843 409 HE2 LYS 53 2HE LYS 53 -9.098 9.569 -12.050 410 HE3 LYS 53 3HE LYS 53 -8.767 7.837 -12.085 411 HZ1 LYS 53 1HZ LYS 53 -9.966 9.443 -14.278 412 HZ2 LYS 53 2HZ LYS 53 -9.704 7.775 -14.331 413 HZ3 LYS 53 3HZ LYS 53 -8.392 8.832 -14.239 414 H VAL 54 H VAL 54 -10.632 3.265 -10.147 415 HA VAL 54 HA VAL 54 -7.943 2.459 -10.313 416 HB VAL 54 HB VAL 54 -10.180 1.534 -8.446 417 HG11 VAL 54 1HG1 VAL 54 -8.435 -0.209 -8.508 418 HG12 VAL 54 2HG1 VAL 54 -8.420 0.631 -6.955 419 HG13 VAL 54 3HG1 VAL 54 -7.196 1.004 -8.172 420 HG21 VAL 54 1HG2 VAL 54 -7.894 3.496 -7.987 421 HG22 VAL 54 2HG2 VAL 54 -9.125 3.054 -6.801 422 HG23 VAL 54 3HG2 VAL 54 -9.579 3.935 -8.261 423 H LEU 55 H LEU 55 -10.980 0.608 -10.744 424 HA LEU 55 HA LEU 55 -9.782 -1.890 -11.366 425 HB2 LEU 55 2HB LEU 55 -12.529 -0.811 -12.094 426 HB3 LEU 55 3HB LEU 55 -12.024 -2.466 -12.379 427 HG LEU 55 HG LEU 55 -12.402 -1.139 -9.670 428 HD11 LEU 55 1HD1 LEU 55 -13.957 -3.363 -11.022 429 HD12 LEU 55 2HD1 LEU 55 -14.497 -1.697 -10.793 430 HD13 LEU 55 3HD1 LEU 55 -14.240 -2.736 -9.394 431 HD21 LEU 55 1HD2 LEU 55 -10.507 -2.688 -9.522 432 HD22 LEU 55 2HD2 LEU 55 -11.469 -3.977 -10.253 433 HD23 LEU 55 3HD2 LEU 55 -11.903 -3.339 -8.664 434 H ASP 56 H ASP 56 -10.916 0.809 -13.399 435 HA ASP 56 HA ASP 56 -10.677 -0.397 -15.943 436 HB2 ASP 56 2HB ASP 56 -11.986 1.688 -15.476 437 HB3 ASP 56 3HB ASP 56 -10.485 2.575 -15.235 438 H TYR 57 H TYR 57 -8.375 1.443 -13.996 439 HA TYR 57 HA TYR 57 -6.224 1.522 -15.842 440 HB2 TYR 57 2HB TYR 57 -6.284 3.008 -13.876 441 HB3 TYR 57 3HB TYR 57 -6.204 1.625 -12.791 442 HD1 TYR 57 HD1 TYR 57 -4.058 0.371 -12.504 443 HD2 TYR 57 HD2 TYR 57 -4.268 3.815 -15.037 444 HE1 TYR 57 HE1 TYR 57 -1.609 0.471 -12.552 445 HE2 TYR 57 HE2 TYR 57 -1.814 3.917 -15.087 446 HH TYR 57 HH TYR 57 0.098 3.162 -13.779 447 H CYS 58 H CYS 58 -7.096 -0.703 -13.200 448 HA CYS 58 HA CYS 58 -4.892 -2.430 -13.346 449 HB2 CYS 58 2HB CYS 58 -7.727 -2.947 -12.378 450 HB3 CYS 58 3HB CYS 58 -6.389 -4.075 -12.147 451 HG CYS 58 HG CYS 58 -7.276 -1.595 -10.276 452 H ARG 59 H ARG 59 -7.888 -2.356 -15.238 453 HA ARG 59 HA ARG 59 -7.679 -4.862 -16.511 454 HB2 ARG 59 2HB ARG 59 -8.885 -2.311 -17.671 455 HB3 ARG 59 3HB ARG 59 -9.148 -3.945 -18.278 456 HG2 ARG 59 2HG ARG 59 -10.190 -4.533 -16.065 457 HG3 ARG 59 3HG ARG 59 -10.042 -2.840 -15.601 458 HD2 ARG 59 2HD ARG 59 -12.266 -3.047 -16.347 459 HD3 ARG 59 3HD ARG 59 -11.428 -2.316 -17.718 460 HE ARG 59 HE ARG 59 -12.117 -5.194 -17.509 461 HH11 ARG 59 1HH1 ARG 59 -11.755 -2.325 -19.510 462 HH12 ARG 59 2HH1 ARG 59 -12.269 -3.141 -20.950 463 HH21 ARG 59 1HH2 ARG 59 -12.809 -6.215 -19.379 464 HH22 ARG 59 2HH2 ARG 59 -12.866 -5.340 -20.880 465 H HIS 60 H HIS 60 -6.386 -1.667 -17.356 466 HA HIS 60 HA HIS 60 -5.094 -2.406 -19.763 467 HB2 HIS 60 2HB HIS 60 -5.585 -0.038 -19.192 468 HB3 HIS 60 3HB HIS 60 -4.411 -0.105 -17.875 469 HD1 HIS 60 HD1 HIS 60 -2.008 0.390 -18.485 470 HD2 HIS 60 HD2 HIS 60 -4.365 -0.353 -21.821 471 HE1 HIS 60 HE1 HIS 60 -0.510 0.702 -20.460 472 HE2 HIS 60 HE2 HIS 60 -2.042 0.555 -22.435 473 H HIS 61 H HIS 61 -4.007 -2.296 -16.383 474 HA HIS 61 HA HIS 61 -1.271 -2.909 -16.914 475 HB2 HIS 61 2HB HIS 61 -2.069 -1.719 -14.838 476 HB3 HIS 61 3HB HIS 61 -2.784 -3.230 -14.280 477 HD1 HIS 61 HD1 HIS 61 -1.130 -5.126 -13.536 478 HD2 HIS 61 HD2 HIS 61 0.721 -1.558 -14.582 479 HE1 HIS 61 HE1 HIS 61 1.249 -5.366 -12.794 480 HE2 HIS 61 HE2 HIS 61 2.372 -3.224 -13.484 481 H HIS 62 H HIS 62 -4.135 -4.876 -16.602 482 HA HIS 62 HA HIS 62 -2.734 -7.361 -16.136 483 HB2 HIS 62 2HB HIS 62 -5.092 -7.120 -15.446 484 HB3 HIS 62 3HB HIS 62 -5.575 -6.864 -17.120 485 HD1 HIS 62 HD1 HIS 62 -4.291 -9.547 -14.798 486 HD2 HIS 62 HD2 HIS 62 -5.943 -9.213 -18.590 487 HE1 HIS 62 HE1 HIS 62 -4.749 -11.894 -15.542 488 HE2 HIS 62 HE2 HIS 62 -5.583 -11.667 -17.902 489 H GLN 63 H GLN 63 -4.087 -5.640 -18.929 490 HA GLN 63 HA GLN 63 -3.430 -7.608 -20.899 491 HB2 GLN 63 2HB GLN 63 -3.936 -4.618 -21.276 492 HB3 GLN 63 3HB GLN 63 -3.947 -5.833 -22.550 493 HG2 GLN 63 2HG GLN 63 -5.929 -5.584 -20.267 494 HG3 GLN 63 3HG GLN 63 -6.225 -5.214 -21.960 495 HE21 GLN 63 1HE2 GLN 63 -6.464 -6.938 -23.431 496 HE22 GLN 63 2HE2 GLN 63 -6.792 -8.549 -22.911 497 H HIS 64 H HIS 64 -1.719 -4.959 -19.398 498 HA HIS 64 HA HIS 64 0.772 -5.706 -20.820 499 HB2 HIS 64 2HB HIS 64 -0.059 -2.902 -19.939 500 HB3 HIS 64 3HB HIS 64 1.527 -3.328 -20.570 501 HD1 HIS 64 HD1 HIS 64 1.749 -3.650 -23.112 502 HD2 HIS 64 HD2 HIS 64 -2.112 -2.740 -21.885 503 HE1 HIS 64 HE1 HIS 64 0.493 -3.069 -25.204 504 HE2 HIS 64 HE2 HIS 64 -1.883 -2.726 -24.451 505 HA PRO 65 HA PRO 65 1.085 -6.414 -16.231 506 HB2 PRO 65 2HB PRO 65 2.346 -8.837 -16.300 507 HB3 PRO 65 3HB PRO 65 0.598 -8.677 -16.566 508 HG2 PRO 65 2HG PRO 65 2.784 -9.017 -18.596 509 HG3 PRO 65 3HG PRO 65 1.177 -9.776 -18.533 510 HD2 PRO 65 2HD PRO 65 1.749 -7.600 -20.124 511 HD3 PRO 65 3HD PRO 65 0.127 -7.957 -19.494 512 H GLY 66 H GLY 66 2.505 -4.539 -16.309 513 HA2 GLY 66 2HA GLY 66 5.104 -5.065 -15.364 514 HA3 GLY 66 3HA GLY 66 5.217 -4.604 -17.057 515 H GLY 67 H GLY 67 5.072 -2.462 -17.602 516 HA2 GLY 67 2HA GLY 67 4.772 -0.147 -17.249 517 HA3 GLY 67 3HA GLY 67 4.471 -0.440 -15.539 518 H SER 68 H SER 68 6.911 -0.132 -18.014 519 HA SER 68 HA SER 68 9.172 -0.764 -16.299 520 HB2 SER 68 2HB SER 68 9.114 0.195 -19.195 521 HB3 SER 68 3HB SER 68 10.488 -0.536 -18.358 522 HG SER 68 HG SER 68 8.034 -1.731 -19.090 523 H GLY 69 H GLY 69 7.517 2.103 -17.360 524 HA2 GLY 69 2HA GLY 69 7.893 4.330 -16.772 525 HA3 GLY 69 3HA GLY 69 9.490 3.913 -16.166 526 H LEU 70 H LEU 70 10.733 2.733 -18.208 527 HA LEU 70 HA LEU 70 11.244 4.846 -20.110 528 HB2 LEU 70 2HB LEU 70 13.068 3.285 -20.920 529 HB3 LEU 70 3HB LEU 70 13.167 3.764 -19.241 530 HG LEU 70 HG LEU 70 12.120 1.464 -18.662 531 HD11 LEU 70 1HD1 LEU 70 11.266 0.807 -20.852 532 HD12 LEU 70 2HD1 LEU 70 12.441 -0.372 -20.276 533 HD13 LEU 70 3HD1 LEU 70 12.900 0.795 -21.519 534 HD21 LEU 70 1HD2 LEU 70 14.470 1.975 -18.234 535 HD22 LEU 70 2HD2 LEU 70 14.896 1.525 -19.888 536 HD23 LEU 70 3HD2 LEU 70 14.289 0.302 -18.767 537 H ASP 71 H ASP 71 8.825 2.666 -20.110 538 HA ASP 71 HA ASP 71 8.987 1.646 -22.838 539 HB2 ASP 71 2HB ASP 71 6.878 0.480 -22.314 540 HB3 ASP 71 3HB ASP 71 8.033 0.236 -21.010 541 H ASP 72 H ASP 72 8.573 4.634 -22.026 542 HA ASP 72 HA ASP 72 7.826 6.461 -23.097 543 HB2 ASP 72 2HB ASP 72 7.595 5.266 -25.235 544 HB3 ASP 72 3HB ASP 72 6.033 4.631 -24.740 545 H ILE 73 H ILE 73 5.615 4.153 -21.718 546 HA ILE 73 HA ILE 73 3.828 4.245 -20.385 547 HB ILE 73 HB ILE 73 4.658 7.139 -19.888 548 HG12 ILE 73 2HG1 ILE 73 6.327 5.420 -19.153 549 HG13 ILE 73 3HG1 ILE 73 5.655 6.303 -17.788 550 HG21 ILE 73 1HG2 ILE 73 3.204 7.069 -17.855 551 HG22 ILE 73 2HG2 ILE 73 2.587 5.497 -18.371 552 HG23 ILE 73 3HG2 ILE 73 2.277 6.929 -19.353 553 HD11 ILE 73 1HD1 ILE 73 5.890 3.963 -17.261 554 HD12 ILE 73 2HD1 ILE 73 4.918 3.505 -18.658 555 HD13 ILE 73 3HD1 ILE 73 4.177 4.379 -17.312 556 HA PRO 74 HA PRO 74 0.867 5.472 -23.691 557 HB2 PRO 74 2HB PRO 74 -1.270 4.178 -22.327 558 HB3 PRO 74 3HB PRO 74 -0.250 3.460 -23.588 559 HG2 PRO 74 2HG PRO 74 -0.024 3.232 -20.616 560 HG3 PRO 74 3HG PRO 74 0.267 2.006 -21.869 561 HD2 PRO 74 2HD PRO 74 2.311 3.201 -20.633 562 HD3 PRO 74 3HD PRO 74 2.402 2.833 -22.373 563 HA PRO 75 HA PRO 75 -0.530 9.354 -22.031 564 HB2 PRO 75 2HB PRO 75 -2.985 8.874 -23.744 565 HB3 PRO 75 3HB PRO 75 -1.944 10.314 -23.636 566 HG2 PRO 75 2HG PRO 75 -1.674 8.689 -25.701 567 HG3 PRO 75 3HG PRO 75 -0.227 9.345 -24.895 568 HD2 PRO 75 2HD PRO 75 -1.413 6.585 -24.679 569 HD3 PRO 75 3HD PRO 75 0.297 7.081 -24.740 570 H TYR 76 H TYR 76 -2.996 6.744 -22.047 571 HA TYR 76 HA TYR 76 -4.834 7.872 -20.259 572 HB2 TYR 76 2HB TYR 76 -5.574 5.908 -21.414 573 HB3 TYR 76 3HB TYR 76 -4.181 4.967 -20.887 574 HD1 TYR 76 HD1 TYR 76 -4.386 3.558 -18.953 575 HD2 TYR 76 HD2 TYR 76 -7.251 6.685 -19.550 576 HE1 TYR 76 HE1 TYR 76 -5.641 2.786 -16.991 577 HE2 TYR 76 HE2 TYR 76 -8.501 5.900 -17.584 578 HH TYR 76 HH TYR 76 -8.740 3.655 -16.318 579 H ASP 77 H ASP 77 -2.013 5.810 -19.594 580 HA ASP 77 HA ASP 77 -2.504 5.477 -16.801 581 HB2 ASP 77 2HB ASP 77 0.007 4.989 -18.479 582 HB3 ASP 77 3HB ASP 77 -0.190 4.464 -16.805 583 H ARG 78 H ARG 78 -0.648 7.735 -18.701 584 HA ARG 78 HA ARG 78 0.786 9.054 -16.601 585 HB2 ARG 78 2HB ARG 78 1.519 9.117 -18.952 586 HB3 ARG 78 3HB ARG 78 0.016 9.897 -19.427 587 HG2 ARG 78 2HG ARG 78 0.720 11.870 -17.959 588 HG3 ARG 78 3HG ARG 78 2.300 11.087 -17.825 589 HD2 ARG 78 2HD ARG 78 2.291 12.788 -19.607 590 HD3 ARG 78 3HD ARG 78 2.557 11.172 -20.276 591 HE ARG 78 HE ARG 78 -0.222 11.996 -20.254 592 HH11 ARG 78 1HH1 ARG 78 2.740 12.102 -22.163 593 HH12 ARG 78 2HH1 ARG 78 1.895 12.349 -23.658 594 HH21 ARG 78 1HH2 ARG 78 -1.292 12.314 -22.201 595 HH22 ARG 78 2HH2 ARG 78 -0.389 12.471 -23.680 596 H ASP 79 H ASP 79 -2.145 9.773 -18.440 597 HA ASP 79 HA ASP 79 -2.783 12.197 -17.027 598 HB2 ASP 79 2HB ASP 79 -4.129 10.723 -19.302 599 HB3 ASP 79 3HB ASP 79 -4.899 12.105 -18.525 600 H PHE 80 H PHE 80 -3.480 8.903 -16.503 601 HA PHE 80 HA PHE 80 -5.879 8.905 -15.102 602 HB2 PHE 80 2HB PHE 80 -4.508 6.859 -15.579 603 HB3 PHE 80 3HB PHE 80 -3.331 7.374 -14.376 604 HD1 PHE 80 HD1 PHE 80 -6.778 6.141 -14.881 605 HD2 PHE 80 HD2 PHE 80 -3.756 7.064 -11.997 606 HE1 PHE 80 HE1 PHE 80 -8.087 5.032 -13.133 607 HE2 PHE 80 HE2 PHE 80 -5.075 5.946 -10.257 608 HZ PHE 80 HZ PHE 80 -7.245 4.928 -10.823 609 H CYS 81 H CYS 81 -2.711 10.032 -14.151 610 HA CYS 81 HA CYS 81 -3.144 10.534 -11.398 611 HB2 CYS 81 2HB CYS 81 -1.128 11.788 -13.299 612 HB3 CYS 81 3HB CYS 81 -1.009 11.732 -11.540 613 HG CYS 81 HG CYS 81 -0.348 9.187 -11.287 614 H LYS 82 H LYS 82 -4.145 12.275 -14.230 615 HA LYS 82 HA LYS 82 -4.263 14.921 -13.095 616 HB2 LYS 82 2HB LYS 82 -5.762 13.866 -15.533 617 HB3 LYS 82 3HB LYS 82 -5.527 15.560 -15.106 618 HG2 LYS 82 2HG LYS 82 -3.352 13.606 -15.899 619 HG3 LYS 82 3HG LYS 82 -4.064 14.839 -16.944 620 HD2 LYS 82 2HD LYS 82 -3.202 16.591 -15.337 621 HD3 LYS 82 3HD LYS 82 -2.385 15.301 -14.444 622 HE2 LYS 82 2HE LYS 82 -0.836 16.425 -15.995 623 HE3 LYS 82 3HE LYS 82 -1.068 14.737 -16.454 624 HZ1 LYS 82 1HZ LYS 82 -1.132 16.226 -18.361 625 HZ2 LYS 82 2HZ LYS 82 -2.451 17.052 -17.703 626 HZ3 LYS 82 3HZ LYS 82 -2.607 15.429 -18.162 627 H VAL 83 H VAL 83 -5.324 14.368 -11.125 628 HA VAL 83 HA VAL 83 -8.261 14.545 -11.269 629 HB VAL 83 HB VAL 83 -8.431 13.022 -9.242 630 HG11 VAL 83 1HG1 VAL 83 -8.259 10.881 -10.464 631 HG12 VAL 83 2HG1 VAL 83 -7.332 11.675 -11.739 632 HG13 VAL 83 3HG1 VAL 83 -9.012 12.133 -11.456 633 HG21 VAL 83 1HG2 VAL 83 -6.096 13.166 -8.457 634 HG22 VAL 83 2HG2 VAL 83 -5.542 12.305 -9.895 635 HG23 VAL 83 3HG2 VAL 83 -6.563 11.483 -8.711 636 H ASP 84 H ASP 84 -9.144 15.367 -9.199 637 HA ASP 84 HA ASP 84 -7.839 17.740 -8.374 638 HB2 ASP 84 2HB ASP 84 -10.334 17.340 -8.487 639 HB3 ASP 84 3HB ASP 84 -10.197 16.312 -7.067 640 H GLN 85 H GLN 85 -7.326 18.289 -6.038 641 HA GLN 85 HA GLN 85 -5.100 16.781 -5.313 642 HB2 GLN 85 2HB GLN 85 -5.832 19.324 -4.804 643 HB3 GLN 85 3HB GLN 85 -6.277 18.650 -3.249 644 HG2 GLN 85 2HG GLN 85 -3.516 18.542 -4.497 645 HG3 GLN 85 3HG GLN 85 -4.027 19.685 -3.267 646 HE21 GLN 85 1HE2 GLN 85 -5.474 17.668 -1.651 647 HE22 GLN 85 2HE2 GLN 85 -4.251 16.698 -0.916 648 HA PRO 86 HA PRO 86 -7.445 14.835 -1.511 649 HB2 PRO 86 2HB PRO 86 -10.195 14.913 -1.402 650 HB3 PRO 86 3HB PRO 86 -9.168 16.168 -0.674 651 HG2 PRO 86 2HG PRO 86 -10.575 16.206 -3.331 652 HG3 PRO 86 3HG PRO 86 -10.494 17.474 -2.085 653 HD2 PRO 86 2HD PRO 86 -8.893 17.549 -4.265 654 HD3 PRO 86 3HD PRO 86 -8.333 18.123 -2.681 655 H THR 87 H THR 87 -9.061 14.836 -4.654 656 HA THR 87 HA THR 87 -10.197 12.266 -4.668 657 HB THR 87 HB THR 87 -9.199 13.864 -7.069 658 HG1 THR 87 HG1 THR 87 -11.393 14.724 -6.997 659 HG21 THR 87 1HG2 THR 87 -9.954 11.580 -7.658 660 HG22 THR 87 2HG2 THR 87 -11.062 12.800 -8.286 661 HG23 THR 87 3HG2 THR 87 -11.495 11.875 -6.846 662 H LEU 88 H LEU 88 -6.958 13.400 -5.409 663 HA LEU 88 HA LEU 88 -5.883 11.069 -6.605 664 HB2 LEU 88 2HB LEU 88 -5.003 13.550 -6.484 665 HB3 LEU 88 3HB LEU 88 -4.240 13.047 -4.989 666 HG LEU 88 HG LEU 88 -3.719 11.668 -7.660 667 HD11 LEU 88 1HD1 LEU 88 -3.073 14.011 -7.880 668 HD12 LEU 88 2HD1 LEU 88 -1.655 12.967 -7.852 669 HD13 LEU 88 3HD1 LEU 88 -2.089 13.902 -6.417 670 HD21 LEU 88 1HD2 LEU 88 -3.112 10.304 -5.728 671 HD22 LEU 88 2HD2 LEU 88 -2.147 11.621 -5.064 672 HD23 LEU 88 3HD2 LEU 88 -1.660 10.842 -6.573 673 H PHE 89 H PHE 89 -6.070 12.218 -3.255 674 HA PHE 89 HA PHE 89 -4.702 9.985 -2.106 675 HB2 PHE 89 2HB PHE 89 -6.413 12.172 -0.865 676 HB3 PHE 89 3HB PHE 89 -5.616 10.915 0.086 677 HD1 PHE 89 HD1 PHE 89 -3.053 10.629 -0.246 678 HD2 PHE 89 HD2 PHE 89 -5.175 14.154 -1.412 679 HE1 PHE 89 HE1 PHE 89 -0.945 11.894 -0.273 680 HE2 PHE 89 HE2 PHE 89 -3.059 15.405 -1.427 681 HZ PHE 89 HZ PHE 89 -0.945 14.280 -0.872 682 H GLU 90 H GLU 90 -8.090 10.646 -2.879 683 HA GLU 90 HA GLU 90 -9.287 8.471 -1.543 684 HB2 GLU 90 2HB GLU 90 -10.101 9.636 -4.242 685 HB3 GLU 90 3HB GLU 90 -11.114 8.639 -3.202 686 HG2 GLU 90 2HG GLU 90 -10.100 11.426 -2.586 687 HG3 GLU 90 3HG GLU 90 -11.735 11.000 -3.072 688 H LEU 91 H LEU 91 -7.608 8.682 -4.672 689 HA LEU 91 HA LEU 91 -7.998 6.024 -5.568 690 HB2 LEU 91 2HB LEU 91 -5.756 7.995 -6.150 691 HB3 LEU 91 3HB LEU 91 -5.927 6.456 -6.982 692 HG LEU 91 HG LEU 91 -7.974 8.715 -7.087 693 HD11 LEU 91 1HD1 LEU 91 -5.945 7.883 -9.189 694 HD12 LEU 91 2HD1 LEU 91 -5.880 9.352 -8.213 695 HD13 LEU 91 3HD1 LEU 91 -7.189 9.125 -9.370 696 HD21 LEU 91 1HD2 LEU 91 -8.995 6.496 -7.400 697 HD22 LEU 91 2HD2 LEU 91 -7.836 6.124 -8.677 698 HD23 LEU 91 3HD2 LEU 91 -9.015 7.418 -8.900 699 H ILE 92 H ILE 92 -5.542 7.493 -3.452 700 HA ILE 92 HA ILE 92 -3.828 5.220 -3.209 701 HB ILE 92 HB ILE 92 -4.179 7.587 -1.302 702 HG12 ILE 92 2HG1 ILE 92 -2.157 7.119 -3.547 703 HG13 ILE 92 3HG1 ILE 92 -3.466 8.294 -3.560 704 HG21 ILE 92 1HG2 ILE 92 -1.956 6.996 -0.376 705 HG22 ILE 92 2HG2 ILE 92 -1.902 5.564 -1.405 706 HG23 ILE 92 3HG2 ILE 92 -3.116 5.687 -0.131 707 HD11 ILE 92 1HD1 ILE 92 -2.369 9.480 -1.699 708 HD12 ILE 92 2HD1 ILE 92 -1.380 9.390 -3.153 709 HD13 ILE 92 3HD1 ILE 92 -1.031 8.333 -1.786 710 H LEU 93 H LEU 93 -6.538 6.468 -1.264 711 HA LEU 93 HA LEU 93 -6.438 4.589 0.849 712 HB2 LEU 93 2HB LEU 93 -8.766 6.255 -0.193 713 HB3 LEU 93 3HB LEU 93 -8.822 5.319 1.294 714 HG LEU 93 HG LEU 93 -6.974 7.684 0.774 715 HD11 LEU 93 1HD1 LEU 93 -9.307 8.389 1.002 716 HD12 LEU 93 2HD1 LEU 93 -8.359 8.899 2.398 717 HD13 LEU 93 3HD1 LEU 93 -9.443 7.511 2.529 718 HD21 LEU 93 1HD2 LEU 93 -6.377 7.528 3.164 719 HD22 LEU 93 2HD2 LEU 93 -5.906 6.078 2.282 720 HD23 LEU 93 3HD2 LEU 93 -7.339 6.054 3.313 721 H ALA 94 H ALA 94 -8.115 4.622 -2.267 722 HA ALA 94 HA ALA 94 -9.653 2.239 -1.909 723 HB1 ALA 94 1HB ALA 94 -10.282 3.965 -3.538 724 HB2 ALA 94 2HB ALA 94 -10.061 2.408 -4.336 725 HB3 ALA 94 3HB ALA 94 -8.813 3.653 -4.464 726 H ALA 95 H ALA 95 -6.523 2.973 -3.404 727 HA ALA 95 HA ALA 95 -5.969 0.439 -4.542 728 HB1 ALA 95 1HB ALA 95 -3.678 1.242 -4.756 729 HB2 ALA 95 2HB ALA 95 -3.996 2.545 -3.604 730 HB3 ALA 95 3HB ALA 95 -4.805 2.533 -5.171 731 H ASN 96 H ASN 96 -5.329 1.848 -1.379 732 HA ASN 96 HA ASN 96 -3.792 -0.367 -0.360 733 HB2 ASN 96 2HB ASN 96 -3.414 1.934 0.452 734 HB3 ASN 96 3HB ASN 96 -5.065 2.017 1.058 735 HD21 ASN 96 1HD2 ASN 96 -4.248 2.459 3.140 736 HD22 ASN 96 2HD2 ASN 96 -3.583 1.218 4.126 737 H TYR 97 H TYR 97 -7.164 0.730 -0.164 738 HA TYR 97 HA TYR 97 -8.143 -1.123 1.740 739 HB2 TYR 97 2HB TYR 97 -9.442 0.844 1.183 740 HB3 TYR 97 3HB TYR 97 -9.508 0.401 -0.516 741 HD1 TYR 97 HD1 TYR 97 -11.508 -0.584 -1.307 742 HD2 TYR 97 HD2 TYR 97 -10.571 -0.941 2.857 743 HE1 TYR 97 HE1 TYR 97 -13.679 -1.667 -0.913 744 HE2 TYR 97 HE2 TYR 97 -12.748 -2.026 3.245 745 HH TYR 97 HH TYR 97 -14.972 -2.120 2.195 746 H LEU 98 H LEU 98 -7.641 -1.325 -1.718 747 HA LEU 98 HA LEU 98 -8.795 -4.027 -1.893 748 HB2 LEU 98 2HB LEU 98 -7.817 -2.106 -4.041 749 HB3 LEU 98 3HB LEU 98 -8.491 -3.697 -4.361 750 HG LEU 98 HG LEU 98 -9.996 -1.370 -3.093 751 HD11 LEU 98 1HD1 LEU 98 -10.264 -2.544 -5.880 752 HD12 LEU 98 2HD1 LEU 98 -9.577 -0.971 -5.466 753 HD13 LEU 98 3HD1 LEU 98 -11.286 -1.283 -5.177 754 HD21 LEU 98 1HD2 LEU 98 -10.813 -3.493 -2.209 755 HD22 LEU 98 2HD2 LEU 98 -11.003 -4.138 -3.842 756 HD23 LEU 98 3HD2 LEU 98 -12.007 -2.791 -3.300 757 H ASP 99 H ASP 99 -5.804 -2.518 -1.420 758 HA ASP 99 HA ASP 99 -3.630 -3.113 -1.431 759 HB2 ASP 99 2HB ASP 99 -4.892 -5.866 -1.189 760 HB3 ASP 99 3HB ASP 99 -3.147 -5.651 -1.155 761 H ILE 100 H ILE 100 -4.879 -2.662 -3.985 762 HA ILE 100 HA ILE 100 -3.637 -4.391 -5.933 763 HB ILE 100 HB ILE 100 -4.715 -1.560 -6.359 764 HG12 ILE 100 2HG1 ILE 100 -6.105 -4.256 -6.629 765 HG13 ILE 100 3HG1 ILE 100 -6.488 -2.993 -5.471 766 HG21 ILE 100 1HG2 ILE 100 -4.852 -2.183 -8.754 767 HG22 ILE 100 2HG2 ILE 100 -4.149 -3.761 -8.396 768 HG23 ILE 100 3HG2 ILE 100 -3.191 -2.295 -8.169 769 HD11 ILE 100 1HD1 ILE 100 -6.887 -2.858 -8.456 770 HD12 ILE 100 2HD1 ILE 100 -7.248 -1.567 -7.309 771 HD13 ILE 100 3HD1 ILE 100 -8.129 -3.089 -7.226 772 H LYS 101 H LYS 101 -1.494 -4.516 -5.508 773 HA LYS 101 HA LYS 101 0.238 -2.566 -4.603 774 HB2 LYS 101 2HB LYS 101 0.499 -5.190 -4.867 775 HB3 LYS 101 3HB LYS 101 1.255 -4.790 -6.396 776 HG2 LYS 101 2HG LYS 101 2.202 -3.843 -3.670 777 HG3 LYS 101 3HG LYS 101 2.875 -5.204 -4.562 778 HD2 LYS 101 2HD LYS 101 3.606 -3.648 -6.358 779 HD3 LYS 101 3HD LYS 101 2.938 -2.290 -5.445 780 HE2 LYS 101 2HE LYS 101 5.225 -4.094 -4.578 781 HE3 LYS 101 3HE LYS 101 5.352 -2.415 -5.105 782 HZ1 LYS 101 1HZ LYS 101 5.428 -2.620 -2.699 783 HZ2 LYS 101 2HZ LYS 101 3.913 -3.356 -2.687 784 HZ3 LYS 101 3HZ LYS 101 4.063 -1.750 -3.180 785 HA PRO 102 HA PRO 102 1.674 -1.685 -9.295 786 HB2 PRO 102 2HB PRO 102 -0.448 -1.850 -11.142 787 HB3 PRO 102 3HB PRO 102 0.821 -3.067 -10.928 788 HG2 PRO 102 2HG PRO 102 -1.950 -3.028 -9.781 789 HG3 PRO 102 3HG PRO 102 -1.044 -4.384 -10.493 790 HD2 PRO 102 2HD PRO 102 -1.251 -4.160 -7.844 791 HD3 PRO 102 3HD PRO 102 0.282 -4.681 -8.576 792 H LEU 103 H LEU 103 -1.818 -1.027 -8.693 793 HA LEU 103 HA LEU 103 -1.741 1.618 -9.751 794 HB2 LEU 103 2HB LEU 103 -3.782 0.139 -9.637 795 HB3 LEU 103 3HB LEU 103 -3.843 0.403 -7.908 796 HG LEU 103 HG LEU 103 -5.437 1.776 -9.505 797 HD11 LEU 103 1HD1 LEU 103 -5.518 3.702 -8.014 798 HD12 LEU 103 2HD1 LEU 103 -3.955 3.260 -7.322 799 HD13 LEU 103 3HD1 LEU 103 -5.349 2.201 -7.103 800 HD21 LEU 103 1HD2 LEU 103 -3.698 2.561 -11.051 801 HD22 LEU 103 2HD2 LEU 103 -2.938 3.481 -9.754 802 HD23 LEU 103 3HD2 LEU 103 -4.555 3.904 -10.310 803 H LEU 104 H LEU 104 -1.543 0.277 -6.484 804 HA LEU 104 HA LEU 104 -1.600 2.596 -4.927 805 HB2 LEU 104 2HB LEU 104 -1.716 0.321 -3.997 806 HB3 LEU 104 3HB LEU 104 -0.069 0.003 -4.493 807 HG LEU 104 HG LEU 104 0.702 1.773 -2.861 808 HD11 LEU 104 1HD1 LEU 104 -2.195 1.786 -1.942 809 HD12 LEU 104 2HD1 LEU 104 -1.336 3.120 -2.716 810 HD13 LEU 104 3HD1 LEU 104 -0.839 2.569 -1.118 811 HD21 LEU 104 1HD2 LEU 104 0.756 -0.616 -2.294 812 HD22 LEU 104 2HD2 LEU 104 -0.886 -0.512 -1.651 813 HD23 LEU 104 3HD2 LEU 104 0.425 0.378 -0.875 814 H ASP 105 H ASP 105 1.112 0.926 -6.511 815 HA ASP 105 HA ASP 105 3.175 2.516 -5.389 816 HB2 ASP 105 2HB ASP 105 3.499 0.178 -6.314 817 HB3 ASP 105 3HB ASP 105 3.354 0.842 -7.940 818 H VAL 106 H VAL 106 1.668 2.503 -8.629 819 HA VAL 106 HA VAL 106 3.082 4.608 -9.795 820 HB VAL 106 HB VAL 106 0.214 3.691 -10.300 821 HG11 VAL 106 1HG1 VAL 106 0.480 5.967 -11.206 822 HG12 VAL 106 2HG1 VAL 106 0.369 4.793 -12.518 823 HG13 VAL 106 3HG1 VAL 106 1.936 5.473 -12.074 824 HG21 VAL 106 1HG2 VAL 106 2.794 2.997 -11.761 825 HG22 VAL 106 2HG2 VAL 106 1.180 2.413 -12.177 826 HG23 VAL 106 3HG2 VAL 106 1.922 1.940 -10.649 827 H THR 107 H THR 107 0.049 4.714 -7.910 828 HA THR 107 HA THR 107 -0.413 7.512 -8.235 829 HB THR 107 HB THR 107 -1.627 5.624 -6.162 830 HG1 THR 107 HG1 THR 107 -2.615 4.794 -7.834 831 HG21 THR 107 1HG2 THR 107 -2.710 8.222 -7.319 832 HG22 THR 107 2HG2 THR 107 -2.086 8.025 -5.680 833 HG23 THR 107 3HG2 THR 107 -3.547 7.168 -6.178 834 H CYS 108 H CYS 108 1.221 5.595 -5.710 835 HA CYS 108 HA CYS 108 1.561 7.742 -3.828 836 HB2 CYS 108 2HB CYS 108 2.974 5.057 -4.085 837 HB3 CYS 108 3HB CYS 108 3.268 6.190 -2.763 838 HG CYS 108 HG CYS 108 0.170 4.910 -3.424 839 H LYS 109 H LYS 109 3.503 6.394 -6.471 840 HA LYS 109 HA LYS 109 5.856 7.953 -6.050 841 HB2 LYS 109 2HB LYS 109 4.853 6.576 -8.589 842 HB3 LYS 109 3HB LYS 109 6.445 7.309 -8.418 843 HG2 LYS 109 2HG LYS 109 5.406 4.956 -6.807 844 HG3 LYS 109 3HG LYS 109 6.511 4.851 -8.177 845 HD2 LYS 109 2HD LYS 109 8.247 6.026 -6.927 846 HD3 LYS 109 3HD LYS 109 7.138 6.339 -5.589 847 HE2 LYS 109 2HE LYS 109 8.713 4.467 -5.116 848 HE3 LYS 109 3HE LYS 109 7.027 3.953 -5.071 849 HZ1 LYS 109 1HZ LYS 109 7.256 2.960 -7.211 850 HZ2 LYS 109 2HZ LYS 109 8.532 2.412 -6.249 851 HZ3 LYS 109 3HZ LYS 109 8.808 3.597 -7.416 852 H THR 110 H THR 110 2.830 8.446 -7.821 853 HA THR 110 HA THR 110 3.449 10.732 -9.306 854 HB THR 110 HB THR 110 0.779 9.929 -8.063 855 HG1 THR 110 HG1 THR 110 2.090 8.749 -9.910 856 HG21 THR 110 1HG2 THR 110 1.313 11.990 -10.245 857 HG22 THR 110 2HG2 THR 110 0.722 12.344 -8.620 858 HG23 THR 110 3HG2 THR 110 -0.281 11.425 -9.746 859 H VAL 111 H VAL 111 2.191 10.472 -5.952 860 HA VAL 111 HA VAL 111 1.985 13.262 -5.462 861 HB VAL 111 HB VAL 111 2.463 11.169 -3.291 862 HG11 VAL 111 1HG1 VAL 111 1.027 13.857 -3.244 863 HG12 VAL 111 2HG1 VAL 111 2.595 13.499 -2.517 864 HG13 VAL 111 3HG1 VAL 111 1.136 12.737 -1.883 865 HG21 VAL 111 1HG2 VAL 111 0.640 10.366 -4.722 866 HG22 VAL 111 2HG2 VAL 111 -0.190 11.917 -4.573 867 HG23 VAL 111 3HG2 VAL 111 0.011 10.881 -3.155 868 H ALA 112 H ALA 112 4.511 10.878 -4.844 869 HA ALA 112 HA ALA 112 6.404 12.481 -3.522 870 HB1 ALA 112 1HB ALA 112 6.858 10.064 -5.304 871 HB2 ALA 112 2HB ALA 112 6.504 10.024 -3.575 872 HB3 ALA 112 3HB ALA 112 8.019 10.725 -4.145 873 H ASN 113 H ASN 113 5.692 12.034 -6.943 874 HA ASN 113 HA ASN 113 7.934 13.569 -7.941 875 HB2 ASN 113 2HB ASN 113 5.487 12.355 -9.290 876 HB3 ASN 113 3HB ASN 113 6.671 13.317 -10.172 877 HD21 ASN 113 1HD2 ASN 113 6.990 11.374 -11.457 878 HD22 ASN 113 2HD2 ASN 113 8.022 10.116 -10.874 879 H MET 114 H MET 114 4.632 14.285 -6.968 880 HA MET 114 HA MET 114 4.432 16.835 -8.286 881 HB2 MET 114 2HB MET 114 2.934 15.800 -5.834 882 HB3 MET 114 3HB MET 114 2.570 17.312 -6.652 883 HG2 MET 114 2HG MET 114 2.095 15.935 -8.726 884 HG3 MET 114 3HG MET 114 2.182 14.507 -7.694 885 HE1 MET 114 1HE MET 114 0.890 16.035 -4.947 886 HE2 MET 114 2HE MET 114 0.527 14.362 -5.366 887 HE3 MET 114 3HE MET 114 -0.784 15.510 -5.103 888 H ILE 115 H ILE 115 5.236 15.803 -4.965 889 HA ILE 115 HA ILE 115 5.871 18.471 -4.055 890 HB ILE 115 HB ILE 115 6.507 17.436 -1.917 891 HG12 ILE 115 2HG1 ILE 115 6.062 14.699 -3.215 892 HG13 ILE 115 3HG1 ILE 115 7.647 15.387 -2.887 893 HG21 ILE 115 1HG2 ILE 115 3.966 16.170 -3.014 894 HG22 ILE 115 2HG2 ILE 115 4.102 17.792 -2.336 895 HG23 ILE 115 3HG2 ILE 115 4.354 16.385 -1.303 896 HD11 ILE 115 1HD1 ILE 115 5.574 14.646 -0.828 897 HD12 ILE 115 2HD1 ILE 115 7.154 15.364 -0.490 898 HD13 ILE 115 3HD1 ILE 115 7.049 13.762 -1.218 899 H ARG 116 H ARG 116 7.610 15.778 -5.425 900 HA ARG 116 HA ARG 116 9.745 15.197 -5.774 901 HB2 ARG 116 2HB ARG 116 10.118 18.208 -5.987 902 HB3 ARG 116 3HB ARG 116 11.300 17.012 -6.523 903 HG2 ARG 116 2HG ARG 116 9.713 16.134 -8.167 904 HG3 ARG 116 3HG ARG 116 8.468 17.246 -7.593 905 HD2 ARG 116 2HD ARG 116 9.846 19.160 -8.333 906 HD3 ARG 116 3HD ARG 116 11.083 18.040 -8.924 907 HE ARG 116 HE ARG 116 9.029 17.140 -10.289 908 HH11 ARG 116 1HH1 ARG 116 9.862 20.515 -9.740 909 HH12 ARG 116 2HH1 ARG 116 9.139 21.050 -11.221 910 HH21 ARG 116 1HH2 ARG 116 8.075 17.868 -12.202 911 HH22 ARG 116 2HH2 ARG 116 8.130 19.549 -12.617 912 H GLY 117 H GLY 117 9.494 14.497 -3.505 913 HA2 GLY 117 2HA GLY 117 10.926 15.944 -1.428 914 HA3 GLY 117 3HA GLY 117 10.089 14.404 -1.271 915 H1 SER 2 1H SER 2 14.979 -16.083 16.316 916 H2 SER 2 2H SER 2 14.212 -15.169 15.123 917 H3 SER 2 3H SER 2 14.460 -14.516 16.659 918 HA SER 2 HA SER 2 16.803 -14.514 16.375 919 HB2 SER 2 2HB SER 2 16.265 -15.617 13.581 920 HB3 SER 2 3HB SER 2 17.849 -15.244 14.274 921 HG SER 2 HG SER 2 17.234 -16.830 15.951 922 H LEU 3 H LEU 3 17.826 -12.662 15.552 923 HA LEU 3 HA LEU 3 16.068 -10.584 14.542 924 HB2 LEU 3 2HB LEU 3 19.041 -10.515 15.208 925 HB3 LEU 3 3HB LEU 3 18.051 -9.108 14.839 926 HG LEU 3 HG LEU 3 17.728 -10.911 17.273 927 HD11 LEU 3 1HD1 LEU 3 18.536 -8.997 18.571 928 HD12 LEU 3 2HD1 LEU 3 18.810 -8.082 17.086 929 HD13 LEU 3 3HD1 LEU 3 19.749 -9.542 17.413 930 HD21 LEU 3 1HD2 LEU 3 15.564 -10.022 16.573 931 HD22 LEU 3 2HD2 LEU 3 16.219 -8.383 16.523 932 HD23 LEU 3 3HD2 LEU 3 16.093 -9.241 18.060 933 H VAL 4 H VAL 4 15.708 -10.427 12.378 934 HA VAL 4 HA VAL 4 17.758 -11.091 10.419 935 HB VAL 4 HB VAL 4 16.088 -10.298 8.699 936 HG11 VAL 4 1HG1 VAL 4 14.566 -12.232 8.943 937 HG12 VAL 4 2HG1 VAL 4 15.066 -12.418 10.627 938 HG13 VAL 4 3HG1 VAL 4 16.234 -12.671 9.328 939 HG21 VAL 4 1HG2 VAL 4 14.818 -8.663 10.039 940 HG22 VAL 4 2HG2 VAL 4 14.210 -9.955 11.078 941 HG23 VAL 4 3HG2 VAL 4 13.730 -9.889 9.379 942 H LYS 5 H LYS 5 19.216 -9.745 9.746 943 HA LYS 5 HA LYS 5 19.358 -7.018 10.738 944 HB2 LYS 5 2HB LYS 5 21.350 -8.615 9.066 945 HB3 LYS 5 3HB LYS 5 21.682 -7.125 9.947 946 HG2 LYS 5 2HG LYS 5 21.283 -8.289 12.084 947 HG3 LYS 5 3HG LYS 5 20.909 -9.778 11.214 948 HD2 LYS 5 2HD LYS 5 23.231 -9.817 10.318 949 HD3 LYS 5 3HD LYS 5 23.595 -8.337 11.214 950 HE2 LYS 5 2HE LYS 5 23.154 -9.517 13.337 951 HE3 LYS 5 3HE LYS 5 22.780 -10.992 12.444 952 HZ1 LYS 5 1HZ LYS 5 25.043 -10.927 13.352 953 HZ2 LYS 5 2HZ LYS 5 25.396 -9.604 12.360 954 HZ3 LYS 5 3HZ LYS 5 25.009 -11.096 11.674 955 H LEU 6 H LEU 6 18.741 -5.314 9.522 956 HA LEU 6 HA LEU 6 18.372 -5.651 6.593 957 HB2 LEU 6 2HB LEU 6 16.703 -3.951 8.500 958 HB3 LEU 6 3HB LEU 6 16.442 -4.123 6.770 959 HG LEU 6 HG LEU 6 16.114 -6.345 8.832 960 HD11 LEU 6 1HD1 LEU 6 13.712 -6.168 8.383 961 HD12 LEU 6 2HD1 LEU 6 13.999 -4.789 7.316 962 HD13 LEU 6 3HD1 LEU 6 14.363 -4.669 9.041 963 HD21 LEU 6 1HD2 LEU 6 15.148 -7.681 6.998 964 HD22 LEU 6 2HD2 LEU 6 16.828 -7.267 6.676 965 HD23 LEU 6 3HD2 LEU 6 15.535 -6.396 5.846 966 H GLU 7 H GLU 7 20.223 -4.638 5.832 967 HA GLU 7 HA GLU 7 21.072 -2.049 6.741 968 HB2 GLU 7 2HB GLU 7 21.679 -3.540 4.149 969 HB3 GLU 7 3HB GLU 7 22.339 -1.947 4.522 970 HG2 GLU 7 2HG GLU 7 24.053 -3.455 5.068 971 HG3 GLU 7 3HG GLU 7 23.333 -3.011 6.618 972 H SER 8 H SER 8 20.573 -0.089 5.949 973 HA SER 8 HA SER 8 18.209 0.246 4.259 974 HB2 SER 8 2HB SER 8 18.534 2.668 4.984 975 HB3 SER 8 3HB SER 8 18.292 1.531 6.313 976 HG SER 8 HG SER 8 20.359 1.716 6.894 977 H SER 9 H SER 9 18.475 2.320 2.756 978 HA SER 9 HA SER 9 20.510 1.995 0.802 979 HB2 SER 9 2HB SER 9 19.646 4.200 -0.071 980 HB3 SER 9 3HB SER 9 18.370 3.016 0.217 981 HG SER 9 HG SER 9 18.076 5.270 1.015 982 H ASP 10 H ASP 10 20.314 3.726 3.793 983 HA ASP 10 HA ASP 10 22.715 5.336 3.433 984 HB2 ASP 10 2HB ASP 10 20.750 6.151 4.727 985 HB3 ASP 10 3HB ASP 10 20.922 4.809 5.851 986 H GLU 11 H GLU 11 22.074 2.125 4.116 987 HA GLU 11 HA GLU 11 23.386 0.336 4.385 988 HB2 GLU 11 2HB GLU 11 25.670 2.314 4.666 989 HB3 GLU 11 3HB GLU 11 25.892 0.567 4.629 990 HG2 GLU 11 2HG GLU 11 25.031 0.458 2.355 991 HG3 GLU 11 3HG GLU 11 24.635 2.175 2.384 992 H LYS 12 H LYS 12 22.696 2.430 6.877 993 HA LYS 12 HA LYS 12 24.070 1.049 8.992 994 HB2 LYS 12 2HB LYS 12 21.743 3.006 9.042 995 HB3 LYS 12 3HB LYS 12 22.258 2.158 10.496 996 HG2 LYS 12 2HG LYS 12 24.639 3.112 9.908 997 HG3 LYS 12 3HG LYS 12 23.747 4.266 8.917 998 HD2 LYS 12 2HD LYS 12 23.170 3.823 11.877 999 HD3 LYS 12 3HD LYS 12 24.347 5.005 11.305 1000 HE2 LYS 12 2HE LYS 12 21.421 5.026 10.505 1001 HE3 LYS 12 3HE LYS 12 22.076 5.943 11.860 1002 HZ1 LYS 12 1HZ LYS 12 21.860 7.253 9.820 1003 HZ2 LYS 12 2HZ LYS 12 22.974 6.243 9.047 1004 HZ3 LYS 12 3HZ LYS 12 23.458 7.175 10.364 1005 H VAL 13 H VAL 13 23.476 -0.663 10.135 1006 HA VAL 13 HA VAL 13 21.533 -2.493 8.991 1007 HB VAL 13 HB VAL 13 23.451 -2.907 11.339 1008 HG11 VAL 13 1HG1 VAL 13 23.206 -5.324 10.874 1009 HG12 VAL 13 2HG1 VAL 13 22.036 -4.966 9.602 1010 HG13 VAL 13 3HG1 VAL 13 21.653 -4.587 11.283 1011 HG21 VAL 13 1HG2 VAL 13 25.010 -3.949 9.734 1012 HG22 VAL 13 2HG2 VAL 13 24.710 -2.260 9.319 1013 HG23 VAL 13 3HG2 VAL 13 23.921 -3.546 8.401 1014 H PHE 14 H PHE 14 19.670 -3.212 9.999 1015 HA PHE 14 HA PHE 14 19.028 -2.308 12.745 1016 HB2 PHE 14 2HB PHE 14 17.206 -2.159 10.295 1017 HB3 PHE 14 3HB PHE 14 16.637 -1.962 11.953 1018 HD1 PHE 14 HD1 PHE 14 17.455 -0.030 13.337 1019 HD2 PHE 14 HD2 PHE 14 18.347 -0.330 9.161 1020 HE1 PHE 14 HE1 PHE 14 18.093 2.339 13.291 1021 HE2 PHE 14 HE2 PHE 14 18.969 2.040 9.131 1022 HZ PHE 14 HZ PHE 14 18.847 3.375 11.193 1023 H GLU 15 H GLU 15 19.182 -4.150 13.797 1024 HA GLU 15 HA GLU 15 18.442 -6.727 12.648 1025 HB2 GLU 15 2HB GLU 15 19.509 -6.149 15.445 1026 HB3 GLU 15 3HB GLU 15 19.551 -7.683 14.574 1027 HG2 GLU 15 2HG GLU 15 21.166 -6.744 12.972 1028 HG3 GLU 15 3HG GLU 15 21.085 -5.184 13.785 1029 H ILE 16 H ILE 16 16.190 -6.484 12.514 1030 HA ILE 16 HA ILE 16 14.623 -6.131 14.999 1031 HB ILE 16 HB ILE 16 13.997 -4.723 13.038 1032 HG12 ILE 16 2HG1 ILE 16 11.855 -6.775 13.767 1033 HG13 ILE 16 3HG1 ILE 16 12.242 -5.320 14.681 1034 HG21 ILE 16 1HG2 ILE 16 13.004 -5.676 11.000 1035 HG22 ILE 16 2HG2 ILE 16 13.290 -7.309 11.605 1036 HG23 ILE 16 3HG2 ILE 16 14.656 -6.263 11.221 1037 HD11 ILE 16 1HD1 ILE 16 11.048 -5.442 11.918 1038 HD12 ILE 16 2HD1 ILE 16 11.514 -3.964 12.761 1039 HD13 ILE 16 3HD1 ILE 16 10.241 -4.985 13.418 1040 H GLU 17 H GLU 17 13.025 -7.689 15.571 1041 HA GLU 17 HA GLU 17 13.644 -10.422 15.319 1042 HB2 GLU 17 2HB GLU 17 11.081 -9.014 16.171 1043 HB3 GLU 17 3HB GLU 17 11.311 -10.745 16.304 1044 HG2 GLU 17 2HG GLU 17 11.653 -9.838 18.474 1045 HG3 GLU 17 3HG GLU 17 13.236 -10.306 17.864 1046 H LYS 18 H LYS 18 12.881 -12.015 13.941 1047 HA LYS 18 HA LYS 18 12.211 -11.241 11.304 1048 HB2 LYS 18 2HB LYS 18 13.541 -13.283 11.868 1049 HB3 LYS 18 3HB LYS 18 12.081 -14.037 12.512 1050 HG2 LYS 18 2HG LYS 18 11.035 -13.880 10.240 1051 HG3 LYS 18 3HG LYS 18 12.540 -13.200 9.621 1052 HD2 LYS 18 2HD LYS 18 12.462 -15.558 9.056 1053 HD3 LYS 18 3HD LYS 18 13.718 -15.317 10.276 1054 HE2 LYS 18 2HE LYS 18 12.158 -16.116 12.027 1055 HE3 LYS 18 3HE LYS 18 10.906 -16.352 10.805 1056 HZ1 LYS 18 1HZ LYS 18 12.028 -18.415 11.349 1057 HZ2 LYS 18 2HZ LYS 18 13.517 -17.763 10.892 1058 HZ3 LYS 18 3HZ LYS 18 12.306 -17.992 9.738 1059 H GLU 19 H GLU 19 10.313 -12.866 13.819 1060 HA GLU 19 HA GLU 19 7.894 -13.255 12.529 1061 HB2 GLU 19 2HB GLU 19 6.836 -13.270 14.784 1062 HB3 GLU 19 3HB GLU 19 8.291 -14.249 14.716 1063 HG2 GLU 19 2HG GLU 19 8.588 -11.428 15.710 1064 HG3 GLU 19 3HG GLU 19 7.745 -12.565 16.755 1065 H ILE 20 H ILE 20 9.197 -10.284 13.917 1066 HA ILE 20 HA ILE 20 6.766 -8.738 13.673 1067 HB ILE 20 HB ILE 20 9.655 -7.785 14.002 1068 HG12 ILE 20 2HG1 ILE 20 7.492 -8.332 16.080 1069 HG13 ILE 20 3HG1 ILE 20 9.010 -9.192 15.900 1070 HG21 ILE 20 1HG2 ILE 20 8.200 -6.015 13.098 1071 HG22 ILE 20 2HG2 ILE 20 8.688 -5.644 14.748 1072 HG23 ILE 20 3HG2 ILE 20 7.063 -6.254 14.429 1073 HD11 ILE 20 1HD1 ILE 20 9.058 -7.721 17.812 1074 HD12 ILE 20 2HD1 ILE 20 8.681 -6.331 16.798 1075 HD13 ILE 20 3HD1 ILE 20 10.217 -7.176 16.601 1076 H ALA 21 H ALA 21 9.735 -9.192 11.792 1077 HA ALA 21 HA ALA 21 9.186 -7.304 9.722 1078 HB1 ALA 21 1HB ALA 21 11.470 -8.005 10.306 1079 HB2 ALA 21 2HB ALA 21 11.133 -8.309 8.598 1080 HB3 ALA 21 3HB ALA 21 11.117 -9.645 9.754 1081 H CYS 22 H CYS 22 7.700 -10.250 10.355 1082 HA CYS 22 HA CYS 22 7.232 -11.200 7.707 1083 HB2 CYS 22 2HB CYS 22 5.751 -11.717 10.309 1084 HB3 CYS 22 3HB CYS 22 5.459 -12.589 8.800 1085 HG CYS 22 HG CYS 22 8.678 -12.654 9.479 1086 H MET 23 H MET 23 5.696 -8.672 9.664 1087 HA MET 23 HA MET 23 3.328 -8.417 8.069 1088 HB2 MET 23 2HB MET 23 4.691 -6.454 9.939 1089 HB3 MET 23 3HB MET 23 3.241 -6.028 9.036 1090 HG2 MET 23 2HG MET 23 2.059 -7.935 10.119 1091 HG3 MET 23 3HG MET 23 3.496 -8.223 11.095 1092 HE1 MET 23 1HE MET 23 4.466 -5.182 11.678 1093 HE2 MET 23 2HE MET 23 4.436 -6.465 12.890 1094 HE3 MET 23 3HE MET 23 3.662 -4.914 13.222 1095 H SER 24 H SER 24 6.597 -7.277 7.707 1096 HA SER 24 HA SER 24 6.134 -5.734 5.321 1097 HB2 SER 24 2HB SER 24 8.200 -5.418 6.673 1098 HB3 SER 24 3HB SER 24 8.675 -7.086 6.355 1099 HG SER 24 HG SER 24 8.153 -5.303 4.248 1100 H VAL 25 H VAL 25 5.018 -6.856 3.770 1101 HA VAL 25 HA VAL 25 5.101 -9.663 3.410 1102 HB VAL 25 HB VAL 25 4.086 -7.577 1.424 1103 HG11 VAL 25 1HG1 VAL 25 4.358 -9.780 0.353 1104 HG12 VAL 25 2HG1 VAL 25 2.647 -9.383 0.522 1105 HG13 VAL 25 3HG1 VAL 25 3.400 -10.536 1.627 1106 HG21 VAL 25 1HG2 VAL 25 1.858 -7.921 2.439 1107 HG22 VAL 25 2HG2 VAL 25 3.011 -7.322 3.633 1108 HG23 VAL 25 3HG2 VAL 25 2.564 -9.029 3.623 1109 H THR 26 H THR 26 6.833 -7.009 1.820 1110 HA THR 26 HA THR 26 8.018 -8.385 -0.318 1111 HB THR 26 HB THR 26 9.102 -6.010 1.261 1112 HG1 THR 26 HG1 THR 26 7.917 -4.808 -0.166 1113 HG21 THR 26 1HG2 THR 26 9.803 -6.909 -1.570 1114 HG22 THR 26 2HG2 THR 26 10.883 -6.994 -0.174 1115 HG23 THR 26 3HG2 THR 26 10.357 -5.426 -0.793 1116 H ILE 27 H ILE 27 9.372 -7.706 2.941 1117 HA ILE 27 HA ILE 27 11.782 -9.181 2.596 1118 HB ILE 27 HB ILE 27 10.374 -8.314 5.167 1119 HG12 ILE 27 2HG1 ILE 27 12.684 -6.999 3.647 1120 HG13 ILE 27 3HG1 ILE 27 11.018 -6.429 3.656 1121 HG21 ILE 27 1HG2 ILE 27 11.954 -10.152 5.652 1122 HG22 ILE 27 2HG2 ILE 27 12.547 -8.632 6.320 1123 HG23 ILE 27 3HG2 ILE 27 13.247 -9.274 4.832 1124 HD11 ILE 27 1HD1 ILE 27 11.192 -6.013 6.069 1125 HD12 ILE 27 2HD1 ILE 27 12.371 -5.097 5.130 1126 HD13 ILE 27 3HD1 ILE 27 12.880 -6.531 6.023 1127 H LYS 28 H LYS 28 8.607 -9.966 3.957 1128 HA LYS 28 HA LYS 28 9.059 -12.490 5.068 1129 HB2 LYS 28 2HB LYS 28 6.971 -11.178 5.381 1130 HB3 LYS 28 3HB LYS 28 6.546 -11.435 3.694 1131 HG2 LYS 28 2HG LYS 28 6.455 -13.925 4.190 1132 HG3 LYS 28 3HG LYS 28 6.684 -13.522 5.894 1133 HD2 LYS 28 2HD LYS 28 4.310 -13.885 5.423 1134 HD3 LYS 28 3HD LYS 28 4.589 -12.201 5.865 1135 HE2 LYS 28 2HE LYS 28 3.018 -12.349 3.988 1136 HE3 LYS 28 3HE LYS 28 4.507 -11.566 3.464 1137 HZ1 LYS 28 1HZ LYS 28 3.774 -14.405 2.982 1138 HZ2 LYS 28 2HZ LYS 28 5.198 -13.665 2.459 1139 HZ3 LYS 28 3HZ LYS 28 3.707 -13.162 1.842 1140 H ASN 29 H ASN 29 8.024 -11.619 1.747 1141 HA ASN 29 HA ASN 29 7.787 -14.253 0.730 1142 HB2 ASN 29 2HB ASN 29 8.203 -11.616 -0.753 1143 HB3 ASN 29 3HB ASN 29 7.847 -13.146 -1.554 1144 HD21 ASN 29 1HD2 ASN 29 6.285 -10.738 -1.666 1145 HD22 ASN 29 2HD2 ASN 29 4.729 -11.112 -1.020 1146 H MET 30 H MET 30 10.496 -11.969 0.855 1147 HA MET 30 HA MET 30 12.333 -13.370 -0.790 1148 HB2 MET 30 2HB MET 30 12.815 -11.415 1.497 1149 HB3 MET 30 3HB MET 30 14.106 -12.048 0.486 1150 HG2 MET 30 2HG MET 30 13.111 -10.992 -1.478 1151 HG3 MET 30 3HG MET 30 11.775 -10.387 -0.490 1152 HE1 MET 30 1HE MET 30 12.308 -7.913 -1.415 1153 HE2 MET 30 2HE MET 30 13.684 -8.508 -2.345 1154 HE3 MET 30 3HE MET 30 13.882 -7.138 -1.255 1155 H ILE 31 H ILE 31 11.671 -13.482 2.693 1156 HA ILE 31 HA ILE 31 13.768 -15.270 3.407 1157 HB ILE 31 HB ILE 31 11.183 -14.576 4.885 1158 HG12 ILE 31 2HG1 ILE 31 14.042 -13.560 5.295 1159 HG13 ILE 31 3HG1 ILE 31 12.750 -12.652 4.526 1160 HG21 ILE 31 1HG2 ILE 31 13.629 -16.029 5.967 1161 HG22 ILE 31 2HG2 ILE 31 12.054 -16.761 5.665 1162 HG23 ILE 31 3HG2 ILE 31 12.227 -15.527 6.914 1163 HD11 ILE 31 1HD1 ILE 31 11.507 -12.660 6.643 1164 HD12 ILE 31 2HD1 ILE 31 13.089 -11.895 6.783 1165 HD13 ILE 31 3HD1 ILE 31 12.842 -13.527 7.407 1166 H GLU 32 H GLU 32 10.293 -15.733 2.717 1167 HA GLU 32 HA GLU 32 10.094 -18.501 3.209 1168 HB2 GLU 32 2HB GLU 32 8.463 -16.720 1.346 1169 HB3 GLU 32 3HB GLU 32 8.021 -18.380 1.752 1170 HG2 GLU 32 2HG GLU 32 7.720 -17.776 4.091 1171 HG3 GLU 32 3HG GLU 32 8.293 -16.137 3.782 1172 H ASP 33 H ASP 33 10.948 -16.677 0.333 1173 HA ASP 33 HA ASP 33 10.970 -18.662 -1.640 1174 HB2 ASP 33 2HB ASP 33 11.100 -16.246 -2.119 1175 HB3 ASP 33 3HB ASP 33 12.665 -16.138 -1.330 1176 H ILE 34 H ILE 34 13.483 -17.579 0.586 1177 HA ILE 34 HA ILE 34 15.487 -19.491 -0.362 1178 HB ILE 34 HB ILE 34 15.641 -17.306 1.782 1179 HG12 ILE 34 2HG1 ILE 34 16.572 -17.269 -1.135 1180 HG13 ILE 34 3HG1 ILE 34 15.173 -16.414 -0.505 1181 HG21 ILE 34 1HG2 ILE 34 17.375 -19.036 2.140 1182 HG22 ILE 34 2HG2 ILE 34 18.099 -17.515 1.620 1183 HG23 ILE 34 3HG2 ILE 34 17.921 -18.843 0.471 1184 HD11 ILE 34 1HD1 ILE 34 16.991 -14.893 -0.836 1185 HD12 ILE 34 2HD1 ILE 34 18.060 -15.874 0.166 1186 HD13 ILE 34 3HD1 ILE 34 16.677 -15.050 0.894 1187 H GLY 35 H GLY 35 12.963 -19.495 1.847 1188 HA2 GLY 35 2HA GLY 35 12.367 -21.278 3.277 1189 HA3 GLY 35 3HA GLY 35 14.063 -21.717 3.446 1190 H GLU 36 H GLU 36 15.462 -20.205 4.627 1191 HA GLU 36 HA GLU 36 14.188 -18.104 6.232 1192 HB2 GLU 36 2HB GLU 36 15.779 -20.416 7.445 1193 HB3 GLU 36 3HB GLU 36 15.560 -18.882 8.284 1194 HG2 GLU 36 2HG GLU 36 13.119 -19.198 8.271 1195 HG3 GLU 36 3HG GLU 36 13.305 -20.705 7.381 1196 H SER 37 H SER 37 15.223 -16.448 5.299 1197 HA SER 37 HA SER 37 17.899 -16.422 4.369 1198 HB2 SER 37 2HB SER 37 16.054 -14.076 5.023 1199 HB3 SER 37 3HB SER 37 17.530 -13.987 4.055 1200 HG SER 37 HG SER 37 16.472 -14.733 2.412 1201 H ASP 38 H ASP 38 19.473 -16.829 5.831 1202 HA ASP 38 HA ASP 38 19.510 -15.679 8.505 1203 HB2 ASP 38 2HB ASP 38 21.473 -17.035 8.896 1204 HB3 ASP 38 3HB ASP 38 20.324 -18.032 8.011 1205 H SER 39 H SER 39 21.052 -15.163 5.375 1206 HA SER 39 HA SER 39 23.060 -13.319 6.230 1207 HB2 SER 39 2HB SER 39 23.282 -12.838 3.771 1208 HB3 SER 39 3HB SER 39 23.306 -14.563 4.126 1209 HG SER 39 HG SER 39 21.354 -13.030 2.845 1210 HA PRO 40 HA PRO 40 20.578 -9.586 6.824 1211 HB2 PRO 40 2HB PRO 40 22.947 -8.163 5.631 1212 HB3 PRO 40 3HB PRO 40 22.116 -7.877 7.173 1213 HG2 PRO 40 2HG PRO 40 24.487 -9.039 7.119 1214 HG3 PRO 40 3HG PRO 40 23.235 -9.589 8.258 1215 HD2 PRO 40 2HD PRO 40 24.138 -10.872 5.691 1216 HD3 PRO 40 3HD PRO 40 23.663 -11.636 7.227 1217 H ILE 41 H ILE 41 19.166 -8.386 5.612 1218 HA ILE 41 HA ILE 41 19.246 -8.640 2.681 1219 HB ILE 41 HB ILE 41 16.920 -7.750 4.459 1220 HG12 ILE 41 2HG1 ILE 41 15.860 -9.996 3.635 1221 HG13 ILE 41 3HG1 ILE 41 17.492 -10.470 3.187 1222 HG21 ILE 41 1HG2 ILE 41 16.957 -8.310 1.472 1223 HG22 ILE 41 2HG2 ILE 41 16.793 -6.727 2.234 1224 HG23 ILE 41 3HG2 ILE 41 15.518 -7.932 2.420 1225 HD11 ILE 41 1HD1 ILE 41 16.825 -11.420 5.323 1226 HD12 ILE 41 2HD1 ILE 41 16.534 -9.806 5.975 1227 HD13 ILE 41 3HD1 ILE 41 18.172 -10.301 5.542 1228 HA PRO 42 HA PRO 42 20.428 -4.176 2.877 1229 HB2 PRO 42 2HB PRO 42 21.431 -4.545 0.121 1230 HB3 PRO 42 3HB PRO 42 22.352 -4.173 1.591 1231 HG2 PRO 42 2HG PRO 42 22.574 -6.558 0.317 1232 HG3 PRO 42 3HG PRO 42 22.760 -6.392 2.079 1233 HD2 PRO 42 2HD PRO 42 20.323 -7.289 0.526 1234 HD3 PRO 42 3HD PRO 42 21.068 -8.017 1.972 1235 H LEU 43 H LEU 43 18.966 -2.629 2.405 1236 HA LEU 43 HA LEU 43 16.961 -3.043 0.257 1237 HB2 LEU 43 2HB LEU 43 16.709 -1.565 2.906 1238 HB3 LEU 43 3HB LEU 43 15.445 -1.658 1.689 1239 HG LEU 43 HG LEU 43 16.577 -4.074 3.169 1240 HD11 LEU 43 1HD1 LEU 43 15.419 -2.622 4.746 1241 HD12 LEU 43 2HD1 LEU 43 14.500 -4.100 4.474 1242 HD13 LEU 43 3HD1 LEU 43 13.988 -2.590 3.711 1243 HD21 LEU 43 1HD2 LEU 43 14.616 -5.282 2.255 1244 HD22 LEU 43 2HD2 LEU 43 15.670 -4.681 0.979 1245 HD23 LEU 43 3HD2 LEU 43 14.157 -3.844 1.336 1246 HA PRO 44 HA PRO 44 19.190 0.788 -1.079 1247 HB2 PRO 44 2HB PRO 44 19.274 0.308 -3.736 1248 HB3 PRO 44 3HB PRO 44 20.298 -0.619 -2.615 1249 HG2 PRO 44 2HG PRO 44 17.738 -1.446 -3.943 1250 HG3 PRO 44 3HG PRO 44 19.214 -2.394 -3.654 1251 HD2 PRO 44 2HD PRO 44 16.922 -2.479 -2.039 1252 HD3 PRO 44 3HD PRO 44 18.540 -3.012 -1.542 1253 H ASN 45 H ASN 45 17.014 1.584 -0.196 1254 HA ASN 45 HA ASN 45 15.867 3.392 -2.080 1255 HB2 ASN 45 2HB ASN 45 14.490 1.438 -2.728 1256 HB3 ASN 45 3HB ASN 45 14.050 1.151 -1.051 1257 HD21 ASN 45 1HD2 ASN 45 13.510 3.166 -3.854 1258 HD22 ASN 45 2HD2 ASN 45 12.085 3.946 -3.266 1259 H VAL 46 H VAL 46 14.793 1.715 0.880 1260 HA VAL 46 HA VAL 46 13.893 4.136 2.127 1261 HB VAL 46 HB VAL 46 12.664 2.061 2.501 1262 HG11 VAL 46 1HG1 VAL 46 13.535 0.164 3.808 1263 HG12 VAL 46 2HG1 VAL 46 15.117 0.939 3.903 1264 HG13 VAL 46 3HG1 VAL 46 14.486 0.416 2.341 1265 HG21 VAL 46 1HG2 VAL 46 12.437 2.131 4.965 1266 HG22 VAL 46 2HG2 VAL 46 12.546 3.749 4.270 1267 HG23 VAL 46 3HG2 VAL 46 13.948 3.041 5.076 1268 H THR 47 H THR 47 15.046 5.491 3.367 1269 HA THR 47 HA THR 47 17.858 5.153 3.867 1270 HB THR 47 HB THR 47 17.699 7.366 4.991 1271 HG1 THR 47 HG1 THR 47 15.425 8.302 4.812 1272 HG21 THR 47 1HG2 THR 47 16.076 7.265 2.417 1273 HG22 THR 47 2HG2 THR 47 17.840 7.327 2.519 1274 HG23 THR 47 3HG2 THR 47 16.877 8.693 3.085 1275 H SER 48 H SER 48 18.749 5.623 6.146 1276 HA SER 48 HA SER 48 17.969 3.467 7.837 1277 HB2 SER 48 2HB SER 48 19.743 4.349 9.373 1278 HB3 SER 48 3HB SER 48 20.306 4.156 7.711 1279 HG SER 48 HG SER 48 20.922 6.140 8.023 1280 H THR 49 H THR 49 17.470 6.965 7.956 1281 HA THR 49 HA THR 49 16.438 7.232 10.563 1282 HB THR 49 HB THR 49 15.703 8.924 8.130 1283 HG1 THR 49 HG1 THR 49 17.583 10.020 8.457 1284 HG21 THR 49 1HG2 THR 49 15.494 10.776 9.767 1285 HG22 THR 49 2HG2 THR 49 15.842 9.659 11.085 1286 HG23 THR 49 3HG2 THR 49 14.362 9.473 10.143 1287 H ILE 50 H ILE 50 14.814 6.779 7.425 1288 HA ILE 50 HA ILE 50 12.147 6.786 8.463 1289 HB ILE 50 HB ILE 50 13.225 5.898 5.752 1290 HG12 ILE 50 2HG1 ILE 50 13.614 8.289 6.217 1291 HG13 ILE 50 3HG1 ILE 50 12.405 8.109 4.954 1292 HG21 ILE 50 1HG2 ILE 50 10.330 6.371 6.549 1293 HG22 ILE 50 2HG2 ILE 50 11.055 4.817 6.134 1294 HG23 ILE 50 3HG2 ILE 50 10.902 6.073 4.904 1295 HD11 ILE 50 1HD1 ILE 50 11.801 9.892 6.452 1296 HD12 ILE 50 2HD1 ILE 50 11.888 8.818 7.847 1297 HD13 ILE 50 3HD1 ILE 50 10.636 8.580 6.622 1298 H LEU 51 H LEU 51 14.387 4.217 7.389 1299 HA LEU 51 HA LEU 51 12.697 1.993 7.680 1300 HB2 LEU 51 2HB LEU 51 14.901 1.962 6.477 1301 HB3 LEU 51 3HB LEU 51 15.727 2.057 8.022 1302 HG LEU 51 HG LEU 51 14.788 -0.175 8.653 1303 HD11 LEU 51 1HD1 LEU 51 13.669 -1.590 6.988 1304 HD12 LEU 51 2HD1 LEU 51 13.631 -0.243 5.848 1305 HD13 LEU 51 3HD1 LEU 51 12.719 -0.152 7.357 1306 HD21 LEU 51 1HD2 LEU 51 17.010 -0.062 7.624 1307 HD22 LEU 51 2HD2 LEU 51 16.295 -0.208 6.017 1308 HD23 LEU 51 3HD2 LEU 51 16.175 -1.546 7.163 1309 H GLU 52 H GLU 52 14.803 3.663 9.980 1310 HA GLU 52 HA GLU 52 14.694 1.916 12.165 1311 HB2 GLU 52 2HB GLU 52 16.214 3.903 12.000 1312 HB3 GLU 52 3HB GLU 52 14.829 4.965 12.231 1313 HG2 GLU 52 2HG GLU 52 14.465 4.042 14.480 1314 HG3 GLU 52 3HG GLU 52 15.802 2.917 14.252 1315 H LYS 53 H LYS 53 12.634 4.702 11.325 1316 HA LYS 53 HA LYS 53 10.895 4.554 13.551 1317 HB2 LYS 53 2HB LYS 53 10.536 5.860 10.824 1318 HB3 LYS 53 3HB LYS 53 9.389 6.037 12.148 1319 HG2 LYS 53 2HG LYS 53 11.240 7.029 13.537 1320 HG3 LYS 53 3HG LYS 53 12.265 6.988 12.099 1321 HD2 LYS 53 2HD LYS 53 11.311 9.222 12.367 1322 HD3 LYS 53 3HD LYS 53 10.650 8.464 10.915 1323 HE2 LYS 53 2HE LYS 53 8.884 9.630 12.155 1324 HE3 LYS 53 3HE LYS 53 8.581 7.894 12.177 1325 HZ1 LYS 53 1HZ LYS 53 9.786 9.491 14.375 1326 HZ2 LYS 53 2HZ LYS 53 9.545 7.822 14.410 1327 HZ3 LYS 53 3HZ LYS 53 8.218 8.863 14.349 1328 H VAL 54 H VAL 54 10.570 3.353 10.215 1329 HA VAL 54 HA VAL 54 7.885 2.513 10.346 1330 HB VAL 54 HB VAL 54 10.150 1.649 8.482 1331 HG11 VAL 54 1HG1 VAL 54 8.431 -0.121 8.507 1332 HG12 VAL 54 2HG1 VAL 54 8.418 0.737 6.967 1333 HG13 VAL 54 3HG1 VAL 54 7.178 1.076 8.177 1334 HG21 VAL 54 1HG2 VAL 54 7.835 3.580 8.034 1335 HG22 VAL 54 2HG2 VAL 54 9.084 3.175 6.851 1336 HG23 VAL 54 3HG2 VAL 54 9.510 4.044 8.328 1337 H LEU 55 H LEU 55 10.946 0.698 10.770 1338 HA LEU 55 HA LEU 55 9.779 -1.820 11.363 1339 HB2 LEU 55 2HB LEU 55 12.503 -0.716 12.135 1340 HB3 LEU 55 3HB LEU 55 12.015 -2.381 12.385 1341 HG LEU 55 HG LEU 55 12.404 -1.003 9.701 1342 HD11 LEU 55 1HD1 LEU 55 13.980 -3.222 11.040 1343 HD12 LEU 55 2HD1 LEU 55 14.494 -1.543 10.839 1344 HD13 LEU 55 3HD1 LEU 55 14.271 -2.568 9.423 1345 HD21 LEU 55 1HD2 LEU 55 10.535 -2.581 9.510 1346 HD22 LEU 55 2HD2 LEU 55 11.509 -3.866 10.231 1347 HD23 LEU 55 3HD2 LEU 55 11.950 -3.197 8.657 1348 H ASP 56 H ASP 56 10.844 0.882 13.431 1349 HA ASP 56 HA ASP 56 10.618 -0.365 15.958 1350 HB2 ASP 56 2HB ASP 56 11.898 1.741 15.519 1351 HB3 ASP 56 3HB ASP 56 10.390 2.609 15.282 1352 H TYR 57 H TYR 57 8.298 1.443 14.010 1353 HA TYR 57 HA TYR 57 6.130 1.480 15.843 1354 HB2 TYR 57 2HB TYR 57 6.179 2.993 13.898 1355 HB3 TYR 57 3HB TYR 57 6.135 1.624 12.794 1356 HD1 TYR 57 HD1 TYR 57 4.011 0.338 12.467 1357 HD2 TYR 57 HD2 TYR 57 4.136 3.753 15.046 1358 HE1 TYR 57 HE1 TYR 57 1.559 0.401 12.484 1359 HE2 TYR 57 HE2 TYR 57 1.681 3.816 15.065 1360 HH TYR 57 HH TYR 57 -0.207 3.046 13.731 1361 H CYS 58 H CYS 58 7.067 -0.699 13.190 1362 HA CYS 58 HA CYS 58 4.880 -2.454 13.283 1363 HB2 CYS 58 2HB CYS 58 7.732 -2.914 12.335 1364 HB3 CYS 58 3HB CYS 58 6.418 -4.062 12.076 1365 HG CYS 58 HG CYS 58 7.279 -1.552 10.240 1366 H ARG 59 H ARG 59 7.859 -2.369 15.198 1367 HA ARG 59 HA ARG 59 7.670 -4.897 16.434 1368 HB2 ARG 59 2HB ARG 59 8.849 -2.352 17.634 1369 HB3 ARG 59 3HB ARG 59 9.132 -3.994 18.214 1370 HG2 ARG 59 2HG ARG 59 10.194 -4.532 16.004 1371 HG3 ARG 59 3HG ARG 59 10.008 -2.840 15.552 1372 HD2 ARG 59 2HD ARG 59 12.243 -3.020 16.290 1373 HD3 ARG 59 3HD ARG 59 11.393 -2.290 17.653 1374 HE ARG 59 HE ARG 59 12.181 -5.143 17.467 1375 HH11 ARG 59 1HH1 ARG 59 11.555 -2.318 19.468 1376 HH12 ARG 59 2HH1 ARG 59 12.040 -3.116 20.930 1377 HH21 ARG 59 1HH2 ARG 59 12.845 -6.147 19.356 1378 HH22 ARG 59 2HH2 ARG 59 12.778 -5.297 20.872 1379 H HIS 60 H HIS 60 6.330 -1.728 17.316 1380 HA HIS 60 HA HIS 60 5.029 -2.525 19.699 1381 HB2 HIS 60 2HB HIS 60 5.480 -0.138 19.177 1382 HB3 HIS 60 3HB HIS 60 4.328 -0.204 17.839 1383 HD1 HIS 60 HD1 HIS 60 1.926 0.299 18.425 1384 HD2 HIS 60 HD2 HIS 60 4.218 -0.585 21.771 1385 HE1 HIS 60 HE1 HIS 60 0.385 0.505 20.378 1386 HE2 HIS 60 HE2 HIS 60 1.872 0.248 22.383 1387 H HIS 61 H HIS 61 3.962 -2.381 16.306 1388 HA HIS 61 HA HIS 61 1.231 -3.053 16.806 1389 HB2 HIS 61 2HB HIS 61 2.029 -1.824 14.747 1390 HB3 HIS 61 3HB HIS 61 2.762 -3.322 14.174 1391 HD1 HIS 61 HD1 HIS 61 1.114 -5.234 13.401 1392 HD2 HIS 61 HD2 HIS 61 -0.758 -1.683 14.475 1393 HE1 HIS 61 HE1 HIS 61 -1.269 -5.481 12.658 1394 HE2 HIS 61 HE2 HIS 61 -2.398 -3.342 13.353 1395 H HIS 62 H HIS 62 4.127 -4.964 16.520 1396 HA HIS 62 HA HIS 62 2.773 -7.467 15.991 1397 HB2 HIS 62 2HB HIS 62 5.136 -7.170 15.338 1398 HB3 HIS 62 3HB HIS 62 5.590 -6.931 17.024 1399 HD1 HIS 62 HD1 HIS 62 4.302 -9.611 14.694 1400 HD2 HIS 62 HD2 HIS 62 6.041 -9.272 18.435 1401 HE1 HIS 62 HE1 HIS 62 4.851 -11.949 15.387 1402 HE2 HIS 62 HE2 HIS 62 5.628 -11.721 17.764 1403 H GLN 63 H GLN 63 4.057 -5.767 18.831 1404 HA GLN 63 HA GLN 63 3.397 -7.778 20.762 1405 HB2 GLN 63 2HB GLN 63 3.866 -4.795 21.193 1406 HB3 GLN 63 3HB GLN 63 3.882 -6.033 22.446 1407 HG2 GLN 63 2HG GLN 63 5.874 -5.721 20.180 1408 HG3 GLN 63 3HG GLN 63 6.156 -5.384 21.885 1409 HE21 GLN 63 1HE2 GLN 63 6.381 -7.139 23.323 1410 HE22 GLN 63 2HE2 GLN 63 6.718 -8.741 22.771 1411 H HIS 64 H HIS 64 1.667 -5.147 19.271 1412 HA HIS 64 HA HIS 64 -0.827 -5.946 20.658 1413 HB2 HIS 64 2HB HIS 64 -0.033 -3.110 19.836 1414 HB3 HIS 64 3HB HIS 64 -1.613 -3.575 20.457 1415 HD1 HIS 64 HD1 HIS 64 -1.843 -3.900 22.987 1416 HD2 HIS 64 HD2 HIS 64 2.034 -3.004 21.786 1417 HE1 HIS 64 HE1 HIS 64 -0.584 -3.384 25.092 1418 HE2 HIS 64 HE2 HIS 64 1.786 -3.003 24.353 1419 HA PRO 65 HA PRO 65 -1.064 -6.565 16.049 1420 HB2 PRO 65 2HB PRO 65 -2.270 -9.022 16.058 1421 HB3 PRO 65 3HB PRO 65 -0.528 -8.827 16.357 1422 HG2 PRO 65 2HG PRO 65 -2.743 -9.237 18.345 1423 HG3 PRO 65 3HG PRO 65 -1.125 -9.974 18.295 1424 HD2 PRO 65 2HD PRO 65 -1.744 -7.836 19.912 1425 HD3 PRO 65 3HD PRO 65 -0.109 -8.150 19.291 1426 H GLY 66 H GLY 66 -2.521 -4.724 16.143 1427 HA2 GLY 66 2HA GLY 66 -5.126 -5.277 15.204 1428 HA3 GLY 66 3HA GLY 66 -5.223 -4.818 16.902 1429 H GLY 67 H GLY 67 -5.166 -2.682 17.422 1430 HA2 GLY 67 2HA GLY 67 -4.858 -0.362 17.071 1431 HA3 GLY 67 3HA GLY 67 -4.548 -0.658 15.363 1432 H SER 68 H SER 68 -7.011 -0.434 17.841 1433 HA SER 68 HA SER 68 -9.236 -1.057 16.074 1434 HB2 SER 68 2HB SER 68 -9.244 -0.190 19.003 1435 HB3 SER 68 3HB SER 68 -10.587 -0.930 18.121 1436 HG SER 68 HG SER 68 -8.097 -2.092 18.819 1437 H GLY 69 H GLY 69 -7.635 1.809 17.213 1438 HA2 GLY 69 2HA GLY 69 -8.032 4.039 16.656 1439 HA3 GLY 69 3HA GLY 69 -9.615 3.612 16.017 1440 H LEU 70 H LEU 70 -10.881 2.400 18.028 1441 HA LEU 70 HA LEU 70 -11.446 4.475 19.948 1442 HB2 LEU 70 2HB LEU 70 -13.247 2.873 20.729 1443 HB3 LEU 70 3HB LEU 70 -13.342 3.369 19.054 1444 HG LEU 70 HG LEU 70 -12.253 1.096 18.457 1445 HD11 LEU 70 1HD1 LEU 70 -11.395 0.433 20.647 1446 HD12 LEU 70 2HD1 LEU 70 -12.539 -0.763 20.043 1447 HD13 LEU 70 3HD1 LEU 70 -13.032 0.376 21.300 1448 HD21 LEU 70 1HD2 LEU 70 -14.610 1.568 18.027 1449 HD22 LEU 70 2HD2 LEU 70 -15.034 1.090 19.672 1450 HD23 LEU 70 3HD2 LEU 70 -14.400 -0.107 18.539 1451 H ASP 71 H ASP 71 -8.999 2.324 19.964 1452 HA ASP 71 HA ASP 71 -9.199 1.256 22.666 1453 HB2 ASP 71 2HB ASP 71 -7.033 0.169 22.155 1454 HB3 ASP 71 3HB ASP 71 -8.177 -0.094 20.844 1455 H ASP 72 H ASP 72 -8.799 4.275 21.914 1456 HA ASP 72 HA ASP 72 -8.094 6.088 23.016 1457 HB2 ASP 72 2HB ASP 72 -7.879 4.861 25.145 1458 HB3 ASP 72 3HB ASP 72 -6.278 4.305 24.682 1459 H ILE 73 H ILE 73 -5.805 3.828 21.659 1460 HA ILE 73 HA ILE 73 -4.013 3.983 20.331 1461 HB ILE 73 HB ILE 73 -4.906 6.860 19.852 1462 HG12 ILE 73 2HG1 ILE 73 -6.523 5.117 19.070 1463 HG13 ILE 73 3HG1 ILE 73 -5.840 6.020 17.725 1464 HG21 ILE 73 1HG2 ILE 73 -3.424 6.847 17.840 1465 HG22 ILE 73 2HG2 ILE 73 -2.780 5.282 18.343 1466 HG23 ILE 73 3HG2 ILE 73 -2.510 6.708 19.346 1467 HD11 ILE 73 1HD1 ILE 73 -6.014 3.675 17.183 1468 HD12 ILE 73 2HD1 ILE 73 -5.054 3.233 18.591 1469 HD13 ILE 73 3HD1 ILE 73 -4.316 4.134 17.263 1470 HA PRO 74 HA PRO 74 -1.094 5.225 23.658 1471 HB2 PRO 74 2HB PRO 74 1.067 3.975 22.297 1472 HB3 PRO 74 3HB PRO 74 0.046 3.230 23.541 1473 HG2 PRO 74 2HG PRO 74 -0.161 3.036 20.565 1474 HG3 PRO 74 3HG PRO 74 -0.439 1.788 21.799 1475 HD2 PRO 74 2HD PRO 74 -2.496 2.968 20.574 1476 HD3 PRO 74 3HD PRO 74 -2.585 2.581 22.310 1477 HA PRO 75 HA PRO 75 0.232 9.145 22.063 1478 HB2 PRO 75 2HB PRO 75 2.673 8.691 23.802 1479 HB3 PRO 75 3HB PRO 75 1.608 10.113 23.696 1480 HG2 PRO 75 2HG PRO 75 1.340 8.458 25.736 1481 HG3 PRO 75 3HG PRO 75 -0.108 9.098 24.919 1482 HD2 PRO 75 2HD PRO 75 1.131 6.362 24.691 1483 HD3 PRO 75 3HD PRO 75 -0.587 6.827 24.729 1484 H TYR 76 H TYR 76 2.756 6.593 22.078 1485 HA TYR 76 HA TYR 76 4.577 7.776 20.309 1486 HB2 TYR 76 2HB TYR 76 5.357 5.829 21.457 1487 HB3 TYR 76 3HB TYR 76 3.992 4.858 20.915 1488 HD1 TYR 76 HD1 TYR 76 4.214 3.486 18.954 1489 HD2 TYR 76 HD2 TYR 76 7.054 6.619 19.633 1490 HE1 TYR 76 HE1 TYR 76 5.495 2.750 16.996 1491 HE2 TYR 76 HE2 TYR 76 8.333 5.870 17.671 1492 HH TYR 76 HH TYR 76 8.596 3.657 16.364 1493 H ASP 77 H ASP 77 1.807 5.660 19.601 1494 HA ASP 77 HA ASP 77 2.329 5.374 16.809 1495 HB2 ASP 77 2HB ASP 77 -0.191 4.815 18.446 1496 HB3 ASP 77 3HB ASP 77 0.038 4.314 16.770 1497 H ARG 78 H ARG 78 0.396 7.569 18.717 1498 HA ARG 78 HA ARG 78 -1.023 8.896 16.614 1499 HB2 ARG 78 2HB ARG 78 -1.793 8.941 18.948 1500 HB3 ARG 78 3HB ARG 78 -0.294 9.710 19.458 1501 HG2 ARG 78 2HG ARG 78 -0.972 11.704 17.997 1502 HG3 ARG 78 3HG ARG 78 -2.553 10.929 17.842 1503 HD2 ARG 78 2HD ARG 78 -2.550 12.613 19.641 1504 HD3 ARG 78 3HD ARG 78 -2.837 10.991 20.284 1505 HE ARG 78 HE ARG 78 -0.054 11.816 20.318 1506 HH11 ARG 78 1HH1 ARG 78 -3.043 11.774 22.177 1507 HH12 ARG 78 2HH1 ARG 78 -2.230 11.970 23.695 1508 HH21 ARG 78 1HH2 ARG 78 0.973 12.110 22.298 1509 HH22 ARG 78 2HH2 ARG 78 0.043 12.161 23.763 1510 H ASP 79 H ASP 79 1.865 9.636 18.496 1511 HA ASP 79 HA ASP 79 2.487 12.080 17.115 1512 HB2 ASP 79 2HB ASP 79 3.837 10.593 19.382 1513 HB3 ASP 79 3HB ASP 79 4.581 12.007 18.635 1514 H PHE 80 H PHE 80 3.234 8.804 16.551 1515 HA PHE 80 HA PHE 80 5.654 8.869 15.187 1516 HB2 PHE 80 2HB PHE 80 4.314 6.799 15.620 1517 HB3 PHE 80 3HB PHE 80 3.140 7.310 14.411 1518 HD1 PHE 80 HD1 PHE 80 6.602 6.120 14.938 1519 HD2 PHE 80 HD2 PHE 80 3.601 7.037 12.029 1520 HE1 PHE 80 HE1 PHE 80 7.948 5.053 13.190 1521 HE2 PHE 80 HE2 PHE 80 4.958 5.961 10.291 1522 HZ PHE 80 HZ PHE 80 7.136 4.967 10.870 1523 H CYS 81 H CYS 81 2.483 9.959 14.208 1524 HA CYS 81 HA CYS 81 2.939 10.515 11.469 1525 HB2 CYS 81 2HB CYS 81 0.884 11.706 13.371 1526 HB3 CYS 81 3HB CYS 81 0.777 11.667 11.610 1527 HG CYS 81 HG CYS 81 0.174 9.101 11.330 1528 H LYS 82 H LYS 82 3.910 12.220 14.328 1529 HA LYS 82 HA LYS 82 3.978 14.894 13.243 1530 HB2 LYS 82 2HB LYS 82 5.491 13.830 15.669 1531 HB3 LYS 82 3HB LYS 82 5.207 15.525 15.275 1532 HG2 LYS 82 2HG LYS 82 3.102 13.487 16.044 1533 HG3 LYS 82 3HG LYS 82 3.764 14.746 17.091 1534 HD2 LYS 82 2HD LYS 82 2.830 16.461 15.496 1535 HD3 LYS 82 3HD LYS 82 2.067 15.142 14.595 1536 HE2 LYS 82 2HE LYS 82 0.470 16.179 16.147 1537 HE3 LYS 82 3HE LYS 82 0.791 14.509 16.622 1538 HZ1 LYS 82 1HZ LYS 82 0.790 16.038 18.511 1539 HZ2 LYS 82 2HZ LYS 82 2.069 16.907 17.831 1540 HZ3 LYS 82 3HZ LYS 82 2.299 15.303 18.316 1541 H VAL 83 H VAL 83 5.072 14.334 11.263 1542 HA VAL 83 HA VAL 83 8.006 14.580 11.447 1543 HB VAL 83 HB VAL 83 8.203 13.108 9.369 1544 HG11 VAL 83 1HG1 VAL 83 8.093 10.945 10.558 1545 HG12 VAL 83 2HG1 VAL 83 7.144 11.692 11.845 1546 HG13 VAL 83 3HG1 VAL 83 8.813 12.199 11.575 1547 HG21 VAL 83 1HG2 VAL 83 5.856 13.215 8.612 1548 HG22 VAL 83 2HG2 VAL 83 5.334 12.323 10.042 1549 HG23 VAL 83 3HG2 VAL 83 6.356 11.537 8.836 1550 H ASP 84 H ASP 84 8.909 15.452 9.402 1551 HA ASP 84 HA ASP 84 7.589 17.823 8.585 1552 HB2 ASP 84 2HB ASP 84 10.086 17.461 8.695 1553 HB3 ASP 84 3HB ASP 84 9.966 16.415 7.287 1554 H GLN 85 H GLN 85 7.069 18.386 6.265 1555 HA GLN 85 HA GLN 85 4.866 16.859 5.506 1556 HB2 GLN 85 2HB GLN 85 5.553 19.419 5.033 1557 HB3 GLN 85 3HB GLN 85 6.037 18.772 3.477 1558 HG2 GLN 85 2HG GLN 85 3.258 18.575 4.673 1559 HG3 GLN 85 3HG GLN 85 3.759 19.760 3.478 1560 HE21 GLN 85 1HE2 GLN 85 5.290 17.830 1.836 1561 HE22 GLN 85 2HE2 GLN 85 4.110 16.831 1.068 1562 HA PRO 86 HA PRO 86 7.253 14.993 1.691 1563 HB2 PRO 86 2HB PRO 86 9.993 15.138 1.566 1564 HB3 PRO 86 3HB PRO 86 8.938 16.388 0.873 1565 HG2 PRO 86 2HG PRO 86 10.353 16.393 3.527 1566 HG3 PRO 86 3HG PRO 86 10.253 17.683 2.305 1567 HD2 PRO 86 2HD PRO 86 8.649 17.697 4.479 1568 HD3 PRO 86 3HD PRO 86 8.078 18.283 2.904 1569 H THR 87 H THR 87 8.857 14.978 4.848 1570 HA THR 87 HA THR 87 10.027 12.418 4.813 1571 HB THR 87 HB THR 87 9.026 13.972 7.239 1572 HG1 THR 87 HG1 THR 87 11.136 14.887 7.214 1573 HG21 THR 87 1HG2 THR 87 9.732 11.649 7.790 1574 HG22 THR 87 2HG2 THR 87 10.835 12.844 8.471 1575 HG23 THR 87 3HG2 THR 87 11.298 11.950 7.023 1576 H LEU 88 H LEU 88 6.768 13.501 5.565 1577 HA LEU 88 HA LEU 88 5.723 11.134 6.718 1578 HB2 LEU 88 2HB LEU 88 4.805 13.600 6.620 1579 HB3 LEU 88 3HB LEU 88 4.066 13.108 5.112 1580 HG LEU 88 HG LEU 88 3.532 11.687 7.758 1581 HD11 LEU 88 1HD1 LEU 88 2.857 14.020 7.996 1582 HD12 LEU 88 2HD1 LEU 88 1.451 12.960 7.942 1583 HD13 LEU 88 3HD1 LEU 88 1.891 13.916 6.521 1584 HD21 LEU 88 1HD2 LEU 88 2.966 10.341 5.799 1585 HD22 LEU 88 2HD2 LEU 88 1.988 11.655 5.143 1586 HD23 LEU 88 3HD2 LEU 88 1.499 10.847 6.636 1587 H PHE 89 H PHE 89 5.912 12.333 3.387 1588 HA PHE 89 HA PHE 89 4.604 10.090 2.189 1589 HB2 PHE 89 2HB PHE 89 6.290 12.325 0.999 1590 HB3 PHE 89 3HB PHE 89 5.524 11.066 0.023 1591 HD1 PHE 89 HD1 PHE 89 2.960 10.734 0.320 1592 HD2 PHE 89 HD2 PHE 89 5.014 14.276 1.559 1593 HE1 PHE 89 HE1 PHE 89 0.834 11.966 0.338 1594 HE2 PHE 89 HE2 PHE 89 2.877 15.494 1.564 1595 HZ PHE 89 HZ PHE 89 0.788 14.344 0.967 1596 H GLU 90 H GLU 90 7.974 10.795 3.013 1597 HA GLU 90 HA GLU 90 9.223 8.656 1.659 1598 HB2 GLU 90 2HB GLU 90 9.979 9.799 4.385 1599 HB3 GLU 90 3HB GLU 90 11.021 8.821 3.356 1600 HG2 GLU 90 2HG GLU 90 9.982 11.594 2.724 1601 HG3 GLU 90 3HG GLU 90 11.607 11.198 3.268 1602 H LEU 91 H LEU 91 7.499 8.806 4.761 1603 HA LEU 91 HA LEU 91 7.933 6.144 5.641 1604 HB2 LEU 91 2HB LEU 91 5.660 8.075 6.231 1605 HB3 LEU 91 3HB LEU 91 5.852 6.534 7.050 1606 HG LEU 91 HG LEU 91 7.852 8.835 7.195 1607 HD11 LEU 91 1HD1 LEU 91 5.825 7.927 9.269 1608 HD12 LEU 91 2HD1 LEU 91 5.735 9.407 8.310 1609 HD13 LEU 91 3HD1 LEU 91 7.037 9.197 9.479 1610 HD21 LEU 91 1HD2 LEU 91 8.924 6.635 7.496 1611 HD22 LEU 91 2HD2 LEU 91 7.762 6.226 8.761 1612 HD23 LEU 91 3HD2 LEU 91 8.910 7.546 9.006 1613 H ILE 92 H ILE 92 5.472 7.597 3.520 1614 HA ILE 92 HA ILE 92 3.794 5.302 3.231 1615 HB ILE 92 HB ILE 92 4.125 7.698 1.357 1616 HG12 ILE 92 2HG1 ILE 92 2.091 7.169 3.574 1617 HG13 ILE 92 3HG1 ILE 92 3.379 8.365 3.616 1618 HG21 ILE 92 1HG2 ILE 92 1.921 7.083 0.401 1619 HG22 ILE 92 2HG2 ILE 92 1.879 5.638 1.412 1620 HG23 ILE 92 3HG2 ILE 92 3.104 5.795 0.152 1621 HD11 ILE 92 1HD1 ILE 92 2.282 9.558 1.758 1622 HD12 ILE 92 2HD1 ILE 92 1.281 9.433 3.202 1623 HD13 ILE 92 3HD1 ILE 92 0.959 8.388 1.819 1624 H LEU 93 H LEU 93 6.498 6.619 1.324 1625 HA LEU 93 HA LEU 93 6.450 4.762 -0.810 1626 HB2 LEU 93 2HB LEU 93 8.737 6.458 0.274 1627 HB3 LEU 93 3HB LEU 93 8.830 5.535 -1.220 1628 HG LEU 93 HG LEU 93 6.928 7.859 -0.703 1629 HD11 LEU 93 1HD1 LEU 93 9.250 8.609 -0.894 1630 HD12 LEU 93 2HD1 LEU 93 8.311 9.117 -2.295 1631 HD13 LEU 93 3HD1 LEU 93 9.423 7.752 -2.429 1632 HD21 LEU 93 1HD2 LEU 93 6.369 7.717 -3.103 1633 HD22 LEU 93 2HD2 LEU 93 5.913 6.250 -2.243 1634 HD23 LEU 93 3HD2 LEU 93 7.360 6.263 -3.256 1635 H ALA 94 H ALA 94 8.099 4.782 2.322 1636 HA ALA 94 HA ALA 94 9.678 2.428 1.951 1637 HB1 ALA 94 1HB ALA 94 10.260 4.144 3.610 1638 HB2 ALA 94 2HB ALA 94 10.056 2.573 4.385 1639 HB3 ALA 94 3HB ALA 94 8.785 3.796 4.515 1640 H ALA 95 H ALA 95 6.518 3.091 3.416 1641 HA ALA 95 HA ALA 95 5.995 0.535 4.515 1642 HB1 ALA 95 1HB ALA 95 3.689 1.299 4.717 1643 HB2 ALA 95 2HB ALA 95 3.997 2.622 3.585 1644 HB3 ALA 95 3HB ALA 95 4.793 2.604 5.159 1645 H ASN 96 H ASN 96 5.374 1.966 1.357 1646 HA ASN 96 HA ASN 96 3.867 -0.260 0.302 1647 HB2 ASN 96 2HB ASN 96 3.451 2.043 -0.488 1648 HB3 ASN 96 3HB ASN 96 5.105 2.163 -1.077 1649 HD21 ASN 96 1HD2 ASN 96 4.271 2.631 -3.159 1650 HD22 ASN 96 2HD2 ASN 96 3.659 1.386 -4.170 1651 H TYR 97 H TYR 97 7.214 0.894 0.139 1652 HA TYR 97 HA TYR 97 8.249 -0.908 -1.783 1653 HB2 TYR 97 2HB TYR 97 9.510 1.069 -1.168 1654 HB3 TYR 97 3HB TYR 97 9.556 0.599 0.524 1655 HD1 TYR 97 HD1 TYR 97 11.562 -0.357 1.330 1656 HD2 TYR 97 HD2 TYR 97 10.686 -0.675 -2.848 1657 HE1 TYR 97 HE1 TYR 97 13.757 -1.396 0.953 1658 HE2 TYR 97 HE2 TYR 97 12.883 -1.721 -3.220 1659 HH TYR 97 HH TYR 97 15.108 -1.760 -2.124 1660 H LEU 98 H LEU 98 7.739 -1.163 1.680 1661 HA LEU 98 HA LEU 98 8.925 -3.849 1.837 1662 HB2 LEU 98 2HB LEU 98 7.891 -1.966 3.992 1663 HB3 LEU 98 3HB LEU 98 8.581 -3.551 4.309 1664 HG LEU 98 HG LEU 98 10.069 -1.187 3.089 1665 HD11 LEU 98 1HD1 LEU 98 10.320 -2.396 5.863 1666 HD12 LEU 98 2HD1 LEU 98 9.611 -0.829 5.462 1667 HD13 LEU 98 3HD1 LEU 98 11.329 -1.109 5.193 1668 HD21 LEU 98 1HD2 LEU 98 10.929 -3.288 2.190 1669 HD22 LEU 98 2HD2 LEU 98 11.110 -3.948 3.817 1670 HD23 LEU 98 3HD2 LEU 98 12.099 -2.577 3.301 1671 H ASP 99 H ASP 99 5.915 -2.389 1.348 1672 HA ASP 99 HA ASP 99 3.751 -3.014 1.338 1673 HB2 ASP 99 2HB ASP 99 5.065 -5.738 1.070 1674 HB3 ASP 99 3HB ASP 99 3.315 -5.559 1.036 1675 H ILE 100 H ILE 100 4.967 -2.572 3.909 1676 HA ILE 100 HA ILE 100 3.733 -4.346 5.821 1677 HB ILE 100 HB ILE 100 4.758 -1.505 6.299 1678 HG12 ILE 100 2HG1 ILE 100 6.189 -4.181 6.552 1679 HG13 ILE 100 3HG1 ILE 100 6.565 -2.898 5.414 1680 HG21 ILE 100 1HG2 ILE 100 4.878 -2.161 8.688 1681 HG22 ILE 100 2HG2 ILE 100 4.205 -3.745 8.296 1682 HG23 ILE 100 3HG2 ILE 100 3.225 -2.292 8.080 1683 HD11 ILE 100 1HD1 ILE 100 6.927 -2.793 8.404 1684 HD12 ILE 100 2HD1 ILE 100 7.278 -1.483 7.278 1685 HD13 ILE 100 3HD1 ILE 100 8.187 -2.989 7.187 1686 H LYS 101 H LYS 101 1.594 -4.501 5.382 1687 HA LYS 101 HA LYS 101 -0.158 -2.566 4.480 1688 HB2 LYS 101 2HB LYS 101 -0.381 -5.196 4.709 1689 HB3 LYS 101 3HB LYS 101 -1.155 -4.828 6.238 1690 HG2 LYS 101 2HG LYS 101 -2.093 -3.857 3.517 1691 HG3 LYS 101 3HG LYS 101 -2.752 -5.242 4.385 1692 HD2 LYS 101 2HD LYS 101 -3.514 -3.718 6.201 1693 HD3 LYS 101 3HD LYS 101 -2.870 -2.340 5.303 1694 HE2 LYS 101 2HE LYS 101 -5.125 -4.178 4.428 1695 HE3 LYS 101 3HE LYS 101 -5.273 -2.498 4.949 1696 HZ1 LYS 101 1HZ LYS 101 -5.337 -2.713 2.549 1697 HZ2 LYS 101 2HZ LYS 101 -3.814 -3.434 2.543 1698 HZ3 LYS 101 3HZ LYS 101 -3.984 -1.829 3.033 1699 HA PRO 102 HA PRO 102 -1.658 -1.767 9.167 1700 HB2 PRO 102 2HB PRO 102 0.447 -1.918 11.034 1701 HB3 PRO 102 3HB PRO 102 -0.797 -3.159 10.791 1702 HG2 PRO 102 2HG PRO 102 1.986 -3.047 9.675 1703 HG3 PRO 102 3HG PRO 102 1.097 -4.432 10.357 1704 HD2 PRO 102 2HD PRO 102 1.329 -4.166 7.713 1705 HD3 PRO 102 3HD PRO 102 -0.202 -4.727 8.422 1706 H LEU 103 H LEU 103 1.827 -1.045 8.605 1707 HA LEU 103 HA LEU 103 1.698 1.583 9.704 1708 HB2 LEU 103 2HB LEU 103 3.763 0.138 9.594 1709 HB3 LEU 103 3HB LEU 103 3.838 0.424 7.869 1710 HG LEU 103 HG LEU 103 5.394 1.800 9.497 1711 HD11 LEU 103 1HD1 LEU 103 5.461 3.747 8.032 1712 HD12 LEU 103 2HD1 LEU 103 3.913 3.289 7.317 1713 HD13 LEU 103 3HD1 LEU 103 5.325 2.255 7.102 1714 HD21 LEU 103 1HD2 LEU 103 3.631 2.542 11.036 1715 HD22 LEU 103 2HD2 LEU 103 2.867 3.465 9.744 1716 HD23 LEU 103 3HD2 LEU 103 4.472 3.907 10.319 1717 H LEU 104 H LEU 104 1.560 0.280 6.420 1718 HA LEU 104 HA LEU 104 1.588 2.624 4.898 1719 HB2 LEU 104 2HB LEU 104 1.767 0.366 3.937 1720 HB3 LEU 104 3HB LEU 104 0.122 0.005 4.409 1721 HG LEU 104 HG LEU 104 -0.670 1.786 2.795 1722 HD11 LEU 104 1HD1 LEU 104 2.232 1.860 1.900 1723 HD12 LEU 104 2HD1 LEU 104 1.345 3.170 2.683 1724 HD13 LEU 104 3HD1 LEU 104 0.871 2.631 1.075 1725 HD21 LEU 104 1HD2 LEU 104 -0.679 -0.595 2.197 1726 HD22 LEU 104 2HD2 LEU 104 0.967 -0.455 1.571 1727 HD23 LEU 104 3HD2 LEU 104 -0.353 0.421 0.794 1728 H ASP 105 H ASP 105 -1.119 0.880 6.424 1729 HA ASP 105 HA ASP 105 -3.195 2.455 5.309 1730 HB2 ASP 105 2HB ASP 105 -3.506 0.114 6.219 1731 HB3 ASP 105 3HB ASP 105 -3.362 0.763 7.849 1732 H VAL 106 H VAL 106 -1.703 2.437 8.550 1733 HA VAL 106 HA VAL 106 -3.173 4.498 9.729 1734 HB VAL 106 HB VAL 106 -0.299 3.614 10.256 1735 HG11 VAL 106 1HG1 VAL 106 -0.605 5.875 11.187 1736 HG12 VAL 106 2HG1 VAL 106 -0.492 4.686 12.485 1737 HG13 VAL 106 3HG1 VAL 106 -2.063 5.349 12.034 1738 HG21 VAL 106 1HG2 VAL 106 -2.888 2.872 11.680 1739 HG22 VAL 106 2HG2 VAL 106 -1.272 2.302 12.106 1740 HG23 VAL 106 3HG2 VAL 106 -1.990 1.838 10.564 1741 H THR 107 H THR 107 -0.120 4.675 7.883 1742 HA THR 107 HA THR 107 0.294 7.475 8.248 1743 HB THR 107 HB THR 107 1.556 5.636 6.162 1744 HG1 THR 107 HG1 THR 107 2.534 4.795 7.834 1745 HG21 THR 107 1HG2 THR 107 2.587 8.234 7.368 1746 HG22 THR 107 2HG2 THR 107 1.982 8.051 5.720 1747 HG23 THR 107 3HG2 THR 107 3.451 7.210 6.220 1748 H CYS 108 H CYS 108 -1.295 5.566 5.692 1749 HA CYS 108 HA CYS 108 -1.645 7.729 3.830 1750 HB2 CYS 108 2HB CYS 108 -3.018 5.020 4.044 1751 HB3 CYS 108 3HB CYS 108 -3.318 6.163 2.733 1752 HG CYS 108 HG CYS 108 -0.205 4.933 3.406 1753 H LYS 109 H LYS 109 -3.606 6.319 6.432 1754 HA LYS 109 HA LYS 109 -5.967 7.861 6.004 1755 HB2 LYS 109 2HB LYS 109 -4.984 6.475 8.547 1756 HB3 LYS 109 3HB LYS 109 -6.585 7.183 8.354 1757 HG2 LYS 109 2HG LYS 109 -5.485 4.867 6.734 1758 HG3 LYS 109 3HG LYS 109 -6.597 4.725 8.093 1759 HD2 LYS 109 2HD LYS 109 -8.347 5.881 6.846 1760 HD3 LYS 109 3HD LYS 109 -7.233 6.231 5.520 1761 HE2 LYS 109 2HE LYS 109 -8.774 4.328 5.021 1762 HE3 LYS 109 3HE LYS 109 -7.075 3.861 4.962 1763 HZ1 LYS 109 1HZ LYS 109 -7.267 2.811 7.071 1764 HZ2 LYS 109 2HZ LYS 109 -8.551 2.264 6.121 1765 HZ3 LYS 109 3HZ LYS 109 -8.821 3.420 7.318 1766 H THR 110 H THR 110 -2.967 8.368 7.808 1767 HA THR 110 HA THR 110 -3.632 10.626 9.321 1768 HB THR 110 HB THR 110 -0.938 9.872 8.098 1769 HG1 THR 110 HG1 THR 110 -2.242 8.637 9.898 1770 HG21 THR 110 1HG2 THR 110 -1.522 11.898 10.298 1771 HG22 THR 110 2HG2 THR 110 -0.919 12.280 8.683 1772 HG23 THR 110 3HG2 THR 110 0.085 11.360 9.807 1773 H VAL 111 H VAL 111 -2.335 10.422 5.980 1774 HA VAL 111 HA VAL 111 -2.160 13.222 5.527 1775 HB VAL 111 HB VAL 111 -2.584 11.150 3.323 1776 HG11 VAL 111 1HG1 VAL 111 -1.188 13.858 3.329 1777 HG12 VAL 111 2HG1 VAL 111 -2.741 13.487 2.579 1778 HG13 VAL 111 3HG1 VAL 111 -1.263 12.755 1.953 1779 HG21 VAL 111 1HG2 VAL 111 -0.766 10.354 4.765 1780 HG22 VAL 111 2HG2 VAL 111 0.044 11.917 4.644 1781 HG23 VAL 111 3HG2 VAL 111 -0.128 10.898 3.212 1782 H ALA 112 H ALA 112 -4.629 10.803 4.838 1783 HA ALA 112 HA ALA 112 -6.548 12.364 3.521 1784 HB1 ALA 112 1HB ALA 112 -6.949 9.945 5.319 1785 HB2 ALA 112 2HB ALA 112 -6.598 9.902 3.590 1786 HB3 ALA 112 3HB ALA 112 -8.125 10.574 4.158 1787 H ASN 113 H ASN 113 -5.861 11.917 6.949 1788 HA ASN 113 HA ASN 113 -8.144 13.404 7.926 1789 HB2 ASN 113 2HB ASN 113 -5.702 12.202 9.294 1790 HB3 ASN 113 3HB ASN 113 -6.897 13.153 10.174 1791 HD21 ASN 113 1HD2 ASN 113 -7.198 11.216 11.440 1792 HD22 ASN 113 2HD2 ASN 113 -8.210 9.945 10.856 1793 H MET 114 H MET 114 -4.828 14.190 7.019 1794 HA MET 114 HA MET 114 -4.697 16.728 8.365 1795 HB2 MET 114 2HB MET 114 -3.166 15.770 5.897 1796 HB3 MET 114 3HB MET 114 -2.836 17.272 6.750 1797 HG2 MET 114 2HG MET 114 -2.348 15.858 8.801 1798 HG3 MET 114 3HG MET 114 -2.395 14.454 7.734 1799 HE1 MET 114 1HE MET 114 -1.102 16.027 5.029 1800 HE2 MET 114 2HE MET 114 -0.728 14.356 5.452 1801 HE3 MET 114 3HE MET 114 0.577 15.515 5.206 1802 H ILE 115 H ILE 115 -5.447 15.728 5.027 1803 HA ILE 115 HA ILE 115 -6.114 18.390 4.139 1804 HB ILE 115 HB ILE 115 -6.713 17.362 1.985 1805 HG12 ILE 115 2HG1 ILE 115 -6.250 14.623 3.271 1806 HG13 ILE 115 3HG1 ILE 115 -7.840 15.293 2.928 1807 HG21 ILE 115 1HG2 ILE 115 -4.173 16.107 3.100 1808 HG22 ILE 115 2HG2 ILE 115 -4.315 17.738 2.442 1809 HG23 ILE 115 3HG2 ILE 115 -4.541 16.342 1.387 1810 HD11 ILE 115 1HD1 ILE 115 -5.734 14.599 0.889 1811 HD12 ILE 115 2HD1 ILE 115 -7.318 15.295 0.539 1812 HD13 ILE 115 3HD1 ILE 115 -7.199 13.689 1.255 1813 H ARG 116 H ARG 116 -7.825 15.664 5.479 1814 HA ARG 116 HA ARG 116 -9.953 15.019 5.755 1815 HB2 ARG 116 2HB ARG 116 -10.392 18.014 6.040 1816 HB3 ARG 116 3HB ARG 116 -11.556 16.782 6.528 1817 HG2 ARG 116 2HG ARG 116 -9.986 15.906 8.188 1818 HG3 ARG 116 3HG ARG 116 -8.745 17.040 7.651 1819 HD2 ARG 116 2HD ARG 116 -10.164 18.925 8.393 1820 HD3 ARG 116 3HD ARG 116 -11.384 17.775 8.962 1821 HE ARG 116 HE ARG 116 -9.323 16.902 10.336 1822 HH11 ARG 116 1HH1 ARG 116 -10.211 20.271 9.794 1823 HH12 ARG 116 2HH1 ARG 116 -9.514 20.811 11.287 1824 HH21 ARG 116 1HH2 ARG 116 -8.438 17.624 12.284 1825 HH22 ARG 116 2HH2 ARG 116 -8.510 19.306 12.704 1826 H GLY 117 H GLY 117 -9.701 14.348 3.497 1827 HA2 GLY 117 2HA GLY 117 -11.144 15.814 1.430 1828 HA3 GLY 117 3HA GLY 117 -10.283 14.288 1.252 Start of MODEL 5 1 H1 SER 2 1H SER 2 -17.861 -16.374 -16.284 2 H2 SER 2 2H SER 2 -17.183 -15.506 -15.000 3 H3 SER 2 3H SER 2 -16.648 -15.235 -16.577 4 HA SER 2 HA SER 2 -18.739 -14.345 -17.217 5 HB2 SER 2 2HB SER 2 -19.548 -14.901 -14.327 6 HB3 SER 2 3HB SER 2 -20.532 -14.025 -15.502 7 HG SER 2 HG SER 2 -21.106 -16.241 -15.337 8 H LEU 3 H LEU 3 -19.449 -12.105 -16.694 9 HA LEU 3 HA LEU 3 -17.400 -10.398 -15.645 10 HB2 LEU 3 2HB LEU 3 -20.302 -9.805 -16.385 11 HB3 LEU 3 3HB LEU 3 -19.109 -8.576 -15.994 12 HG LEU 3 HG LEU 3 -18.906 -10.467 -18.371 13 HD11 LEU 3 1HD1 LEU 3 -19.730 -7.544 -18.319 14 HD12 LEU 3 2HD1 LEU 3 -20.781 -8.916 -18.674 15 HD13 LEU 3 3HD1 LEU 3 -19.458 -8.522 -19.766 16 HD21 LEU 3 1HD2 LEU 3 -17.094 -8.978 -19.111 17 HD22 LEU 3 2HD2 LEU 3 -16.718 -9.738 -17.569 18 HD23 LEU 3 3HD2 LEU 3 -17.238 -8.050 -17.614 19 H VAL 4 H VAL 4 -17.023 -10.202 -13.492 20 HA VAL 4 HA VAL 4 -19.071 -10.668 -11.489 21 HB VAL 4 HB VAL 4 -17.288 -10.103 -9.814 22 HG11 VAL 4 1HG1 VAL 4 -16.479 -12.170 -11.901 23 HG12 VAL 4 2HG1 VAL 4 -17.610 -12.424 -10.571 24 HG13 VAL 4 3HG1 VAL 4 -15.908 -12.118 -10.229 25 HG21 VAL 4 1HG2 VAL 4 -15.480 -9.748 -12.246 26 HG22 VAL 4 2HG2 VAL 4 -14.940 -9.798 -10.567 27 HG23 VAL 4 3HG2 VAL 4 -15.968 -8.478 -11.120 28 H LYS 5 H LYS 5 -20.323 -9.200 -10.593 29 HA LYS 5 HA LYS 5 -20.212 -6.423 -11.538 30 HB2 LYS 5 2HB LYS 5 -22.424 -7.898 -10.055 31 HB3 LYS 5 3HB LYS 5 -22.559 -6.329 -10.840 32 HG2 LYS 5 2HG LYS 5 -22.084 -7.473 -13.038 33 HG3 LYS 5 3HG LYS 5 -22.148 -9.016 -12.190 34 HD2 LYS 5 2HD LYS 5 -24.503 -8.514 -11.515 35 HD3 LYS 5 3HD LYS 5 -24.424 -7.011 -12.440 36 HE2 LYS 5 2HE LYS 5 -24.007 -8.336 -14.506 37 HE3 LYS 5 3HE LYS 5 -24.159 -9.820 -13.563 38 HZ1 LYS 5 1HZ LYS 5 -26.282 -7.780 -13.925 39 HZ2 LYS 5 2HZ LYS 5 -26.434 -9.208 -13.031 40 HZ3 LYS 5 3HZ LYS 5 -26.209 -9.278 -14.704 41 H LEU 6 H LEU 6 -19.152 -5.071 -10.255 42 HA LEU 6 HA LEU 6 -19.008 -5.525 -7.332 43 HB2 LEU 6 2HB LEU 6 -17.047 -4.035 -9.134 44 HB3 LEU 6 3HB LEU 6 -16.845 -4.348 -7.417 45 HG LEU 6 HG LEU 6 -16.881 -6.474 -9.599 46 HD11 LEU 6 1HD1 LEU 6 -14.487 -6.757 -9.144 47 HD12 LEU 6 2HD1 LEU 6 -14.537 -5.424 -7.989 48 HD13 LEU 6 3HD1 LEU 6 -14.845 -5.124 -9.699 49 HD21 LEU 6 1HD2 LEU 6 -16.390 -6.794 -6.619 50 HD22 LEU 6 2HD2 LEU 6 -16.195 -8.061 -7.833 51 HD23 LEU 6 3HD2 LEU 6 -17.789 -7.381 -7.523 52 H GLU 7 H GLU 7 -20.665 -4.285 -6.547 53 HA GLU 7 HA GLU 7 -21.252 -1.644 -7.607 54 HB2 GLU 7 2HB GLU 7 -22.394 -3.051 -5.154 55 HB3 GLU 7 3HB GLU 7 -22.948 -1.498 -5.776 56 HG2 GLU 7 2HG GLU 7 -24.491 -3.177 -6.469 57 HG3 GLU 7 3HG GLU 7 -23.614 -2.614 -7.889 58 H SER 8 H SER 8 -20.357 0.183 -6.909 59 HA SER 8 HA SER 8 -18.485 0.362 -4.754 60 HB2 SER 8 2HB SER 8 -18.647 2.835 -5.335 61 HB3 SER 8 3HB SER 8 -18.285 1.783 -6.706 62 HG SER 8 HG SER 8 -20.136 2.261 -7.583 63 H SER 9 H SER 9 -18.873 2.292 -3.103 64 HA SER 9 HA SER 9 -21.183 1.892 -1.481 65 HB2 SER 9 2HB SER 9 -20.325 3.910 -0.236 66 HB3 SER 9 3HB SER 9 -19.086 2.685 -0.490 67 HG SER 9 HG SER 9 -18.006 4.323 -1.274 68 H ASP 10 H ASP 10 -20.552 3.826 -4.271 69 HA ASP 10 HA ASP 10 -22.943 5.499 -4.019 70 HB2 ASP 10 2HB ASP 10 -20.748 6.360 -4.916 71 HB3 ASP 10 3HB ASP 10 -20.908 5.258 -6.277 72 H GLU 11 H GLU 11 -22.522 2.354 -4.675 73 HA GLU 11 HA GLU 11 -23.949 0.727 -5.257 74 HB2 GLU 11 2HB GLU 11 -25.907 2.979 -5.866 75 HB3 GLU 11 3HB GLU 11 -26.341 1.276 -5.737 76 HG2 GLU 11 2HG GLU 11 -25.674 1.261 -3.366 77 HG3 GLU 11 3HG GLU 11 -25.167 2.944 -3.480 78 H LYS 12 H LYS 12 -22.395 2.460 -7.428 79 HA LYS 12 HA LYS 12 -23.768 1.824 -9.885 80 HB2 LYS 12 2HB LYS 12 -20.925 2.801 -9.366 81 HB3 LYS 12 3HB LYS 12 -21.611 2.596 -10.972 82 HG2 LYS 12 2HG LYS 12 -22.672 4.489 -8.856 83 HG3 LYS 12 3HG LYS 12 -21.640 4.949 -10.211 84 HD2 LYS 12 2HD LYS 12 -23.410 4.204 -11.795 85 HD3 LYS 12 3HD LYS 12 -24.443 3.779 -10.426 86 HE2 LYS 12 2HE LYS 12 -23.428 6.569 -11.074 87 HE3 LYS 12 3HE LYS 12 -25.055 5.969 -11.380 88 HZ1 LYS 12 1HZ LYS 12 -24.913 7.299 -9.358 89 HZ2 LYS 12 2HZ LYS 12 -23.815 6.206 -8.697 90 HZ3 LYS 12 3HZ LYS 12 -25.398 5.718 -9.028 91 H VAL 13 H VAL 13 -23.747 -0.039 -10.915 92 HA VAL 13 HA VAL 13 -22.331 -2.351 -9.925 93 HB VAL 13 HB VAL 13 -24.223 -2.079 -12.319 94 HG11 VAL 13 1HG1 VAL 13 -24.548 -4.522 -12.127 95 HG12 VAL 13 2HG1 VAL 13 -23.343 -4.583 -10.837 96 HG13 VAL 13 3HG1 VAL 13 -22.864 -4.116 -12.470 97 HG21 VAL 13 1HG2 VAL 13 -24.879 -2.907 -9.465 98 HG22 VAL 13 2HG2 VAL 13 -26.009 -2.899 -10.822 99 HG23 VAL 13 3HG2 VAL 13 -25.329 -1.382 -10.232 100 H PHE 14 H PHE 14 -20.171 -2.340 -10.458 101 HA PHE 14 HA PHE 14 -19.288 -1.696 -13.185 102 HB2 PHE 14 2HB PHE 14 -17.697 -2.280 -10.650 103 HB3 PHE 14 3HB PHE 14 -16.977 -1.903 -12.217 104 HD1 PHE 14 HD1 PHE 14 -17.757 0.335 -13.339 105 HD2 PHE 14 HD2 PHE 14 -18.165 -0.479 -9.160 106 HE1 PHE 14 HE1 PHE 14 -17.951 2.736 -12.880 107 HE2 PHE 14 HE2 PHE 14 -18.352 1.931 -8.719 108 HZ PHE 14 HZ PHE 14 -18.252 3.533 -10.577 109 H GLU 15 H GLU 15 -20.179 -3.447 -14.253 110 HA GLU 15 HA GLU 15 -19.468 -6.182 -13.733 111 HB2 GLU 15 2HB GLU 15 -20.402 -4.953 -16.366 112 HB3 GLU 15 3HB GLU 15 -20.470 -6.654 -15.906 113 HG2 GLU 15 2HG GLU 15 -22.106 -6.087 -14.128 114 HG3 GLU 15 3HG GLU 15 -22.034 -4.405 -14.631 115 H ILE 16 H ILE 16 -17.419 -6.863 -13.912 116 HA ILE 16 HA ILE 16 -15.731 -6.010 -16.165 117 HB ILE 16 HB ILE 16 -15.228 -4.499 -14.229 118 HG12 ILE 16 2HG1 ILE 16 -12.921 -6.404 -14.843 119 HG13 ILE 16 3HG1 ILE 16 -13.457 -5.119 -15.913 120 HG21 ILE 16 1HG2 ILE 16 -14.147 -5.351 -12.183 121 HG22 ILE 16 2HG2 ILE 16 -14.333 -7.009 -12.758 122 HG23 ILE 16 3HG2 ILE 16 -15.760 -6.046 -12.371 123 HD11 ILE 16 1HD1 ILE 16 -12.859 -3.470 -14.181 124 HD12 ILE 16 2HD1 ILE 16 -11.496 -4.444 -14.726 125 HD13 ILE 16 3HD1 ILE 16 -12.255 -4.790 -13.174 126 H GLU 17 H GLU 17 -13.952 -7.482 -16.556 127 HA GLU 17 HA GLU 17 -14.670 -10.197 -16.433 128 HB2 GLU 17 2HB GLU 17 -11.959 -8.963 -17.068 129 HB3 GLU 17 3HB GLU 17 -12.389 -10.644 -17.352 130 HG2 GLU 17 2HG GLU 17 -12.570 -9.614 -19.463 131 HG3 GLU 17 3HG GLU 17 -14.226 -9.781 -18.910 132 H LYS 18 H LYS 18 -14.178 -11.807 -15.056 133 HA LYS 18 HA LYS 18 -13.566 -11.296 -12.376 134 HB2 LYS 18 2HB LYS 18 -14.925 -13.206 -13.206 135 HB3 LYS 18 3HB LYS 18 -13.468 -13.948 -13.859 136 HG2 LYS 18 2HG LYS 18 -12.556 -14.003 -11.470 137 HG3 LYS 18 3HG LYS 18 -14.165 -13.503 -10.938 138 HD2 LYS 18 2HD LYS 18 -13.922 -15.951 -10.755 139 HD3 LYS 18 3HD LYS 18 -15.145 -15.541 -11.959 140 HE2 LYS 18 2HE LYS 18 -13.457 -15.892 -13.759 141 HE3 LYS 18 3HE LYS 18 -12.273 -16.360 -12.536 142 HZ1 LYS 18 1HZ LYS 18 -13.432 -18.226 -13.685 143 HZ2 LYS 18 2HZ LYS 18 -14.861 -17.768 -12.907 144 HZ3 LYS 18 3HZ LYS 18 -13.523 -18.268 -12.001 145 H GLU 19 H GLU 19 -11.504 -12.334 -15.030 146 HA GLU 19 HA GLU 19 -9.151 -13.113 -13.755 147 HB2 GLU 19 2HB GLU 19 -9.513 -11.575 -16.357 148 HB3 GLU 19 3HB GLU 19 -7.991 -12.301 -15.854 149 HG2 GLU 19 2HG GLU 19 -8.963 -14.529 -15.973 150 HG3 GLU 19 3HG GLU 19 -10.542 -13.847 -16.359 151 H ILE 20 H ILE 20 -10.378 -9.888 -14.387 152 HA ILE 20 HA ILE 20 -7.981 -8.452 -13.613 153 HB ILE 20 HB ILE 20 -10.798 -7.371 -14.078 154 HG12 ILE 20 2HG1 ILE 20 -8.546 -7.616 -16.133 155 HG13 ILE 20 3HG1 ILE 20 -9.910 -8.724 -16.032 156 HG21 ILE 20 1HG2 ILE 20 -9.311 -5.779 -12.927 157 HG22 ILE 20 2HG2 ILE 20 -9.653 -5.228 -14.565 158 HG23 ILE 20 3HG2 ILE 20 -8.097 -5.969 -14.193 159 HD11 ILE 20 1HD1 ILE 20 -10.150 -7.057 -17.795 160 HD12 ILE 20 2HD1 ILE 20 -10.129 -5.779 -16.582 161 HD13 ILE 20 3HD1 ILE 20 -11.437 -6.962 -16.594 162 H ALA 21 H ALA 21 -11.135 -9.253 -12.213 163 HA ALA 21 HA ALA 21 -10.850 -7.979 -9.694 164 HB1 ALA 21 1HB ALA 21 -12.996 -8.830 -10.514 165 HB2 ALA 21 2HB ALA 21 -12.613 -9.535 -8.946 166 HB3 ALA 21 3HB ALA 21 -12.399 -10.488 -10.419 167 H CYS 22 H CYS 22 -9.539 -10.965 -10.982 168 HA CYS 22 HA CYS 22 -8.538 -12.040 -8.522 169 HB2 CYS 22 2HB CYS 22 -7.765 -12.647 -11.397 170 HB3 CYS 22 3HB CYS 22 -7.265 -13.593 -9.996 171 HG CYS 22 HG CYS 22 -10.575 -13.235 -10.174 172 H MET 23 H MET 23 -7.310 -9.742 -10.903 173 HA MET 23 HA MET 23 -4.583 -9.631 -10.071 174 HB2 MET 23 2HB MET 23 -6.313 -7.413 -11.257 175 HB3 MET 23 3HB MET 23 -4.561 -7.355 -11.109 176 HG2 MET 23 2HG MET 23 -4.368 -9.243 -12.671 177 HG3 MET 23 3HG MET 23 -6.126 -9.297 -12.811 178 HE1 MET 23 1HE MET 23 -2.881 -7.153 -13.505 179 HE2 MET 23 2HE MET 23 -3.859 -6.009 -12.581 180 HE3 MET 23 3HE MET 23 -3.562 -5.730 -14.297 181 H SER 24 H SER 24 -7.506 -7.969 -9.025 182 HA SER 24 HA SER 24 -6.346 -6.477 -6.884 183 HB2 SER 24 2HB SER 24 -8.561 -5.894 -7.856 184 HB3 SER 24 3HB SER 24 -9.215 -7.431 -7.289 185 HG SER 24 HG SER 24 -9.152 -5.174 -5.980 186 H VAL 25 H VAL 25 -5.479 -7.365 -5.085 187 HA VAL 25 HA VAL 25 -5.385 -10.138 -4.621 188 HB VAL 25 HB VAL 25 -4.646 -7.831 -2.761 189 HG11 VAL 25 1HG1 VAL 25 -4.995 -9.861 -1.422 190 HG12 VAL 25 2HG1 VAL 25 -3.278 -9.462 -1.493 191 HG13 VAL 25 3HG1 VAL 25 -3.919 -10.774 -2.484 192 HG21 VAL 25 1HG2 VAL 25 -2.906 -9.530 -4.600 193 HG22 VAL 25 2HG2 VAL 25 -2.321 -8.273 -3.507 194 HG23 VAL 25 3HG2 VAL 25 -3.362 -7.844 -4.865 195 H THR 26 H THR 26 -7.124 -7.582 -2.814 196 HA THR 26 HA THR 26 -8.280 -9.278 -0.876 197 HB THR 26 HB THR 26 -9.157 -6.507 -1.788 198 HG1 THR 26 HG1 THR 26 -7.971 -5.952 0.173 199 HG21 THR 26 1HG2 THR 26 -9.883 -7.990 0.773 200 HG22 THR 26 2HG2 THR 26 -11.001 -7.590 -0.533 201 HG23 THR 26 3HG2 THR 26 -10.263 -6.304 0.423 202 H ILE 27 H ILE 27 -9.609 -8.030 -3.980 203 HA ILE 27 HA ILE 27 -12.215 -9.129 -3.640 204 HB ILE 27 HB ILE 27 -10.814 -8.394 -6.251 205 HG12 ILE 27 2HG1 ILE 27 -12.812 -6.796 -4.569 206 HG13 ILE 27 3HG1 ILE 27 -11.087 -6.469 -4.676 207 HG21 ILE 27 1HG2 ILE 27 -13.769 -8.933 -5.737 208 HG22 ILE 27 2HG2 ILE 27 -12.676 -9.956 -6.670 209 HG23 ILE 27 3HG2 ILE 27 -13.087 -8.347 -7.257 210 HD11 ILE 27 1HD1 ILE 27 -13.065 -6.256 -6.942 211 HD12 ILE 27 2HD1 ILE 27 -11.333 -5.933 -7.047 212 HD13 ILE 27 3HD1 ILE 27 -12.358 -4.921 -6.032 213 H LYS 28 H LYS 28 -9.278 -10.312 -5.255 214 HA LYS 28 HA LYS 28 -10.125 -12.777 -6.243 215 HB2 LYS 28 2HB LYS 28 -7.896 -11.806 -6.708 216 HB3 LYS 28 3HB LYS 28 -7.431 -12.037 -5.029 217 HG2 LYS 28 2HG LYS 28 -7.723 -14.538 -5.389 218 HG3 LYS 28 3HG LYS 28 -7.946 -14.192 -7.106 219 HD2 LYS 28 2HD LYS 28 -5.615 -14.879 -6.583 220 HD3 LYS 28 3HD LYS 28 -5.689 -13.249 -7.256 221 HE2 LYS 28 2HE LYS 28 -4.106 -13.416 -5.353 222 HE3 LYS 28 3HE LYS 28 -5.414 -12.281 -5.018 223 HZ1 LYS 28 1HZ LYS 28 -5.138 -15.052 -4.003 224 HZ2 LYS 28 2HZ LYS 28 -6.517 -14.115 -3.780 225 HZ3 LYS 28 3HZ LYS 28 -5.050 -13.629 -3.101 226 H ASN 29 H ASN 29 -8.907 -11.906 -3.006 227 HA ASN 29 HA ASN 29 -8.926 -14.496 -1.857 228 HB2 ASN 29 2HB ASN 29 -9.104 -11.755 -0.521 229 HB3 ASN 29 3HB ASN 29 -8.927 -13.263 0.372 230 HD21 ASN 29 1HD2 ASN 29 -7.135 -10.999 0.364 231 HD22 ASN 29 2HD2 ASN 29 -5.606 -11.571 -0.199 232 H MET 30 H MET 30 -11.421 -12.012 -2.179 233 HA MET 30 HA MET 30 -13.353 -13.295 -0.484 234 HB2 MET 30 2HB MET 30 -13.724 -11.142 -2.612 235 HB3 MET 30 3HB MET 30 -14.992 -11.690 -1.521 236 HG2 MET 30 2HG MET 30 -13.512 -10.979 0.403 237 HG3 MET 30 3HG MET 30 -12.449 -10.236 -0.786 238 HE1 MET 30 1HE MET 30 -14.469 -9.001 -2.939 239 HE2 MET 30 2HE MET 30 -13.115 -8.097 -2.256 240 HE3 MET 30 3HE MET 30 -14.729 -7.395 -2.261 241 H ILE 31 H ILE 31 -12.629 -13.427 -3.940 242 HA ILE 31 HA ILE 31 -14.842 -15.046 -4.745 243 HB ILE 31 HB ILE 31 -12.081 -14.751 -6.049 244 HG12 ILE 31 2HG1 ILE 31 -14.695 -13.323 -6.751 245 HG13 ILE 31 3HG1 ILE 31 -13.379 -12.597 -5.842 246 HG21 ILE 31 1HG2 ILE 31 -14.649 -15.876 -7.244 247 HG22 ILE 31 2HG2 ILE 31 -13.196 -16.796 -6.851 248 HG23 ILE 31 3HG2 ILE 31 -13.151 -15.585 -8.131 249 HD11 ILE 31 1HD1 ILE 31 -13.256 -13.519 -8.710 250 HD12 ILE 31 2HD1 ILE 31 -11.913 -12.827 -7.796 251 HD13 ILE 31 3HD1 ILE 31 -13.344 -11.855 -8.132 252 H GLU 32 H GLU 32 -11.575 -15.717 -3.538 253 HA GLU 32 HA GLU 32 -11.694 -18.590 -3.791 254 HB2 GLU 32 2HB GLU 32 -9.834 -16.801 -2.165 255 HB3 GLU 32 3HB GLU 32 -9.614 -18.534 -2.386 256 HG2 GLU 32 2HG GLU 32 -9.242 -18.268 -4.760 257 HG3 GLU 32 3HG GLU 32 -9.671 -16.559 -4.684 258 H ASP 33 H ASP 33 -12.701 -16.275 -1.387 259 HA ASP 33 HA ASP 33 -12.796 -18.070 0.872 260 HB2 ASP 33 2HB ASP 33 -12.426 -15.632 1.146 261 HB3 ASP 33 3HB ASP 33 -14.006 -15.288 0.452 262 H ILE 34 H ILE 34 -15.172 -16.647 -1.345 263 HA ILE 34 HA ILE 34 -17.443 -17.962 -0.049 264 HB ILE 34 HB ILE 34 -17.355 -16.070 -2.461 265 HG12 ILE 34 2HG1 ILE 34 -18.078 -15.438 0.447 266 HG13 ILE 34 3HG1 ILE 34 -16.544 -15.028 -0.308 267 HG21 ILE 34 1HG2 ILE 34 -19.791 -15.780 -2.107 268 HG22 ILE 34 2HG2 ILE 34 -19.752 -16.976 -0.812 269 HG23 ILE 34 3HG2 ILE 34 -19.397 -17.461 -2.471 270 HD11 ILE 34 1HD1 ILE 34 -19.249 -13.941 -1.071 271 HD12 ILE 34 2HD1 ILE 34 -17.727 -13.555 -1.877 272 HD13 ILE 34 3HD1 ILE 34 -17.973 -13.099 -0.193 273 H GLY 35 H GLY 35 -15.623 -18.045 -3.079 274 HA2 GLY 35 2HA GLY 35 -15.360 -20.132 -4.309 275 HA3 GLY 35 3HA GLY 35 -17.048 -20.502 -3.962 276 H GLU 36 H GLU 36 -17.541 -20.686 -6.180 277 HA GLU 36 HA GLU 36 -17.157 -18.461 -8.002 278 HB2 GLU 36 2HB GLU 36 -18.786 -21.016 -8.404 279 HB3 GLU 36 3HB GLU 36 -18.271 -19.890 -9.658 280 HG2 GLU 36 2HG GLU 36 -15.873 -20.432 -9.040 281 HG3 GLU 36 3HG GLU 36 -16.499 -21.689 -7.983 282 H SER 37 H SER 37 -18.244 -16.924 -6.579 283 HA SER 37 HA SER 37 -21.041 -17.132 -5.971 284 HB2 SER 37 2HB SER 37 -20.700 -14.739 -5.148 285 HB3 SER 37 3HB SER 37 -19.640 -15.940 -4.413 286 HG SER 37 HG SER 37 -18.977 -14.160 -6.518 287 H ASP 38 H ASP 38 -22.454 -17.062 -7.617 288 HA ASP 38 HA ASP 38 -22.238 -15.421 -9.966 289 HB2 ASP 38 2HB ASP 38 -24.737 -16.725 -8.775 290 HB3 ASP 38 3HB ASP 38 -24.575 -16.099 -10.415 291 H SER 39 H SER 39 -23.601 -15.068 -6.775 292 HA SER 39 HA SER 39 -25.094 -12.714 -7.023 293 HB2 SER 39 2HB SER 39 -23.442 -13.687 -4.642 294 HB3 SER 39 3HB SER 39 -24.710 -12.464 -4.571 295 HG SER 39 HG SER 39 -25.714 -14.588 -5.783 296 HA PRO 40 HA PRO 40 -21.819 -9.685 -7.855 297 HB2 PRO 40 2HB PRO 40 -23.218 -7.394 -7.282 298 HB3 PRO 40 3HB PRO 40 -23.520 -8.347 -8.744 299 HG2 PRO 40 2HG PRO 40 -25.032 -8.364 -6.155 300 HG3 PRO 40 3HG PRO 40 -25.657 -8.304 -7.822 301 HD2 PRO 40 2HD PRO 40 -25.583 -10.619 -6.427 302 HD3 PRO 40 3HD PRO 40 -25.306 -10.577 -8.182 303 H ILE 41 H ILE 41 -20.247 -8.581 -6.668 304 HA ILE 41 HA ILE 41 -20.448 -8.825 -3.723 305 HB ILE 41 HB ILE 41 -17.922 -8.651 -5.440 306 HG12 ILE 41 2HG1 ILE 41 -19.092 -10.806 -5.821 307 HG13 ILE 41 3HG1 ILE 41 -17.597 -11.066 -4.937 308 HG21 ILE 41 1HG2 ILE 41 -18.227 -9.208 -2.461 309 HG22 ILE 41 2HG2 ILE 41 -17.547 -7.750 -3.185 310 HG23 ILE 41 3HG2 ILE 41 -16.714 -9.294 -3.367 311 HD11 ILE 41 1HD1 ILE 41 -19.367 -12.479 -4.075 312 HD12 ILE 41 2HD1 ILE 41 -20.386 -11.073 -3.771 313 HD13 ILE 41 3HD1 ILE 41 -18.897 -11.300 -2.849 314 HA PRO 42 HA PRO 42 -20.431 -4.252 -4.152 315 HB2 PRO 42 2HB PRO 42 -21.862 -3.669 -1.927 316 HB3 PRO 42 3HB PRO 42 -22.646 -4.331 -3.375 317 HG2 PRO 42 2HG PRO 42 -21.864 -5.737 -0.851 318 HG3 PRO 42 3HG PRO 42 -23.347 -5.902 -1.817 319 HD2 PRO 42 2HD PRO 42 -21.188 -7.646 -1.968 320 HD3 PRO 42 3HD PRO 42 -22.379 -7.412 -3.267 321 H LEU 43 H LEU 43 -18.816 -2.982 -3.481 322 HA LEU 43 HA LEU 43 -17.354 -3.459 -0.970 323 HB2 LEU 43 2HB LEU 43 -16.632 -1.671 -3.334 324 HB3 LEU 43 3HB LEU 43 -15.592 -2.063 -1.973 325 HG LEU 43 HG LEU 43 -16.543 -4.022 -4.099 326 HD11 LEU 43 1HD1 LEU 43 -14.207 -4.077 -4.852 327 HD12 LEU 43 2HD1 LEU 43 -13.790 -2.829 -3.673 328 HD13 LEU 43 3HD1 LEU 43 -14.904 -2.463 -4.994 329 HD21 LEU 43 1HD2 LEU 43 -16.286 -5.183 -1.985 330 HD22 LEU 43 2HD2 LEU 43 -14.671 -4.505 -1.764 331 HD23 LEU 43 3HD2 LEU 43 -14.985 -5.638 -3.080 332 HA PRO 44 HA PRO 44 -20.197 0.063 0.046 333 HB2 PRO 44 2HB PRO 44 -20.697 -0.542 2.614 334 HB3 PRO 44 3HB PRO 44 -21.275 -1.611 1.318 335 HG2 PRO 44 2HG PRO 44 -18.840 -1.925 3.054 336 HG3 PRO 44 3HG PRO 44 -20.082 -3.130 2.638 337 HD2 PRO 44 2HD PRO 44 -17.665 -2.929 1.322 338 HD3 PRO 44 3HD PRO 44 -19.140 -3.591 0.582 339 H ASN 45 H ASN 45 -17.376 0.624 -0.116 340 HA ASN 45 HA ASN 45 -17.153 2.743 1.912 341 HB2 ASN 45 2HB ASN 45 -15.779 0.845 2.789 342 HB3 ASN 45 3HB ASN 45 -14.864 0.819 1.284 343 HD21 ASN 45 1HD2 ASN 45 -12.896 1.277 2.265 344 HD22 ASN 45 2HD2 ASN 45 -12.524 2.810 2.968 345 H VAL 46 H VAL 46 -15.448 1.276 -0.877 346 HA VAL 46 HA VAL 46 -14.348 3.766 -1.769 347 HB VAL 46 HB VAL 46 -13.116 1.692 -2.180 348 HG11 VAL 46 1HG1 VAL 46 -15.367 0.822 -4.021 349 HG12 VAL 46 2HG1 VAL 46 -14.980 0.123 -2.447 350 HG13 VAL 46 3HG1 VAL 46 -13.833 -0.023 -3.780 351 HG21 VAL 46 1HG2 VAL 46 -13.989 2.963 -4.808 352 HG22 VAL 46 2HG2 VAL 46 -12.530 1.997 -4.569 353 HG23 VAL 46 3HG2 VAL 46 -12.708 3.544 -3.741 354 H THR 47 H THR 47 -15.204 5.235 -3.162 355 HA THR 47 HA THR 47 -17.989 5.059 -3.884 356 HB THR 47 HB THR 47 -17.594 7.370 -4.837 357 HG1 THR 47 HG1 THR 47 -15.378 8.175 -4.131 358 HG21 THR 47 1HG2 THR 47 -16.520 6.941 -2.023 359 HG22 THR 47 2HG2 THR 47 -18.223 7.114 -2.459 360 HG23 THR 47 3HG2 THR 47 -17.112 8.467 -2.680 361 H SER 48 H SER 48 -18.607 5.917 -6.158 362 HA SER 48 HA SER 48 -18.057 3.856 -7.996 363 HB2 SER 48 2HB SER 48 -19.432 5.282 -9.571 364 HB3 SER 48 3HB SER 48 -20.197 4.947 -8.017 365 HG SER 48 HG SER 48 -20.411 7.133 -8.493 366 H THR 49 H THR 49 -17.106 7.267 -7.966 367 HA THR 49 HA THR 49 -15.798 7.439 -10.422 368 HB THR 49 HB THR 49 -14.617 9.429 -9.400 369 HG1 THR 49 HG1 THR 49 -14.446 9.518 -7.297 370 HG21 THR 49 1HG2 THR 49 -16.921 9.736 -10.288 371 HG22 THR 49 2HG2 THR 49 -16.658 10.744 -8.864 372 HG23 THR 49 3HG2 THR 49 -17.584 9.250 -8.726 373 H ILE 50 H ILE 50 -14.541 6.564 -7.216 374 HA ILE 50 HA ILE 50 -11.794 6.425 -8.043 375 HB ILE 50 HB ILE 50 -13.108 5.446 -5.465 376 HG12 ILE 50 2HG1 ILE 50 -13.486 7.843 -5.767 377 HG13 ILE 50 3HG1 ILE 50 -12.277 7.617 -4.511 378 HG21 ILE 50 1HG2 ILE 50 -10.841 5.570 -4.475 379 HG22 ILE 50 2HG2 ILE 50 -10.167 5.959 -6.058 380 HG23 ILE 50 3HG2 ILE 50 -10.916 4.384 -5.780 381 HD11 ILE 50 1HD1 ILE 50 -11.759 8.456 -7.370 382 HD12 ILE 50 2HD1 ILE 50 -10.509 8.170 -6.157 383 HD13 ILE 50 3HD1 ILE 50 -11.676 9.470 -5.931 384 H LEU 51 H LEU 51 -14.304 4.010 -7.230 385 HA LEU 51 HA LEU 51 -12.703 1.706 -7.519 386 HB2 LEU 51 2HB LEU 51 -14.888 1.723 -6.319 387 HB3 LEU 51 3HB LEU 51 -15.724 1.926 -7.852 388 HG LEU 51 HG LEU 51 -14.942 -0.311 -8.594 389 HD11 LEU 51 1HD1 LEU 51 -12.799 -0.430 -7.423 390 HD12 LEU 51 2HD1 LEU 51 -13.779 -1.847 -7.066 391 HD13 LEU 51 3HD1 LEU 51 -13.629 -0.561 -5.867 392 HD21 LEU 51 1HD2 LEU 51 -17.099 -0.167 -7.418 393 HD22 LEU 51 2HD2 LEU 51 -16.291 -0.426 -5.869 394 HD23 LEU 51 3HD2 LEU 51 -16.298 -1.702 -7.089 395 H GLU 52 H GLU 52 -14.658 3.535 -9.845 396 HA GLU 52 HA GLU 52 -14.555 1.828 -12.073 397 HB2 GLU 52 2HB GLU 52 -15.963 3.910 -11.955 398 HB3 GLU 52 3HB GLU 52 -14.504 4.887 -12.093 399 HG2 GLU 52 2HG GLU 52 -14.073 3.788 -14.334 400 HG3 GLU 52 3HG GLU 52 -15.650 3.014 -14.194 401 H LYS 53 H LYS 53 -12.397 4.436 -11.032 402 HA LYS 53 HA LYS 53 -10.586 4.356 -13.197 403 HB2 LYS 53 2HB LYS 53 -10.242 5.422 -10.362 404 HB3 LYS 53 3HB LYS 53 -9.078 5.671 -11.658 405 HG2 LYS 53 2HG LYS 53 -10.896 6.846 -12.965 406 HG3 LYS 53 3HG LYS 53 -11.909 6.728 -11.526 407 HD2 LYS 53 2HD LYS 53 -10.854 8.934 -11.602 408 HD3 LYS 53 3HD LYS 53 -10.210 8.016 -10.236 409 HE2 LYS 53 2HE LYS 53 -8.432 9.215 -11.472 410 HE3 LYS 53 3HE LYS 53 -8.190 7.470 -11.522 411 HZ1 LYS 53 1HZ LYS 53 -9.350 9.158 -13.673 412 HZ2 LYS 53 2HZ LYS 53 -9.214 7.476 -13.739 413 HZ3 LYS 53 3HZ LYS 53 -7.823 8.436 -13.683 414 H VAL 54 H VAL 54 -10.439 2.926 -9.945 415 HA VAL 54 HA VAL 54 -7.842 1.849 -10.073 416 HB VAL 54 HB VAL 54 -10.257 1.048 -8.376 417 HG11 VAL 54 1HG1 VAL 54 -8.697 -0.171 -6.890 418 HG12 VAL 54 2HG1 VAL 54 -7.381 0.120 -8.030 419 HG13 VAL 54 3HG1 VAL 54 -8.749 -0.890 -8.501 420 HG21 VAL 54 1HG2 VAL 54 -9.096 2.280 -6.570 421 HG22 VAL 54 2HG2 VAL 54 -9.399 3.329 -7.955 422 HG23 VAL 54 3HG2 VAL 54 -7.780 2.682 -7.678 423 H LEU 55 H LEU 55 -11.018 0.439 -10.828 424 HA LEU 55 HA LEU 55 -10.057 -2.128 -11.647 425 HB2 LEU 55 2HB LEU 55 -12.687 -0.691 -12.158 426 HB3 LEU 55 3HB LEU 55 -12.380 -2.335 -12.684 427 HG LEU 55 HG LEU 55 -12.493 -1.378 -9.797 428 HD11 LEU 55 1HD1 LEU 55 -14.517 -2.752 -9.623 429 HD12 LEU 55 2HD1 LEU 55 -14.397 -3.178 -11.333 430 HD13 LEU 55 3HD1 LEU 55 -14.698 -1.505 -10.855 431 HD21 LEU 55 1HD2 LEU 55 -10.819 -3.153 -9.986 432 HD22 LEU 55 2HD2 LEU 55 -11.973 -4.190 -10.827 433 HD23 LEU 55 3HD2 LEU 55 -12.248 -3.745 -9.141 434 H ASP 56 H ASP 56 -10.512 0.940 -13.317 435 HA ASP 56 HA ASP 56 -10.416 -0.131 -15.991 436 HB2 ASP 56 2HB ASP 56 -11.608 2.018 -15.397 437 HB3 ASP 56 3HB ASP 56 -10.043 2.782 -15.163 438 H TYR 57 H TYR 57 -8.056 1.212 -13.740 439 HA TYR 57 HA TYR 57 -5.873 1.271 -15.628 440 HB2 TYR 57 2HB TYR 57 -5.784 2.727 -13.635 441 HB3 TYR 57 3HB TYR 57 -5.814 1.323 -12.570 442 HD1 TYR 57 HD1 TYR 57 -3.761 0.003 -12.182 443 HD2 TYR 57 HD2 TYR 57 -3.732 3.217 -15.004 444 HE1 TYR 57 HE1 TYR 57 -1.319 -0.181 -12.353 445 HE2 TYR 57 HE2 TYR 57 -1.291 3.038 -15.162 446 HH TYR 57 HH TYR 57 0.590 2.143 -14.092 447 H CYS 58 H CYS 58 -7.070 -0.980 -13.158 448 HA CYS 58 HA CYS 58 -5.052 -2.945 -13.409 449 HB2 CYS 58 2HB CYS 58 -7.942 -3.201 -12.486 450 HB3 CYS 58 3HB CYS 58 -6.743 -4.488 -12.350 451 HG CYS 58 HG CYS 58 -7.392 -2.136 -10.243 452 H ARG 59 H ARG 59 -8.098 -2.397 -15.170 453 HA ARG 59 HA ARG 59 -7.951 -4.809 -16.721 454 HB2 ARG 59 2HB ARG 59 -9.960 -4.211 -17.688 455 HB3 ARG 59 3HB ARG 59 -10.052 -3.305 -16.193 456 HG2 ARG 59 2HG ARG 59 -9.341 -1.258 -17.466 457 HG3 ARG 59 3HG ARG 59 -9.412 -2.216 -18.945 458 HD2 ARG 59 2HD ARG 59 -11.708 -1.510 -17.088 459 HD3 ARG 59 3HD ARG 59 -11.489 -1.005 -18.767 460 HE ARG 59 HE ARG 59 -11.607 -3.670 -19.028 461 HH11 ARG 59 1HH1 ARG 59 -13.758 -1.451 -17.309 462 HH12 ARG 59 2HH1 ARG 59 -15.152 -2.468 -17.506 463 HH21 ARG 59 1HH2 ARG 59 -13.415 -5.034 -19.201 464 HH22 ARG 59 2HH2 ARG 59 -14.951 -4.508 -18.585 465 H HIS 60 H HIS 60 -6.897 -1.485 -17.185 466 HA HIS 60 HA HIS 60 -5.853 -1.588 -19.787 467 HB2 HIS 60 2HB HIS 60 -5.921 0.560 -18.788 468 HB3 HIS 60 3HB HIS 60 -5.180 0.004 -17.299 469 HD1 HIS 60 HD1 HIS 60 -4.282 1.029 -20.823 470 HD2 HIS 60 HD2 HIS 60 -2.418 0.266 -17.184 471 HE1 HIS 60 HE1 HIS 60 -1.909 1.802 -21.095 472 HE2 HIS 60 HE2 HIS 60 -0.901 1.574 -18.810 473 H HIS 61 H HIS 61 -4.395 -2.452 -16.687 474 HA HIS 61 HA HIS 61 -1.843 -3.225 -17.806 475 HB2 HIS 61 2HB HIS 61 -2.311 -2.216 -15.443 476 HB3 HIS 61 3HB HIS 61 -2.811 -3.838 -14.980 477 HD1 HIS 61 HD1 HIS 61 -0.816 -5.731 -15.500 478 HD2 HIS 61 HD2 HIS 61 0.336 -1.762 -15.045 479 HE1 HIS 61 HE1 HIS 61 1.644 -5.798 -15.018 480 HE2 HIS 61 HE2 HIS 61 2.341 -3.388 -14.914 481 H HIS 62 H HIS 62 -4.890 -4.778 -17.321 482 HA HIS 62 HA HIS 62 -3.854 -7.487 -17.258 483 HB2 HIS 62 2HB HIS 62 -6.051 -6.822 -16.196 484 HB3 HIS 62 3HB HIS 62 -6.721 -6.589 -17.809 485 HD1 HIS 62 HD1 HIS 62 -5.156 -9.302 -15.689 486 HD2 HIS 62 HD2 HIS 62 -7.719 -8.923 -18.937 487 HE1 HIS 62 HE1 HIS 62 -5.892 -11.629 -16.243 488 HE2 HIS 62 HE2 HIS 62 -7.284 -11.397 -18.320 489 H GLN 63 H GLN 63 -5.238 -5.275 -19.642 490 HA GLN 63 HA GLN 63 -5.249 -7.123 -21.847 491 HB2 GLN 63 2HB GLN 63 -5.434 -4.074 -21.815 492 HB3 GLN 63 3HB GLN 63 -5.698 -5.077 -23.235 493 HG2 GLN 63 2HG GLN 63 -7.385 -5.079 -20.720 494 HG3 GLN 63 3HG GLN 63 -7.818 -4.350 -22.262 495 HE21 GLN 63 1HE2 GLN 63 -6.900 -6.529 -23.928 496 HE22 GLN 63 2HE2 GLN 63 -7.979 -7.849 -23.668 497 H HIS 64 H HIS 64 -2.999 -4.791 -20.525 498 HA HIS 64 HA HIS 64 -0.881 -5.779 -22.342 499 HB2 HIS 64 2HB HIS 64 -1.196 -2.956 -21.213 500 HB3 HIS 64 3HB HIS 64 0.234 -3.528 -22.067 501 HD1 HIS 64 HD1 HIS 64 0.258 -2.970 -24.479 502 HD2 HIS 64 HD2 HIS 64 -3.623 -3.140 -23.029 503 HE1 HIS 64 HE1 HIS 64 -1.200 -2.270 -26.390 504 HE2 HIS 64 HE2 HIS 64 -3.536 -2.620 -25.550 505 HA PRO 65 HA PRO 65 0.019 -6.936 -17.900 506 HB2 PRO 65 2HB PRO 65 1.218 -9.377 -19.146 507 HB3 PRO 65 3HB PRO 65 -0.023 -9.249 -17.877 508 HG2 PRO 65 2HG PRO 65 -0.668 -10.065 -20.341 509 HG3 PRO 65 3HG PRO 65 -1.770 -9.029 -19.401 510 HD2 PRO 65 2HD PRO 65 0.149 -8.223 -21.603 511 HD3 PRO 65 3HD PRO 65 -1.558 -7.766 -21.369 512 H GLY 66 H GLY 66 2.271 -8.015 -20.487 513 HA2 GLY 66 2HA GLY 66 4.495 -7.726 -20.849 514 HA3 GLY 66 3HA GLY 66 4.344 -6.181 -20.029 515 H GLY 67 H GLY 67 4.642 -6.094 -17.768 516 HA2 GLY 67 2HA GLY 67 5.114 -7.306 -15.666 517 HA3 GLY 67 3HA GLY 67 6.238 -8.302 -16.581 518 H SER 68 H SER 68 8.269 -7.548 -17.023 519 HA SER 68 HA SER 68 9.198 -5.216 -15.562 520 HB2 SER 68 2HB SER 68 11.467 -6.015 -16.384 521 HB3 SER 68 3HB SER 68 10.573 -7.202 -15.438 522 HG SER 68 HG SER 68 11.577 -7.985 -17.421 523 H GLY 69 H GLY 69 7.944 -3.683 -16.788 524 HA2 GLY 69 2HA GLY 69 9.360 -2.652 -19.159 525 HA3 GLY 69 3HA GLY 69 7.635 -2.985 -19.296 526 H LEU 70 H LEU 70 9.508 -1.647 -16.588 527 HA LEU 70 HA LEU 70 7.750 0.574 -16.143 528 HB2 LEU 70 2HB LEU 70 10.587 0.106 -15.135 529 HB3 LEU 70 3HB LEU 70 9.471 1.304 -14.502 530 HG LEU 70 HG LEU 70 9.095 -1.719 -14.330 531 HD11 LEU 70 1HD1 LEU 70 10.893 -0.952 -12.858 532 HD12 LEU 70 2HD1 LEU 70 9.495 -1.459 -11.916 533 HD13 LEU 70 3HD1 LEU 70 9.825 0.260 -12.143 534 HD21 LEU 70 1HD2 LEU 70 6.920 -0.615 -14.480 535 HD22 LEU 70 2HD2 LEU 70 7.358 0.497 -13.184 536 HD23 LEU 70 3HD2 LEU 70 7.176 -1.225 -12.847 537 H ASP 71 H ASP 71 10.438 0.052 -18.204 538 HA ASP 71 HA ASP 71 11.213 2.761 -18.763 539 HB2 ASP 71 2HB ASP 71 12.408 1.739 -20.734 540 HB3 ASP 71 3HB ASP 71 12.794 0.954 -19.205 541 H ASP 72 H ASP 72 8.620 0.709 -19.830 542 HA ASP 72 HA ASP 72 7.853 2.593 -21.988 543 HB2 ASP 72 2HB ASP 72 8.224 0.189 -22.651 544 HB3 ASP 72 3HB ASP 72 6.940 -0.298 -21.551 545 H ILE 73 H ILE 73 6.780 4.124 -20.724 546 HA ILE 73 HA ILE 73 4.482 3.244 -19.080 547 HB ILE 73 HB ILE 73 5.834 5.985 -19.182 548 HG12 ILE 73 2HG1 ILE 73 7.241 4.251 -18.073 549 HG13 ILE 73 3HG1 ILE 73 6.702 5.470 -16.926 550 HG21 ILE 73 1HG2 ILE 73 4.402 6.569 -17.239 551 HG22 ILE 73 2HG2 ILE 73 3.574 5.019 -17.378 552 HG23 ILE 73 3HG2 ILE 73 3.437 6.210 -18.671 553 HD11 ILE 73 1HD1 ILE 73 5.556 2.688 -17.240 554 HD12 ILE 73 2HD1 ILE 73 4.993 3.901 -16.089 555 HD13 ILE 73 3HD1 ILE 73 6.623 3.245 -15.952 556 HA PRO 74 HA PRO 74 1.954 4.694 -22.669 557 HB2 PRO 74 2HB PRO 74 -0.230 3.758 -20.811 558 HB3 PRO 74 3HB PRO 74 0.042 3.360 -22.522 559 HG2 PRO 74 2HG PRO 74 0.538 1.558 -20.622 560 HG3 PRO 74 3HG PRO 74 1.608 1.703 -22.038 561 HD2 PRO 74 2HD PRO 74 2.032 2.736 -19.238 562 HD3 PRO 74 3HD PRO 74 3.186 1.945 -20.341 563 HA PRO 75 HA PRO 75 1.126 8.810 -20.992 564 HB2 PRO 75 2HB PRO 75 -1.052 9.472 -22.698 565 HB3 PRO 75 3HB PRO 75 0.668 9.737 -23.041 566 HG2 PRO 75 2HG PRO 75 -1.091 7.489 -23.935 567 HG3 PRO 75 3HG PRO 75 0.208 8.330 -24.813 568 HD2 PRO 75 2HD PRO 75 0.619 5.900 -23.777 569 HD3 PRO 75 3HD PRO 75 1.900 7.130 -23.734 570 H TYR 76 H TYR 76 -1.566 6.519 -21.406 571 HA TYR 76 HA TYR 76 -3.584 7.681 -19.902 572 HB2 TYR 76 2HB TYR 76 -4.120 5.669 -21.091 573 HB3 TYR 76 3HB TYR 76 -2.838 4.752 -20.304 574 HD1 TYR 76 HD1 TYR 76 -3.303 3.522 -18.289 575 HD2 TYR 76 HD2 TYR 76 -6.161 6.387 -19.666 576 HE1 TYR 76 HE1 TYR 76 -4.867 2.791 -16.553 577 HE2 TYR 76 HE2 TYR 76 -7.729 5.644 -17.923 578 HH TYR 76 HH TYR 76 -8.091 3.544 -16.514 579 H ASP 77 H ASP 77 -0.803 5.827 -18.745 580 HA ASP 77 HA ASP 77 -1.581 5.469 -16.046 581 HB2 ASP 77 2HB ASP 77 1.213 5.565 -17.281 582 HB3 ASP 77 3HB ASP 77 0.851 4.978 -15.659 583 H ARG 78 H ARG 78 0.197 8.024 -17.701 584 HA ARG 78 HA ARG 78 0.778 9.600 -15.351 585 HB2 ARG 78 2HB ARG 78 0.836 10.392 -18.301 586 HB3 ARG 78 3HB ARG 78 1.527 11.332 -16.980 587 HG2 ARG 78 2HG ARG 78 2.421 8.592 -17.891 588 HG3 ARG 78 3HG ARG 78 3.277 10.111 -18.163 589 HD2 ARG 78 2HD ARG 78 3.540 10.355 -15.681 590 HD3 ARG 78 3HD ARG 78 2.773 8.779 -15.470 591 HE ARG 78 HE ARG 78 5.090 8.753 -17.191 592 HH11 ARG 78 1HH1 ARG 78 3.995 8.413 -13.856 593 HH12 ARG 78 2HH1 ARG 78 5.409 7.536 -13.364 594 HH21 ARG 78 1HH2 ARG 78 6.939 7.633 -16.510 595 HH22 ARG 78 2HH2 ARG 78 7.069 7.097 -14.862 596 H ASP 79 H ASP 79 -1.763 9.524 -17.814 597 HA ASP 79 HA ASP 79 -3.095 11.908 -16.980 598 HB2 ASP 79 2HB ASP 79 -4.007 9.578 -18.708 599 HB3 ASP 79 3HB ASP 79 -5.111 10.883 -18.280 600 H PHE 80 H PHE 80 -3.123 8.621 -15.916 601 HA PHE 80 HA PHE 80 -5.562 8.521 -14.474 602 HB2 PHE 80 2HB PHE 80 -4.256 6.487 -15.107 603 HB3 PHE 80 3HB PHE 80 -2.961 6.965 -14.016 604 HD1 PHE 80 HD1 PHE 80 -3.110 6.485 -11.632 605 HD2 PHE 80 HD2 PHE 80 -6.489 5.819 -14.174 606 HE1 PHE 80 HE1 PHE 80 -4.273 5.324 -9.796 607 HE2 PHE 80 HE2 PHE 80 -7.627 4.669 -12.337 608 HZ PHE 80 HZ PHE 80 -6.537 4.423 -10.148 609 H CYS 81 H CYS 81 -2.293 9.472 -13.672 610 HA CYS 81 HA CYS 81 -2.625 9.968 -10.899 611 HB2 CYS 81 2HB CYS 81 -0.552 11.001 -12.874 612 HB3 CYS 81 3HB CYS 81 -0.399 11.040 -11.118 613 HG CYS 81 HG CYS 81 -0.363 8.271 -10.817 614 H LYS 82 H LYS 82 -3.449 11.821 -13.729 615 HA LYS 82 HA LYS 82 -3.490 14.434 -12.493 616 HB2 LYS 82 2HB LYS 82 -4.818 13.475 -15.067 617 HB3 LYS 82 3HB LYS 82 -4.647 15.157 -14.573 618 HG2 LYS 82 2HG LYS 82 -2.204 14.985 -14.748 619 HG3 LYS 82 3HG LYS 82 -2.346 13.276 -15.175 620 HD2 LYS 82 2HD LYS 82 -3.653 13.935 -17.211 621 HD3 LYS 82 3HD LYS 82 -3.377 15.631 -16.803 622 HE2 LYS 82 2HE LYS 82 -0.960 15.331 -17.087 623 HE3 LYS 82 3HE LYS 82 -1.193 13.604 -17.396 624 HZ1 LYS 82 1HZ LYS 82 -2.228 15.829 -19.076 625 HZ2 LYS 82 2HZ LYS 82 -2.486 14.183 -19.370 626 HZ3 LYS 82 3HZ LYS 82 -0.923 14.824 -19.452 627 H VAL 83 H VAL 83 -4.687 13.945 -10.614 628 HA VAL 83 HA VAL 83 -7.628 13.986 -10.909 629 HB VAL 83 HB VAL 83 -7.789 12.515 -8.829 630 HG11 VAL 83 1HG1 VAL 83 -6.544 11.169 -11.253 631 HG12 VAL 83 2HG1 VAL 83 -8.252 11.551 -11.040 632 HG13 VAL 83 3HG1 VAL 83 -7.479 10.363 -9.990 633 HG21 VAL 83 1HG2 VAL 83 -4.847 11.949 -9.385 634 HG22 VAL 83 2HG2 VAL 83 -5.853 11.087 -8.218 635 HG23 VAL 83 3HG2 VAL 83 -5.497 12.796 -7.978 636 H ASP 84 H ASP 84 -8.652 14.731 -8.811 637 HA ASP 84 HA ASP 84 -7.399 17.146 -7.902 638 HB2 ASP 84 2HB ASP 84 -9.914 16.751 -8.180 639 HB3 ASP 84 3HB ASP 84 -9.853 15.786 -6.709 640 H GLN 85 H GLN 85 -7.000 17.609 -5.548 641 HA GLN 85 HA GLN 85 -4.957 15.932 -4.667 642 HB2 GLN 85 2HB GLN 85 -5.067 18.381 -4.234 643 HB3 GLN 85 3HB GLN 85 -6.342 18.114 -3.053 644 HG2 GLN 85 2HG GLN 85 -4.175 18.470 -1.958 645 HG3 GLN 85 3HG GLN 85 -4.790 16.853 -1.635 646 HE21 GLN 85 1HE2 GLN 85 -2.676 16.202 -1.081 647 HE22 GLN 85 2HE2 GLN 85 -1.489 15.871 -2.282 648 HA PRO 86 HA PRO 86 -7.814 14.134 -1.101 649 HB2 PRO 86 2HB PRO 86 -10.548 14.245 -1.504 650 HB3 PRO 86 3HB PRO 86 -9.649 15.446 -0.555 651 HG2 PRO 86 2HG PRO 86 -10.525 15.609 -3.426 652 HG3 PRO 86 3HG PRO 86 -10.658 16.836 -2.143 653 HD2 PRO 86 2HD PRO 86 -8.695 16.960 -3.970 654 HD3 PRO 86 3HD PRO 86 -8.389 17.406 -2.272 655 H THR 87 H THR 87 -9.071 14.133 -4.436 656 HA THR 87 HA THR 87 -10.078 11.522 -4.611 657 HB THR 87 HB THR 87 -8.856 13.214 -6.840 658 HG1 THR 87 HG1 THR 87 -11.458 13.212 -5.680 659 HG21 THR 87 1HG2 THR 87 -10.971 11.035 -7.016 660 HG22 THR 87 2HG2 THR 87 -9.307 10.899 -7.585 661 HG23 THR 87 3HG2 THR 87 -10.407 12.042 -8.353 662 H LEU 88 H LEU 88 -6.820 12.778 -4.981 663 HA LEU 88 HA LEU 88 -5.524 10.536 -6.119 664 HB2 LEU 88 2HB LEU 88 -4.749 13.017 -5.840 665 HB3 LEU 88 3HB LEU 88 -4.200 12.544 -4.245 666 HG LEU 88 HG LEU 88 -3.202 11.239 -6.816 667 HD11 LEU 88 1HD1 LEU 88 -2.610 13.599 -6.872 668 HD12 LEU 88 2HD1 LEU 88 -1.174 12.617 -6.599 669 HD13 LEU 88 3HD1 LEU 88 -1.907 13.495 -5.254 670 HD21 LEU 88 1HD2 LEU 88 -2.873 9.828 -4.845 671 HD22 LEU 88 2HD2 LEU 88 -2.058 11.149 -4.005 672 HD23 LEU 88 3HD2 LEU 88 -1.328 10.429 -5.443 673 H PHE 89 H PHE 89 -5.907 11.623 -2.743 674 HA PHE 89 HA PHE 89 -4.613 9.400 -1.535 675 HB2 PHE 89 2HB PHE 89 -6.576 11.408 -0.361 676 HB3 PHE 89 3HB PHE 89 -5.668 10.234 0.591 677 HD1 PHE 89 HD1 PHE 89 -2.989 10.248 -0.122 678 HD2 PHE 89 HD2 PHE 89 -5.664 13.582 -0.287 679 HE1 PHE 89 HE1 PHE 89 -1.085 11.789 0.026 680 HE2 PHE 89 HE2 PHE 89 -3.748 15.115 -0.133 681 HZ PHE 89 HZ PHE 89 -1.455 14.222 0.017 682 H GLU 90 H GLU 90 -7.931 9.970 -2.546 683 HA GLU 90 HA GLU 90 -9.177 7.743 -1.330 684 HB2 GLU 90 2HB GLU 90 -9.808 9.204 -3.920 685 HB3 GLU 90 3HB GLU 90 -10.838 7.944 -3.259 686 HG2 GLU 90 2HG GLU 90 -10.155 10.523 -1.837 687 HG3 GLU 90 3HG GLU 90 -11.620 10.254 -2.772 688 H LEU 91 H LEU 91 -7.420 8.077 -4.402 689 HA LEU 91 HA LEU 91 -7.766 5.436 -5.375 690 HB2 LEU 91 2HB LEU 91 -5.500 7.408 -5.859 691 HB3 LEU 91 3HB LEU 91 -5.710 5.916 -6.755 692 HG LEU 91 HG LEU 91 -7.667 8.253 -6.790 693 HD11 LEU 91 1HD1 LEU 91 -6.862 8.681 -9.078 694 HD12 LEU 91 2HD1 LEU 91 -5.673 7.385 -8.917 695 HD13 LEU 91 3HD1 LEU 91 -5.550 8.828 -7.909 696 HD21 LEU 91 1HD2 LEU 91 -7.655 5.705 -8.444 697 HD22 LEU 91 2HD2 LEU 91 -8.770 7.062 -8.639 698 HD23 LEU 91 3HD2 LEU 91 -8.800 6.106 -7.160 699 H ILE 92 H ILE 92 -5.358 6.890 -3.200 700 HA ILE 92 HA ILE 92 -3.641 4.645 -2.882 701 HB ILE 92 HB ILE 92 -4.169 6.961 -0.946 702 HG12 ILE 92 2HG1 ILE 92 -1.965 6.593 -3.034 703 HG13 ILE 92 3HG1 ILE 92 -3.302 7.729 -3.134 704 HG21 ILE 92 1HG2 ILE 92 -3.161 5.061 0.264 705 HG22 ILE 92 2HG2 ILE 92 -2.011 6.389 0.131 706 HG23 ILE 92 3HG2 ILE 92 -1.855 4.981 -0.920 707 HD11 ILE 92 1HD1 ILE 92 -1.042 7.813 -1.139 708 HD12 ILE 92 2HD1 ILE 92 -2.404 8.932 -1.192 709 HD13 ILE 92 3HD1 ILE 92 -1.267 8.865 -2.536 710 H LEU 93 H LEU 93 -6.498 5.770 -1.075 711 HA LEU 93 HA LEU 93 -6.454 3.844 1.012 712 HB2 LEU 93 2HB LEU 93 -8.708 5.579 -0.070 713 HB3 LEU 93 3HB LEU 93 -8.870 4.580 1.365 714 HG LEU 93 HG LEU 93 -6.906 6.894 1.077 715 HD11 LEU 93 1HD1 LEU 93 -8.363 8.134 2.610 716 HD12 LEU 93 2HD1 LEU 93 -9.515 6.797 2.626 717 HD13 LEU 93 3HD1 LEU 93 -9.226 7.696 1.136 718 HD21 LEU 93 1HD2 LEU 93 -6.527 6.633 3.498 719 HD22 LEU 93 2HD2 LEU 93 -6.064 5.180 2.617 720 HD23 LEU 93 3HD2 LEU 93 -7.580 5.216 3.520 721 H ALA 94 H ALA 94 -8.071 3.948 -2.136 722 HA ALA 94 HA ALA 94 -9.603 1.539 -1.829 723 HB1 ALA 94 1HB ALA 94 -10.056 1.783 -4.240 724 HB2 ALA 94 2HB ALA 94 -8.822 3.043 -4.356 725 HB3 ALA 94 3HB ALA 94 -10.272 3.315 -3.392 726 H ALA 95 H ALA 95 -6.427 2.346 -3.128 727 HA ALA 95 HA ALA 95 -5.866 -0.207 -4.315 728 HB1 ALA 95 1HB ALA 95 -4.803 1.912 -5.027 729 HB2 ALA 95 2HB ALA 95 -3.639 0.642 -4.671 730 HB3 ALA 95 3HB ALA 95 -3.903 1.953 -3.514 731 H ASN 96 H ASN 96 -5.356 1.203 -1.113 732 HA ASN 96 HA ASN 96 -3.758 -0.983 -0.081 733 HB2 ASN 96 2HB ASN 96 -3.570 1.286 0.887 734 HB3 ASN 96 3HB ASN 96 -5.266 1.266 1.351 735 HD21 ASN 96 1HD2 ASN 96 -4.711 1.639 3.538 736 HD22 ASN 96 2HD2 ASN 96 -4.041 0.411 4.544 737 H TYR 97 H TYR 97 -7.166 -0.036 -0.036 738 HA TYR 97 HA TYR 97 -8.212 -2.044 1.656 739 HB2 TYR 97 2HB TYR 97 -9.565 -0.103 1.206 740 HB3 TYR 97 3HB TYR 97 -9.477 -0.346 -0.533 741 HD1 TYR 97 HD1 TYR 97 -11.535 -1.000 -1.480 742 HD2 TYR 97 HD2 TYR 97 -10.591 -2.407 2.449 743 HE1 TYR 97 HE1 TYR 97 -13.668 -2.219 -1.406 744 HE2 TYR 97 HE2 TYR 97 -12.726 -3.624 2.517 745 HH TYR 97 HH TYR 97 -14.957 -3.526 1.435 746 H LEU 98 H LEU 98 -7.703 -1.944 -1.851 747 HA LEU 98 HA LEU 98 -8.668 -4.692 -2.209 748 HB2 LEU 98 2HB LEU 98 -7.782 -2.601 -4.230 749 HB3 LEU 98 3HB LEU 98 -8.397 -4.191 -4.641 750 HG LEU 98 HG LEU 98 -9.959 -1.946 -3.305 751 HD11 LEU 98 1HD1 LEU 98 -11.332 -1.951 -5.355 752 HD12 LEU 98 2HD1 LEU 98 -10.276 -3.177 -6.064 753 HD13 LEU 98 3HD1 LEU 98 -9.644 -1.570 -5.697 754 HD21 LEU 98 1HD2 LEU 98 -10.691 -4.052 -2.347 755 HD22 LEU 98 2HD2 LEU 98 -10.885 -4.757 -3.951 756 HD23 LEU 98 3HD2 LEU 98 -11.933 -3.435 -3.434 757 H ASP 99 H ASP 99 -5.814 -3.095 -1.553 758 HA ASP 99 HA ASP 99 -3.639 -3.588 -1.417 759 HB2 ASP 99 2HB ASP 99 -4.658 -5.483 -0.085 760 HB3 ASP 99 3HB ASP 99 -4.540 -6.500 -1.519 761 H ILE 100 H ILE 100 -4.599 -3.064 -4.022 762 HA ILE 100 HA ILE 100 -3.290 -4.832 -5.925 763 HB ILE 100 HB ILE 100 -4.531 -2.081 -6.433 764 HG12 ILE 100 2HG1 ILE 100 -5.778 -4.843 -6.705 765 HG13 ILE 100 3HG1 ILE 100 -6.189 -3.658 -5.479 766 HG21 ILE 100 1HG2 ILE 100 -4.639 -2.810 -8.800 767 HG22 ILE 100 2HG2 ILE 100 -3.851 -4.330 -8.375 768 HG23 ILE 100 3HG2 ILE 100 -2.974 -2.808 -8.214 769 HD11 ILE 100 1HD1 ILE 100 -7.870 -3.720 -7.170 770 HD12 ILE 100 2HD1 ILE 100 -6.685 -3.424 -8.440 771 HD13 ILE 100 3HD1 ILE 100 -7.035 -2.170 -7.245 772 H LYS 101 H LYS 101 -1.118 -4.790 -5.891 773 HA LYS 101 HA LYS 101 0.505 -2.717 -4.928 774 HB2 LYS 101 2HB LYS 101 1.217 -5.148 -6.612 775 HB3 LYS 101 3HB LYS 101 2.430 -4.003 -6.057 776 HG2 LYS 101 2HG LYS 101 2.516 -5.801 -4.523 777 HG3 LYS 101 3HG LYS 101 1.655 -4.514 -3.682 778 HD2 LYS 101 2HD LYS 101 -0.509 -5.656 -4.262 779 HD3 LYS 101 3HD LYS 101 0.421 -6.981 -4.972 780 HE2 LYS 101 2HE LYS 101 -0.307 -7.541 -2.686 781 HE3 LYS 101 3HE LYS 101 1.455 -7.423 -2.756 782 HZ1 LYS 101 1HZ LYS 101 -0.393 -5.314 -1.781 783 HZ2 LYS 101 2HZ LYS 101 1.294 -5.187 -1.837 784 HZ3 LYS 101 3HZ LYS 101 0.565 -6.309 -0.812 785 HA PRO 102 HA PRO 102 1.546 -1.547 -9.667 786 HB2 PRO 102 2HB PRO 102 -0.649 -1.903 -11.406 787 HB3 PRO 102 3HB PRO 102 0.772 -2.961 -11.323 788 HG2 PRO 102 2HG PRO 102 -1.912 -3.321 -10.043 789 HG3 PRO 102 3HG PRO 102 -0.869 -4.525 -10.832 790 HD2 PRO 102 2HD PRO 102 -1.007 -4.377 -8.159 791 HD3 PRO 102 3HD PRO 102 0.542 -4.716 -8.969 792 H LEU 103 H LEU 103 -1.842 -1.280 -8.500 793 HA LEU 103 HA LEU 103 -2.308 1.365 -9.518 794 HB2 LEU 103 2HB LEU 103 -4.011 -0.498 -8.685 795 HB3 LEU 103 3HB LEU 103 -3.769 0.205 -7.101 796 HG LEU 103 HG LEU 103 -5.840 1.034 -8.135 797 HD11 LEU 103 1HD1 LEU 103 -5.580 3.473 -7.974 798 HD12 LEU 103 2HD1 LEU 103 -3.822 3.295 -7.983 799 HD13 LEU 103 3HD1 LEU 103 -4.769 2.642 -6.652 800 HD21 LEU 103 1HD2 LEU 103 -5.190 0.743 -10.481 801 HD22 LEU 103 2HD2 LEU 103 -4.141 2.159 -10.370 802 HD23 LEU 103 3HD2 LEU 103 -5.885 2.332 -10.179 803 H LEU 104 H LEU 104 -1.502 0.041 -6.333 804 HA LEU 104 HA LEU 104 -1.587 2.408 -4.841 805 HB2 LEU 104 2HB LEU 104 -1.744 0.119 -3.898 806 HB3 LEU 104 3HB LEU 104 -0.053 -0.159 -4.280 807 HG LEU 104 HG LEU 104 0.604 1.587 -2.629 808 HD11 LEU 104 1HD1 LEU 104 -1.052 2.550 -1.077 809 HD12 LEU 104 2HD1 LEU 104 -2.362 1.800 -1.992 810 HD13 LEU 104 3HD1 LEU 104 -1.363 3.050 -2.738 811 HD21 LEU 104 1HD2 LEU 104 0.453 -0.772 -1.932 812 HD22 LEU 104 2HD2 LEU 104 -1.235 -0.539 -1.466 813 HD23 LEU 104 3HD2 LEU 104 0.050 0.315 -0.607 814 H ASP 105 H ASP 105 1.095 0.741 -6.441 815 HA ASP 105 HA ASP 105 3.190 2.297 -5.339 816 HB2 ASP 105 2HB ASP 105 3.492 0.002 -6.313 817 HB3 ASP 105 3HB ASP 105 3.251 0.673 -7.928 818 H VAL 106 H VAL 106 1.562 2.388 -8.518 819 HA VAL 106 HA VAL 106 2.952 4.535 -9.665 820 HB VAL 106 HB VAL 106 0.139 3.455 -10.134 821 HG11 VAL 106 1HG1 VAL 106 0.060 5.819 -10.812 822 HG12 VAL 106 2HG1 VAL 106 -0.010 4.761 -12.219 823 HG13 VAL 106 3HG1 VAL 106 1.493 5.599 -11.820 824 HG21 VAL 106 1HG2 VAL 106 1.131 2.536 -12.205 825 HG22 VAL 106 2HG2 VAL 106 1.992 1.974 -10.775 826 HG23 VAL 106 3HG2 VAL 106 2.692 3.244 -11.780 827 H THR 107 H THR 107 0.015 4.541 -7.650 828 HA THR 107 HA THR 107 -0.463 7.362 -7.834 829 HB THR 107 HB THR 107 -1.608 5.358 -5.835 830 HG1 THR 107 HG1 THR 107 -2.517 4.573 -7.585 831 HG21 THR 107 1HG2 THR 107 -3.540 6.887 -5.734 832 HG22 THR 107 2HG2 THR 107 -2.735 8.004 -6.834 833 HG23 THR 107 3HG2 THR 107 -2.075 7.723 -5.222 834 H CYS 108 H CYS 108 1.300 5.316 -5.543 835 HA CYS 108 HA CYS 108 1.772 7.380 -3.576 836 HB2 CYS 108 2HB CYS 108 3.107 4.675 -4.005 837 HB3 CYS 108 3HB CYS 108 3.462 5.746 -2.646 838 HG CYS 108 HG CYS 108 0.277 4.671 -3.218 839 H LYS 109 H LYS 109 3.364 6.231 -6.478 840 HA LYS 109 HA LYS 109 5.782 7.761 -6.134 841 HB2 LYS 109 2HB LYS 109 4.689 5.978 -8.293 842 HB3 LYS 109 3HB LYS 109 5.826 7.219 -8.811 843 HG2 LYS 109 2HG LYS 109 6.903 5.012 -8.335 844 HG3 LYS 109 3HG LYS 109 7.570 6.335 -7.380 845 HD2 LYS 109 2HD LYS 109 6.171 5.598 -5.445 846 HD3 LYS 109 3HD LYS 109 5.582 4.243 -6.409 847 HE2 LYS 109 2HE LYS 109 8.478 4.716 -5.632 848 HE3 LYS 109 3HE LYS 109 7.381 3.579 -4.851 849 HZ1 LYS 109 1HZ LYS 109 8.834 2.504 -6.459 850 HZ2 LYS 109 2HZ LYS 109 8.200 3.461 -7.697 851 HZ3 LYS 109 3HZ LYS 109 7.205 2.352 -6.896 852 H THR 110 H THR 110 2.608 8.339 -7.519 853 HA THR 110 HA THR 110 3.046 10.661 -9.005 854 HB THR 110 HB THR 110 0.627 9.958 -7.279 855 HG1 THR 110 HG1 THR 110 1.585 8.782 -9.434 856 HG21 THR 110 1HG2 THR 110 0.825 11.908 -9.612 857 HG22 THR 110 2HG2 THR 110 0.581 12.349 -7.919 858 HG23 THR 110 3HG2 THR 110 -0.662 11.443 -8.781 859 H VAL 111 H VAL 111 2.150 10.402 -5.512 860 HA VAL 111 HA VAL 111 2.478 13.185 -4.962 861 HB VAL 111 HB VAL 111 2.511 12.531 -2.510 862 HG11 VAL 111 1HG1 VAL 111 0.406 13.092 -3.620 863 HG12 VAL 111 2HG1 VAL 111 0.154 11.823 -2.422 864 HG13 VAL 111 3HG1 VAL 111 0.204 11.419 -4.140 865 HG21 VAL 111 1HG2 VAL 111 1.969 10.196 -1.889 866 HG22 VAL 111 2HG2 VAL 111 3.538 10.305 -2.688 867 HG23 VAL 111 3HG2 VAL 111 2.138 9.702 -3.578 868 H ALA 112 H ALA 112 4.668 10.420 -4.811 869 HA ALA 112 HA ALA 112 6.831 11.585 -3.443 870 HB1 ALA 112 1HB ALA 112 6.622 9.169 -3.865 871 HB2 ALA 112 2HB ALA 112 8.185 9.779 -4.407 872 HB3 ALA 112 3HB ALA 112 6.912 9.436 -5.584 873 H ASN 113 H ASN 113 5.907 11.681 -6.850 874 HA ASN 113 HA ASN 113 8.299 12.928 -7.837 875 HB2 ASN 113 2HB ASN 113 5.511 12.653 -9.058 876 HB3 ASN 113 3HB ASN 113 6.876 13.374 -9.908 877 HD21 ASN 113 1HD2 ASN 113 5.301 10.979 -10.566 878 HD22 ASN 113 2HD2 ASN 113 6.439 9.680 -10.674 879 H MET 114 H MET 114 5.094 14.100 -6.818 880 HA MET 114 HA MET 114 5.357 16.774 -7.716 881 HB2 MET 114 2HB MET 114 3.559 15.633 -5.537 882 HB3 MET 114 3HB MET 114 3.434 17.272 -6.159 883 HG2 MET 114 2HG MET 114 3.013 16.258 -8.444 884 HG3 MET 114 3HG MET 114 2.876 14.701 -7.632 885 HE1 MET 114 1HE MET 114 1.427 15.697 -4.817 886 HE2 MET 114 2HE MET 114 0.974 14.226 -5.681 887 HE3 MET 114 3HE MET 114 -0.260 15.407 -5.254 888 H ILE 115 H ILE 115 6.165 15.232 -4.643 889 HA ILE 115 HA ILE 115 6.867 17.733 -3.321 890 HB ILE 115 HB ILE 115 7.518 16.307 -1.390 891 HG12 ILE 115 2HG1 ILE 115 6.811 13.972 -3.231 892 HG13 ILE 115 3HG1 ILE 115 8.409 14.353 -2.612 893 HG21 ILE 115 1HG2 ILE 115 4.813 15.572 -2.559 894 HG22 ILE 115 2HG2 ILE 115 5.180 17.041 -1.655 895 HG23 ILE 115 3HG2 ILE 115 5.267 15.472 -0.855 896 HD11 ILE 115 1HD1 ILE 115 6.061 13.504 -0.939 897 HD12 ILE 115 2HD1 ILE 115 7.708 13.797 -0.381 898 HD13 ILE 115 3HD1 ILE 115 7.378 12.466 -1.481 899 H ARG 116 H ARG 116 8.521 15.150 -5.046 900 HA ARG 116 HA ARG 116 11.179 15.968 -4.226 901 HB2 ARG 116 2HB ARG 116 10.655 13.594 -4.838 902 HB3 ARG 116 3HB ARG 116 10.351 14.103 -6.490 903 HG2 ARG 116 2HG ARG 116 12.952 15.080 -5.958 904 HG3 ARG 116 3HG ARG 116 12.921 13.506 -5.168 905 HD2 ARG 116 2HD ARG 116 13.756 13.268 -7.430 906 HD3 ARG 116 3HD ARG 116 12.170 12.491 -7.329 907 HE ARG 116 HE ARG 116 11.747 15.116 -8.167 908 HH11 ARG 116 1HH1 ARG 116 13.351 12.248 -9.439 909 HH12 ARG 116 2HH1 ARG 116 13.084 12.697 -11.094 910 HH21 ARG 116 1HH2 ARG 116 11.419 15.690 -10.333 911 HH22 ARG 116 2HH2 ARG 116 11.991 14.646 -11.596 912 H GLY 117 H GLY 117 11.396 18.091 -4.794 913 HA2 GLY 117 2HA GLY 117 10.915 19.301 -7.294 914 HA3 GLY 117 3HA GLY 117 12.058 19.861 -6.085 915 H1 SER 2 1H SER 2 18.334 -16.071 15.765 916 H2 SER 2 2H SER 2 17.571 -15.219 14.524 917 H3 SER 2 3H SER 2 17.155 -14.916 16.131 918 HA SER 2 HA SER 2 19.315 -14.053 16.601 919 HB2 SER 2 2HB SER 2 19.890 -14.614 13.656 920 HB3 SER 2 3HB SER 2 20.991 -13.820 14.786 921 HG SER 2 HG SER 2 21.533 -15.988 14.660 922 H LEU 3 H LEU 3 19.971 -11.825 16.082 923 HA LEU 3 HA LEU 3 17.885 -10.115 15.123 924 HB2 LEU 3 2HB LEU 3 20.816 -9.507 15.714 925 HB3 LEU 3 3HB LEU 3 19.592 -8.287 15.393 926 HG LEU 3 HG LEU 3 19.518 -10.196 17.762 927 HD11 LEU 3 1HD1 LEU 3 20.351 -7.279 17.694 928 HD12 LEU 3 2HD1 LEU 3 21.409 -8.660 17.984 929 HD13 LEU 3 3HD1 LEU 3 20.147 -8.266 19.144 930 HD21 LEU 3 1HD2 LEU 3 17.747 -8.706 18.608 931 HD22 LEU 3 2HD2 LEU 3 17.289 -9.462 17.087 932 HD23 LEU 3 3HD2 LEU 3 17.809 -7.774 17.109 933 H VAL 4 H VAL 4 17.395 -9.902 13.011 934 HA VAL 4 HA VAL 4 19.321 -10.351 10.886 935 HB VAL 4 HB VAL 4 17.439 -9.797 9.320 936 HG11 VAL 4 1HG1 VAL 4 16.755 -11.880 11.433 937 HG12 VAL 4 2HG1 VAL 4 17.816 -12.118 10.043 938 HG13 VAL 4 3HG1 VAL 4 16.095 -11.819 9.795 939 HG21 VAL 4 1HG2 VAL 4 15.764 -9.460 11.849 940 HG22 VAL 4 2HG2 VAL 4 15.135 -9.511 10.200 941 HG23 VAL 4 3HG2 VAL 4 16.183 -8.186 10.699 942 H LYS 5 H LYS 5 20.507 -8.866 9.944 943 HA LYS 5 HA LYS 5 20.416 -6.097 10.899 944 HB2 LYS 5 2HB LYS 5 22.554 -7.539 9.283 945 HB3 LYS 5 3HB LYS 5 22.720 -5.979 10.077 946 HG2 LYS 5 2HG LYS 5 22.401 -7.138 12.281 947 HG3 LYS 5 3HG LYS 5 22.393 -8.676 11.427 948 HD2 LYS 5 2HD LYS 5 24.710 -8.204 10.606 949 HD3 LYS 5 3HD LYS 5 24.702 -6.695 11.528 950 HE2 LYS 5 2HE LYS 5 24.357 -8.022 13.616 951 HE3 LYS 5 3HE LYS 5 24.496 -9.501 12.666 952 HZ1 LYS 5 1HZ LYS 5 26.600 -7.431 12.957 953 HZ2 LYS 5 2HZ LYS 5 26.743 -8.860 12.069 954 HZ3 LYS 5 3HZ LYS 5 26.570 -8.925 13.750 955 H LEU 6 H LEU 6 19.289 -4.738 9.676 956 HA LEU 6 HA LEU 6 18.986 -5.191 6.764 957 HB2 LEU 6 2HB LEU 6 17.110 -3.723 8.672 958 HB3 LEU 6 3HB LEU 6 16.819 -4.034 6.968 959 HG LEU 6 HG LEU 6 16.992 -6.163 9.138 960 HD11 LEU 6 1HD1 LEU 6 14.580 -6.474 8.811 961 HD12 LEU 6 2HD1 LEU 6 14.552 -5.135 7.661 962 HD13 LEU 6 3HD1 LEU 6 14.950 -4.838 9.354 963 HD21 LEU 6 1HD2 LEU 6 16.343 -6.483 6.188 964 HD22 LEU 6 2HD2 LEU 6 16.229 -7.754 7.408 965 HD23 LEU 6 3HD2 LEU 6 17.798 -7.055 7.014 966 H GLU 7 H GLU 7 20.615 -3.948 5.918 967 HA GLU 7 HA GLU 7 21.225 -1.296 6.928 968 HB2 GLU 7 2HB GLU 7 22.225 -2.695 4.409 969 HB3 GLU 7 3HB GLU 7 22.803 -1.135 4.995 970 HG2 GLU 7 2HG GLU 7 24.405 -2.783 5.614 971 HG3 GLU 7 3HG GLU 7 23.576 -2.263 7.080 972 H SER 8 H SER 8 20.244 0.512 6.308 973 HA SER 8 HA SER 8 18.269 0.689 4.252 974 HB2 SER 8 2HB SER 8 18.450 3.164 4.824 975 HB3 SER 8 3HB SER 8 18.158 2.109 6.208 976 HG SER 8 HG SER 8 20.044 2.602 6.998 977 H SER 9 H SER 9 18.542 2.609 2.573 978 HA SER 9 HA SER 9 20.755 2.249 0.821 979 HB2 SER 9 2HB SER 9 19.826 4.306 -0.329 980 HB3 SER 9 3HB SER 9 18.617 3.054 -0.051 981 HG SER 9 HG SER 9 17.594 4.755 0.738 982 H ASP 10 H ASP 10 20.265 4.186 3.650 983 HA ASP 10 HA ASP 10 22.624 5.880 3.273 984 HB2 ASP 10 2HB ASP 10 20.475 6.709 4.299 985 HB3 ASP 10 3HB ASP 10 20.735 5.610 5.647 986 H GLU 11 H GLU 11 22.254 2.732 3.978 987 HA GLU 11 HA GLU 11 23.737 1.120 4.457 988 HB2 GLU 11 2HB GLU 11 25.710 3.394 4.919 989 HB3 GLU 11 3HB GLU 11 26.150 1.693 4.790 990 HG2 GLU 11 2HG GLU 11 25.347 1.636 2.464 991 HG3 GLU 11 3HG GLU 11 24.838 3.319 2.584 992 H LYS 12 H LYS 12 22.281 2.804 6.708 993 HA LYS 12 HA LYS 12 23.812 2.190 9.086 994 HB2 LYS 12 2HB LYS 12 20.932 3.122 8.730 995 HB3 LYS 12 3HB LYS 12 21.714 2.931 10.293 996 HG2 LYS 12 2HG LYS 12 22.620 4.834 8.115 997 HG3 LYS 12 3HG LYS 12 21.665 5.281 9.532 998 HD2 LYS 12 2HD LYS 12 23.534 4.556 11.005 999 HD3 LYS 12 3HD LYS 12 24.490 4.146 9.577 1000 HE2 LYS 12 2HE LYS 12 23.474 6.919 10.279 1001 HE3 LYS 12 3HE LYS 12 25.120 6.342 10.508 1002 HZ1 LYS 12 1HZ LYS 12 24.865 7.654 8.488 1003 HZ2 LYS 12 2HZ LYS 12 23.751 6.541 7.890 1004 HZ3 LYS 12 3HZ LYS 12 25.350 6.076 8.150 1005 H VAL 13 H VAL 13 23.857 0.321 10.126 1006 HA VAL 13 HA VAL 13 22.417 -1.997 9.164 1007 HB VAL 13 HB VAL 13 24.432 -1.739 11.458 1008 HG11 VAL 13 1HG1 VAL 13 24.772 -4.178 11.214 1009 HG12 VAL 13 2HG1 VAL 13 23.492 -4.238 10.000 1010 HG13 VAL 13 3HG1 VAL 13 23.109 -3.792 11.663 1011 HG21 VAL 13 1HG2 VAL 13 24.943 -2.529 8.561 1012 HG22 VAL 13 2HG2 VAL 13 26.145 -2.526 9.857 1013 HG23 VAL 13 3HG2 VAL 13 25.419 -1.008 9.324 1014 H PHE 14 H PHE 14 20.279 -2.007 9.821 1015 HA PHE 14 HA PHE 14 19.556 -1.381 12.601 1016 HB2 PHE 14 2HB PHE 14 17.818 -1.953 10.158 1017 HB3 PHE 14 3HB PHE 14 17.190 -1.590 11.767 1018 HD1 PHE 14 HD1 PHE 14 18.030 0.650 12.860 1019 HD2 PHE 14 HD2 PHE 14 18.189 -0.142 8.659 1020 HE1 PHE 14 HE1 PHE 14 18.189 3.057 12.407 1021 HE2 PHE 14 HE2 PHE 14 18.342 2.271 8.221 1022 HZ PHE 14 HZ PHE 14 18.349 3.867 10.092 1023 H GLU 15 H GLU 15 20.496 -3.121 13.618 1024 HA GLU 15 HA GLU 15 19.810 -5.865 13.112 1025 HB2 GLU 15 2HB GLU 15 20.863 -4.641 15.708 1026 HB3 GLU 15 3HB GLU 15 20.925 -6.336 15.234 1027 HG2 GLU 15 2HG GLU 15 22.462 -5.745 13.373 1028 HG3 GLU 15 3HG GLU 15 22.400 -4.067 13.891 1029 H ILE 16 H ILE 16 17.771 -6.578 13.398 1030 HA ILE 16 HA ILE 16 16.208 -5.755 15.753 1031 HB ILE 16 HB ILE 16 15.579 -4.238 13.862 1032 HG12 ILE 16 2HG1 ILE 16 13.327 -6.163 14.593 1033 HG13 ILE 16 3HG1 ILE 16 13.909 -4.874 15.634 1034 HG21 ILE 16 1HG2 ILE 16 14.397 -5.089 11.872 1035 HG22 ILE 16 2HG2 ILE 16 14.628 -6.747 12.429 1036 HG23 ILE 16 3HG2 ILE 16 16.024 -5.769 11.972 1037 HD11 ILE 16 1HD1 ILE 16 13.202 -3.228 13.944 1038 HD12 ILE 16 2HD1 ILE 16 11.879 -4.217 14.559 1039 HD13 ILE 16 3HD1 ILE 16 12.556 -4.551 12.966 1040 H GLU 17 H GLU 17 14.463 -7.232 16.232 1041 HA GLU 17 HA GLU 17 15.185 -9.947 16.045 1042 HB2 GLU 17 2HB GLU 17 12.509 -8.735 16.842 1043 HB3 GLU 17 3HB GLU 17 12.969 -10.413 17.092 1044 HG2 GLU 17 2HG GLU 17 13.266 -9.400 19.195 1045 HG3 GLU 17 3HG GLU 17 14.891 -9.532 18.537 1046 H LYS 18 H LYS 18 14.595 -11.562 14.716 1047 HA LYS 18 HA LYS 18 13.872 -11.031 12.054 1048 HB2 LYS 18 2HB LYS 18 15.292 -12.927 12.803 1049 HB3 LYS 18 3HB LYS 18 13.884 -13.683 13.540 1050 HG2 LYS 18 2HG LYS 18 12.841 -13.761 11.206 1051 HG3 LYS 18 3HG LYS 18 14.411 -13.245 10.581 1052 HD2 LYS 18 2HD LYS 18 14.187 -15.697 10.424 1053 HD3 LYS 18 3HD LYS 18 15.470 -15.270 11.559 1054 HE2 LYS 18 2HE LYS 18 13.904 -15.645 13.450 1055 HE3 LYS 18 3HE LYS 18 12.638 -16.100 12.310 1056 HZ1 LYS 18 1HZ LYS 18 13.860 -17.978 13.361 1057 HZ2 LYS 18 2HZ LYS 18 15.233 -17.508 12.499 1058 HZ3 LYS 18 3HZ LYS 18 13.850 -18.002 11.674 1059 H GLU 19 H GLU 19 11.965 -12.087 14.813 1060 HA GLU 19 HA GLU 19 9.558 -12.890 13.644 1061 HB2 GLU 19 2HB GLU 19 10.058 -11.413 16.258 1062 HB3 GLU 19 3HB GLU 19 8.508 -12.126 15.824 1063 HG2 GLU 19 2HG GLU 19 9.521 -14.361 15.794 1064 HG3 GLU 19 3HG GLU 19 11.093 -13.662 16.188 1065 H ILE 20 H ILE 20 10.781 -9.661 14.275 1066 HA ILE 20 HA ILE 20 8.339 -8.241 13.623 1067 HB ILE 20 HB ILE 20 11.170 -7.139 13.934 1068 HG12 ILE 20 2HG1 ILE 20 9.039 -7.411 16.111 1069 HG13 ILE 20 3HG1 ILE 20 10.402 -8.508 15.927 1070 HG21 ILE 20 1HG2 ILE 20 9.605 -5.557 12.874 1071 HG22 ILE 20 2HG2 ILE 20 10.034 -5.008 14.494 1072 HG23 ILE 20 3HG2 ILE 20 8.464 -5.763 14.206 1073 HD11 ILE 20 1HD1 ILE 20 10.729 -6.850 17.686 1074 HD12 ILE 20 2HD1 ILE 20 10.631 -5.564 16.484 1075 HD13 ILE 20 3HD1 ILE 20 11.945 -6.737 16.415 1076 H ALA 21 H ALA 21 11.422 -9.010 12.050 1077 HA ALA 21 HA ALA 21 10.996 -7.723 9.560 1078 HB1 ALA 21 1HB ALA 21 13.188 -8.566 10.258 1079 HB2 ALA 21 2HB ALA 21 12.727 -9.269 8.709 1080 HB3 ALA 21 3HB ALA 21 12.597 -10.225 10.186 1081 H CYS 22 H CYS 22 9.772 -10.728 10.891 1082 HA CYS 22 HA CYS 22 8.658 -11.795 8.477 1083 HB2 CYS 22 2HB CYS 22 8.045 -12.414 11.389 1084 HB3 CYS 22 3HB CYS 22 7.445 -13.346 10.017 1085 HG CYS 22 HG CYS 22 10.777 -12.993 10.054 1086 H MET 23 H MET 23 7.518 -9.552 10.967 1087 HA MET 23 HA MET 23 4.766 -9.436 10.261 1088 HB2 MET 23 2HB MET 23 6.535 -7.223 11.398 1089 HB3 MET 23 3HB MET 23 4.780 -7.170 11.323 1090 HG2 MET 23 2HG MET 23 4.654 -9.085 12.863 1091 HG3 MET 23 3HG MET 23 6.418 -9.128 12.935 1092 HE1 MET 23 1HE MET 23 3.189 -6.992 13.778 1093 HE2 MET 23 2HE MET 23 4.139 -5.848 12.827 1094 HE3 MET 23 3HE MET 23 3.906 -5.579 14.554 1095 H SER 24 H SER 24 7.619 -7.741 9.073 1096 HA SER 24 HA SER 24 6.328 -6.255 7.001 1097 HB2 SER 24 2HB SER 24 8.588 -5.657 7.848 1098 HB3 SER 24 3HB SER 24 9.223 -7.190 7.244 1099 HG SER 24 HG SER 24 9.081 -4.938 5.942 1100 H VAL 25 H VAL 25 5.384 -7.138 5.230 1101 HA VAL 25 HA VAL 25 5.270 -9.918 4.780 1102 HB VAL 25 HB VAL 25 4.425 -7.619 2.954 1103 HG11 VAL 25 1HG1 VAL 25 4.705 -9.657 1.603 1104 HG12 VAL 25 2HG1 VAL 25 2.993 -9.261 1.765 1105 HG13 VAL 25 3HG1 VAL 25 3.691 -10.567 2.727 1106 HG21 VAL 25 1HG2 VAL 25 2.794 -9.314 4.890 1107 HG22 VAL 25 2HG2 VAL 25 2.146 -8.063 3.825 1108 HG23 VAL 25 3HG2 VAL 25 3.258 -7.625 5.121 1109 H THR 26 H THR 26 6.883 -7.350 2.883 1110 HA THR 26 HA THR 26 7.956 -9.026 0.885 1111 HB THR 26 HB THR 26 8.860 -6.257 1.772 1112 HG1 THR 26 HG1 THR 26 7.569 -5.729 -0.160 1113 HG21 THR 26 1HG2 THR 26 9.444 -7.709 -0.841 1114 HG22 THR 26 2HG2 THR 26 10.635 -7.316 0.402 1115 HG23 THR 26 3HG2 THR 26 9.834 -6.026 -0.495 1116 H ILE 27 H ILE 27 9.446 -7.768 3.910 1117 HA ILE 27 HA ILE 27 12.033 -8.854 3.433 1118 HB ILE 27 HB ILE 27 10.770 -8.136 6.118 1119 HG12 ILE 27 2HG1 ILE 27 12.660 -6.516 4.335 1120 HG13 ILE 27 3HG1 ILE 27 10.941 -6.204 4.538 1121 HG21 ILE 27 1HG2 ILE 27 13.698 -8.650 5.441 1122 HG22 ILE 27 2HG2 ILE 27 12.665 -9.686 6.428 1123 HG23 ILE 27 3HG2 ILE 27 13.095 -8.075 6.999 1124 HD11 ILE 27 1HD1 ILE 27 13.038 -5.985 6.693 1125 HD12 ILE 27 2HD1 ILE 27 11.313 -5.678 6.894 1126 HD13 ILE 27 3HD1 ILE 27 12.271 -4.650 5.828 1127 H LYS 28 H LYS 28 9.193 -10.061 5.196 1128 HA LYS 28 HA LYS 28 10.111 -12.521 6.133 1129 HB2 LYS 28 2HB LYS 28 7.898 -11.571 6.712 1130 HB3 LYS 28 3HB LYS 28 7.350 -11.802 5.057 1131 HG2 LYS 28 2HG LYS 28 7.682 -14.301 5.395 1132 HG3 LYS 28 3HG LYS 28 7.987 -13.955 7.100 1133 HD2 LYS 28 2HD LYS 28 5.643 -14.663 6.703 1134 HD3 LYS 28 3HD LYS 28 5.731 -13.027 7.359 1135 HE2 LYS 28 2HE LYS 28 4.053 -13.228 5.548 1136 HE3 LYS 28 3HE LYS 28 5.326 -12.079 5.136 1137 HZ1 LYS 28 1HZ LYS 28 5.019 -14.860 4.143 1138 HZ2 LYS 28 2HZ LYS 28 6.381 -13.912 3.848 1139 HZ3 LYS 28 3HZ LYS 28 4.878 -13.433 3.246 1140 H ASN 29 H ASN 29 8.730 -11.650 2.970 1141 HA ASN 29 HA ASN 29 8.690 -14.233 1.810 1142 HB2 ASN 29 2HB ASN 29 8.804 -11.488 0.473 1143 HB3 ASN 29 3HB ASN 29 8.559 -12.994 -0.408 1144 HD21 ASN 29 1HD2 ASN 29 6.800 -10.719 -0.308 1145 HD22 ASN 29 2HD2 ASN 29 5.300 -11.269 0.347 1146 H MET 30 H MET 30 11.189 -11.744 2.005 1147 HA MET 30 HA MET 30 13.032 -13.006 0.203 1148 HB2 MET 30 2HB MET 30 13.499 -10.850 2.305 1149 HB3 MET 30 3HB MET 30 14.707 -11.381 1.139 1150 HG2 MET 30 2HG MET 30 13.115 -10.674 -0.694 1151 HG3 MET 30 3HG MET 30 12.108 -9.952 0.557 1152 HE1 MET 30 1HE MET 30 14.250 -8.702 2.608 1153 HE2 MET 30 2HE MET 30 12.849 -7.804 2.019 1154 HE3 MET 30 3HE MET 30 14.453 -7.089 1.925 1155 H ILE 31 H ILE 31 12.498 -13.144 3.698 1156 HA ILE 31 HA ILE 31 14.763 -14.756 4.381 1157 HB ILE 31 HB ILE 31 12.073 -14.471 5.827 1158 HG12 ILE 31 2HG1 ILE 31 14.715 -13.030 6.395 1159 HG13 ILE 31 3HG1 ILE 31 13.346 -12.315 5.558 1160 HG21 ILE 31 1HG2 ILE 31 14.699 -15.596 6.896 1161 HG22 ILE 31 2HG2 ILE 31 13.232 -16.517 6.568 1162 HG23 ILE 31 3HG2 ILE 31 13.242 -15.312 7.854 1163 HD11 ILE 31 1HD1 ILE 31 13.382 -13.238 8.428 1164 HD12 ILE 31 2HD1 ILE 31 11.986 -12.558 7.585 1165 HD13 ILE 31 3HD1 ILE 31 13.424 -11.573 7.848 1166 H GLU 32 H GLU 32 11.455 -15.439 3.318 1167 HA GLU 32 HA GLU 32 11.599 -18.316 3.576 1168 HB2 GLU 32 2HB GLU 32 9.636 -16.528 2.078 1169 HB3 GLU 32 3HB GLU 32 9.434 -18.265 2.293 1170 HG2 GLU 32 2HG GLU 32 9.197 -18.023 4.684 1171 HG3 GLU 32 3HG GLU 32 9.626 -16.314 4.610 1172 H ASP 33 H ASP 33 12.437 -15.994 1.127 1173 HA ASP 33 HA ASP 33 12.432 -17.779 -1.140 1174 HB2 ASP 33 2HB ASP 33 12.022 -15.351 -1.390 1175 HB3 ASP 33 3HB ASP 33 13.623 -14.986 -0.756 1176 H ILE 34 H ILE 34 14.897 -16.315 0.936 1177 HA ILE 34 HA ILE 34 17.110 -17.620 -0.451 1178 HB ILE 34 HB ILE 34 17.134 -15.717 1.954 1179 HG12 ILE 34 2HG1 ILE 34 17.701 -15.095 -0.996 1180 HG13 ILE 34 3HG1 ILE 34 16.210 -14.682 -0.156 1181 HG21 ILE 34 1HG2 ILE 34 19.550 -15.414 1.474 1182 HG22 ILE 34 2HG2 ILE 34 19.448 -16.612 0.183 1183 HG23 ILE 34 3HG2 ILE 34 19.185 -17.098 1.857 1184 HD11 ILE 34 1HD1 ILE 34 18.954 -13.598 0.455 1185 HD12 ILE 34 2HD1 ILE 34 17.480 -13.212 1.346 1186 HD13 ILE 34 3HD1 ILE 34 17.630 -12.752 -0.349 1187 H GLY 35 H GLY 35 15.460 -17.707 2.677 1188 HA2 GLY 35 2HA GLY 35 15.281 -19.803 3.913 1189 HA3 GLY 35 3HA GLY 35 16.941 -20.169 3.451 1190 H GLU 36 H GLU 36 17.609 -20.366 5.613 1191 HA GLU 36 HA GLU 36 17.311 -18.169 7.488 1192 HB2 GLU 36 2HB GLU 36 18.983 -20.712 7.768 1193 HB3 GLU 36 3HB GLU 36 18.520 -19.610 9.063 1194 HG2 GLU 36 2HG GLU 36 16.111 -20.175 8.602 1195 HG3 GLU 36 3HG GLU 36 16.662 -21.376 7.443 1196 H SER 37 H SER 37 18.291 -16.615 6.021 1197 HA SER 37 HA SER 37 21.061 -16.765 5.270 1198 HB2 SER 37 2HB SER 37 20.636 -14.373 4.497 1199 HB3 SER 37 3HB SER 37 19.558 -15.579 3.794 1200 HG SER 37 HG SER 37 18.970 -13.838 5.961 1201 H ASP 38 H ASP 38 22.534 -16.674 6.847 1202 HA ASP 38 HA ASP 38 22.398 -15.075 9.224 1203 HB2 ASP 38 2HB ASP 38 24.832 -16.334 7.859 1204 HB3 ASP 38 3HB ASP 38 24.797 -15.687 9.497 1205 H SER 39 H SER 39 23.596 -14.678 5.969 1206 HA SER 39 HA SER 39 25.074 -12.316 6.166 1207 HB2 SER 39 2HB SER 39 23.371 -13.296 3.827 1208 HB3 SER 39 3HB SER 39 24.661 -12.090 3.731 1209 HG SER 39 HG SER 39 25.835 -14.050 4.865 1210 HA PRO 40 HA PRO 40 21.832 -9.330 7.135 1211 HB2 PRO 40 2HB PRO 40 23.182 -7.028 6.484 1212 HB3 PRO 40 3HB PRO 40 23.571 -7.979 7.926 1213 HG2 PRO 40 2HG PRO 40 24.939 -7.983 5.259 1214 HG3 PRO 40 3HG PRO 40 25.652 -7.921 6.889 1215 HD2 PRO 40 2HD PRO 40 25.517 -10.230 5.496 1216 HD3 PRO 40 3HD PRO 40 25.337 -10.195 7.265 1217 H ILE 41 H ILE 41 20.187 -8.228 6.024 1218 HA ILE 41 HA ILE 41 20.243 -8.474 3.072 1219 HB ILE 41 HB ILE 41 17.805 -8.326 4.914 1220 HG12 ILE 41 2HG1 ILE 41 19.018 -10.470 5.226 1221 HG13 ILE 41 3HG1 ILE 41 17.482 -10.746 4.420 1222 HG21 ILE 41 1HG2 ILE 41 17.966 -8.864 1.920 1223 HG22 ILE 41 2HG2 ILE 41 17.311 -7.417 2.689 1224 HG23 ILE 41 3HG2 ILE 41 16.502 -8.967 2.899 1225 HD11 ILE 41 1HD1 ILE 41 19.222 -12.134 3.463 1226 HD12 ILE 41 2HD1 ILE 41 20.208 -10.716 3.114 1227 HD13 ILE 41 3HD1 ILE 41 18.679 -10.956 2.266 1228 HA PRO 42 HA PRO 42 20.209 -3.902 3.514 1229 HB2 PRO 42 2HB PRO 42 21.521 -3.294 1.223 1230 HB3 PRO 42 3HB PRO 42 22.382 -3.944 2.630 1231 HG2 PRO 42 2HG PRO 42 21.501 -5.361 0.145 1232 HG3 PRO 42 3HG PRO 42 23.031 -5.503 1.038 1233 HD2 PRO 42 2HD PRO 42 20.914 -7.283 1.292 1234 HD3 PRO 42 3HD PRO 42 22.157 -7.026 2.534 1235 H LEU 43 H LEU 43 18.566 -2.638 2.932 1236 HA LEU 43 HA LEU 43 16.978 -3.112 0.497 1237 HB2 LEU 43 2HB LEU 43 16.358 -1.342 2.905 1238 HB3 LEU 43 3HB LEU 43 15.256 -1.750 1.600 1239 HG LEU 43 HG LEU 43 16.342 -3.700 3.669 1240 HD11 LEU 43 1HD1 LEU 43 14.049 -3.777 4.549 1241 HD12 LEU 43 2HD1 LEU 43 13.559 -2.532 3.398 1242 HD13 LEU 43 3HD1 LEU 43 14.737 -2.158 4.656 1243 HD21 LEU 43 1HD2 LEU 43 15.979 -4.858 1.564 1244 HD22 LEU 43 2HD2 LEU 43 14.348 -4.195 1.439 1245 HD23 LEU 43 3HD2 LEU 43 14.746 -5.331 2.731 1246 HA PRO 44 HA PRO 44 19.738 0.451 -0.627 1247 HB2 PRO 44 2HB PRO 44 20.125 -0.132 -3.220 1248 HB3 PRO 44 3HB PRO 44 20.786 -1.198 -1.962 1249 HG2 PRO 44 2HG PRO 44 18.261 -1.540 -3.564 1250 HG3 PRO 44 3HG PRO 44 19.550 -2.726 -3.240 1251 HD2 PRO 44 2HD PRO 44 17.218 -2.604 -1.782 1252 HD3 PRO 44 3HD PRO 44 18.753 -3.214 -1.123 1253 H ASN 45 H ASN 45 16.902 0.972 -0.337 1254 HA ASN 45 HA ASN 45 16.575 3.103 -2.342 1255 HB2 ASN 45 2HB ASN 45 15.176 1.204 -3.175 1256 HB3 ASN 45 3HB ASN 45 14.335 1.147 -1.627 1257 HD21 ASN 45 1HD2 ASN 45 12.314 1.598 -2.483 1258 HD22 ASN 45 2HD2 ASN 45 11.889 3.134 -3.154 1259 H VAL 46 H VAL 46 15.015 1.605 0.524 1260 HA VAL 46 HA VAL 46 13.941 4.079 1.494 1261 HB VAL 46 HB VAL 46 12.756 1.986 1.958 1262 HG11 VAL 46 1HG1 VAL 46 15.110 1.130 3.671 1263 HG12 VAL 46 2HG1 VAL 46 14.646 0.432 2.119 1264 HG13 VAL 46 3HG1 VAL 46 13.574 0.271 3.511 1265 HG21 VAL 46 1HG2 VAL 46 13.760 3.251 4.538 1266 HG22 VAL 46 2HG2 VAL 46 12.298 2.273 4.375 1267 HG23 VAL 46 3HG2 VAL 46 12.417 3.825 3.548 1268 H THR 47 H THR 47 14.868 5.546 2.828 1269 HA THR 47 HA THR 47 17.685 5.406 3.411 1270 HB THR 47 HB THR 47 17.285 7.715 4.400 1271 HG1 THR 47 HG1 THR 47 15.080 8.522 3.827 1272 HG21 THR 47 1HG2 THR 47 16.146 7.280 1.611 1273 HG22 THR 47 2HG2 THR 47 17.860 7.463 1.999 1274 HG23 THR 47 3HG2 THR 47 16.748 8.808 2.256 1275 H SER 48 H SER 48 18.410 6.237 5.648 1276 HA SER 48 HA SER 48 17.962 4.152 7.487 1277 HB2 SER 48 2HB SER 48 19.425 5.571 8.997 1278 HB3 SER 48 3HB SER 48 20.099 5.237 7.399 1279 HG SER 48 HG SER 48 20.347 7.405 7.816 1280 H THR 49 H THR 49 17.000 7.565 7.553 1281 HA THR 49 HA THR 49 15.839 7.694 10.082 1282 HB THR 49 HB THR 49 14.592 9.691 9.173 1283 HG1 THR 49 HG1 THR 49 14.234 9.742 7.095 1284 HG21 THR 49 1HG2 THR 49 16.936 9.997 9.916 1285 HG22 THR 49 2HG2 THR 49 16.585 11.023 8.524 1286 HG23 THR 49 3HG2 THR 49 17.509 9.537 8.310 1287 H ILE 50 H ILE 50 14.408 6.833 6.955 1288 HA ILE 50 HA ILE 50 11.705 6.680 7.931 1289 HB ILE 50 HB ILE 50 12.893 5.733 5.281 1290 HG12 ILE 50 2HG1 ILE 50 13.270 8.130 5.584 1291 HG13 ILE 50 3HG1 ILE 50 12.001 7.905 4.386 1292 HG21 ILE 50 1HG2 ILE 50 10.581 5.844 4.406 1293 HG22 ILE 50 2HG2 ILE 50 9.982 6.217 6.022 1294 HG23 ILE 50 3HG2 ILE 50 10.730 4.651 5.696 1295 HD11 ILE 50 1HD1 ILE 50 11.625 8.724 7.272 1296 HD12 ILE 50 2HD1 ILE 50 10.315 8.435 6.124 1297 HD13 ILE 50 3HD1 ILE 50 11.459 9.744 5.843 1298 H LEU 51 H LEU 51 14.189 4.295 6.963 1299 HA LEU 51 HA LEU 51 12.627 1.974 7.326 1300 HB2 LEU 51 2HB LEU 51 14.741 2.018 6.003 1301 HB3 LEU 51 3HB LEU 51 15.661 2.225 7.486 1302 HG LEU 51 HG LEU 51 14.942 -0.023 8.264 1303 HD11 LEU 51 1HD1 LEU 51 12.743 -0.159 7.207 1304 HD12 LEU 51 2HD1 LEU 51 13.716 -1.565 6.790 1305 HD13 LEU 51 3HD1 LEU 51 13.489 -0.274 5.608 1306 HD21 LEU 51 1HD2 LEU 51 17.034 0.145 6.976 1307 HD22 LEU 51 2HD2 LEU 51 16.148 -0.115 5.472 1308 HD23 LEU 51 3HD2 LEU 51 16.232 -1.396 6.684 1309 H GLU 52 H GLU 52 14.697 3.813 9.543 1310 HA GLU 52 HA GLU 52 14.727 2.105 11.772 1311 HB2 GLU 52 2HB GLU 52 16.104 4.193 11.593 1312 HB3 GLU 52 3HB GLU 52 14.651 5.164 11.803 1313 HG2 GLU 52 2HG GLU 52 14.341 4.061 14.058 1314 HG3 GLU 52 3HG GLU 52 15.914 3.296 13.841 1315 H LYS 53 H LYS 53 12.483 4.689 10.848 1316 HA LYS 53 HA LYS 53 10.792 4.591 13.111 1317 HB2 LYS 53 2HB LYS 53 10.295 5.645 10.300 1318 HB3 LYS 53 3HB LYS 53 9.188 5.879 11.647 1319 HG2 LYS 53 2HG LYS 53 11.043 7.078 12.871 1320 HG3 LYS 53 3HG LYS 53 11.998 6.968 11.391 1321 HD2 LYS 53 2HD LYS 53 10.923 9.159 11.504 1322 HD3 LYS 53 3HD LYS 53 10.227 8.231 10.170 1323 HE2 LYS 53 2HE LYS 53 8.501 9.421 11.478 1324 HE3 LYS 53 3HE LYS 53 8.274 7.673 11.550 1325 HZ1 LYS 53 1HZ LYS 53 9.535 9.372 13.633 1326 HZ2 LYS 53 2HZ LYS 53 9.381 7.691 13.715 1327 HZ3 LYS 53 3HZ LYS 53 8.001 8.666 13.717 1328 H VAL 54 H VAL 54 10.493 3.157 9.876 1329 HA VAL 54 HA VAL 54 7.912 2.062 10.137 1330 HB VAL 54 HB VAL 54 10.240 1.292 8.308 1331 HG11 VAL 54 1HG1 VAL 54 8.615 0.064 6.902 1332 HG12 VAL 54 2HG1 VAL 54 7.359 0.336 8.113 1333 HG13 VAL 54 3HG1 VAL 54 8.759 -0.661 8.504 1334 HG21 VAL 54 1HG2 VAL 54 8.971 2.520 6.573 1335 HG22 VAL 54 2HG2 VAL 54 9.338 3.566 7.944 1336 HG23 VAL 54 3HG2 VAL 54 7.714 2.905 7.752 1337 H LEU 55 H LEU 55 11.139 0.674 10.704 1338 HA LEU 55 HA LEU 55 10.252 -1.902 11.568 1339 HB2 LEU 55 2HB LEU 55 12.891 -0.437 11.948 1340 HB3 LEU 55 3HB LEU 55 12.627 -2.086 12.484 1341 HG LEU 55 HG LEU 55 12.577 -1.117 9.597 1342 HD11 LEU 55 1HD1 LEU 55 14.601 -2.477 9.310 1343 HD12 LEU 55 2HD1 LEU 55 14.577 -2.905 11.022 1344 HD13 LEU 55 3HD1 LEU 55 14.839 -1.230 10.534 1345 HD21 LEU 55 1HD2 LEU 55 10.931 -2.909 9.869 1346 HD22 LEU 55 2HD2 LEU 55 12.137 -3.939 10.643 1347 HD23 LEU 55 3HD2 LEU 55 12.318 -3.485 8.946 1348 H ASP 56 H ASP 56 10.758 1.164 13.215 1349 HA ASP 56 HA ASP 56 10.818 0.099 15.888 1350 HB2 ASP 56 2HB ASP 56 11.940 2.267 15.199 1351 HB3 ASP 56 3HB ASP 56 10.349 3.011 15.103 1352 H TYR 57 H TYR 57 8.323 1.419 13.776 1353 HA TYR 57 HA TYR 57 6.250 1.448 15.783 1354 HB2 TYR 57 2HB TYR 57 6.036 2.906 13.805 1355 HB3 TYR 57 3HB TYR 57 6.020 1.505 12.735 1356 HD1 TYR 57 HD1 TYR 57 3.954 0.172 12.454 1357 HD2 TYR 57 HD2 TYR 57 4.071 3.367 15.294 1358 HE1 TYR 57 HE1 TYR 57 1.525 -0.021 12.761 1359 HE2 TYR 57 HE2 TYR 57 1.643 3.179 15.589 1360 HH TYR 57 HH TYR 57 -0.287 2.296 14.613 1361 H CYS 58 H CYS 58 7.334 -0.786 13.247 1362 HA CYS 58 HA CYS 58 5.349 -2.770 13.596 1363 HB2 CYS 58 2HB CYS 58 8.190 -2.986 12.522 1364 HB3 CYS 58 3HB CYS 58 7.004 -4.290 12.440 1365 HG CYS 58 HG CYS 58 7.516 -1.925 10.315 1366 H ARG 59 H ARG 59 8.480 -2.201 15.192 1367 HA ARG 59 HA ARG 59 8.444 -4.619 16.740 1368 HB2 ARG 59 2HB ARG 59 10.497 -3.996 17.598 1369 HB3 ARG 59 3HB ARG 59 10.495 -3.096 16.097 1370 HG2 ARG 59 2HG ARG 59 9.837 -1.049 17.395 1371 HG3 ARG 59 3HG ARG 59 9.982 -1.999 18.873 1372 HD2 ARG 59 2HD ARG 59 12.184 -1.271 16.914 1373 HD3 ARG 59 3HD ARG 59 12.044 -0.786 18.608 1374 HE ARG 59 HE ARG 59 12.189 -3.449 18.840 1375 HH11 ARG 59 1HH1 ARG 59 14.236 -1.218 17.020 1376 HH12 ARG 59 2HH1 ARG 59 15.635 -2.239 17.144 1377 HH21 ARG 59 1HH2 ARG 59 14.009 -4.812 18.911 1378 HH22 ARG 59 2HH2 ARG 59 15.506 -4.271 18.212 1379 H HIS 60 H HIS 60 7.392 -1.305 17.279 1380 HA HIS 60 HA HIS 60 6.485 -1.430 19.931 1381 HB2 HIS 60 2HB HIS 60 6.480 0.721 18.943 1382 HB3 HIS 60 3HB HIS 60 5.686 0.162 17.482 1383 HD1 HIS 60 HD1 HIS 60 4.919 1.183 21.036 1384 HD2 HIS 60 HD2 HIS 60 2.921 0.391 17.483 1385 HE1 HIS 60 HE1 HIS 60 2.557 1.936 21.400 1386 HE2 HIS 60 HE2 HIS 60 1.451 1.660 19.170 1387 H HIS 61 H HIS 61 4.850 -2.277 16.901 1388 HA HIS 61 HA HIS 61 2.381 -3.096 18.156 1389 HB2 HIS 61 2HB HIS 61 2.696 -2.081 15.771 1390 HB3 HIS 61 3HB HIS 61 3.206 -3.691 15.280 1391 HD1 HIS 61 HD1 HIS 61 1.253 -5.625 15.925 1392 HD2 HIS 61 HD2 HIS 61 0.030 -1.684 15.463 1393 HE1 HIS 61 HE1 HIS 61 -1.225 -5.726 15.555 1394 HE2 HIS 61 HE2 HIS 61 -1.958 -3.327 15.510 1395 H HIS 62 H HIS 62 5.410 -4.614 17.495 1396 HA HIS 62 HA HIS 62 4.398 -7.334 17.482 1397 HB2 HIS 62 2HB HIS 62 6.527 -6.633 16.304 1398 HB3 HIS 62 3HB HIS 62 7.285 -6.420 17.879 1399 HD1 HIS 62 HD1 HIS 62 5.579 -9.137 15.845 1400 HD2 HIS 62 HD2 HIS 62 8.395 -8.739 18.871 1401 HE1 HIS 62 HE1 HIS 62 6.387 -11.455 16.325 1402 HE2 HIS 62 HE2 HIS 62 7.917 -11.217 18.305 1403 H GLN 63 H GLN 63 5.918 -5.125 19.792 1404 HA GLN 63 HA GLN 63 6.047 -6.978 21.987 1405 HB2 GLN 63 2HB GLN 63 6.195 -3.926 21.965 1406 HB3 GLN 63 3HB GLN 63 6.539 -4.939 23.361 1407 HG2 GLN 63 2HG GLN 63 8.103 -4.899 20.771 1408 HG3 GLN 63 3HG GLN 63 8.598 -4.168 22.293 1409 HE21 GLN 63 1HE2 GLN 63 7.751 -6.435 23.956 1410 HE22 GLN 63 2HE2 GLN 63 8.870 -7.709 23.637 1411 H HIS 64 H HIS 64 3.706 -4.637 20.806 1412 HA HIS 64 HA HIS 64 1.695 -5.689 22.719 1413 HB2 HIS 64 2HB HIS 64 1.925 -2.843 21.621 1414 HB3 HIS 64 3HB HIS 64 0.532 -3.445 22.516 1415 HD1 HIS 64 HD1 HIS 64 0.593 -2.851 24.930 1416 HD2 HIS 64 HD2 HIS 64 4.421 -3.130 23.336 1417 HE1 HIS 64 HE1 HIS 64 2.150 -2.188 26.783 1418 HE2 HIS 64 HE2 HIS 64 4.454 -2.443 25.824 1419 HA PRO 65 HA PRO 65 0.568 -6.807 18.338 1420 HB2 PRO 65 2HB PRO 65 -0.524 -9.275 19.609 1421 HB3 PRO 65 3HB PRO 65 0.655 -9.112 18.290 1422 HG2 PRO 65 2HG PRO 65 1.411 -9.948 20.721 1423 HG3 PRO 65 3HG PRO 65 2.466 -8.909 19.732 1424 HD2 PRO 65 2HD PRO 65 0.669 -8.121 22.032 1425 HD3 PRO 65 3HD PRO 65 2.352 -7.643 21.698 1426 H GLY 66 H GLY 66 -1.520 -7.905 21.055 1427 HA2 GLY 66 2HA GLY 66 -3.721 -7.587 21.567 1428 HA3 GLY 66 3HA GLY 66 -3.620 -6.063 20.700 1429 H GLY 67 H GLY 67 -4.075 -6.024 18.467 1430 HA2 GLY 67 2HA GLY 67 -4.635 -7.302 16.416 1431 HA3 GLY 67 3HA GLY 67 -5.711 -8.277 17.411 1432 H SER 68 H SER 68 -7.721 -7.508 17.924 1433 HA SER 68 HA SER 68 -8.725 -5.185 16.499 1434 HB2 SER 68 2HB SER 68 -10.955 -5.970 17.414 1435 HB3 SER 68 3HB SER 68 -10.109 -7.182 16.453 1436 HG SER 68 HG SER 68 -11.000 -7.983 18.444 1437 H GLY 69 H GLY 69 -7.388 -3.659 17.679 1438 HA2 GLY 69 2HA GLY 69 -8.676 -2.654 20.141 1439 HA3 GLY 69 3HA GLY 69 -6.940 -2.960 20.156 1440 H LEU 70 H LEU 70 -8.995 -1.629 17.579 1441 HA LEU 70 HA LEU 70 -7.299 0.614 17.033 1442 HB2 LEU 70 2HB LEU 70 -10.185 0.109 16.202 1443 HB3 LEU 70 3HB LEU 70 -9.133 1.332 15.509 1444 HG LEU 70 HG LEU 70 -8.730 -1.682 15.283 1445 HD11 LEU 70 1HD1 LEU 70 -10.617 -0.903 13.936 1446 HD12 LEU 70 2HD1 LEU 70 -9.276 -1.393 12.905 1447 HD13 LEU 70 3HD1 LEU 70 -9.597 0.321 13.172 1448 HD21 LEU 70 1HD2 LEU 70 -6.555 -0.558 15.320 1449 HD22 LEU 70 2HD2 LEU 70 -7.079 0.561 14.060 1450 HD23 LEU 70 3HD2 LEU 70 -6.902 -1.157 13.698 1451 H ASP 71 H ASP 71 -9.892 0.066 19.219 1452 HA ASP 71 HA ASP 71 -10.667 2.752 19.846 1453 HB2 ASP 71 2HB ASP 71 -11.693 1.694 21.897 1454 HB3 ASP 71 3HB ASP 71 -12.173 0.916 20.395 1455 H ASP 72 H ASP 72 -7.995 0.719 20.779 1456 HA ASP 72 HA ASP 72 -7.107 2.637 22.847 1457 HB2 ASP 72 2HB ASP 72 -7.401 0.229 23.535 1458 HB3 ASP 72 3HB ASP 72 -6.137 -0.223 22.391 1459 H ILE 73 H ILE 73 -6.125 4.167 21.536 1460 HA ILE 73 HA ILE 73 -3.897 3.319 19.793 1461 HB ILE 73 HB ILE 73 -5.260 6.053 19.981 1462 HG12 ILE 73 2HG1 ILE 73 -6.724 4.328 18.931 1463 HG13 ILE 73 3HG1 ILE 73 -6.238 5.550 17.766 1464 HG21 ILE 73 1HG2 ILE 73 -3.934 6.651 17.968 1465 HG22 ILE 73 2HG2 ILE 73 -3.101 5.099 18.055 1466 HG23 ILE 73 3HG2 ILE 73 -2.894 6.284 19.345 1467 HD11 ILE 73 1HD1 ILE 73 -5.074 2.767 18.007 1468 HD12 ILE 73 2HD1 ILE 73 -4.580 3.989 16.832 1469 HD13 ILE 73 3HD1 ILE 73 -6.212 3.326 16.782 1470 HA PRO 74 HA PRO 74 -1.209 4.781 23.257 1471 HB2 PRO 74 2HB PRO 74 0.876 3.874 21.277 1472 HB3 PRO 74 3HB PRO 74 0.712 3.471 23.000 1473 HG2 PRO 74 2HG PRO 74 0.126 1.662 21.130 1474 HG3 PRO 74 3HG PRO 74 -0.867 1.793 22.602 1475 HD2 PRO 74 2HD PRO 74 -1.451 2.831 19.831 1476 HD3 PRO 74 3HD PRO 74 -2.537 2.025 20.990 1477 HA PRO 75 HA PRO 75 -0.524 8.913 21.538 1478 HB2 PRO 75 2HB PRO 75 1.727 9.586 23.148 1479 HB3 PRO 75 3HB PRO 75 0.024 9.852 23.559 1480 HG2 PRO 75 2HG PRO 75 1.818 7.608 24.385 1481 HG3 PRO 75 3HG PRO 75 0.559 8.453 25.316 1482 HD2 PRO 75 2HD PRO 75 0.105 6.018 24.314 1483 HD3 PRO 75 3HD PRO 75 -1.180 7.244 24.309 1484 H TYR 76 H TYR 76 2.215 6.639 21.813 1485 HA TYR 76 HA TYR 76 4.137 7.832 20.209 1486 HB2 TYR 76 2HB TYR 76 4.778 5.822 21.352 1487 HB3 TYR 76 3HB TYR 76 3.468 4.888 20.633 1488 HD1 TYR 76 HD1 TYR 76 3.840 3.664 18.598 1489 HD2 TYR 76 HD2 TYR 76 6.716 6.599 19.793 1490 HE1 TYR 76 HE1 TYR 76 5.301 2.982 16.752 1491 HE2 TYR 76 HE2 TYR 76 8.177 5.903 17.940 1492 HH TYR 76 HH TYR 76 8.477 3.752 16.510 1493 H ASP 77 H ASP 77 1.333 5.931 19.185 1494 HA ASP 77 HA ASP 77 1.950 5.600 16.448 1495 HB2 ASP 77 2HB ASP 77 -0.765 5.714 17.839 1496 HB3 ASP 77 3HB ASP 77 -0.510 5.132 16.196 1497 H ARG 78 H ARG 78 0.263 8.132 18.206 1498 HA ARG 78 HA ARG 78 -0.480 9.711 15.904 1499 HB2 ARG 78 2HB ARG 78 -0.349 10.468 18.855 1500 HB3 ARG 78 3HB ARG 78 -1.133 11.419 17.595 1501 HG2 ARG 78 2HG ARG 78 -1.937 8.658 18.522 1502 HG3 ARG 78 3HG ARG 78 -2.793 10.161 18.862 1503 HD2 ARG 78 2HD ARG 78 -3.191 10.430 16.393 1504 HD3 ARG 78 3HD ARG 78 -2.438 8.856 16.134 1505 HE ARG 78 HE ARG 78 -4.659 8.835 17.980 1506 HH11 ARG 78 1HH1 ARG 78 -3.756 8.498 14.589 1507 HH12 ARG 78 2HH1 ARG 78 -5.197 7.621 14.179 1508 HH21 ARG 78 1HH2 ARG 78 -6.539 7.726 17.428 1509 HH22 ARG 78 2HH2 ARG 78 -6.778 7.184 15.795 1510 H ASP 79 H ASP 79 2.188 9.672 18.214 1511 HA ASP 79 HA ASP 79 3.443 12.067 17.313 1512 HB2 ASP 79 2HB ASP 79 4.435 9.759 19.015 1513 HB3 ASP 79 3HB ASP 79 5.524 11.051 18.524 1514 H PHE 80 H PHE 80 3.446 8.782 16.244 1515 HA PHE 80 HA PHE 80 5.813 8.707 14.684 1516 HB2 PHE 80 2HB PHE 80 4.564 6.657 15.372 1517 HB3 PHE 80 3HB PHE 80 3.208 7.125 14.352 1518 HD1 PHE 80 HD1 PHE 80 3.240 6.662 11.968 1519 HD2 PHE 80 HD2 PHE 80 6.750 6.017 14.327 1520 HE1 PHE 80 HE1 PHE 80 4.311 5.514 10.070 1521 HE2 PHE 80 HE2 PHE 80 7.799 4.880 12.433 1522 HZ PHE 80 HZ PHE 80 6.598 4.630 10.304 1523 H CYS 81 H CYS 81 2.500 9.628 14.058 1524 HA CYS 81 HA CYS 81 2.681 10.149 11.271 1525 HB2 CYS 81 2HB CYS 81 0.694 11.114 13.360 1526 HB3 CYS 81 3HB CYS 81 0.445 11.141 11.614 1527 HG CYS 81 HG CYS 81 0.445 8.388 11.301 1528 H LYS 82 H LYS 82 3.632 11.981 14.064 1529 HA LYS 82 HA LYS 82 3.587 14.604 12.851 1530 HB2 LYS 82 2HB LYS 82 5.056 13.629 15.342 1531 HB3 LYS 82 3HB LYS 82 4.855 15.315 14.869 1532 HG2 LYS 82 2HG LYS 82 2.421 15.128 15.166 1533 HG3 LYS 82 3HG LYS 82 2.599 13.420 15.587 1534 HD2 LYS 82 2HD LYS 82 4.017 14.098 17.546 1535 HD3 LYS 82 3HD LYS 82 3.689 15.788 17.156 1536 HE2 LYS 82 2HE LYS 82 1.299 15.450 17.573 1537 HE3 LYS 82 3HE LYS 82 1.571 13.728 17.859 1538 HZ1 LYS 82 1HZ LYS 82 2.672 15.952 19.496 1539 HZ2 LYS 82 2HZ LYS 82 2.959 14.311 19.761 1540 HZ3 LYS 82 3HZ LYS 82 1.400 14.933 19.931 1541 H VAL 83 H VAL 83 4.687 14.119 10.903 1542 HA VAL 83 HA VAL 83 7.637 14.192 11.040 1543 HB VAL 83 HB VAL 83 7.693 12.737 8.945 1544 HG11 VAL 83 1HG1 VAL 83 6.581 11.368 11.420 1545 HG12 VAL 83 2HG1 VAL 83 8.274 11.765 11.124 1546 HG13 VAL 83 3HG1 VAL 83 7.459 10.579 10.106 1547 HG21 VAL 83 1HG2 VAL 83 4.784 12.150 9.653 1548 HG22 VAL 83 2HG2 VAL 83 5.732 11.301 8.429 1549 HG23 VAL 83 3HG2 VAL 83 5.354 13.009 8.218 1550 H ASP 84 H ASP 84 8.548 14.998 8.913 1551 HA ASP 84 HA ASP 84 7.208 17.385 8.064 1552 HB2 ASP 84 2HB ASP 84 9.733 17.050 8.200 1553 HB3 ASP 84 3HB ASP 84 9.620 16.049 6.757 1554 H GLN 85 H GLN 85 6.679 17.840 5.739 1555 HA GLN 85 HA GLN 85 4.611 16.153 4.966 1556 HB2 GLN 85 2HB GLN 85 4.680 18.610 4.534 1557 HB3 GLN 85 3HB GLN 85 5.886 18.349 3.278 1558 HG2 GLN 85 2HG GLN 85 3.648 18.692 2.312 1559 HG3 GLN 85 3HG GLN 85 4.262 17.083 1.948 1560 HE21 GLN 85 1HE2 GLN 85 2.124 16.413 1.512 1561 HE22 GLN 85 2HE2 GLN 85 1.015 16.053 2.779 1562 HA PRO 86 HA PRO 86 7.291 14.391 1.257 1563 HB2 PRO 86 2HB PRO 86 10.044 14.525 1.503 1564 HB3 PRO 86 3HB PRO 86 9.081 15.714 0.604 1565 HG2 PRO 86 2HG PRO 86 10.111 15.892 3.423 1566 HG3 PRO 86 3HG PRO 86 10.159 17.118 2.133 1567 HD2 PRO 86 2HD PRO 86 8.297 17.225 4.063 1568 HD3 PRO 86 3HD PRO 86 7.892 17.659 2.382 1569 H THR 87 H THR 87 8.707 14.384 4.511 1570 HA THR 87 HA THR 87 9.759 11.784 4.606 1571 HB THR 87 HB THR 87 8.664 13.473 6.900 1572 HG1 THR 87 HG1 THR 87 11.241 13.435 5.676 1573 HG21 THR 87 1HG2 THR 87 10.812 11.320 6.950 1574 HG22 THR 87 2HG2 THR 87 9.185 11.156 7.613 1575 HG23 THR 87 3HG2 THR 87 10.310 12.318 8.318 1576 H LEU 88 H LEU 88 6.517 13.004 5.146 1577 HA LEU 88 HA LEU 88 5.307 10.750 6.357 1578 HB2 LEU 88 2HB LEU 88 4.490 13.219 6.117 1579 HB3 LEU 88 3HB LEU 88 3.868 12.741 4.549 1580 HG LEU 88 HG LEU 88 3.011 11.423 7.166 1581 HD11 LEU 88 1HD1 LEU 88 2.407 13.778 7.251 1582 HD12 LEU 88 2HD1 LEU 88 0.967 12.786 7.050 1583 HD13 LEU 88 3HD1 LEU 88 1.626 13.669 5.669 1584 HD21 LEU 88 1HD2 LEU 88 2.597 10.012 5.211 1585 HD22 LEU 88 2HD2 LEU 88 1.730 11.326 4.417 1586 HD23 LEU 88 3HD2 LEU 88 1.078 10.599 5.888 1587 H PHE 89 H PHE 89 5.496 11.841 2.967 1588 HA PHE 89 HA PHE 89 4.154 9.603 1.841 1589 HB2 PHE 89 2HB PHE 89 6.009 11.638 0.556 1590 HB3 PHE 89 3HB PHE 89 5.051 10.461 -0.341 1591 HD1 PHE 89 HD1 PHE 89 2.429 10.450 0.520 1592 HD2 PHE 89 HD2 PHE 89 5.070 13.803 0.582 1593 HE1 PHE 89 HE1 PHE 89 0.506 11.973 0.482 1594 HE2 PHE 89 HE2 PHE 89 3.140 15.321 0.534 1595 HZ PHE 89 HZ PHE 89 0.852 14.410 0.489 1596 H GLU 90 H GLU 90 7.523 10.221 2.632 1597 HA GLU 90 HA GLU 90 8.727 8.007 1.360 1598 HB2 GLU 90 2HB GLU 90 9.462 9.499 3.907 1599 HB3 GLU 90 3HB GLU 90 10.471 8.231 3.229 1600 HG2 GLU 90 2HG GLU 90 9.726 10.778 1.776 1601 HG3 GLU 90 3HG GLU 90 11.220 10.540 2.670 1602 H LEU 91 H LEU 91 7.129 8.313 4.528 1603 HA LEU 91 HA LEU 91 7.553 5.671 5.467 1604 HB2 LEU 91 2HB LEU 91 5.298 7.617 6.082 1605 HB3 LEU 91 3HB LEU 91 5.571 6.124 6.963 1606 HG LEU 91 HG LEU 91 7.506 8.479 6.893 1607 HD11 LEU 91 1HD1 LEU 91 6.823 8.892 9.220 1608 HD12 LEU 91 2HD1 LEU 91 5.640 7.588 9.122 1609 HD13 LEU 91 3HD1 LEU 91 5.449 9.031 8.125 1610 HD21 LEU 91 1HD2 LEU 91 7.610 5.926 8.539 1611 HD22 LEU 91 2HD2 LEU 91 8.722 7.293 8.675 1612 HD23 LEU 91 3HD2 LEU 91 8.677 6.342 7.194 1613 H ILE 92 H ILE 92 5.023 7.107 3.427 1614 HA ILE 92 HA ILE 92 3.310 4.847 3.195 1615 HB ILE 92 HB ILE 92 3.708 7.177 1.244 1616 HG12 ILE 92 2HG1 ILE 92 1.626 6.774 3.447 1617 HG13 ILE 92 3HG1 ILE 92 2.953 7.926 3.479 1618 HG21 ILE 92 1HG2 ILE 92 2.659 5.269 0.084 1619 HG22 ILE 92 2HG2 ILE 92 1.504 6.586 0.282 1620 HG23 ILE 92 3HG2 ILE 92 1.415 5.174 1.336 1621 HD11 ILE 92 1HD1 ILE 92 0.586 7.989 1.614 1622 HD12 ILE 92 2HD1 ILE 92 1.936 9.123 1.594 1623 HD13 ILE 92 3HD1 ILE 92 0.878 9.041 2.999 1624 H LEU 93 H LEU 93 6.054 6.004 1.243 1625 HA LEU 93 HA LEU 93 5.928 4.088 -0.847 1626 HB2 LEU 93 2HB LEU 93 8.230 5.811 0.152 1627 HB3 LEU 93 3HB LEU 93 8.321 4.830 -1.302 1628 HG LEU 93 HG LEU 93 6.382 7.142 -0.887 1629 HD11 LEU 93 1HD1 LEU 93 7.753 8.383 -2.484 1630 HD12 LEU 93 2HD1 LEU 93 8.897 7.043 -2.583 1631 HD13 LEU 93 3HD1 LEU 93 8.700 7.929 -1.070 1632 HD21 LEU 93 1HD2 LEU 93 5.872 6.900 -3.275 1633 HD22 LEU 93 2HD2 LEU 93 5.456 5.443 -2.381 1634 HD23 LEU 93 3HD2 LEU 93 6.920 5.481 -3.367 1635 H ALA 94 H ALA 94 7.714 4.193 2.208 1636 HA ALA 94 HA ALA 94 9.232 1.792 1.817 1637 HB1 ALA 94 1HB ALA 94 9.813 2.038 4.199 1638 HB2 ALA 94 2HB ALA 94 8.577 3.286 4.383 1639 HB3 ALA 94 3HB ALA 94 9.972 3.572 3.343 1640 H ALA 95 H ALA 95 6.124 2.571 3.285 1641 HA ALA 95 HA ALA 95 5.649 0.014 4.501 1642 HB1 ALA 95 1HB ALA 95 4.601 2.123 5.269 1643 HB2 ALA 95 2HB ALA 95 3.433 0.843 4.969 1644 HB3 ALA 95 3HB ALA 95 3.626 2.157 3.802 1645 H ASN 96 H ASN 96 4.990 1.418 1.340 1646 HA ASN 96 HA ASN 96 3.330 -0.759 0.384 1647 HB2 ASN 96 2HB ASN 96 3.082 1.506 -0.569 1648 HB3 ASN 96 3HB ASN 96 4.762 1.504 -1.104 1649 HD21 ASN 96 1HD2 ASN 96 4.158 1.846 -3.260 1650 HD22 ASN 96 2HD2 ASN 96 3.439 0.616 -4.226 1651 H TYR 97 H TYR 97 6.725 0.208 0.147 1652 HA TYR 97 HA TYR 97 7.687 -1.787 -1.603 1653 HB2 TYR 97 2HB TYR 97 9.051 0.160 -1.222 1654 HB3 TYR 97 3HB TYR 97 9.056 -0.086 0.518 1655 HD1 TYR 97 HD1 TYR 97 11.179 -0.700 1.337 1656 HD2 TYR 97 HD2 TYR 97 10.011 -2.166 -2.506 1657 HE1 TYR 97 HE1 TYR 97 13.311 -1.908 1.153 1658 HE2 TYR 97 HE2 TYR 97 12.146 -3.373 -2.686 1659 HH TYR 97 HH TYR 97 14.428 -3.260 -1.747 1660 H LEU 98 H LEU 98 7.364 -1.705 1.923 1661 HA LEU 98 HA LEU 98 8.369 -4.447 2.219 1662 HB2 LEU 98 2HB LEU 98 7.580 -2.370 4.295 1663 HB3 LEU 98 3HB LEU 98 8.235 -3.956 4.662 1664 HG LEU 98 HG LEU 98 9.693 -1.688 3.247 1665 HD11 LEU 98 1HD1 LEU 98 11.179 -1.687 5.218 1666 HD12 LEU 98 2HD1 LEU 98 10.178 -2.923 5.980 1667 HD13 LEU 98 3HD1 LEU 98 9.511 -1.322 5.655 1668 HD21 LEU 98 1HD2 LEU 98 10.395 -3.784 2.243 1669 HD22 LEU 98 2HD2 LEU 98 10.686 -4.492 3.832 1670 HD23 LEU 98 3HD2 LEU 98 11.689 -3.157 3.262 1671 H ASP 99 H ASP 99 5.473 -2.888 1.701 1672 HA ASP 99 HA ASP 99 3.295 -3.383 1.708 1673 HB2 ASP 99 2HB ASP 99 4.235 -5.276 0.312 1674 HB3 ASP 99 3HB ASP 99 4.198 -6.294 1.747 1675 H ILE 100 H ILE 100 4.391 -2.848 4.246 1676 HA ILE 100 HA ILE 100 3.202 -4.625 6.218 1677 HB ILE 100 HB ILE 100 4.452 -1.872 6.667 1678 HG12 ILE 100 2HG1 ILE 100 5.730 -4.628 6.857 1679 HG13 ILE 100 3HG1 ILE 100 6.065 -3.434 5.617 1680 HG21 ILE 100 1HG2 ILE 100 4.696 -2.611 9.022 1681 HG22 ILE 100 2HG2 ILE 100 3.894 -4.133 8.634 1682 HG23 ILE 100 3HG2 ILE 100 3.001 -2.617 8.530 1683 HD11 ILE 100 1HD1 ILE 100 7.838 -3.494 7.212 1684 HD12 ILE 100 2HD1 ILE 100 6.721 -3.210 8.546 1685 HD13 ILE 100 3HD1 ILE 100 7.000 -1.951 7.338 1686 H LYS 101 H LYS 101 1.027 -4.596 6.322 1687 HA LYS 101 HA LYS 101 -0.643 -2.511 5.434 1688 HB2 LYS 101 2HB LYS 101 -1.277 -4.963 7.117 1689 HB3 LYS 101 3HB LYS 101 -2.514 -3.815 6.625 1690 HG2 LYS 101 2HG LYS 101 -2.668 -5.584 5.078 1691 HG3 LYS 101 3HG LYS 101 -1.823 -4.301 4.211 1692 HD2 LYS 101 2HD LYS 101 0.347 -5.468 4.695 1693 HD3 LYS 101 3HD LYS 101 -0.561 -6.775 5.463 1694 HE2 LYS 101 2HE LYS 101 0.064 -7.353 3.146 1695 HE3 LYS 101 3HE LYS 101 -1.693 -7.248 3.315 1696 HZ1 LYS 101 1HZ LYS 101 0.074 -5.119 2.235 1697 HZ2 LYS 101 2HZ LYS 101 -1.611 -5.036 2.356 1698 HZ3 LYS 101 3HZ LYS 101 -0.893 -6.147 1.314 1699 HA PRO 102 HA PRO 102 -1.442 -1.422 10.233 1700 HB2 PRO 102 2HB PRO 102 0.853 -1.778 11.837 1701 HB3 PRO 102 3HB PRO 102 -0.564 -2.842 11.828 1702 HG2 PRO 102 2HG PRO 102 2.040 -3.177 10.391 1703 HG3 PRO 102 3HG PRO 102 1.051 -4.394 11.228 1704 HD2 PRO 102 2HD PRO 102 1.033 -4.221 8.553 1705 HD3 PRO 102 3HD PRO 102 -0.465 -4.573 9.446 1706 H LEU 103 H LEU 103 1.863 -1.111 8.864 1707 HA LEU 103 HA LEU 103 2.361 1.535 9.874 1708 HB2 LEU 103 2HB LEU 103 4.034 -0.308 8.943 1709 HB3 LEU 103 3HB LEU 103 3.699 0.398 7.378 1710 HG LEU 103 HG LEU 103 5.817 1.243 8.302 1711 HD11 LEU 103 1HD1 LEU 103 5.524 3.682 8.170 1712 HD12 LEU 103 2HD1 LEU 103 3.772 3.486 8.272 1713 HD13 LEU 103 3HD1 LEU 103 4.652 2.849 6.888 1714 HD21 LEU 103 1HD2 LEU 103 5.299 0.936 10.678 1715 HD22 LEU 103 2HD2 LEU 103 4.231 2.342 10.633 1716 HD23 LEU 103 3HD2 LEU 103 5.962 2.533 10.347 1717 H LEU 104 H LEU 104 1.387 0.216 6.730 1718 HA LEU 104 HA LEU 104 1.377 2.592 5.243 1719 HB2 LEU 104 2HB LEU 104 1.485 0.307 4.282 1720 HB3 LEU 104 3HB LEU 104 -0.176 0.017 4.762 1721 HG LEU 104 HG LEU 104 -0.939 1.763 3.158 1722 HD11 LEU 104 1HD1 LEU 104 0.625 2.735 1.514 1723 HD12 LEU 104 2HD1 LEU 104 1.987 1.993 2.355 1724 HD13 LEU 104 3HD1 LEU 104 1.023 3.236 3.155 1725 HD21 LEU 104 1HD2 LEU 104 -0.816 -0.594 2.444 1726 HD22 LEU 104 2HD2 LEU 104 0.842 -0.350 1.889 1727 HD23 LEU 104 3HD2 LEU 104 -0.489 0.497 1.100 1728 H ASP 105 H ASP 105 -1.201 0.884 6.956 1729 HA ASP 105 HA ASP 105 -3.373 2.419 5.987 1730 HB2 ASP 105 2HB ASP 105 -3.583 0.108 6.961 1731 HB3 ASP 105 3HB ASP 105 -3.271 0.779 8.565 1732 H VAL 106 H VAL 106 -1.561 2.523 9.073 1733 HA VAL 106 HA VAL 106 -2.918 4.651 10.310 1734 HB VAL 106 HB VAL 106 -0.071 3.605 10.627 1735 HG11 VAL 106 1HG1 VAL 106 0.019 5.970 11.310 1736 HG12 VAL 106 2HG1 VAL 106 0.175 4.908 12.706 1737 HG13 VAL 106 3HG1 VAL 106 -1.357 5.730 12.392 1738 HG21 VAL 106 1HG2 VAL 106 -0.937 2.669 12.745 1739 HG22 VAL 106 2HG2 VAL 106 -1.870 2.101 11.362 1740 HG23 VAL 106 3HG2 VAL 106 -2.527 3.361 12.408 1741 H THR 107 H THR 107 -0.085 4.696 8.151 1742 HA THR 107 HA THR 107 0.369 7.521 8.313 1743 HB THR 107 HB THR 107 1.430 5.534 6.249 1744 HG1 THR 107 HG1 THR 107 2.442 4.751 7.939 1745 HG21 THR 107 1HG2 THR 107 3.340 7.080 6.057 1746 HG22 THR 107 2HG2 THR 107 2.585 8.185 7.204 1747 HG23 THR 107 3HG2 THR 107 1.844 7.910 5.627 1748 H CYS 108 H CYS 108 -1.505 5.467 6.117 1749 HA CYS 108 HA CYS 108 -2.102 7.534 4.184 1750 HB2 CYS 108 2HB CYS 108 -3.386 4.813 4.666 1751 HB3 CYS 108 3HB CYS 108 -3.827 5.889 3.337 1752 HG CYS 108 HG CYS 108 -0.606 4.838 3.729 1753 H LYS 109 H LYS 109 -3.521 6.359 7.161 1754 HA LYS 109 HA LYS 109 -5.966 7.870 6.959 1755 HB2 LYS 109 2HB LYS 109 -4.744 6.076 9.035 1756 HB3 LYS 109 3HB LYS 109 -5.866 7.299 9.625 1757 HG2 LYS 109 2HG LYS 109 -6.946 5.087 9.177 1758 HG3 LYS 109 3HG LYS 109 -7.672 6.413 8.270 1759 HD2 LYS 109 2HD LYS 109 -6.377 5.707 6.255 1760 HD3 LYS 109 3HD LYS 109 -5.710 4.356 7.172 1761 HE2 LYS 109 2HE LYS 109 -8.650 4.786 6.563 1762 HE3 LYS 109 3HE LYS 109 -7.585 3.666 5.719 1763 HZ1 LYS 109 1HZ LYS 109 -8.926 2.564 7.402 1764 HZ2 LYS 109 2HZ LYS 109 -8.252 3.534 8.603 1765 HZ3 LYS 109 3HZ LYS 109 -7.277 2.446 7.757 1766 H THR 110 H THR 110 -2.730 8.460 8.182 1767 HA THR 110 HA THR 110 -3.102 10.775 9.695 1768 HB THR 110 HB THR 110 -0.782 10.085 7.833 1769 HG1 THR 110 HG1 THR 110 -1.604 8.898 10.038 1770 HG21 THR 110 1HG2 THR 110 -0.864 12.028 10.174 1771 HG22 THR 110 2HG2 THR 110 -0.718 12.471 8.472 1772 HG23 THR 110 3HG2 THR 110 0.577 11.575 9.262 1773 H VAL 111 H VAL 111 -2.383 10.539 6.152 1774 HA VAL 111 HA VAL 111 -2.772 13.319 5.632 1775 HB VAL 111 HB VAL 111 -2.928 12.688 3.180 1776 HG11 VAL 111 1HG1 VAL 111 -0.770 13.257 4.174 1777 HG12 VAL 111 2HG1 VAL 111 -0.570 11.993 2.961 1778 HG13 VAL 111 3HG1 VAL 111 -0.528 11.583 4.678 1779 HG21 VAL 111 1HG2 VAL 111 -2.403 10.366 2.502 1780 HG22 VAL 111 2HG2 VAL 111 -3.928 10.454 3.383 1781 HG23 VAL 111 3HG2 VAL 111 -2.479 9.850 4.190 1782 H ALA 112 H ALA 112 -4.939 10.533 5.585 1783 HA ALA 112 HA ALA 112 -7.178 11.695 4.331 1784 HB1 ALA 112 1HB ALA 112 -6.938 9.271 4.701 1785 HB2 ALA 112 2HB ALA 112 -8.474 9.867 5.332 1786 HB3 ALA 112 3HB ALA 112 -7.141 9.511 6.437 1787 H ASN 113 H ASN 113 -6.077 11.773 7.692 1788 HA ASN 113 HA ASN 113 -8.417 13.015 8.803 1789 HB2 ASN 113 2HB ASN 113 -5.570 12.738 9.872 1790 HB3 ASN 113 3HB ASN 113 -6.872 13.494 10.784 1791 HD21 ASN 113 1HD2 ASN 113 -5.269 11.061 11.329 1792 HD22 ASN 113 2HD2 ASN 113 -6.422 9.798 11.564 1793 H MET 114 H MET 114 -5.269 14.205 7.634 1794 HA MET 114 HA MET 114 -5.513 16.881 8.534 1795 HB2 MET 114 2HB MET 114 -3.835 15.764 6.249 1796 HB3 MET 114 3HB MET 114 -3.682 17.399 6.877 1797 HG2 MET 114 2HG MET 114 -3.131 16.370 9.124 1798 HG3 MET 114 3HG MET 114 -3.033 14.818 8.296 1799 HE1 MET 114 1HE MET 114 -1.755 15.846 5.427 1800 HE2 MET 114 2HE MET 114 -1.237 14.370 6.247 1801 HE3 MET 114 3HE MET 114 -0.043 15.570 5.757 1802 H ILE 115 H ILE 115 -6.474 15.329 5.508 1803 HA ILE 115 HA ILE 115 -7.263 17.829 4.244 1804 HB ILE 115 HB ILE 115 -7.982 16.439 2.327 1805 HG12 ILE 115 2HG1 ILE 115 -7.208 14.050 4.073 1806 HG13 ILE 115 3HG1 ILE 115 -8.829 14.444 3.518 1807 HG21 ILE 115 1HG2 ILE 115 -5.233 15.674 3.371 1808 HG22 ILE 115 2HG2 ILE 115 -5.634 17.152 2.497 1809 HG23 ILE 115 3HG2 ILE 115 -5.757 15.593 1.686 1810 HD11 ILE 115 1HD1 ILE 115 -6.524 13.646 1.738 1811 HD12 ILE 115 2HD1 ILE 115 -8.184 13.971 1.228 1812 HD13 ILE 115 3HD1 ILE 115 -7.836 12.598 2.278 1813 H ARG 116 H ARG 116 -8.808 15.232 6.043 1814 HA ARG 116 HA ARG 116 -11.515 16.031 5.372 1815 HB2 ARG 116 2HB ARG 116 -10.928 13.663 5.948 1816 HB3 ARG 116 3HB ARG 116 -10.542 14.172 7.581 1817 HG2 ARG 116 2HG ARG 116 -13.187 15.105 7.182 1818 HG3 ARG 116 3HG ARG 116 -13.163 13.528 6.400 1819 HD2 ARG 116 2HD ARG 116 -13.884 13.285 8.702 1820 HD3 ARG 116 3HD ARG 116 -12.291 12.537 8.525 1821 HE ARG 116 HE ARG 116 -11.864 15.162 9.332 1822 HH11 ARG 116 1HH1 ARG 116 -13.364 12.281 10.714 1823 HH12 ARG 116 2HH1 ARG 116 -13.030 12.763 12.346 1824 HH21 ARG 116 1HH2 ARG 116 -11.451 15.774 11.470 1825 HH22 ARG 116 2HH2 ARG 116 -11.949 14.739 12.772 1826 H GLY 117 H GLY 117 -11.739 18.161 5.970 1827 HA2 GLY 117 2HA GLY 117 -11.114 19.323 8.474 1828 HA3 GLY 117 3HA GLY 117 -12.287 19.931 7.320 Start of MODEL 6 1 H1 SER 2 1H SER 2 -15.284 -15.258 -18.154 2 H2 SER 2 2H SER 2 -14.465 -14.298 -17.032 3 H3 SER 2 3H SER 2 -15.108 -13.602 -18.430 4 HA SER 2 HA SER 2 -17.299 -13.966 -17.738 5 HB2 SER 2 2HB SER 2 -16.098 -15.386 -15.327 6 HB3 SER 2 3HB SER 2 -17.821 -15.141 -15.633 7 HG SER 2 HG SER 2 -17.787 -16.845 -16.844 8 H LEU 3 H LEU 3 -18.341 -12.330 -16.611 9 HA LEU 3 HA LEU 3 -16.614 -10.309 -15.360 10 HB2 LEU 3 2HB LEU 3 -19.545 -10.151 -16.174 11 HB3 LEU 3 3HB LEU 3 -18.553 -8.804 -15.639 12 HG LEU 3 HG LEU 3 -18.091 -10.381 -18.202 13 HD11 LEU 3 1HD1 LEU 3 -18.933 -8.398 -19.375 14 HD12 LEU 3 2HD1 LEU 3 -19.335 -7.640 -17.830 15 HD13 LEU 3 3HD1 LEU 3 -20.163 -9.116 -18.336 16 HD21 LEU 3 1HD2 LEU 3 -16.745 -7.856 -17.185 17 HD22 LEU 3 2HD2 LEU 3 -16.519 -8.577 -18.781 18 HD23 LEU 3 3HD2 LEU 3 -16.011 -9.455 -17.343 19 H VAL 4 H VAL 4 -16.413 -10.423 -13.156 20 HA VAL 4 HA VAL 4 -18.674 -11.173 -11.447 21 HB VAL 4 HB VAL 4 -17.128 -10.695 -9.522 22 HG11 VAL 4 1HG1 VAL 4 -15.994 -12.606 -11.596 23 HG12 VAL 4 2HG1 VAL 4 -17.290 -12.964 -10.453 24 HG13 VAL 4 3HG1 VAL 4 -15.659 -12.649 -9.861 25 HG21 VAL 4 1HG2 VAL 4 -14.706 -10.309 -9.931 26 HG22 VAL 4 2HG2 VAL 4 -15.687 -8.969 -10.528 27 HG23 VAL 4 3HG2 VAL 4 -15.030 -10.148 -11.663 28 H LYS 5 H LYS 5 -20.018 -9.746 -10.507 29 HA LYS 5 HA LYS 5 -19.933 -6.949 -11.304 30 HB2 LYS 5 2HB LYS 5 -21.968 -8.280 -9.474 31 HB3 LYS 5 3HB LYS 5 -22.177 -6.809 -10.417 32 HG2 LYS 5 2HG LYS 5 -22.140 -8.159 -12.505 33 HG3 LYS 5 3HG LYS 5 -21.932 -9.624 -11.538 34 HD2 LYS 5 2HD LYS 5 -24.125 -9.082 -10.392 35 HD3 LYS 5 3HD LYS 5 -24.334 -7.759 -11.543 36 HE2 LYS 5 2HE LYS 5 -24.089 -10.694 -12.269 37 HE3 LYS 5 3HE LYS 5 -25.592 -9.778 -12.200 38 HZ1 LYS 5 1HZ LYS 5 -24.762 -9.998 -14.455 39 HZ2 LYS 5 2HZ LYS 5 -23.324 -9.223 -14.028 40 HZ3 LYS 5 3HZ LYS 5 -24.784 -8.376 -13.975 41 H LEU 6 H LEU 6 -18.930 -5.447 -10.068 42 HA LEU 6 HA LEU 6 -18.599 -5.905 -7.147 43 HB2 LEU 6 2HB LEU 6 -16.654 -4.558 -9.071 44 HB3 LEU 6 3HB LEU 6 -16.451 -4.641 -7.327 45 HG LEU 6 HG LEU 6 -16.456 -7.024 -9.222 46 HD11 LEU 6 1HD1 LEU 6 -14.157 -5.776 -7.693 47 HD12 LEU 6 2HD1 LEU 6 -14.436 -5.668 -9.432 48 HD13 LEU 6 3HD1 LEU 6 -14.085 -7.229 -8.696 49 HD21 LEU 6 1HD2 LEU 6 -17.400 -7.671 -7.063 50 HD22 LEU 6 2HD2 LEU 6 -16.019 -6.973 -6.214 51 HD23 LEU 6 3HD2 LEU 6 -15.796 -8.376 -7.264 52 H GLU 7 H GLU 7 -20.154 -4.655 -6.304 53 HA GLU 7 HA GLU 7 -20.803 -2.035 -7.358 54 HB2 GLU 7 2HB GLU 7 -21.829 -3.501 -4.882 55 HB3 GLU 7 3HB GLU 7 -22.391 -1.909 -5.401 56 HG2 GLU 7 2HG GLU 7 -24.003 -3.512 -6.130 57 HG3 GLU 7 3HG GLU 7 -23.132 -2.955 -7.559 58 H SER 8 H SER 8 -20.647 -0.128 -6.194 59 HA SER 8 HA SER 8 -18.256 0.175 -4.539 60 HB2 SER 8 2HB SER 8 -18.800 2.643 -4.982 61 HB3 SER 8 3HB SER 8 -18.459 1.669 -6.413 62 HG SER 8 HG SER 8 -20.480 1.835 -7.045 63 H SER 9 H SER 9 -18.602 2.109 -2.879 64 HA SER 9 HA SER 9 -20.470 1.553 -0.848 65 HB2 SER 9 2HB SER 9 -19.808 3.808 0.021 66 HB3 SER 9 3HB SER 9 -18.415 2.831 -0.428 67 HG SER 9 HG SER 9 -19.280 5.204 -1.448 68 H ASP 10 H ASP 10 -20.584 3.640 -3.700 69 HA ASP 10 HA ASP 10 -23.187 4.792 -3.260 70 HB2 ASP 10 2HB ASP 10 -21.504 4.506 -5.787 71 HB3 ASP 10 3HB ASP 10 -22.981 5.452 -5.697 72 H GLU 11 H GLU 11 -22.309 1.661 -3.920 73 HA GLU 11 HA GLU 11 -23.348 -0.240 -4.490 74 HB2 GLU 11 2HB GLU 11 -25.870 1.459 -4.456 75 HB3 GLU 11 3HB GLU 11 -25.864 -0.296 -4.585 76 HG2 GLU 11 2HG GLU 11 -24.815 -0.476 -2.367 77 HG3 GLU 11 3HG GLU 11 -24.767 1.282 -2.232 78 H LYS 12 H LYS 12 -22.629 1.947 -6.639 79 HA LYS 12 HA LYS 12 -24.195 1.200 -8.931 80 HB2 LYS 12 2HB LYS 12 -21.491 2.602 -8.810 81 HB3 LYS 12 3HB LYS 12 -22.473 2.420 -10.257 82 HG2 LYS 12 2HG LYS 12 -24.301 3.727 -9.020 83 HG3 LYS 12 3HG LYS 12 -23.066 4.106 -7.812 84 HD2 LYS 12 2HD LYS 12 -21.656 5.099 -9.659 85 HD3 LYS 12 3HD LYS 12 -22.994 4.821 -10.774 86 HE2 LYS 12 2HE LYS 12 -23.001 7.141 -10.062 87 HE3 LYS 12 3HE LYS 12 -24.415 6.333 -9.381 88 HZ1 LYS 12 1HZ LYS 12 -23.266 7.780 -7.791 89 HZ2 LYS 12 2HZ LYS 12 -21.871 6.836 -7.922 90 HZ3 LYS 12 3HZ LYS 12 -23.285 6.174 -7.272 91 H VAL 13 H VAL 13 -23.887 -0.458 -10.297 92 HA VAL 13 HA VAL 13 -22.174 -2.637 -9.543 93 HB VAL 13 HB VAL 13 -23.990 -2.366 -11.989 94 HG11 VAL 13 1HG1 VAL 13 -22.354 -4.182 -12.258 95 HG12 VAL 13 2HG1 VAL 13 -23.977 -4.840 -12.045 96 HG13 VAL 13 3HG1 VAL 13 -22.831 -4.870 -10.703 97 HG21 VAL 13 1HG2 VAL 13 -24.640 -3.551 -9.265 98 HG22 VAL 13 2HG2 VAL 13 -25.703 -3.566 -10.675 99 HG23 VAL 13 3HG2 VAL 13 -25.269 -2.033 -9.915 100 H PHE 14 H PHE 14 -20.065 -2.714 -10.152 101 HA PHE 14 HA PHE 14 -19.299 -1.840 -12.886 102 HB2 PHE 14 2HB PHE 14 -17.568 -1.983 -10.376 103 HB3 PHE 14 3HB PHE 14 -16.980 -1.571 -11.986 104 HD1 PHE 14 HD1 PHE 14 -18.362 -0.256 -8.948 105 HD2 PHE 14 HD2 PHE 14 -18.060 0.469 -13.153 106 HE1 PHE 14 HE1 PHE 14 -18.953 2.102 -8.592 107 HE2 PHE 14 HE2 PHE 14 -18.646 2.826 -12.785 108 HZ PHE 14 HZ PHE 14 -19.095 3.643 -10.508 109 H GLU 15 H GLU 15 -19.955 -3.812 -13.750 110 HA GLU 15 HA GLU 15 -18.877 -6.348 -13.038 111 HB2 GLU 15 2HB GLU 15 -19.917 -5.328 -15.717 112 HB3 GLU 15 3HB GLU 15 -19.572 -7.018 -15.357 113 HG2 GLU 15 2HG GLU 15 -21.319 -7.015 -13.623 114 HG3 GLU 15 3HG GLU 15 -21.659 -5.319 -13.946 115 H ILE 16 H ILE 16 -16.903 -7.118 -13.384 116 HA ILE 16 HA ILE 16 -15.137 -6.083 -15.501 117 HB ILE 16 HB ILE 16 -14.537 -4.766 -13.498 118 HG12 ILE 16 2HG1 ILE 16 -12.447 -6.882 -14.192 119 HG13 ILE 16 3HG1 ILE 16 -12.703 -5.350 -15.020 120 HG21 ILE 16 1HG2 ILE 16 -13.707 -5.790 -11.424 121 HG22 ILE 16 2HG2 ILE 16 -14.022 -7.400 -12.075 122 HG23 ILE 16 3HG2 ILE 16 -15.365 -6.301 -11.756 123 HD11 ILE 16 1HD1 ILE 16 -11.676 -5.714 -12.209 124 HD12 ILE 16 2HD1 ILE 16 -12.003 -4.163 -12.985 125 HD13 ILE 16 3HD1 ILE 16 -10.761 -5.225 -13.631 126 H GLU 17 H GLU 17 -13.643 -7.654 -16.217 127 HA GLU 17 HA GLU 17 -14.300 -10.372 -15.973 128 HB2 GLU 17 2HB GLU 17 -11.644 -9.139 -16.812 129 HB3 GLU 17 3HB GLU 17 -12.117 -10.811 -17.094 130 HG2 GLU 17 2HG GLU 17 -13.966 -10.042 -18.550 131 HG3 GLU 17 3HG GLU 17 -13.493 -8.370 -18.253 132 H LYS 18 H LYS 18 -13.664 -11.944 -14.625 133 HA LYS 18 HA LYS 18 -12.973 -11.323 -11.975 134 HB2 LYS 18 2HB LYS 18 -14.398 -13.211 -12.573 135 HB3 LYS 18 3HB LYS 18 -13.081 -13.977 -13.459 136 HG2 LYS 18 2HG LYS 18 -11.848 -14.318 -11.332 137 HG3 LYS 18 3HG LYS 18 -13.165 -13.537 -10.447 138 HD2 LYS 18 2HD LYS 18 -13.286 -16.030 -10.330 139 HD3 LYS 18 3HD LYS 18 -14.716 -15.322 -11.085 140 HE2 LYS 18 2HE LYS 18 -13.826 -15.884 -13.317 141 HE3 LYS 18 3HE LYS 18 -12.376 -16.564 -12.580 142 HZ1 LYS 18 1HZ LYS 18 -13.715 -18.251 -11.543 143 HZ2 LYS 18 2HZ LYS 18 -14.014 -18.251 -13.209 144 HZ3 LYS 18 3HZ LYS 18 -15.134 -17.569 -12.142 145 H GLU 19 H GLU 19 -11.112 -12.767 -14.585 146 HA GLU 19 HA GLU 19 -8.704 -13.342 -13.242 147 HB2 GLU 19 2HB GLU 19 -7.673 -13.267 -15.574 148 HB3 GLU 19 3HB GLU 19 -9.011 -14.378 -15.361 149 HG2 GLU 19 2HG GLU 19 -9.661 -11.649 -16.429 150 HG3 GLU 19 3HG GLU 19 -8.794 -12.747 -17.491 151 H ILE 20 H ILE 20 -9.906 -10.333 -14.630 152 HA ILE 20 HA ILE 20 -7.448 -8.841 -14.338 153 HB ILE 20 HB ILE 20 -10.315 -7.813 -14.623 154 HG12 ILE 20 2HG1 ILE 20 -8.176 -8.270 -16.750 155 HG13 ILE 20 3HG1 ILE 20 -9.706 -9.122 -16.605 156 HG21 ILE 20 1HG2 ILE 20 -9.312 -5.666 -15.274 157 HG22 ILE 20 2HG2 ILE 20 -7.699 -6.323 -14.993 158 HG23 ILE 20 3HG2 ILE 20 -8.819 -6.126 -13.644 159 HD11 ILE 20 1HD1 ILE 20 -10.892 -7.014 -17.126 160 HD12 ILE 20 2HD1 ILE 20 -9.810 -7.543 -18.413 161 HD13 ILE 20 3HD1 ILE 20 -9.330 -6.218 -17.353 162 H ALA 21 H ALA 21 -10.424 -9.306 -12.472 163 HA ALA 21 HA ALA 21 -9.838 -7.496 -10.344 164 HB1 ALA 21 1HB ALA 21 -11.821 -9.791 -10.445 165 HB2 ALA 21 2HB ALA 21 -12.135 -8.130 -10.949 166 HB3 ALA 21 3HB ALA 21 -11.805 -8.488 -9.253 167 H CYS 22 H CYS 22 -8.785 -10.725 -11.006 168 HA CYS 22 HA CYS 22 -8.154 -11.533 -8.338 169 HB2 CYS 22 2HB CYS 22 -7.165 -12.527 -11.027 170 HB3 CYS 22 3HB CYS 22 -6.751 -13.282 -9.488 171 HG CYS 22 HG CYS 22 -10.041 -12.877 -9.844 172 H MET 23 H MET 23 -6.532 -9.469 -10.666 173 HA MET 23 HA MET 23 -3.898 -9.526 -9.586 174 HB2 MET 23 2HB MET 23 -5.203 -7.119 -10.910 175 HB3 MET 23 3HB MET 23 -3.483 -7.454 -10.775 176 HG2 MET 23 2HG MET 23 -3.894 -9.499 -12.234 177 HG3 MET 23 3HG MET 23 -5.506 -8.850 -12.526 178 HE1 MET 23 1HE MET 23 -4.298 -5.581 -12.346 179 HE2 MET 23 2HE MET 23 -5.685 -6.107 -13.303 180 HE3 MET 23 3HE MET 23 -4.335 -5.282 -14.082 181 H SER 24 H SER 24 -6.799 -7.782 -8.714 182 HA SER 24 HA SER 24 -5.748 -6.419 -6.423 183 HB2 SER 24 2HB SER 24 -7.914 -5.760 -7.408 184 HB3 SER 24 3HB SER 24 -8.569 -7.371 -7.112 185 HG SER 24 HG SER 24 -7.767 -5.462 -5.187 186 H VAL 25 H VAL 25 -4.812 -7.537 -4.771 187 HA VAL 25 HA VAL 25 -5.052 -10.349 -4.453 188 HB VAL 25 HB VAL 25 -3.906 -8.389 -2.418 189 HG11 VAL 25 1HG1 VAL 25 -3.410 -11.368 -2.721 190 HG12 VAL 25 2HG1 VAL 25 -4.308 -10.586 -1.418 191 HG13 VAL 25 3HG1 VAL 25 -2.575 -10.301 -1.587 192 HG21 VAL 25 1HG2 VAL 25 -2.798 -8.091 -4.600 193 HG22 VAL 25 2HG2 VAL 25 -2.447 -9.820 -4.668 194 HG23 VAL 25 3HG2 VAL 25 -1.692 -8.816 -3.428 195 H THR 26 H THR 26 -6.615 -7.594 -2.829 196 HA THR 26 HA THR 26 -7.848 -8.966 -0.694 197 HB THR 26 HB THR 26 -8.897 -6.482 -2.128 198 HG1 THR 26 HG1 THR 26 -6.802 -6.922 -0.378 199 HG21 THR 26 1HG2 THR 26 -9.409 -7.470 0.710 200 HG22 THR 26 2HG2 THR 26 -10.589 -7.475 -0.602 201 HG23 THR 26 3HG2 THR 26 -9.982 -5.945 0.032 202 H ILE 27 H ILE 27 -9.123 -8.159 -3.954 203 HA ILE 27 HA ILE 27 -11.652 -9.421 -3.649 204 HB ILE 27 HB ILE 27 -10.099 -8.739 -6.189 205 HG12 ILE 27 2HG1 ILE 27 -12.391 -7.225 -4.836 206 HG13 ILE 27 3HG1 ILE 27 -10.693 -6.783 -4.719 207 HG21 ILE 27 1HG2 ILE 27 -12.243 -8.945 -7.415 208 HG22 ILE 27 2HG2 ILE 27 -13.033 -9.511 -5.945 209 HG23 ILE 27 3HG2 ILE 27 -11.765 -10.484 -6.692 210 HD11 ILE 27 1HD1 ILE 27 -10.626 -6.353 -7.115 211 HD12 ILE 27 2HD1 ILE 27 -11.863 -5.386 -6.313 212 HD13 ILE 27 3HD1 ILE 27 -12.327 -6.804 -7.252 213 H LYS 28 H LYS 28 -8.501 -10.535 -4.869 214 HA LYS 28 HA LYS 28 -9.180 -13.132 -5.712 215 HB2 LYS 28 2HB LYS 28 -6.974 -12.064 -6.178 216 HB3 LYS 28 3HB LYS 28 -6.566 -12.162 -4.469 217 HG2 LYS 28 2HG LYS 28 -6.842 -14.718 -4.707 218 HG3 LYS 28 3HG LYS 28 -6.878 -14.437 -6.448 219 HD2 LYS 28 2HD LYS 28 -4.617 -15.073 -5.754 220 HD3 LYS 28 3HD LYS 28 -4.612 -13.400 -6.316 221 HE2 LYS 28 2HE LYS 28 -4.538 -12.574 -4.031 222 HE3 LYS 28 3HE LYS 28 -4.764 -14.202 -3.383 223 HZ1 LYS 28 1HZ LYS 28 -2.441 -13.497 -3.274 224 HZ2 LYS 28 2HZ LYS 28 -2.402 -13.290 -4.948 225 HZ3 LYS 28 3HZ LYS 28 -2.619 -14.831 -4.296 226 H ASN 29 H ASN 29 -8.312 -11.840 -2.502 227 HA ASN 29 HA ASN 29 -8.242 -14.346 -1.123 228 HB2 ASN 29 2HB ASN 29 -8.536 -11.499 -0.054 229 HB3 ASN 29 3HB ASN 29 -8.369 -12.914 0.980 230 HD21 ASN 29 1HD2 ASN 29 -6.375 -14.144 -0.950 231 HD22 ASN 29 2HD2 ASN 29 -4.914 -13.273 -0.642 232 H MET 30 H MET 30 -10.778 -11.990 -1.812 233 HA MET 30 HA MET 30 -12.844 -13.099 -0.193 234 HB2 MET 30 2HB MET 30 -13.028 -11.483 -2.779 235 HB3 MET 30 3HB MET 30 -14.410 -11.888 -1.770 236 HG2 MET 30 2HG MET 30 -13.457 -10.575 0.076 237 HG3 MET 30 3HG MET 30 -12.059 -10.178 -0.925 238 HE1 MET 30 1HE MET 30 -12.416 -7.558 -0.521 239 HE2 MET 30 2HE MET 30 -13.789 -7.922 0.526 240 HE3 MET 30 3HE MET 30 -13.959 -6.742 -0.771 241 H ILE 31 H ILE 31 -11.768 -13.680 -3.518 242 HA ILE 31 HA ILE 31 -13.709 -15.611 -4.275 243 HB ILE 31 HB ILE 31 -10.887 -15.041 -5.302 244 HG12 ILE 31 2HG1 ILE 31 -13.616 -14.361 -6.495 245 HG13 ILE 31 3HG1 ILE 31 -12.583 -13.232 -5.629 246 HG21 ILE 31 1HG2 ILE 31 -12.930 -16.897 -6.569 247 HG22 ILE 31 2HG2 ILE 31 -11.394 -17.381 -5.852 248 HG23 ILE 31 3HG2 ILE 31 -11.411 -16.390 -7.311 249 HD11 ILE 31 1HD1 ILE 31 -11.959 -14.547 -8.271 250 HD12 ILE 31 2HD1 ILE 31 -10.881 -13.463 -7.387 251 HD13 ILE 31 3HD1 ILE 31 -12.423 -12.866 -7.998 252 H GLU 32 H GLU 32 -10.566 -15.866 -2.635 253 HA GLU 32 HA GLU 32 -10.439 -18.746 -2.702 254 HB2 GLU 32 2HB GLU 32 -8.861 -16.708 -1.076 255 HB3 GLU 32 3HB GLU 32 -8.506 -18.432 -1.111 256 HG2 GLU 32 2HG GLU 32 -8.014 -18.317 -3.509 257 HG3 GLU 32 3HG GLU 32 -8.434 -16.607 -3.534 258 H ASP 33 H ASP 33 -11.571 -16.352 -0.342 259 HA ASP 33 HA ASP 33 -11.768 -18.194 1.878 260 HB2 ASP 33 2HB ASP 33 -11.278 -15.816 2.281 261 HB3 ASP 33 3HB ASP 33 -12.789 -15.338 1.516 262 H ILE 34 H ILE 34 -14.083 -16.589 -0.295 263 HA ILE 34 HA ILE 34 -16.425 -17.790 0.950 264 HB ILE 34 HB ILE 34 -16.224 -16.049 -1.569 265 HG12 ILE 34 2HG1 ILE 34 -16.917 -15.216 1.295 266 HG13 ILE 34 3HG1 ILE 34 -15.384 -14.894 0.496 267 HG21 ILE 34 1HG2 ILE 34 -18.678 -16.728 0.103 268 HG22 ILE 34 2HG2 ILE 34 -18.337 -17.325 -1.523 269 HG23 ILE 34 3HG2 ILE 34 -18.642 -15.608 -1.261 270 HD11 ILE 34 1HD1 ILE 34 -18.073 -13.778 -0.310 271 HD12 ILE 34 2HD1 ILE 34 -16.545 -13.483 -1.144 272 HD13 ILE 34 3HD1 ILE 34 -16.766 -12.921 0.510 273 H GLY 35 H GLY 35 -14.210 -18.633 -1.543 274 HA2 GLY 35 2HA GLY 35 -14.092 -20.618 -2.758 275 HA3 GLY 35 3HA GLY 35 -15.750 -21.000 -2.317 276 H GLU 36 H GLU 36 -14.879 -17.906 -3.598 277 HA GLU 36 HA GLU 36 -15.107 -16.773 -5.490 278 HB2 GLU 36 2HB GLU 36 -14.120 -18.677 -6.723 279 HB3 GLU 36 3HB GLU 36 -15.716 -19.402 -6.896 280 HG2 GLU 36 2HG GLU 36 -16.457 -17.443 -8.220 281 HG3 GLU 36 3HG GLU 36 -14.848 -16.732 -8.068 282 H SER 37 H SER 37 -16.727 -15.461 -5.957 283 HA SER 37 HA SER 37 -19.522 -16.441 -5.888 284 HB2 SER 37 2HB SER 37 -18.468 -13.667 -5.176 285 HB3 SER 37 3HB SER 37 -20.155 -14.185 -5.117 286 HG SER 37 HG SER 37 -18.894 -15.941 -3.688 287 H ASP 38 H ASP 38 -20.152 -16.635 -7.941 288 HA ASP 38 HA ASP 38 -19.544 -14.843 -10.107 289 HB2 ASP 38 2HB ASP 38 -20.238 -17.219 -10.475 290 HB3 ASP 38 3HB ASP 38 -21.807 -16.878 -9.761 291 H SER 39 H SER 39 -21.934 -15.151 -7.597 292 HA SER 39 HA SER 39 -23.827 -13.216 -8.220 293 HB2 SER 39 2HB SER 39 -22.767 -14.042 -5.475 294 HB3 SER 39 3HB SER 39 -24.324 -13.268 -5.794 295 HG SER 39 HG SER 39 -25.038 -15.091 -6.778 296 HA PRO 40 HA PRO 40 -21.730 -9.293 -7.782 297 HB2 PRO 40 2HB PRO 40 -23.704 -7.658 -6.773 298 HB3 PRO 40 3HB PRO 40 -23.721 -8.279 -8.433 299 HG2 PRO 40 2HG PRO 40 -25.174 -9.318 -6.030 300 HG3 PRO 40 3HG PRO 40 -25.789 -9.024 -7.675 301 HD2 PRO 40 2HD PRO 40 -25.093 -11.509 -6.875 302 HD3 PRO 40 3HD PRO 40 -24.809 -10.964 -8.543 303 H ILE 41 H ILE 41 -20.489 -8.150 -6.336 304 HA ILE 41 HA ILE 41 -20.770 -8.681 -3.434 305 HB ILE 41 HB ILE 41 -18.171 -8.526 -5.053 306 HG12 ILE 41 2HG1 ILE 41 -19.312 -10.720 -5.299 307 HG13 ILE 41 3HG1 ILE 41 -17.815 -10.891 -4.393 308 HG21 ILE 41 1HG2 ILE 41 -16.984 -9.005 -2.931 309 HG22 ILE 41 2HG2 ILE 41 -18.509 -8.896 -2.048 310 HG23 ILE 41 3HG2 ILE 41 -17.851 -7.469 -2.853 311 HD11 ILE 41 1HD1 ILE 41 -19.565 -12.265 -3.448 312 HD12 ILE 41 2HD1 ILE 41 -20.609 -10.863 -3.238 313 HD13 ILE 41 3HD1 ILE 41 -19.120 -11.004 -2.297 314 HA PRO 42 HA PRO 42 -20.534 -4.111 -3.586 315 HB2 PRO 42 2HB PRO 42 -21.570 -3.592 -1.125 316 HB3 PRO 42 3HB PRO 42 -22.597 -4.120 -2.474 317 HG2 PRO 42 2HG PRO 42 -21.567 -5.718 -0.167 318 HG3 PRO 42 3HG PRO 42 -23.160 -5.775 -0.951 319 HD2 PRO 42 2HD PRO 42 -21.081 -7.568 -1.460 320 HD3 PRO 42 3HD PRO 42 -22.445 -7.266 -2.557 321 H LEU 43 H LEU 43 -18.935 -2.769 -2.942 322 HA LEU 43 HA LEU 43 -16.954 -3.660 -0.929 323 HB2 LEU 43 2HB LEU 43 -16.595 -1.892 -3.394 324 HB3 LEU 43 3HB LEU 43 -15.382 -2.056 -2.142 325 HG LEU 43 HG LEU 43 -15.207 -4.528 -2.695 326 HD11 LEU 43 1HD1 LEU 43 -16.925 -3.852 -5.093 327 HD12 LEU 43 2HD1 LEU 43 -17.377 -4.904 -3.751 328 HD13 LEU 43 3HD1 LEU 43 -16.064 -5.371 -4.828 329 HD21 LEU 43 1HD2 LEU 43 -14.593 -2.630 -4.973 330 HD22 LEU 43 2HD2 LEU 43 -13.862 -4.219 -4.726 331 HD23 LEU 43 3HD2 LEU 43 -13.576 -2.926 -3.562 332 HA PRO 44 HA PRO 44 -19.097 -0.003 0.914 333 HB2 PRO 44 2HB PRO 44 -19.222 -0.858 3.479 334 HB3 PRO 44 3HB PRO 44 -20.238 -1.605 2.227 335 HG2 PRO 44 2HG PRO 44 -17.693 -2.628 3.440 336 HG3 PRO 44 3HG PRO 44 -19.182 -3.512 3.036 337 HD2 PRO 44 2HD PRO 44 -16.909 -3.439 1.419 338 HD3 PRO 44 3HD PRO 44 -18.545 -3.828 0.847 339 H ASN 45 H ASN 45 -16.943 0.944 0.185 340 HA ASN 45 HA ASN 45 -15.611 2.307 2.307 341 HB2 ASN 45 2HB ASN 45 -14.376 0.181 2.578 342 HB3 ASN 45 3HB ASN 45 -14.004 0.136 0.860 343 HD21 ASN 45 1HD2 ASN 45 -13.295 1.736 3.900 344 HD22 ASN 45 2HD2 ASN 45 -11.810 2.455 3.393 345 H VAL 46 H VAL 46 -15.040 1.093 -0.991 346 HA VAL 46 HA VAL 46 -13.834 3.620 -1.825 347 HB VAL 46 HB VAL 46 -12.682 1.551 -2.452 348 HG11 VAL 46 1HG1 VAL 46 -13.603 -0.091 -4.028 349 HG12 VAL 46 2HG1 VAL 46 -15.142 0.772 -4.045 350 HG13 VAL 46 3HG1 VAL 46 -14.581 0.004 -2.560 351 HG21 VAL 46 1HG2 VAL 46 -12.432 3.460 -3.965 352 HG22 VAL 46 2HG2 VAL 46 -13.838 2.938 -4.897 353 HG23 VAL 46 3HG2 VAL 46 -12.377 1.948 -4.874 354 H THR 47 H THR 47 -14.868 5.142 -2.993 355 HA THR 47 HA THR 47 -17.694 5.015 -3.474 356 HB THR 47 HB THR 47 -17.411 7.309 -4.426 357 HG1 THR 47 HG1 THR 47 -14.705 7.372 -3.728 358 HG21 THR 47 1HG2 THR 47 -17.638 7.056 -1.968 359 HG22 THR 47 2HG2 THR 47 -16.606 8.425 -2.385 360 HG23 THR 47 3HG2 THR 47 -15.883 6.915 -1.822 361 H SER 48 H SER 48 -18.598 5.715 -5.670 362 HA SER 48 HA SER 48 -17.983 3.618 -7.496 363 HB2 SER 48 2HB SER 48 -19.806 4.665 -8.902 364 HB3 SER 48 3HB SER 48 -20.273 4.294 -7.246 365 HG SER 48 HG SER 48 -19.324 6.771 -7.287 366 H THR 49 H THR 49 -17.346 7.112 -7.565 367 HA THR 49 HA THR 49 -16.414 7.289 -10.233 368 HB THR 49 HB THR 49 -15.261 9.421 -9.377 369 HG1 THR 49 HG1 THR 49 -15.875 9.982 -7.200 370 HG21 THR 49 1HG2 THR 49 -17.567 9.509 -10.288 371 HG22 THR 49 2HG2 THR 49 -17.382 10.631 -8.937 372 HG23 THR 49 3HG2 THR 49 -18.216 9.095 -8.698 373 H ILE 50 H ILE 50 -14.775 6.620 -7.152 374 HA ILE 50 HA ILE 50 -12.123 6.553 -8.261 375 HB ILE 50 HB ILE 50 -13.143 5.522 -5.571 376 HG12 ILE 50 2HG1 ILE 50 -13.508 7.939 -5.798 377 HG13 ILE 50 3HG1 ILE 50 -12.207 7.655 -4.650 378 HG21 ILE 50 1HG2 ILE 50 -10.280 6.006 -6.469 379 HG22 ILE 50 2HG2 ILE 50 -11.015 4.440 -6.129 380 HG23 ILE 50 3HG2 ILE 50 -10.777 5.604 -4.824 381 HD11 ILE 50 1HD1 ILE 50 -11.908 8.567 -7.515 382 HD12 ILE 50 2HD1 ILE 50 -10.570 8.237 -6.411 383 HD13 ILE 50 3HD1 ILE 50 -11.704 9.540 -6.061 384 H LEU 51 H LEU 51 -14.532 4.075 -7.303 385 HA LEU 51 HA LEU 51 -12.883 1.802 -7.678 386 HB2 LEU 51 2HB LEU 51 -14.954 1.746 -6.293 387 HB3 LEU 51 3HB LEU 51 -15.929 1.935 -7.743 388 HG LEU 51 HG LEU 51 -15.128 -0.277 -8.579 389 HD11 LEU 51 1HD1 LEU 51 -12.922 -0.355 -7.532 390 HD12 LEU 51 2HD1 LEU 51 -13.852 -1.802 -7.157 391 HD13 LEU 51 3HD1 LEU 51 -13.661 -0.539 -5.938 392 HD21 LEU 51 1HD2 LEU 51 -17.211 -0.192 -7.287 393 HD22 LEU 51 2HD2 LEU 51 -16.309 -0.456 -5.791 394 HD23 LEU 51 3HD2 LEU 51 -16.357 -1.713 -7.031 395 H GLU 52 H GLU 52 -15.086 3.540 -9.846 396 HA GLU 52 HA GLU 52 -15.086 1.865 -12.079 397 HB2 GLU 52 2HB GLU 52 -16.491 3.878 -11.992 398 HB3 GLU 52 3HB GLU 52 -15.067 4.918 -11.968 399 HG2 GLU 52 2HG GLU 52 -14.476 4.159 -14.248 400 HG3 GLU 52 3HG GLU 52 -15.889 3.108 -14.267 401 H LYS 53 H LYS 53 -12.839 4.446 -11.140 402 HA LYS 53 HA LYS 53 -11.082 4.195 -13.368 403 HB2 LYS 53 2HB LYS 53 -10.711 5.549 -10.667 404 HB3 LYS 53 3HB LYS 53 -9.579 5.683 -12.008 405 HG2 LYS 53 2HG LYS 53 -11.425 6.676 -13.401 406 HG3 LYS 53 3HG LYS 53 -12.448 6.664 -11.960 407 HD2 LYS 53 2HD LYS 53 -11.439 8.897 -12.349 408 HD3 LYS 53 3HD LYS 53 -10.909 8.206 -10.815 409 HE2 LYS 53 2HE LYS 53 -8.726 7.783 -11.620 410 HE3 LYS 53 3HE LYS 53 -9.229 7.880 -13.305 411 HZ1 LYS 53 1HZ LYS 53 -7.946 9.820 -12.502 412 HZ2 LYS 53 2HZ LYS 53 -9.233 10.206 -11.473 413 HZ3 LYS 53 3HZ LYS 53 -9.457 10.212 -13.146 414 H VAL 54 H VAL 54 -11.110 2.774 -10.135 415 HA VAL 54 HA VAL 54 -8.442 1.791 -10.073 416 HB VAL 54 HB VAL 54 -10.962 0.967 -8.542 417 HG11 VAL 54 1HG1 VAL 54 -9.496 -0.289 -6.986 418 HG12 VAL 54 2HG1 VAL 54 -8.125 -0.008 -8.059 419 HG13 VAL 54 3HG1 VAL 54 -9.485 -0.989 -8.607 420 HG21 VAL 54 1HG2 VAL 54 -9.916 2.148 -6.642 421 HG22 VAL 54 2HG2 VAL 54 -10.090 3.228 -8.025 422 HG23 VAL 54 3HG2 VAL 54 -8.515 2.538 -7.643 423 H LEU 55 H LEU 55 -11.566 0.313 -10.935 424 HA LEU 55 HA LEU 55 -10.474 -2.218 -11.725 425 HB2 LEU 55 2HB LEU 55 -13.213 -1.003 -12.253 426 HB3 LEU 55 3HB LEU 55 -12.778 -2.667 -12.589 427 HG LEU 55 HG LEU 55 -12.985 -1.368 -9.844 428 HD11 LEU 55 1HD1 LEU 55 -14.625 -3.588 -11.102 429 HD12 LEU 55 2HD1 LEU 55 -15.142 -1.921 -10.835 430 HD13 LEU 55 3HD1 LEU 55 -14.803 -2.965 -9.458 431 HD21 LEU 55 1HD2 LEU 55 -12.442 -3.566 -8.874 432 HD22 LEU 55 2HD2 LEU 55 -11.095 -2.917 -9.802 433 HD23 LEU 55 3HD2 LEU 55 -12.095 -4.203 -10.482 434 H ASP 56 H ASP 56 -11.140 0.808 -13.357 435 HA ASP 56 HA ASP 56 -10.905 -0.137 -16.058 436 HB2 ASP 56 2HB ASP 56 -12.124 1.935 -15.571 437 HB3 ASP 56 3HB ASP 56 -10.677 2.682 -14.904 438 H TYR 57 H TYR 57 -8.665 1.183 -13.672 439 HA TYR 57 HA TYR 57 -6.379 1.432 -15.374 440 HB2 TYR 57 2HB TYR 57 -6.537 2.634 -13.203 441 HB3 TYR 57 3HB TYR 57 -6.533 1.105 -12.335 442 HD1 TYR 57 HD1 TYR 57 -4.417 -0.061 -11.890 443 HD2 TYR 57 HD2 TYR 57 -4.456 3.412 -14.394 444 HE1 TYR 57 HE1 TYR 57 -1.961 0.034 -11.807 445 HE2 TYR 57 HE2 TYR 57 -2.009 3.501 -14.301 446 HH TYR 57 HH TYR 57 -0.091 0.993 -12.907 447 H CYS 58 H CYS 58 -7.573 -1.045 -13.119 448 HA CYS 58 HA CYS 58 -5.565 -2.978 -13.500 449 HB2 CYS 58 2HB CYS 58 -8.489 -3.283 -12.702 450 HB3 CYS 58 3HB CYS 58 -7.304 -4.592 -12.624 451 HG CYS 58 HG CYS 58 -7.954 -2.262 -10.433 452 H ARG 59 H ARG 59 -8.632 -2.362 -15.181 453 HA ARG 59 HA ARG 59 -8.715 -4.573 -16.921 454 HB2 ARG 59 2HB ARG 59 -10.629 -3.007 -16.518 455 HB3 ARG 59 3HB ARG 59 -9.781 -1.753 -17.416 456 HG2 ARG 59 2HG ARG 59 -9.854 -3.322 -19.434 457 HG3 ARG 59 3HG ARG 59 -10.949 -4.341 -18.489 458 HD2 ARG 59 2HD ARG 59 -12.240 -2.869 -19.949 459 HD3 ARG 59 3HD ARG 59 -12.510 -2.418 -18.265 460 HE ARG 59 HE ARG 59 -11.190 -0.462 -18.587 461 HH11 ARG 59 1HH1 ARG 59 -11.715 -2.198 -21.608 462 HH12 ARG 59 2HH1 ARG 59 -11.306 -0.833 -22.594 463 HH21 ARG 59 1HH2 ARG 59 -10.641 1.295 -19.892 464 HH22 ARG 59 2HH2 ARG 59 -10.699 1.141 -21.624 465 H HIS 60 H HIS 60 -7.417 -1.320 -17.324 466 HA HIS 60 HA HIS 60 -6.318 -1.495 -19.885 467 HB2 HIS 60 2HB HIS 60 -6.548 0.681 -18.894 468 HB3 HIS 60 3HB HIS 60 -5.648 0.206 -17.452 469 HD1 HIS 60 HD1 HIS 60 -5.090 1.067 -21.107 470 HD2 HIS 60 HD2 HIS 60 -2.922 0.628 -17.600 471 HE1 HIS 60 HE1 HIS 60 -2.770 1.862 -21.638 472 HE2 HIS 60 HE2 HIS 60 -1.577 1.802 -19.434 473 H HIS 61 H HIS 61 -4.887 -2.247 -16.704 474 HA HIS 61 HA HIS 61 -2.217 -2.567 -17.702 475 HB2 HIS 61 2HB HIS 61 -2.902 -1.871 -15.333 476 HB3 HIS 61 3HB HIS 61 -3.295 -3.557 -15.020 477 HD1 HIS 61 HD1 HIS 61 -1.096 -5.240 -15.519 478 HD2 HIS 61 HD2 HIS 61 -0.357 -1.240 -14.665 479 HE1 HIS 61 HE1 HIS 61 1.307 -5.134 -14.810 480 HE2 HIS 61 HE2 HIS 61 1.776 -2.679 -14.533 481 H HIS 62 H HIS 62 -4.903 -4.768 -17.138 482 HA HIS 62 HA HIS 62 -3.317 -7.191 -17.235 483 HB2 HIS 62 2HB HIS 62 -5.365 -7.065 -15.856 484 HB3 HIS 62 3HB HIS 62 -6.338 -6.781 -17.291 485 HD1 HIS 62 HD1 HIS 62 -4.852 -9.478 -15.234 486 HD2 HIS 62 HD2 HIS 62 -6.653 -9.121 -18.969 487 HE1 HIS 62 HE1 HIS 62 -5.517 -11.804 -15.905 488 HE2 HIS 62 HE2 HIS 62 -6.594 -11.565 -18.155 489 H GLN 63 H GLN 63 -5.596 -5.511 -19.389 490 HA GLN 63 HA GLN 63 -5.386 -7.421 -21.551 491 HB2 GLN 63 2HB GLN 63 -6.614 -4.631 -21.454 492 HB3 GLN 63 3HB GLN 63 -6.799 -5.770 -22.788 493 HG2 GLN 63 2HG GLN 63 -7.984 -7.339 -21.316 494 HG3 GLN 63 3HG GLN 63 -7.757 -6.252 -19.945 495 HE21 GLN 63 1HE2 GLN 63 -10.229 -7.278 -21.143 496 HE22 GLN 63 2HE2 GLN 63 -11.156 -5.885 -21.559 497 H HIS 64 H HIS 64 -3.941 -4.356 -20.704 498 HA HIS 64 HA HIS 64 -2.003 -4.580 -22.936 499 HB2 HIS 64 2HB HIS 64 -3.197 -2.010 -21.786 500 HB3 HIS 64 3HB HIS 64 -1.866 -2.065 -22.930 501 HD1 HIS 64 HD1 HIS 64 -2.450 -2.295 -25.390 502 HD2 HIS 64 HD2 HIS 64 -5.748 -2.698 -22.904 503 HE1 HIS 64 HE1 HIS 64 -4.448 -2.185 -26.899 504 HE2 HIS 64 HE2 HIS 64 -6.420 -2.212 -25.348 505 HA PRO 65 HA PRO 65 0.239 -5.098 -18.861 506 HB2 PRO 65 2HB PRO 65 2.316 -6.000 -20.865 507 HB3 PRO 65 3HB PRO 65 1.834 -6.746 -19.323 508 HG2 PRO 65 2HG PRO 65 0.996 -7.821 -21.582 509 HG3 PRO 65 3HG PRO 65 -0.145 -7.654 -20.225 510 HD2 PRO 65 2HD PRO 65 0.100 -5.949 -22.707 511 HD3 PRO 65 3HD PRO 65 -1.363 -6.556 -21.892 512 H GLY 66 H GLY 66 1.221 -3.350 -21.759 513 HA2 GLY 66 2HA GLY 66 2.040 -1.177 -21.884 514 HA3 GLY 66 3HA GLY 66 2.343 -1.200 -20.153 515 H GLY 67 H GLY 67 3.573 -3.806 -22.137 516 HA2 GLY 67 2HA GLY 67 6.334 -3.098 -21.491 517 HA3 GLY 67 3HA GLY 67 5.763 -4.592 -22.216 518 H SER 68 H SER 68 5.741 -1.122 -23.080 519 HA SER 68 HA SER 68 7.280 -1.629 -25.523 520 HB2 SER 68 2HB SER 68 4.537 -0.291 -25.563 521 HB3 SER 68 3HB SER 68 5.658 -0.317 -26.924 522 HG SER 68 HG SER 68 5.521 -2.762 -26.477 523 H GLY 69 H GLY 69 8.904 -0.550 -24.379 524 HA2 GLY 69 2HA GLY 69 10.252 1.276 -24.019 525 HA3 GLY 69 3HA GLY 69 9.006 2.289 -24.729 526 H LEU 70 H LEU 70 10.289 0.958 -21.771 527 HA LEU 70 HA LEU 70 8.268 2.074 -20.019 528 HB2 LEU 70 2HB LEU 70 10.976 0.778 -19.458 529 HB3 LEU 70 3HB LEU 70 9.934 1.406 -18.195 530 HG LEU 70 HG LEU 70 8.160 -0.249 -18.866 531 HD11 LEU 70 1HD1 LEU 70 8.705 -2.170 -20.282 532 HD12 LEU 70 2HD1 LEU 70 10.263 -1.445 -20.687 533 HD13 LEU 70 3HD1 LEU 70 8.767 -0.661 -21.190 534 HD21 LEU 70 1HD2 LEU 70 9.662 -0.733 -16.989 535 HD22 LEU 70 2HD2 LEU 70 10.817 -1.492 -18.086 536 HD23 LEU 70 3HD2 LEU 70 9.223 -2.210 -17.843 537 H ASP 71 H ASP 71 8.401 4.190 -20.952 538 HA ASP 71 HA ASP 71 9.966 6.195 -19.817 539 HB2 ASP 71 2HB ASP 71 11.865 5.151 -21.071 540 HB3 ASP 71 3HB ASP 71 10.981 5.332 -22.580 541 H ASP 72 H ASP 72 8.159 4.943 -22.539 542 HA ASP 72 HA ASP 72 7.359 7.160 -23.975 543 HB2 ASP 72 2HB ASP 72 6.845 4.894 -24.725 544 HB3 ASP 72 3HB ASP 72 5.825 4.610 -23.321 545 H ILE 73 H ILE 73 5.861 5.824 -21.053 546 HA ILE 73 HA ILE 73 4.236 6.444 -19.637 547 HB ILE 73 HB ILE 73 4.926 9.313 -20.414 548 HG12 ILE 73 2HG1 ILE 73 6.924 8.127 -19.584 549 HG13 ILE 73 3HG1 ILE 73 6.407 9.324 -18.406 550 HG21 ILE 73 1HG2 ILE 73 2.754 9.214 -19.277 551 HG22 ILE 73 2HG2 ILE 73 3.953 9.955 -18.216 552 HG23 ILE 73 3HG2 ILE 73 3.460 8.281 -17.954 553 HD11 ILE 73 1HD1 ILE 73 5.956 6.341 -18.242 554 HD12 ILE 73 2HD1 ILE 73 5.396 7.521 -17.055 555 HD13 ILE 73 3HD1 ILE 73 7.122 7.286 -17.320 556 HA PRO 74 HA PRO 74 1.186 6.443 -23.121 557 HB2 PRO 74 2HB PRO 74 -0.393 4.972 -21.018 558 HB3 PRO 74 3HB PRO 74 -0.114 4.549 -22.721 559 HG2 PRO 74 2HG PRO 74 1.163 3.226 -20.805 560 HG3 PRO 74 3HG PRO 74 2.016 3.673 -22.303 561 HD2 PRO 74 2HD PRO 74 2.149 4.984 -19.591 562 HD3 PRO 74 3HD PRO 74 3.462 4.632 -20.742 563 HA PRO 75 HA PRO 75 -0.954 10.152 -21.559 564 HB2 PRO 75 2HB PRO 75 -2.679 9.697 -23.987 565 HB3 PRO 75 3HB PRO 75 -1.785 11.150 -23.489 566 HG2 PRO 75 2HG PRO 75 -0.874 9.674 -25.500 567 HG3 PRO 75 3HG PRO 75 0.260 10.353 -24.307 568 HD2 PRO 75 2HD PRO 75 -0.799 7.537 -24.510 569 HD3 PRO 75 3HD PRO 75 0.858 8.099 -24.179 570 H TYR 76 H TYR 76 -2.470 7.099 -22.263 571 HA TYR 76 HA TYR 76 -5.044 7.463 -21.204 572 HB2 TYR 76 2HB TYR 76 -4.151 5.443 -22.510 573 HB3 TYR 76 3HB TYR 76 -3.358 4.915 -21.036 574 HD1 TYR 76 HD1 TYR 76 -6.398 4.843 -22.947 575 HD2 TYR 76 HD2 TYR 76 -4.895 4.399 -18.965 576 HE1 TYR 76 HE1 TYR 76 -8.431 3.640 -22.310 577 HE2 TYR 76 HE2 TYR 76 -6.947 3.195 -18.330 578 HH TYR 76 HH TYR 76 -9.259 2.955 -19.089 579 H ASP 77 H ASP 77 -2.079 6.200 -19.668 580 HA ASP 77 HA ASP 77 -3.147 6.011 -17.020 581 HB2 ASP 77 2HB ASP 77 -0.252 5.980 -17.977 582 HB3 ASP 77 3HB ASP 77 -0.792 5.503 -16.367 583 H ARG 78 H ARG 78 -1.441 8.480 -18.806 584 HA ARG 78 HA ARG 78 -0.701 10.085 -16.549 585 HB2 ARG 78 2HB ARG 78 0.472 10.080 -18.780 586 HB3 ARG 78 3HB ARG 78 -0.914 10.921 -19.472 587 HG2 ARG 78 2HG ARG 78 -0.520 12.836 -17.990 588 HG3 ARG 78 3HG ARG 78 0.804 11.975 -17.202 589 HD2 ARG 78 2HD ARG 78 2.049 11.943 -19.344 590 HD3 ARG 78 3HD ARG 78 0.729 12.839 -20.112 591 HE ARG 78 HE ARG 78 1.420 14.389 -17.970 592 HH11 ARG 78 1HH1 ARG 78 3.265 13.097 -20.684 593 HH12 ARG 78 2HH1 ARG 78 4.392 14.415 -20.684 594 HH21 ARG 78 1HH2 ARG 78 2.899 16.099 -17.994 595 HH22 ARG 78 2HH2 ARG 78 4.185 16.114 -19.161 596 H ASP 79 H ASP 79 -3.420 10.048 -18.824 597 HA ASP 79 HA ASP 79 -4.754 12.298 -17.600 598 HB2 ASP 79 2HB ASP 79 -5.568 10.370 -19.775 599 HB3 ASP 79 3HB ASP 79 -6.777 11.407 -19.020 600 H PHE 80 H PHE 80 -4.704 8.844 -17.092 601 HA PHE 80 HA PHE 80 -6.877 8.610 -15.315 602 HB2 PHE 80 2HB PHE 80 -5.707 6.610 -16.073 603 HB3 PHE 80 3HB PHE 80 -4.190 7.165 -15.381 604 HD1 PHE 80 HD1 PHE 80 -3.681 6.816 -13.043 605 HD2 PHE 80 HD2 PHE 80 -7.555 5.837 -14.569 606 HE1 PHE 80 HE1 PHE 80 -4.235 5.698 -10.931 607 HE2 PHE 80 HE2 PHE 80 -8.091 4.726 -12.452 608 HZ PHE 80 HZ PHE 80 -6.448 4.659 -10.632 609 H CYS 81 H CYS 81 -3.575 9.772 -14.869 610 HA CYS 81 HA CYS 81 -3.733 10.175 -12.030 611 HB2 CYS 81 2HB CYS 81 -1.699 11.116 -14.088 612 HB3 CYS 81 3HB CYS 81 -1.500 11.259 -12.340 613 HG CYS 81 HG CYS 81 -2.112 8.176 -13.601 614 H LYS 82 H LYS 82 -5.210 11.920 -14.510 615 HA LYS 82 HA LYS 82 -5.022 14.570 -13.375 616 HB2 LYS 82 2HB LYS 82 -7.111 13.419 -15.270 617 HB3 LYS 82 3HB LYS 82 -6.944 15.124 -14.863 618 HG2 LYS 82 2HG LYS 82 -4.884 13.443 -16.296 619 HG3 LYS 82 3HG LYS 82 -5.991 14.579 -17.066 620 HD2 LYS 82 2HD LYS 82 -4.926 16.450 -15.864 621 HD3 LYS 82 3HD LYS 82 -3.853 15.321 -15.025 622 HE2 LYS 82 2HE LYS 82 -2.722 16.419 -16.926 623 HE3 LYS 82 3HE LYS 82 -2.828 14.673 -17.152 624 HZ1 LYS 82 1HZ LYS 82 -4.565 16.722 -18.426 625 HZ2 LYS 82 2HZ LYS 82 -4.755 15.051 -18.603 626 HZ3 LYS 82 3HZ LYS 82 -3.361 15.806 -19.181 627 H VAL 83 H VAL 83 -5.407 14.145 -11.205 628 HA VAL 83 HA VAL 83 -8.232 13.862 -10.400 629 HB VAL 83 HB VAL 83 -7.422 12.572 -8.354 630 HG11 VAL 83 1HG1 VAL 83 -8.529 11.401 -10.225 631 HG12 VAL 83 2HG1 VAL 83 -7.323 10.381 -9.443 632 HG13 VAL 83 3HG1 VAL 83 -6.962 11.140 -10.995 633 HG21 VAL 83 1HG2 VAL 83 -5.033 13.162 -8.455 634 HG22 VAL 83 2HG2 VAL 83 -4.852 12.245 -9.951 635 HG23 VAL 83 3HG2 VAL 83 -5.245 11.409 -8.444 636 H ASP 84 H ASP 84 -8.747 15.010 -8.472 637 HA ASP 84 HA ASP 84 -7.196 17.396 -7.984 638 HB2 ASP 84 2HB ASP 84 -9.757 17.230 -7.964 639 HB3 ASP 84 3HB ASP 84 -9.618 16.407 -6.416 640 H GLN 85 H GLN 85 -6.798 17.997 -5.512 641 HA GLN 85 HA GLN 85 -4.715 16.370 -4.645 642 HB2 GLN 85 2HB GLN 85 -4.756 18.739 -4.080 643 HB3 GLN 85 3HB GLN 85 -6.190 18.527 -3.085 644 HG2 GLN 85 2HG GLN 85 -4.276 18.764 -1.642 645 HG3 GLN 85 3HG GLN 85 -4.856 17.108 -1.522 646 HE21 GLN 85 1HE2 GLN 85 -2.273 18.153 -0.843 647 HE22 GLN 85 2HE2 GLN 85 -1.112 17.284 -1.781 648 HA PRO 86 HA PRO 86 -7.538 14.401 -1.133 649 HB2 PRO 86 2HB PRO 86 -10.276 14.357 -1.630 650 HB3 PRO 86 3HB PRO 86 -9.475 15.575 -0.613 651 HG2 PRO 86 2HG PRO 86 -10.253 15.783 -3.512 652 HG3 PRO 86 3HG PRO 86 -10.500 16.958 -2.197 653 HD2 PRO 86 2HD PRO 86 -8.483 17.271 -3.928 654 HD3 PRO 86 3HD PRO 86 -8.249 17.635 -2.201 655 H THR 87 H THR 87 -8.511 14.355 -4.531 656 HA THR 87 HA THR 87 -9.456 11.677 -4.631 657 HB THR 87 HB THR 87 -8.479 13.307 -7.014 658 HG1 THR 87 HG1 THR 87 -10.938 13.522 -5.598 659 HG21 THR 87 1HG2 THR 87 -10.732 11.271 -6.751 660 HG22 THR 87 2HG2 THR 87 -9.178 10.985 -7.540 661 HG23 THR 87 3HG2 THR 87 -10.309 12.156 -8.219 662 H LEU 88 H LEU 88 -6.282 13.166 -5.152 663 HA LEU 88 HA LEU 88 -4.745 11.059 -6.150 664 HB2 LEU 88 2HB LEU 88 -4.177 13.425 -4.363 665 HB3 LEU 88 3HB LEU 88 -2.924 12.206 -4.490 666 HG LEU 88 HG LEU 88 -4.075 13.605 -6.933 667 HD11 LEU 88 1HD1 LEU 88 -3.112 15.319 -5.468 668 HD12 LEU 88 2HD1 LEU 88 -2.136 15.093 -6.916 669 HD13 LEU 88 3HD1 LEU 88 -1.600 14.412 -5.377 670 HD21 LEU 88 1HD2 LEU 88 -2.007 12.834 -8.020 671 HD22 LEU 88 2HD2 LEU 88 -2.926 11.476 -7.378 672 HD23 LEU 88 3HD2 LEU 88 -1.492 12.052 -6.522 673 H PHE 89 H PHE 89 -5.489 11.893 -2.777 674 HA PHE 89 HA PHE 89 -4.225 9.633 -1.594 675 HB2 PHE 89 2HB PHE 89 -6.247 11.620 -0.473 676 HB3 PHE 89 3HB PHE 89 -5.451 10.381 0.500 677 HD1 PHE 89 HD1 PHE 89 -2.866 10.396 0.586 678 HD2 PHE 89 HD2 PHE 89 -5.151 13.726 -0.826 679 HE1 PHE 89 HE1 PHE 89 -0.941 11.883 0.945 680 HE2 PHE 89 HE2 PHE 89 -3.217 15.207 -0.457 681 HZ PHE 89 HZ PHE 89 -1.109 14.283 0.429 682 H GLU 90 H GLU 90 -7.496 10.206 -2.783 683 HA GLU 90 HA GLU 90 -8.776 7.984 -1.570 684 HB2 GLU 90 2HB GLU 90 -9.427 9.471 -4.147 685 HB3 GLU 90 3HB GLU 90 -10.468 8.240 -3.439 686 HG2 GLU 90 2HG GLU 90 -9.690 10.854 -2.136 687 HG3 GLU 90 3HG GLU 90 -11.238 10.499 -2.891 688 H LEU 91 H LEU 91 -6.966 8.298 -4.622 689 HA LEU 91 HA LEU 91 -7.400 5.639 -5.567 690 HB2 LEU 91 2HB LEU 91 -5.104 7.548 -6.150 691 HB3 LEU 91 3HB LEU 91 -5.398 6.054 -7.021 692 HG LEU 91 HG LEU 91 -7.188 8.520 -7.040 693 HD11 LEU 91 1HD1 LEU 91 -5.446 7.328 -9.228 694 HD12 LEU 91 2HD1 LEU 91 -5.126 8.817 -8.335 695 HD13 LEU 91 3HD1 LEU 91 -6.524 8.717 -9.402 696 HD21 LEU 91 1HD2 LEU 91 -8.548 6.474 -7.190 697 HD22 LEU 91 2HD2 LEU 91 -7.562 5.904 -8.539 698 HD23 LEU 91 3HD2 LEU 91 -8.550 7.357 -8.715 699 H ILE 92 H ILE 92 -4.962 7.116 -3.459 700 HA ILE 92 HA ILE 92 -3.227 4.890 -3.146 701 HB ILE 92 HB ILE 92 -3.744 7.237 -1.248 702 HG12 ILE 92 2HG1 ILE 92 -1.528 6.837 -3.317 703 HG13 ILE 92 3HG1 ILE 92 -2.901 7.919 -3.492 704 HG21 ILE 92 1HG2 ILE 92 -1.558 6.701 -0.197 705 HG22 ILE 92 2HG2 ILE 92 -1.436 5.255 -1.199 706 HG23 ILE 92 3HG2 ILE 92 -2.719 5.385 0.005 707 HD11 ILE 92 1HD1 ILE 92 -2.080 9.256 -1.609 708 HD12 ILE 92 2HD1 ILE 92 -0.903 9.145 -2.918 709 HD13 ILE 92 3HD1 ILE 92 -0.686 8.180 -1.458 710 H LEU 93 H LEU 93 -6.075 6.008 -1.307 711 HA LEU 93 HA LEU 93 -5.975 4.055 0.770 712 HB2 LEU 93 2HB LEU 93 -8.237 5.851 -0.197 713 HB3 LEU 93 3HB LEU 93 -8.376 4.813 1.212 714 HG LEU 93 HG LEU 93 -6.421 7.135 0.926 715 HD11 LEU 93 1HD1 LEU 93 -8.956 6.938 2.589 716 HD12 LEU 93 2HD1 LEU 93 -8.738 7.908 1.130 717 HD13 LEU 93 3HD1 LEU 93 -7.817 8.289 2.581 718 HD21 LEU 93 1HD2 LEU 93 -5.489 5.367 2.347 719 HD22 LEU 93 2HD2 LEU 93 -6.954 5.358 3.335 720 HD23 LEU 93 3HD2 LEU 93 -5.912 6.785 3.306 721 H ALA 94 H ALA 94 -7.662 4.228 -2.345 722 HA ALA 94 HA ALA 94 -9.287 1.891 -2.007 723 HB1 ALA 94 1HB ALA 94 -9.751 2.135 -4.413 724 HB2 ALA 94 2HB ALA 94 -8.453 3.327 -4.555 725 HB3 ALA 94 3HB ALA 94 -9.882 3.684 -3.581 726 H ALA 95 H ALA 95 -6.123 2.519 -3.493 727 HA ALA 95 HA ALA 95 -5.695 -0.107 -4.551 728 HB1 ALA 95 1HB ALA 95 -3.669 2.051 -3.896 729 HB2 ALA 95 2HB ALA 95 -4.551 1.896 -5.414 730 HB3 ALA 95 3HB ALA 95 -3.405 0.644 -4.937 731 H ASN 96 H ASN 96 -5.000 1.450 -1.474 732 HA ASN 96 HA ASN 96 -3.447 -0.666 -0.306 733 HB2 ASN 96 2HB ASN 96 -3.270 1.593 0.589 734 HB3 ASN 96 3HB ASN 96 -5.001 1.678 0.886 735 HD21 ASN 96 1HD2 ASN 96 -4.589 2.225 3.046 736 HD22 ASN 96 2HD2 ASN 96 -4.133 1.048 4.210 737 H TYR 97 H TYR 97 -6.873 0.267 -0.225 738 HA TYR 97 HA TYR 97 -7.846 -1.720 1.531 739 HB2 TYR 97 2HB TYR 97 -9.191 0.243 1.145 740 HB3 TYR 97 3HB TYR 97 -9.195 -0.005 -0.595 741 HD1 TYR 97 HD1 TYR 97 -11.191 -0.853 -1.533 742 HD2 TYR 97 HD2 TYR 97 -10.305 -1.816 2.541 743 HE1 TYR 97 HE1 TYR 97 -13.343 -2.032 -1.347 744 HE2 TYR 97 HE2 TYR 97 -12.455 -2.994 2.726 745 HH TYR 97 HH TYR 97 -14.658 -3.027 1.646 746 H LEU 98 H LEU 98 -7.311 -1.700 -1.952 747 HA LEU 98 HA LEU 98 -8.463 -4.404 -2.211 748 HB2 LEU 98 2HB LEU 98 -7.895 -2.260 -4.284 749 HB3 LEU 98 3HB LEU 98 -8.387 -3.893 -4.700 750 HG LEU 98 HG LEU 98 -10.040 -1.918 -3.079 751 HD11 LEU 98 1HD1 LEU 98 -10.480 -2.917 -5.910 752 HD12 LEU 98 2HD1 LEU 98 -9.950 -1.298 -5.444 753 HD13 LEU 98 3HD1 LEU 98 -11.558 -1.856 -4.994 754 HD21 LEU 98 1HD2 LEU 98 -11.839 -3.591 -3.183 755 HD22 LEU 98 2HD2 LEU 98 -10.438 -4.209 -2.318 756 HD23 LEU 98 3HD2 LEU 98 -10.750 -4.733 -3.976 757 H ASP 99 H ASP 99 -5.497 -3.148 -1.601 758 HA ASP 99 HA ASP 99 -3.365 -3.952 -1.678 759 HB2 ASP 99 2HB ASP 99 -4.974 -6.456 -2.180 760 HB3 ASP 99 3HB ASP 99 -3.230 -6.550 -2.339 761 H ILE 100 H ILE 100 -4.702 -2.940 -4.241 762 HA ILE 100 HA ILE 100 -3.293 -4.311 -6.380 763 HB ILE 100 HB ILE 100 -4.841 -1.678 -6.553 764 HG12 ILE 100 2HG1 ILE 100 -5.813 -4.518 -7.092 765 HG13 ILE 100 3HG1 ILE 100 -6.278 -3.526 -5.717 766 HG21 ILE 100 1HG2 ILE 100 -4.968 -2.159 -8.985 767 HG22 ILE 100 2HG2 ILE 100 -4.007 -3.620 -8.751 768 HG23 ILE 100 3HG2 ILE 100 -3.288 -2.037 -8.452 769 HD11 ILE 100 1HD1 ILE 100 -7.383 -1.960 -7.222 770 HD12 ILE 100 2HD1 ILE 100 -8.019 -3.594 -7.376 771 HD13 ILE 100 3HD1 ILE 100 -6.924 -2.960 -8.602 772 H LYS 101 H LYS 101 -1.175 -4.104 -5.742 773 HA LYS 101 HA LYS 101 0.117 -1.663 -5.129 774 HB2 LYS 101 2HB LYS 101 1.332 -4.290 -6.040 775 HB3 LYS 101 3HB LYS 101 2.226 -2.929 -5.368 776 HG2 LYS 101 2HG LYS 101 0.751 -3.181 -3.276 777 HG3 LYS 101 3HG LYS 101 0.240 -4.730 -3.961 778 HD2 LYS 101 2HD LYS 101 2.074 -5.128 -2.415 779 HD3 LYS 101 3HD LYS 101 2.648 -5.431 -4.058 780 HE2 LYS 101 2HE LYS 101 3.685 -3.175 -4.092 781 HE3 LYS 101 3HE LYS 101 3.122 -2.900 -2.444 782 HZ1 LYS 101 1HZ LYS 101 5.102 -4.917 -3.336 783 HZ2 LYS 101 2HZ LYS 101 4.462 -4.847 -1.780 784 HZ3 LYS 101 3HZ LYS 101 5.384 -3.559 -2.364 785 HA PRO 102 HA PRO 102 1.317 -1.701 -10.069 786 HB2 PRO 102 2HB PRO 102 -1.592 -2.362 -10.679 787 HB3 PRO 102 3HB PRO 102 -0.154 -2.573 -11.707 788 HG2 PRO 102 2HG PRO 102 -1.164 -4.676 -10.458 789 HG3 PRO 102 3HG PRO 102 0.601 -4.442 -10.521 790 HD2 PRO 102 2HD PRO 102 -1.275 -4.022 -8.216 791 HD3 PRO 102 3HD PRO 102 0.411 -4.581 -8.211 792 H LEU 103 H LEU 103 -1.815 -0.902 -8.534 793 HA LEU 103 HA LEU 103 -1.957 1.743 -9.708 794 HB2 LEU 103 2HB LEU 103 -4.009 0.460 -9.265 795 HB3 LEU 103 3HB LEU 103 -3.637 0.418 -7.549 796 HG LEU 103 HG LEU 103 -3.988 2.846 -7.364 797 HD11 LEU 103 1HD1 LEU 103 -4.774 4.185 -9.258 798 HD12 LEU 103 2HD1 LEU 103 -4.537 2.811 -10.340 799 HD13 LEU 103 3HD1 LEU 103 -3.153 3.552 -9.531 800 HD21 LEU 103 1HD2 LEU 103 -6.288 1.498 -8.821 801 HD22 LEU 103 2HD2 LEU 103 -6.405 2.953 -7.827 802 HD23 LEU 103 3HD2 LEU 103 -5.957 1.418 -7.088 803 H LEU 104 H LEU 104 -1.341 0.375 -6.482 804 HA LEU 104 HA LEU 104 -1.319 2.698 -4.937 805 HB2 LEU 104 2HB LEU 104 -1.416 0.401 -4.011 806 HB3 LEU 104 3HB LEU 104 0.227 0.109 -4.523 807 HG LEU 104 HG LEU 104 0.980 1.902 -2.892 808 HD11 LEU 104 1HD1 LEU 104 -1.098 3.181 -2.707 809 HD12 LEU 104 2HD1 LEU 104 -0.563 2.627 -1.122 810 HD13 LEU 104 3HD1 LEU 104 -1.902 1.810 -1.936 811 HD21 LEU 104 1HD2 LEU 104 1.110 -0.498 -2.349 812 HD22 LEU 104 2HD2 LEU 104 -0.522 -0.437 -1.670 813 HD23 LEU 104 3HD2 LEU 104 0.785 0.481 -0.919 814 H ASP 105 H ASP 105 1.333 0.961 -6.477 815 HA ASP 105 HA ASP 105 3.474 2.478 -5.485 816 HB2 ASP 105 2HB ASP 105 3.721 0.195 -6.442 817 HB3 ASP 105 3HB ASP 105 3.351 0.821 -8.049 818 H VAL 106 H VAL 106 1.736 2.610 -8.600 819 HA VAL 106 HA VAL 106 3.285 4.664 -9.771 820 HB VAL 106 HB VAL 106 0.509 3.575 -10.423 821 HG11 VAL 106 1HG1 VAL 106 0.635 4.717 -12.619 822 HG12 VAL 106 2HG1 VAL 106 2.098 5.560 -12.103 823 HG13 VAL 106 3HG1 VAL 106 0.565 5.877 -11.289 824 HG21 VAL 106 1HG2 VAL 106 3.210 3.166 -11.770 825 HG22 VAL 106 2HG2 VAL 106 1.683 2.460 -12.300 826 HG23 VAL 106 3HG2 VAL 106 2.373 1.998 -10.744 827 H THR 107 H THR 107 0.139 4.817 -8.028 828 HA THR 107 HA THR 107 -0.300 7.599 -8.439 829 HB THR 107 HB THR 107 -1.413 5.828 -6.212 830 HG1 THR 107 HG1 THR 107 -2.081 4.977 -8.140 831 HG21 THR 107 1HG2 THR 107 -3.258 7.475 -6.102 832 HG22 THR 107 2HG2 THR 107 -2.447 8.478 -7.305 833 HG23 THR 107 3HG2 THR 107 -1.715 8.241 -5.717 834 H CYS 108 H CYS 108 1.072 5.774 -5.691 835 HA CYS 108 HA CYS 108 1.671 8.006 -4.037 836 HB2 CYS 108 2HB CYS 108 2.835 5.196 -4.030 837 HB3 CYS 108 3HB CYS 108 3.128 6.398 -2.769 838 HG CYS 108 HG CYS 108 0.391 4.529 -3.361 839 H LYS 109 H LYS 109 3.374 6.470 -6.690 840 HA LYS 109 HA LYS 109 5.959 7.593 -6.174 841 HB2 LYS 109 2HB LYS 109 5.304 5.539 -7.718 842 HB3 LYS 109 3HB LYS 109 5.050 6.755 -8.957 843 HG2 LYS 109 2HG LYS 109 7.271 5.807 -9.194 844 HG3 LYS 109 3HG LYS 109 7.423 7.489 -8.675 845 HD2 LYS 109 2HD LYS 109 9.005 6.004 -7.475 846 HD3 LYS 109 3HD LYS 109 7.864 6.768 -6.369 847 HE2 LYS 109 2HE LYS 109 8.219 4.399 -5.793 848 HE3 LYS 109 3HE LYS 109 6.549 4.681 -6.278 849 HZ1 LYS 109 1HZ LYS 109 8.688 3.488 -7.954 850 HZ2 LYS 109 2HZ LYS 109 7.110 3.793 -8.474 851 HZ3 LYS 109 3HZ LYS 109 7.395 2.666 -7.252 852 H THR 110 H THR 110 3.238 8.390 -8.320 853 HA THR 110 HA THR 110 4.355 10.586 -9.663 854 HB THR 110 HB THR 110 1.424 9.929 -9.103 855 HG1 THR 110 HG1 THR 110 1.820 8.441 -10.545 856 HG21 THR 110 1HG2 THR 110 2.574 11.855 -11.166 857 HG22 THR 110 2HG2 THR 110 1.604 12.307 -9.760 858 HG23 THR 110 3HG2 THR 110 0.882 11.357 -11.061 859 H VAL 111 H VAL 111 2.209 10.503 -6.772 860 HA VAL 111 HA VAL 111 2.084 13.313 -6.418 861 HB VAL 111 HB VAL 111 0.409 11.739 -5.434 862 HG11 VAL 111 1HG1 VAL 111 1.904 9.983 -4.609 863 HG12 VAL 111 2HG1 VAL 111 0.824 10.557 -3.339 864 HG13 VAL 111 3HG1 VAL 111 2.511 11.074 -3.362 865 HG21 VAL 111 1HG2 VAL 111 0.027 12.952 -3.321 866 HG22 VAL 111 2HG2 VAL 111 0.495 14.052 -4.619 867 HG23 VAL 111 3HG2 VAL 111 1.673 13.592 -3.389 868 H ALA 112 H ALA 112 4.344 10.862 -5.238 869 HA ALA 112 HA ALA 112 5.856 12.557 -3.490 870 HB1 ALA 112 1HB ALA 112 5.869 10.113 -3.257 871 HB2 ALA 112 2HB ALA 112 7.506 10.726 -3.499 872 HB3 ALA 112 3HB ALA 112 6.642 9.950 -4.834 873 H ASN 113 H ASN 113 6.029 11.737 -6.934 874 HA ASN 113 HA ASN 113 8.621 12.887 -7.416 875 HB2 ASN 113 2HB ASN 113 6.424 11.944 -9.303 876 HB3 ASN 113 3HB ASN 113 7.893 12.707 -9.906 877 HD21 ASN 113 1HD2 ASN 113 6.887 9.983 -10.337 878 HD22 ASN 113 2HD2 ASN 113 8.139 8.920 -9.809 879 H MET 114 H MET 114 5.379 14.175 -7.305 880 HA MET 114 HA MET 114 5.763 16.552 -8.795 881 HB2 MET 114 2HB MET 114 3.889 16.093 -6.435 882 HB3 MET 114 3HB MET 114 3.814 17.471 -7.524 883 HG2 MET 114 2HG MET 114 3.427 15.785 -9.403 884 HG3 MET 114 3HG MET 114 3.183 14.586 -8.135 885 HE1 MET 114 1HE MET 114 1.743 16.709 -5.923 886 HE2 MET 114 2HE MET 114 1.261 15.024 -6.130 887 HE3 MET 114 3HE MET 114 0.060 16.307 -6.253 888 H ILE 115 H ILE 115 6.397 15.729 -5.420 889 HA ILE 115 HA ILE 115 7.330 18.439 -4.776 890 HB ILE 115 HB ILE 115 7.432 17.691 -2.439 891 HG12 ILE 115 2HG1 ILE 115 6.607 14.926 -3.459 892 HG13 ILE 115 3HG1 ILE 115 8.193 15.341 -2.827 893 HG21 ILE 115 1HG2 ILE 115 5.257 18.459 -3.313 894 HG22 ILE 115 2HG2 ILE 115 5.027 17.234 -2.068 895 HG23 ILE 115 3HG2 ILE 115 4.839 16.805 -3.769 896 HD11 ILE 115 1HD1 ILE 115 5.613 15.330 -1.265 897 HD12 ILE 115 2HD1 ILE 115 7.200 15.772 -0.631 898 HD13 ILE 115 3HD1 ILE 115 6.902 14.129 -1.194 899 H ARG 116 H ARG 116 8.596 15.336 -5.606 900 HA ARG 116 HA ARG 116 11.254 15.599 -4.531 901 HB2 ARG 116 2HB ARG 116 10.217 13.415 -4.963 902 HB3 ARG 116 3HB ARG 116 10.043 13.798 -6.668 903 HG2 ARG 116 2HG ARG 116 12.550 13.792 -6.863 904 HG3 ARG 116 3HG ARG 116 12.638 13.266 -5.178 905 HD2 ARG 116 2HD ARG 116 11.396 11.223 -5.714 906 HD3 ARG 116 3HD ARG 116 11.165 11.771 -7.378 907 HE ARG 116 HE ARG 116 13.923 11.476 -6.494 908 HH11 ARG 116 1HH1 ARG 116 11.221 9.991 -8.205 909 HH12 ARG 116 2HH1 ARG 116 12.226 8.845 -9.038 910 HH21 ARG 116 1HH2 ARG 116 15.217 9.930 -7.546 911 HH22 ARG 116 2HH2 ARG 116 14.490 8.815 -8.663 912 H GLY 117 H GLY 117 9.788 15.983 -7.749 913 HA2 GLY 117 2HA GLY 117 12.164 17.482 -8.720 914 HA3 GLY 117 3HA GLY 117 11.361 16.253 -9.694 915 H1 SER 2 1H SER 2 15.281 -15.222 18.100 916 H2 SER 2 2H SER 2 14.484 -14.272 16.954 917 H3 SER 2 3H SER 2 15.053 -13.576 18.386 918 HA SER 2 HA SER 2 17.279 -13.878 17.782 919 HB2 SER 2 2HB SER 2 16.242 -15.303 15.298 920 HB3 SER 2 3HB SER 2 17.939 -15.038 15.714 921 HG SER 2 HG SER 2 17.845 -16.751 16.916 922 H LEU 3 H LEU 3 18.327 -12.207 16.725 923 HA LEU 3 HA LEU 3 16.623 -10.207 15.422 924 HB2 LEU 3 2HB LEU 3 19.537 -10.025 16.295 925 HB3 LEU 3 3HB LEU 3 18.531 -8.684 15.765 926 HG LEU 3 HG LEU 3 18.073 -10.312 18.298 927 HD11 LEU 3 1HD1 LEU 3 18.830 -8.306 19.499 928 HD12 LEU 3 2HD1 LEU 3 19.227 -7.528 17.964 929 HD13 LEU 3 3HD1 LEU 3 20.097 -8.977 18.474 930 HD21 LEU 3 1HD2 LEU 3 16.653 -7.824 17.295 931 HD22 LEU 3 2HD2 LEU 3 16.430 -8.569 18.881 932 HD23 LEU 3 3HD2 LEU 3 15.970 -9.448 17.426 933 H VAL 4 H VAL 4 16.493 -10.250 13.215 934 HA VAL 4 HA VAL 4 18.808 -10.979 11.565 935 HB VAL 4 HB VAL 4 17.310 -10.511 9.601 936 HG11 VAL 4 1HG1 VAL 4 16.154 -12.472 11.618 937 HG12 VAL 4 2HG1 VAL 4 17.488 -12.789 10.507 938 HG13 VAL 4 3HG1 VAL 4 15.868 -12.495 9.875 939 HG21 VAL 4 1HG2 VAL 4 14.867 -10.176 9.940 940 HG22 VAL 4 2HG2 VAL 4 15.804 -8.822 10.576 941 HG23 VAL 4 3HG2 VAL 4 15.134 -10.023 11.680 942 H LYS 5 H LYS 5 20.140 -9.519 10.641 943 HA LYS 5 HA LYS 5 19.999 -6.734 11.477 944 HB2 LYS 5 2HB LYS 5 22.092 -8.002 9.667 945 HB3 LYS 5 3HB LYS 5 22.254 -6.534 10.624 946 HG2 LYS 5 2HG LYS 5 22.211 -7.905 12.698 947 HG3 LYS 5 3HG LYS 5 22.063 -9.363 11.711 948 HD2 LYS 5 2HD LYS 5 24.272 -8.743 10.619 949 HD3 LYS 5 3HD LYS 5 24.423 -7.442 11.801 950 HE2 LYS 5 2HE LYS 5 24.236 -10.397 12.445 951 HE3 LYS 5 3HE LYS 5 25.716 -9.442 12.452 952 HZ1 LYS 5 1HZ LYS 5 24.841 -9.747 14.674 953 HZ2 LYS 5 2HZ LYS 5 23.373 -9.032 14.228 954 HZ3 LYS 5 3HZ LYS 5 24.787 -8.112 14.247 955 H LEU 6 H LEU 6 18.978 -5.239 10.244 956 HA LEU 6 HA LEU 6 18.726 -5.652 7.311 957 HB2 LEU 6 2HB LEU 6 16.713 -4.376 9.212 958 HB3 LEU 6 3HB LEU 6 16.551 -4.434 7.462 959 HG LEU 6 HG LEU 6 16.562 -6.847 9.318 960 HD11 LEU 6 1HD1 LEU 6 14.275 -5.623 7.754 961 HD12 LEU 6 2HD1 LEU 6 14.511 -5.538 9.502 962 HD13 LEU 6 3HD1 LEU 6 14.209 -7.094 8.733 963 HD21 LEU 6 1HD2 LEU 6 17.569 -7.445 7.173 964 HD22 LEU 6 2HD2 LEU 6 16.195 -6.760 6.299 965 HD23 LEU 6 3HD2 LEU 6 15.974 -8.182 7.324 966 H GLU 7 H GLU 7 20.261 -4.352 6.513 967 HA GLU 7 HA GLU 7 20.833 -1.738 7.635 968 HB2 GLU 7 2HB GLU 7 21.968 -3.146 5.174 969 HB3 GLU 7 3HB GLU 7 22.484 -1.553 5.734 970 HG2 GLU 7 2HG GLU 7 24.100 -3.147 6.486 971 HG3 GLU 7 3HG GLU 7 23.181 -2.626 7.900 972 H SER 8 H SER 8 20.682 0.182 6.495 973 HA SER 8 HA SER 8 18.337 0.474 4.768 974 HB2 SER 8 2HB SER 8 18.822 2.940 5.269 975 HB3 SER 8 3HB SER 8 18.459 1.937 6.675 976 HG SER 8 HG SER 8 20.473 2.106 7.354 977 H SER 9 H SER 9 18.710 2.456 3.162 978 HA SER 9 HA SER 9 20.637 1.922 1.167 979 HB2 SER 9 2HB SER 9 19.946 4.170 0.278 980 HB3 SER 9 3HB SER 9 18.567 3.150 0.674 981 HG SER 9 HG SER 9 19.362 5.530 1.770 982 H ASP 10 H ASP 10 20.625 3.975 4.034 983 HA ASP 10 HA ASP 10 23.212 5.194 3.670 984 HB2 ASP 10 2HB ASP 10 21.461 4.861 6.147 985 HB3 ASP 10 3HB ASP 10 22.919 5.838 6.103 986 H GLU 11 H GLU 11 22.366 2.037 4.297 987 HA GLU 11 HA GLU 11 23.431 0.151 4.862 988 HB2 GLU 11 2HB GLU 11 25.922 1.902 4.883 989 HB3 GLU 11 3HB GLU 11 25.952 0.148 5.022 990 HG2 GLU 11 2HG GLU 11 24.952 -0.066 2.778 991 HG3 GLU 11 3HG GLU 11 24.877 1.690 2.634 992 H LYS 12 H LYS 12 22.629 2.297 7.027 993 HA LYS 12 HA LYS 12 24.155 1.534 9.340 994 HB2 LYS 12 2HB LYS 12 21.422 2.887 9.189 995 HB3 LYS 12 3HB LYS 12 22.377 2.691 10.656 996 HG2 LYS 12 2HG LYS 12 24.204 4.066 9.493 997 HG3 LYS 12 3HG LYS 12 22.997 4.436 8.256 998 HD2 LYS 12 2HD LYS 12 21.514 5.374 10.079 999 HD3 LYS 12 3HD LYS 12 22.831 5.117 11.225 1000 HE2 LYS 12 2HE LYS 12 22.784 7.455 10.506 1001 HE3 LYS 12 3HE LYS 12 24.250 6.680 9.905 1002 HZ1 LYS 12 1HZ LYS 12 23.140 8.091 8.248 1003 HZ2 LYS 12 2HZ LYS 12 21.779 7.093 8.302 1004 HZ3 LYS 12 3HZ LYS 12 23.253 6.483 7.742 1005 H VAL 13 H VAL 13 23.852 -0.155 10.650 1006 HA VAL 13 HA VAL 13 22.195 -2.351 9.842 1007 HB VAL 13 HB VAL 13 23.942 -2.060 12.340 1008 HG11 VAL 13 1HG1 VAL 13 22.342 -3.911 12.562 1009 HG12 VAL 13 2HG1 VAL 13 23.980 -4.536 12.375 1010 HG13 VAL 13 3HG1 VAL 13 22.861 -4.576 11.010 1011 HG21 VAL 13 1HG2 VAL 13 24.683 -3.206 9.621 1012 HG22 VAL 13 2HG2 VAL 13 25.709 -3.222 11.058 1013 HG23 VAL 13 3HG2 VAL 13 25.269 -1.688 10.305 1014 H PHE 14 H PHE 14 20.084 -2.503 10.405 1015 HA PHE 14 HA PHE 14 19.217 -1.657 13.118 1016 HB2 PHE 14 2HB PHE 14 17.558 -1.803 10.560 1017 HB3 PHE 14 3HB PHE 14 16.920 -1.414 12.156 1018 HD1 PHE 14 HD1 PHE 14 18.343 -0.051 9.166 1019 HD2 PHE 14 HD2 PHE 14 17.954 0.622 13.369 1020 HE1 PHE 14 HE1 PHE 14 18.895 2.320 8.846 1021 HE2 PHE 14 HE2 PHE 14 18.500 2.989 13.038 1022 HZ PHE 14 HZ PHE 14 18.974 3.838 10.782 1023 H GLU 15 H GLU 15 19.881 -3.622 13.975 1024 HA GLU 15 HA GLU 15 18.868 -6.168 13.199 1025 HB2 GLU 15 2HB GLU 15 19.851 -5.175 15.912 1026 HB3 GLU 15 3HB GLU 15 19.535 -6.864 15.520 1027 HG2 GLU 15 2HG GLU 15 21.304 -6.814 13.812 1028 HG3 GLU 15 3HG GLU 15 21.616 -5.116 14.163 1029 H ILE 16 H ILE 16 16.914 -6.972 13.512 1030 HA ILE 16 HA ILE 16 15.081 -6.000 15.600 1031 HB ILE 16 HB ILE 16 14.504 -4.672 13.591 1032 HG12 ILE 16 2HG1 ILE 16 12.437 -6.838 14.200 1033 HG13 ILE 16 3HG1 ILE 16 12.635 -5.313 15.052 1034 HG21 ILE 16 1HG2 ILE 16 13.750 -5.691 11.487 1035 HG22 ILE 16 2HG2 ILE 16 14.080 -7.300 12.129 1036 HG23 ILE 16 3HG2 ILE 16 15.409 -6.173 11.856 1037 HD11 ILE 16 1HD1 ILE 16 11.701 -5.665 12.207 1038 HD12 ILE 16 2HD1 ILE 16 11.974 -4.115 13.006 1039 HD13 ILE 16 3HD1 ILE 16 10.733 -5.204 13.604 1040 H GLU 17 H GLU 17 13.577 -7.616 16.231 1041 HA GLU 17 HA GLU 17 14.309 -10.311 15.975 1042 HB2 GLU 17 2HB GLU 17 11.600 -9.157 16.734 1043 HB3 GLU 17 3HB GLU 17 12.105 -10.821 17.010 1044 HG2 GLU 17 2HG GLU 17 13.915 -9.981 18.519 1045 HG3 GLU 17 3HG GLU 17 13.303 -8.341 18.282 1046 H LYS 18 H LYS 18 13.741 -11.882 14.592 1047 HA LYS 18 HA LYS 18 13.099 -11.252 11.934 1048 HB2 LYS 18 2HB LYS 18 14.542 -13.118 12.548 1049 HB3 LYS 18 3HB LYS 18 13.219 -13.919 13.391 1050 HG2 LYS 18 2HG LYS 18 12.045 -14.247 11.225 1051 HG3 LYS 18 3HG LYS 18 13.374 -13.432 10.392 1052 HD2 LYS 18 2HD LYS 18 13.538 -15.920 10.242 1053 HD3 LYS 18 3HD LYS 18 14.936 -15.198 11.046 1054 HE2 LYS 18 2HE LYS 18 13.982 -15.806 13.247 1055 HE3 LYS 18 3HE LYS 18 12.580 -16.523 12.447 1056 HZ1 LYS 18 1HZ LYS 18 14.016 -18.136 11.420 1057 HZ2 LYS 18 2HZ LYS 18 14.246 -18.172 13.093 1058 HZ3 LYS 18 3HZ LYS 18 15.385 -17.425 12.097 1059 H GLU 19 H GLU 19 11.211 -12.761 14.499 1060 HA GLU 19 HA GLU 19 8.846 -13.345 13.076 1061 HB2 GLU 19 2HB GLU 19 7.741 -13.274 15.387 1062 HB3 GLU 19 3HB GLU 19 9.063 -14.403 15.176 1063 HG2 GLU 19 2HG GLU 19 9.740 -11.707 16.308 1064 HG3 GLU 19 3HG GLU 19 8.855 -12.826 17.340 1065 H ILE 20 H ILE 20 9.960 -10.328 14.534 1066 HA ILE 20 HA ILE 20 7.477 -8.889 14.181 1067 HB ILE 20 HB ILE 20 10.311 -7.805 14.555 1068 HG12 ILE 20 2HG1 ILE 20 8.125 -8.335 16.616 1069 HG13 ILE 20 3HG1 ILE 20 9.674 -9.155 16.500 1070 HG21 ILE 20 1HG2 ILE 20 9.249 -5.691 15.207 1071 HG22 ILE 20 2HG2 ILE 20 7.656 -6.374 14.880 1072 HG23 ILE 20 3HG2 ILE 20 8.803 -6.136 13.559 1073 HD11 ILE 20 1HD1 ILE 20 10.803 -7.030 17.073 1074 HD12 ILE 20 2HD1 ILE 20 9.703 -7.600 18.326 1075 HD13 ILE 20 3HD1 ILE 20 9.221 -6.270 17.274 1076 H ALA 21 H ALA 21 10.502 -9.284 12.379 1077 HA ALA 21 HA ALA 21 9.938 -7.450 10.261 1078 HB1 ALA 21 1HB ALA 21 11.959 -9.713 10.387 1079 HB2 ALA 21 2HB ALA 21 12.229 -8.051 10.917 1080 HB3 ALA 21 3HB ALA 21 11.949 -8.394 9.210 1081 H CYS 22 H CYS 22 8.912 -10.699 10.859 1082 HA CYS 22 HA CYS 22 8.366 -11.483 8.158 1083 HB2 CYS 22 2HB CYS 22 7.364 -12.550 10.811 1084 HB3 CYS 22 3HB CYS 22 6.981 -13.288 9.256 1085 HG CYS 22 HG CYS 22 10.259 -12.814 9.707 1086 H MET 23 H MET 23 6.649 -9.497 10.469 1087 HA MET 23 HA MET 23 4.035 -9.595 9.334 1088 HB2 MET 23 2HB MET 23 5.273 -7.171 10.698 1089 HB3 MET 23 3HB MET 23 3.562 -7.550 10.554 1090 HG2 MET 23 2HG MET 23 4.022 -9.593 11.997 1091 HG3 MET 23 3HG MET 23 5.621 -8.916 12.295 1092 HE1 MET 23 1HE MET 23 4.318 -5.672 12.150 1093 HE2 MET 23 2HE MET 23 5.720 -6.154 13.110 1094 HE3 MET 23 3HE MET 23 4.337 -5.386 13.888 1095 H SER 24 H SER 24 6.928 -7.793 8.554 1096 HA SER 24 HA SER 24 5.918 -6.402 6.263 1097 HB2 SER 24 2HB SER 24 8.042 -5.719 7.325 1098 HB3 SER 24 3HB SER 24 8.737 -7.310 7.013 1099 HG SER 24 HG SER 24 7.940 -5.390 5.095 1100 H VAL 25 H VAL 25 5.040 -7.522 4.583 1101 HA VAL 25 HA VAL 25 5.357 -10.321 4.234 1102 HB VAL 25 HB VAL 25 4.177 -8.355 2.220 1103 HG11 VAL 25 1HG1 VAL 25 3.751 -11.355 2.450 1104 HG12 VAL 25 2HG1 VAL 25 4.657 -10.530 1.183 1105 HG13 VAL 25 3HG1 VAL 25 2.917 -10.280 1.321 1106 HG21 VAL 25 1HG2 VAL 25 3.047 -8.143 4.400 1107 HG22 VAL 25 2HG2 VAL 25 2.748 -9.882 4.430 1108 HG23 VAL 25 3HG2 VAL 25 1.970 -8.875 3.207 1109 H THR 26 H THR 26 6.896 -7.511 2.684 1110 HA THR 26 HA THR 26 8.199 -8.829 0.553 1111 HB THR 26 HB THR 26 9.164 -6.346 2.046 1112 HG1 THR 26 HG1 THR 26 7.117 -6.793 0.225 1113 HG21 THR 26 1HG2 THR 26 9.768 -7.289 -0.790 1114 HG22 THR 26 2HG2 THR 26 10.916 -7.275 0.552 1115 HG23 THR 26 3HG2 THR 26 10.284 -5.756 -0.088 1116 H ILE 27 H ILE 27 9.388 -8.040 3.851 1117 HA ILE 27 HA ILE 27 11.950 -9.245 3.592 1118 HB ILE 27 HB ILE 27 10.319 -8.630 6.099 1119 HG12 ILE 27 2HG1 ILE 27 12.613 -7.050 4.832 1120 HG13 ILE 27 3HG1 ILE 27 10.908 -6.639 4.678 1121 HG21 ILE 27 1HG2 ILE 27 12.433 -8.805 7.383 1122 HG22 ILE 27 2HG2 ILE 27 13.273 -9.338 5.927 1123 HG23 ILE 27 3HG2 ILE 27 12.007 -10.345 6.628 1124 HD11 ILE 27 1HD1 ILE 27 10.774 -6.248 7.077 1125 HD12 ILE 27 2HD1 ILE 27 12.013 -5.245 6.323 1126 HD13 ILE 27 3HD1 ILE 27 12.478 -6.670 7.252 1127 H LYS 28 H LYS 28 8.796 -10.439 4.719 1128 HA LYS 28 HA LYS 28 9.512 -13.031 5.554 1129 HB2 LYS 28 2HB LYS 28 7.272 -12.013 5.983 1130 HB3 LYS 28 3HB LYS 28 6.905 -12.102 4.264 1131 HG2 LYS 28 2HG LYS 28 7.223 -14.653 4.477 1132 HG3 LYS 28 3HG LYS 28 7.225 -14.396 6.222 1133 HD2 LYS 28 2HD LYS 28 4.986 -15.063 5.471 1134 HD3 LYS 28 3HD LYS 28 4.943 -13.404 6.072 1135 HE2 LYS 28 2HE LYS 28 4.903 -12.527 3.799 1136 HE3 LYS 28 3HE LYS 28 5.150 -14.143 3.128 1137 HZ1 LYS 28 1HZ LYS 28 2.825 -13.454 3.002 1138 HZ2 LYS 28 2HZ LYS 28 2.758 -13.287 4.681 1139 HZ3 LYS 28 3HZ LYS 28 3.003 -14.811 3.995 1140 H ASN 29 H ASN 29 8.675 -11.722 2.342 1141 HA ASN 29 HA ASN 29 8.701 -14.210 0.931 1142 HB2 ASN 29 2HB ASN 29 8.934 -11.338 -0.078 1143 HB3 ASN 29 3HB ASN 29 8.830 -12.732 -1.143 1144 HD21 ASN 29 1HD2 ASN 29 6.822 -14.093 0.657 1145 HD22 ASN 29 2HD2 ASN 29 5.354 -13.236 0.367 1146 H MET 30 H MET 30 11.168 -11.803 1.713 1147 HA MET 30 HA MET 30 13.288 -12.856 0.124 1148 HB2 MET 30 2HB MET 30 13.386 -11.264 2.728 1149 HB3 MET 30 3HB MET 30 14.799 -11.635 1.749 1150 HG2 MET 30 2HG MET 30 13.868 -10.321 -0.109 1151 HG3 MET 30 3HG MET 30 12.439 -9.959 0.861 1152 HE1 MET 30 1HE MET 30 12.787 -7.322 0.477 1153 HE2 MET 30 2HE MET 30 14.197 -7.668 -0.526 1154 HE3 MET 30 3HE MET 30 14.313 -6.495 0.785 1155 H ILE 31 H ILE 31 12.155 -13.495 3.414 1156 HA ILE 31 HA ILE 31 14.102 -15.413 4.179 1157 HB ILE 31 HB ILE 31 11.253 -14.906 5.164 1158 HG12 ILE 31 2HG1 ILE 31 13.940 -14.172 6.421 1159 HG13 ILE 31 3HG1 ILE 31 12.900 -13.059 5.545 1160 HG21 ILE 31 1HG2 ILE 31 13.318 -16.723 6.449 1161 HG22 ILE 31 2HG2 ILE 31 11.810 -17.238 5.694 1162 HG23 ILE 31 3HG2 ILE 31 11.771 -16.266 7.165 1163 HD11 ILE 31 1HD1 ILE 31 12.247 -14.421 8.157 1164 HD12 ILE 31 2HD1 ILE 31 11.164 -13.351 7.263 1165 HD13 ILE 31 3HD1 ILE 31 12.678 -12.728 7.917 1166 H GLU 32 H GLU 32 10.995 -15.688 2.464 1167 HA GLU 32 HA GLU 32 10.936 -18.578 2.488 1168 HB2 GLU 32 2HB GLU 32 9.331 -16.563 0.866 1169 HB3 GLU 32 3HB GLU 32 9.014 -18.295 0.898 1170 HG2 GLU 32 2HG GLU 32 8.492 -18.195 3.288 1171 HG3 GLU 32 3HG GLU 32 8.886 -16.481 3.330 1172 H ASP 33 H ASP 33 12.103 -16.118 0.212 1173 HA ASP 33 HA ASP 33 12.372 -17.928 -2.038 1174 HB2 ASP 33 2HB ASP 33 11.873 -15.547 -2.403 1175 HB3 ASP 33 3HB ASP 33 13.360 -15.069 -1.597 1176 H ILE 34 H ILE 34 14.600 -16.341 0.229 1177 HA ILE 34 HA ILE 34 16.993 -17.488 -0.968 1178 HB ILE 34 HB ILE 34 16.703 -15.781 1.566 1179 HG12 ILE 34 2HG1 ILE 34 17.411 -14.885 -1.277 1180 HG13 ILE 34 3HG1 ILE 34 15.858 -14.619 -0.495 1181 HG21 ILE 34 1HG2 ILE 34 19.195 -16.379 -0.084 1182 HG22 ILE 34 2HG2 ILE 34 18.847 -17.006 1.528 1183 HG23 ILE 34 3HG2 ILE 34 19.114 -15.279 1.296 1184 HD11 ILE 34 1HD1 ILE 34 18.501 -13.457 0.378 1185 HD12 ILE 34 2HD1 ILE 34 16.949 -13.212 1.185 1186 HD13 ILE 34 3HD1 ILE 34 17.195 -12.614 -0.455 1187 H GLY 35 H GLY 35 14.714 -18.386 1.431 1188 HA2 GLY 35 2HA GLY 35 14.562 -20.366 2.636 1189 HA3 GLY 35 3HA GLY 35 16.228 -20.746 2.225 1190 H GLU 36 H GLU 36 15.308 -17.676 3.526 1191 HA GLU 36 HA GLU 36 15.497 -16.559 5.427 1192 HB2 GLU 36 2HB GLU 36 14.520 -18.493 6.624 1193 HB3 GLU 36 3HB GLU 36 16.125 -19.187 6.822 1194 HG2 GLU 36 2HG GLU 36 16.806 -17.252 8.186 1195 HG3 GLU 36 3HG GLU 36 15.208 -16.531 7.983 1196 H SER 37 H SER 37 17.083 -15.234 5.946 1197 HA SER 37 HA SER 37 19.893 -16.158 5.914 1198 HB2 SER 37 2HB SER 37 18.808 -13.387 5.244 1199 HB3 SER 37 3HB SER 37 20.499 -13.897 5.163 1200 HG SER 37 HG SER 37 19.525 -15.598 3.659 1201 H ASP 38 H ASP 38 20.483 -16.391 7.988 1202 HA ASP 38 HA ASP 38 19.779 -14.639 10.166 1203 HB2 ASP 38 2HB ASP 38 20.546 -17.009 10.489 1204 HB3 ASP 38 3HB ASP 38 22.126 -16.587 9.848 1205 H SER 39 H SER 39 22.228 -14.846 7.716 1206 HA SER 39 HA SER 39 24.068 -12.880 8.412 1207 HB2 SER 39 2HB SER 39 23.093 -13.704 5.634 1208 HB3 SER 39 3HB SER 39 24.616 -12.883 5.995 1209 HG SER 39 HG SER 39 25.317 -14.694 7.086 1210 HA PRO 40 HA PRO 40 21.915 -8.998 7.961 1211 HB2 PRO 40 2HB PRO 40 23.879 -7.311 7.036 1212 HB3 PRO 40 3HB PRO 40 23.874 -7.973 8.679 1213 HG2 PRO 40 2HG PRO 40 25.389 -8.939 6.281 1214 HG3 PRO 40 3HG PRO 40 25.973 -8.654 7.940 1215 HD2 PRO 40 2HD PRO 40 25.340 -11.142 7.108 1216 HD3 PRO 40 3HD PRO 40 25.004 -10.618 8.773 1217 H ILE 41 H ILE 41 20.683 -7.865 6.511 1218 HA ILE 41 HA ILE 41 21.045 -8.341 3.609 1219 HB ILE 41 HB ILE 41 18.407 -8.257 5.169 1220 HG12 ILE 41 2HG1 ILE 41 19.585 -10.431 5.412 1221 HG13 ILE 41 3HG1 ILE 41 18.112 -10.619 4.468 1222 HG21 ILE 41 1HG2 ILE 41 17.282 -8.724 3.011 1223 HG22 ILE 41 2HG2 ILE 41 18.824 -8.577 2.169 1224 HG23 ILE 41 3HG2 ILE 41 18.123 -7.173 2.976 1225 HD11 ILE 41 1HD1 ILE 41 19.910 -11.946 3.547 1226 HD12 ILE 41 2HD1 ILE 41 20.931 -10.522 3.384 1227 HD13 ILE 41 3HD1 ILE 41 19.470 -10.677 2.403 1228 HA PRO 42 HA PRO 42 20.726 -3.779 3.825 1229 HB2 PRO 42 2HB PRO 42 21.822 -3.201 1.409 1230 HB3 PRO 42 3HB PRO 42 22.822 -3.744 2.772 1231 HG2 PRO 42 2HG PRO 42 21.870 -5.308 0.410 1232 HG3 PRO 42 3HG PRO 42 23.444 -5.361 1.232 1233 HD2 PRO 42 2HD PRO 42 21.377 -7.191 1.656 1234 HD3 PRO 42 3HD PRO 42 22.709 -6.891 2.790 1235 H LEU 43 H LEU 43 19.117 -2.462 3.162 1236 HA LEU 43 HA LEU 43 17.207 -3.351 1.086 1237 HB2 LEU 43 2HB LEU 43 16.754 -1.628 3.568 1238 HB3 LEU 43 3HB LEU 43 15.575 -1.792 2.283 1239 HG LEU 43 HG LEU 43 15.434 -4.279 2.793 1240 HD11 LEU 43 1HD1 LEU 43 17.076 -3.600 5.246 1241 HD12 LEU 43 2HD1 LEU 43 17.584 -4.626 3.905 1242 HD13 LEU 43 3HD1 LEU 43 16.251 -5.133 4.939 1243 HD21 LEU 43 1HD2 LEU 43 14.728 -2.421 5.081 1244 HD22 LEU 43 2HD2 LEU 43 14.033 -4.020 4.794 1245 HD23 LEU 43 3HD2 LEU 43 13.752 -2.718 3.639 1246 HA PRO 44 HA PRO 44 19.337 0.358 -0.653 1247 HB2 PRO 44 2HB PRO 44 19.540 -0.459 -3.224 1248 HB3 PRO 44 3HB PRO 44 20.528 -1.210 -1.952 1249 HG2 PRO 44 2HG PRO 44 18.031 -2.245 -3.250 1250 HG3 PRO 44 3HG PRO 44 19.520 -3.116 -2.818 1251 HD2 PRO 44 2HD PRO 44 17.204 -3.094 -1.262 1252 HD3 PRO 44 3HD PRO 44 18.830 -3.469 -0.652 1253 H ASN 45 H ASN 45 17.111 1.219 0.048 1254 HA ASN 45 HA ASN 45 15.840 2.625 -2.095 1255 HB2 ASN 45 2HB ASN 45 14.640 0.490 -2.440 1256 HB3 ASN 45 3HB ASN 45 14.223 0.409 -0.735 1257 HD21 ASN 45 1HD2 ASN 45 13.547 2.019 -3.778 1258 HD22 ASN 45 2HD2 ASN 45 12.044 2.725 -3.295 1259 H VAL 46 H VAL 46 15.189 1.351 1.166 1260 HA VAL 46 HA VAL 46 13.925 3.849 2.001 1261 HB VAL 46 HB VAL 46 12.793 1.752 2.575 1262 HG11 VAL 46 1HG1 VAL 46 13.707 0.105 4.150 1263 HG12 VAL 46 2HG1 VAL 46 15.229 0.996 4.215 1264 HG13 VAL 46 3HG1 VAL 46 14.716 0.239 2.705 1265 HG21 VAL 46 1HG2 VAL 46 12.468 3.635 4.108 1266 HG22 VAL 46 2HG2 VAL 46 13.862 3.129 5.066 1267 HG23 VAL 46 3HG2 VAL 46 12.422 2.110 4.997 1268 H THR 47 H THR 47 14.917 5.375 3.211 1269 HA THR 47 HA THR 47 17.730 5.293 3.761 1270 HB THR 47 HB THR 47 17.369 7.572 4.737 1271 HG1 THR 47 HG1 THR 47 14.737 7.735 3.960 1272 HG21 THR 47 1HG2 THR 47 17.668 7.357 2.283 1273 HG22 THR 47 2HG2 THR 47 16.590 8.691 2.688 1274 HG23 THR 47 3HG2 THR 47 15.922 7.173 2.086 1275 H SER 48 H SER 48 18.556 6.005 6.006 1276 HA SER 48 HA SER 48 17.943 3.854 7.779 1277 HB2 SER 48 2HB SER 48 19.706 4.870 9.244 1278 HB3 SER 48 3HB SER 48 20.227 4.609 7.583 1279 HG SER 48 HG SER 48 19.317 7.008 7.543 1280 H THR 49 H THR 49 17.224 7.309 7.863 1281 HA THR 49 HA THR 49 16.232 7.465 10.511 1282 HB THR 49 HB THR 49 15.042 9.563 9.597 1283 HG1 THR 49 HG1 THR 49 15.684 10.117 7.438 1284 HG21 THR 49 1HG2 THR 49 17.312 9.714 10.606 1285 HG22 THR 49 2HG2 THR 49 17.138 10.835 9.254 1286 HG23 THR 49 3HG2 THR 49 18.031 9.329 9.041 1287 H ILE 50 H ILE 50 14.676 6.813 7.383 1288 HA ILE 50 HA ILE 50 12.006 6.669 8.427 1289 HB ILE 50 HB ILE 50 13.106 5.695 5.750 1290 HG12 ILE 50 2HG1 ILE 50 13.421 8.113 6.016 1291 HG13 ILE 50 3HG1 ILE 50 12.151 7.823 4.837 1292 HG21 ILE 50 1HG2 ILE 50 10.212 6.110 6.587 1293 HG22 ILE 50 2HG2 ILE 50 10.988 4.564 6.241 1294 HG23 ILE 50 3HG2 ILE 50 10.758 5.741 4.947 1295 HD11 ILE 50 1HD1 ILE 50 11.772 8.692 7.708 1296 HD12 ILE 50 2HD1 ILE 50 10.463 8.351 6.572 1297 HD13 ILE 50 3HD1 ILE 50 11.581 9.678 6.261 1298 H LEU 51 H LEU 51 14.480 4.244 7.486 1299 HA LEU 51 HA LEU 51 12.866 1.941 7.811 1300 HB2 LEU 51 2HB LEU 51 14.965 1.938 6.467 1301 HB3 LEU 51 3HB LEU 51 15.908 2.127 7.937 1302 HG LEU 51 HG LEU 51 15.125 -0.111 8.729 1303 HD11 LEU 51 1HD1 LEU 51 12.946 -0.213 7.630 1304 HD12 LEU 51 2HD1 LEU 51 13.911 -1.639 7.258 1305 HD13 LEU 51 3HD1 LEU 51 13.726 -0.364 6.051 1306 HD21 LEU 51 1HD2 LEU 51 17.236 0.031 7.488 1307 HD22 LEU 51 2HD2 LEU 51 16.375 -0.234 5.968 1308 HD23 LEU 51 3HD2 LEU 51 16.418 -1.505 7.194 1309 H GLU 52 H GLU 52 14.991 3.698 10.047 1310 HA GLU 52 HA GLU 52 14.970 1.985 12.256 1311 HB2 GLU 52 2HB GLU 52 16.353 4.023 12.205 1312 HB3 GLU 52 3HB GLU 52 14.914 5.041 12.201 1313 HG2 GLU 52 2HG GLU 52 14.331 4.255 14.462 1314 HG3 GLU 52 3HG GLU 52 15.733 3.186 14.464 1315 H LYS 53 H LYS 53 12.698 4.534 11.294 1316 HA LYS 53 HA LYS 53 10.895 4.218 13.481 1317 HB2 LYS 53 2HB LYS 53 10.567 5.616 10.796 1318 HB3 LYS 53 3HB LYS 53 9.402 5.710 12.114 1319 HG2 LYS 53 2HG LYS 53 11.201 6.706 13.566 1320 HG3 LYS 53 3HG LYS 53 12.259 6.728 12.152 1321 HD2 LYS 53 2HD LYS 53 11.207 8.941 12.557 1322 HD3 LYS 53 3HD LYS 53 10.745 8.270 10.994 1323 HE2 LYS 53 2HE LYS 53 8.543 7.768 11.730 1324 HE3 LYS 53 3HE LYS 53 8.983 7.919 13.429 1325 HZ1 LYS 53 1HZ LYS 53 7.701 9.810 12.586 1326 HZ2 LYS 53 2HZ LYS 53 8.958 10.177 11.514 1327 HZ3 LYS 53 3HZ LYS 53 9.216 10.263 13.180 1328 H VAL 54 H VAL 54 11.023 2.846 10.229 1329 HA VAL 54 HA VAL 54 8.373 1.817 10.088 1330 HB VAL 54 HB VAL 54 10.944 1.060 8.607 1331 HG11 VAL 54 1HG1 VAL 54 9.542 -0.202 6.998 1332 HG12 VAL 54 2HG1 VAL 54 8.138 0.038 8.042 1333 HG13 VAL 54 3HG1 VAL 54 9.504 -0.923 8.609 1334 HG21 VAL 54 1HG2 VAL 54 9.923 2.249 6.699 1335 HG22 VAL 54 2HG2 VAL 54 10.042 3.311 8.101 1336 HG23 VAL 54 3HG2 VAL 54 8.491 2.598 7.671 1337 H LEU 55 H LEU 55 11.501 0.386 11.008 1338 HA LEU 55 HA LEU 55 10.438 -2.179 11.728 1339 HB2 LEU 55 2HB LEU 55 13.141 -0.924 12.344 1340 HB3 LEU 55 3HB LEU 55 12.728 -2.600 12.644 1341 HG LEU 55 HG LEU 55 12.979 -1.259 9.924 1342 HD11 LEU 55 1HD1 LEU 55 14.627 -3.464 11.194 1343 HD12 LEU 55 2HD1 LEU 55 15.120 -1.786 10.965 1344 HD13 LEU 55 3HD1 LEU 55 14.837 -2.814 9.564 1345 HD21 LEU 55 1HD2 LEU 55 12.502 -3.455 8.912 1346 HD22 LEU 55 2HD2 LEU 55 11.120 -2.841 9.816 1347 HD23 LEU 55 3HD2 LEU 55 12.128 -4.118 10.506 1348 H ASP 56 H ASP 56 11.027 0.828 13.431 1349 HA ASP 56 HA ASP 56 10.723 -0.187 16.102 1350 HB2 ASP 56 2HB ASP 56 11.953 1.902 15.682 1351 HB3 ASP 56 3HB ASP 56 10.512 2.662 15.023 1352 H TYR 57 H TYR 57 8.536 1.172 13.675 1353 HA TYR 57 HA TYR 57 6.204 1.361 15.319 1354 HB2 TYR 57 2HB TYR 57 6.338 2.605 13.181 1355 HB3 TYR 57 3HB TYR 57 6.448 1.099 12.278 1356 HD1 TYR 57 HD1 TYR 57 4.421 -0.207 11.783 1357 HD2 TYR 57 HD2 TYR 57 4.163 3.261 14.269 1358 HE1 TYR 57 HE1 TYR 57 1.972 -0.328 11.695 1359 HE2 TYR 57 HE2 TYR 57 1.709 3.142 14.174 1360 HH TYR 57 HH TYR 57 -0.070 2.067 12.570 1361 H CYS 58 H CYS 58 7.488 -1.072 13.066 1362 HA CYS 58 HA CYS 58 5.502 -3.039 13.373 1363 HB2 CYS 58 2HB CYS 58 8.449 -3.292 12.649 1364 HB3 CYS 58 3HB CYS 58 7.284 -4.615 12.524 1365 HG CYS 58 HG CYS 58 7.959 -2.246 10.381 1366 H ARG 59 H ARG 59 8.520 -2.410 15.138 1367 HA ARG 59 HA ARG 59 8.584 -4.637 16.851 1368 HB2 ARG 59 2HB ARG 59 10.483 -3.040 16.530 1369 HB3 ARG 59 3HB ARG 59 9.587 -1.807 17.412 1370 HG2 ARG 59 2HG ARG 59 9.610 -3.408 19.412 1371 HG3 ARG 59 3HG ARG 59 10.758 -4.390 18.493 1372 HD2 ARG 59 2HD ARG 59 11.967 -2.923 20.017 1373 HD3 ARG 59 3HD ARG 59 12.284 -2.440 18.352 1374 HE ARG 59 HE ARG 59 10.925 -0.516 18.663 1375 HH11 ARG 59 1HH1 ARG 59 11.394 -2.298 21.662 1376 HH12 ARG 59 2HH1 ARG 59 10.950 -0.954 22.663 1377 HH21 ARG 59 1HH2 ARG 59 10.372 1.219 19.974 1378 HH22 ARG 59 2HH2 ARG 59 10.371 1.042 21.705 1379 H HIS 60 H HIS 60 7.234 -1.406 17.274 1380 HA HIS 60 HA HIS 60 6.064 -1.640 19.793 1381 HB2 HIS 60 2HB HIS 60 6.283 0.551 18.841 1382 HB3 HIS 60 3HB HIS 60 5.423 0.087 17.373 1383 HD1 HIS 60 HD1 HIS 60 4.781 0.878 21.024 1384 HD2 HIS 60 HD2 HIS 60 2.686 0.445 17.467 1385 HE1 HIS 60 HE1 HIS 60 2.438 1.636 21.516 1386 HE2 HIS 60 HE2 HIS 60 1.291 1.591 19.289 1387 H HIS 61 H HIS 61 4.729 -2.380 16.570 1388 HA HIS 61 HA HIS 61 2.046 -2.768 17.508 1389 HB2 HIS 61 2HB HIS 61 2.768 -2.007 15.166 1390 HB3 HIS 61 3HB HIS 61 3.191 -3.683 14.829 1391 HD1 HIS 61 HD1 HIS 61 1.015 -5.399 15.270 1392 HD2 HIS 61 HD2 HIS 61 0.228 -1.409 14.435 1393 HE1 HIS 61 HE1 HIS 61 -1.380 -5.329 14.541 1394 HE2 HIS 61 HE2 HIS 61 -1.892 -2.879 14.320 1395 H HIS 62 H HIS 62 4.788 -4.911 16.981 1396 HA HIS 62 HA HIS 62 3.241 -7.364 16.990 1397 HB2 HIS 62 2HB HIS 62 5.321 -7.197 15.674 1398 HB3 HIS 62 3HB HIS 62 6.252 -6.891 17.134 1399 HD1 HIS 62 HD1 HIS 62 4.856 -9.617 15.044 1400 HD2 HIS 62 HD2 HIS 62 6.612 -9.233 18.797 1401 HE1 HIS 62 HE1 HIS 62 5.575 -11.934 15.706 1402 HE2 HIS 62 HE2 HIS 62 6.651 -11.669 17.964 1403 H GLN 63 H GLN 63 5.435 -5.682 19.220 1404 HA GLN 63 HA GLN 63 5.210 -7.631 21.340 1405 HB2 GLN 63 2HB GLN 63 6.398 -4.821 21.328 1406 HB3 GLN 63 3HB GLN 63 6.576 -5.988 22.634 1407 HG2 GLN 63 2HG GLN 63 7.835 -7.495 21.154 1408 HG3 GLN 63 3HG GLN 63 7.621 -6.378 19.807 1409 HE21 GLN 63 1HE2 GLN 63 10.095 -7.363 21.021 1410 HE22 GLN 63 2HE2 GLN 63 10.976 -5.961 21.506 1411 H HIS 64 H HIS 64 3.745 -4.546 20.540 1412 HA HIS 64 HA HIS 64 1.746 -4.878 22.703 1413 HB2 HIS 64 2HB HIS 64 2.911 -2.250 21.665 1414 HB3 HIS 64 3HB HIS 64 1.557 -2.371 22.780 1415 HD1 HIS 64 HD1 HIS 64 2.110 -2.601 25.242 1416 HD2 HIS 64 HD2 HIS 64 5.447 -3.027 22.819 1417 HE1 HIS 64 HE1 HIS 64 4.079 -2.552 26.788 1418 HE2 HIS 64 HE2 HIS 64 6.081 -2.570 25.278 1419 HA PRO 65 HA PRO 65 -0.388 -5.376 18.579 1420 HB2 PRO 65 2HB PRO 65 -2.507 -6.303 20.529 1421 HB3 PRO 65 3HB PRO 65 -1.981 -7.038 18.995 1422 HG2 PRO 65 2HG PRO 65 -1.179 -8.118 21.263 1423 HG3 PRO 65 3HG PRO 65 -0.010 -7.925 19.933 1424 HD2 PRO 65 2HD PRO 65 -0.331 -6.244 22.423 1425 HD3 PRO 65 3HD PRO 65 1.156 -6.828 21.634 1426 H GLY 66 H GLY 66 -1.474 -3.652 21.451 1427 HA2 GLY 66 2HA GLY 66 -2.334 -1.504 21.558 1428 HA3 GLY 66 3HA GLY 66 -2.592 -1.516 19.821 1429 H GLY 67 H GLY 67 -3.821 -4.154 21.751 1430 HA2 GLY 67 2HA GLY 67 -6.581 -3.459 21.091 1431 HA3 GLY 67 3HA GLY 67 -6.001 -4.964 21.785 1432 H SER 68 H SER 68 -6.084 -1.507 22.695 1433 HA SER 68 HA SER 68 -7.651 -2.090 25.093 1434 HB2 SER 68 2HB SER 68 -4.930 -0.718 25.244 1435 HB3 SER 68 3HB SER 68 -6.097 -0.780 26.568 1436 HG SER 68 HG SER 68 -5.901 -3.230 25.984 1437 H GLY 69 H GLY 69 -9.262 -1.014 23.937 1438 HA2 GLY 69 2HA GLY 69 -10.624 0.796 23.568 1439 HA3 GLY 69 3HA GLY 69 -9.410 1.822 24.318 1440 H LEU 70 H LEU 70 -10.610 0.499 21.320 1441 HA LEU 70 HA LEU 70 -8.569 1.657 19.615 1442 HB2 LEU 70 2HB LEU 70 -11.248 0.316 19.004 1443 HB3 LEU 70 3HB LEU 70 -10.204 0.979 17.760 1444 HG LEU 70 HG LEU 70 -8.399 -0.642 18.447 1445 HD11 LEU 70 1HD1 LEU 70 -8.933 -2.600 19.819 1446 HD12 LEU 70 2HD1 LEU 70 -10.513 -1.912 20.206 1447 HD13 LEU 70 3HD1 LEU 70 -9.040 -1.107 20.752 1448 HD21 LEU 70 1HD2 LEU 70 -9.846 -1.133 16.533 1449 HD22 LEU 70 2HD2 LEU 70 -11.009 -1.931 17.593 1450 HD23 LEU 70 3HD2 LEU 70 -9.395 -2.612 17.379 1451 H ASP 71 H ASP 71 -8.774 3.761 20.605 1452 HA ASP 71 HA ASP 71 -10.366 5.765 19.469 1453 HB2 ASP 71 2HB ASP 71 -12.262 4.667 20.677 1454 HB3 ASP 71 3HB ASP 71 -11.386 4.796 22.197 1455 H ASP 72 H ASP 72 -8.558 4.501 22.183 1456 HA ASP 72 HA ASP 72 -7.848 6.715 23.675 1457 HB2 ASP 72 2HB ASP 72 -7.318 4.438 24.400 1458 HB3 ASP 72 3HB ASP 72 -6.219 4.207 23.046 1459 H ILE 73 H ILE 73 -6.278 5.441 20.768 1460 HA ILE 73 HA ILE 73 -4.617 6.090 19.409 1461 HB ILE 73 HB ILE 73 -5.375 8.940 20.191 1462 HG12 ILE 73 2HG1 ILE 73 -7.328 7.719 19.304 1463 HG13 ILE 73 3HG1 ILE 73 -6.809 8.944 18.154 1464 HG21 ILE 73 1HG2 ILE 73 -3.175 8.892 19.102 1465 HG22 ILE 73 2HG2 ILE 73 -4.364 9.622 18.024 1466 HG23 ILE 73 3HG2 ILE 73 -3.835 7.960 17.755 1467 HD11 ILE 73 1HD1 ILE 73 -6.288 5.974 17.962 1468 HD12 ILE 73 2HD1 ILE 73 -5.723 7.185 16.807 1469 HD13 ILE 73 3HD1 ILE 73 -7.450 6.908 17.023 1470 HA PRO 74 HA PRO 74 -1.653 6.116 22.967 1471 HB2 PRO 74 2HB PRO 74 0.007 4.673 20.907 1472 HB3 PRO 74 3HB PRO 74 -0.324 4.233 22.597 1473 HG2 PRO 74 2HG PRO 74 -1.522 2.912 20.626 1474 HG3 PRO 74 3HG PRO 74 -2.427 3.328 22.102 1475 HD2 PRO 74 2HD PRO 74 -2.501 4.668 19.401 1476 HD3 PRO 74 3HD PRO 74 -3.839 4.284 20.511 1477 HA PRO 75 HA PRO 75 0.450 9.873 21.489 1478 HB2 PRO 75 2HB PRO 75 2.135 9.428 23.948 1479 HB3 PRO 75 3HB PRO 75 1.222 10.868 23.447 1480 HG2 PRO 75 2HG PRO 75 0.297 9.350 25.417 1481 HG3 PRO 75 3HG PRO 75 -0.824 10.013 24.203 1482 HD2 PRO 75 2HD PRO 75 0.305 7.222 24.399 1483 HD3 PRO 75 3HD PRO 75 -1.359 7.744 24.042 1484 H TYR 76 H TYR 76 2.029 6.856 22.200 1485 HA TYR 76 HA TYR 76 4.615 7.281 21.200 1486 HB2 TYR 76 2HB TYR 76 3.717 5.239 22.459 1487 HB3 TYR 76 3HB TYR 76 2.972 4.713 20.958 1488 HD1 TYR 76 HD1 TYR 76 5.951 4.634 22.962 1489 HD2 TYR 76 HD2 TYR 76 4.577 4.272 18.932 1490 HE1 TYR 76 HE1 TYR 76 8.019 3.465 22.356 1491 HE2 TYR 76 HE2 TYR 76 6.654 3.103 18.329 1492 HH TYR 76 HH TYR 76 8.930 2.850 19.135 1493 H ASP 77 H ASP 77 1.702 6.007 19.584 1494 HA ASP 77 HA ASP 77 2.843 5.854 16.960 1495 HB2 ASP 77 2HB ASP 77 -0.071 5.748 17.856 1496 HB3 ASP 77 3HB ASP 77 0.507 5.314 16.247 1497 H ARG 78 H ARG 78 1.028 8.257 18.720 1498 HA ARG 78 HA ARG 78 0.319 9.885 16.466 1499 HB2 ARG 78 2HB ARG 78 -0.915 9.824 18.667 1500 HB3 ARG 78 3HB ARG 78 0.443 10.666 19.411 1501 HG2 ARG 78 2HG ARG 78 0.064 12.610 17.968 1502 HG3 ARG 78 3HG ARG 78 -1.227 11.755 17.121 1503 HD2 ARG 78 2HD ARG 78 -2.525 11.650 19.232 1504 HD3 ARG 78 3HD ARG 78 -1.243 12.556 20.049 1505 HE ARG 78 HE ARG 78 -1.892 14.133 17.939 1506 HH11 ARG 78 1HH1 ARG 78 -3.835 12.748 20.529 1507 HH12 ARG 78 2HH1 ARG 78 -4.991 14.045 20.499 1508 HH21 ARG 78 1HH2 ARG 78 -3.396 15.799 17.907 1509 HH22 ARG 78 2HH2 ARG 78 -4.744 15.779 19.010 1510 H ASP 79 H ASP 79 2.963 9.869 18.834 1511 HA ASP 79 HA ASP 79 4.298 12.156 17.689 1512 HB2 ASP 79 2HB ASP 79 5.083 10.194 19.845 1513 HB3 ASP 79 3HB ASP 79 6.309 11.242 19.131 1514 H PHE 80 H PHE 80 4.326 8.709 17.110 1515 HA PHE 80 HA PHE 80 6.566 8.545 15.403 1516 HB2 PHE 80 2HB PHE 80 5.414 6.506 16.088 1517 HB3 PHE 80 3HB PHE 80 3.903 7.047 15.371 1518 HD1 PHE 80 HD1 PHE 80 3.454 6.710 13.014 1519 HD2 PHE 80 HD2 PHE 80 7.315 5.793 14.608 1520 HE1 PHE 80 HE1 PHE 80 4.073 5.625 10.903 1521 HE2 PHE 80 HE2 PHE 80 7.914 4.714 12.493 1522 HZ PHE 80 HZ PHE 80 6.310 4.633 10.638 1523 H CYS 81 H CYS 81 3.243 9.622 14.866 1524 HA CYS 81 HA CYS 81 3.478 10.076 12.041 1525 HB2 CYS 81 2HB CYS 81 1.357 10.936 14.046 1526 HB3 CYS 81 3HB CYS 81 1.208 11.103 12.296 1527 HG CYS 81 HG CYS 81 1.839 8.021 13.554 1528 H LYS 82 H LYS 82 4.838 11.825 14.581 1529 HA LYS 82 HA LYS 82 4.625 14.482 13.468 1530 HB2 LYS 82 2HB LYS 82 6.709 13.347 15.390 1531 HB3 LYS 82 3HB LYS 82 6.510 15.054 15.001 1532 HG2 LYS 82 2HG LYS 82 4.470 13.310 16.384 1533 HG3 LYS 82 3HG LYS 82 5.534 14.469 17.177 1534 HD2 LYS 82 2HD LYS 82 4.435 16.320 15.983 1535 HD3 LYS 82 3HD LYS 82 3.413 15.172 15.107 1536 HE2 LYS 82 2HE LYS 82 2.203 16.203 16.992 1537 HE3 LYS 82 3HE LYS 82 2.372 14.462 17.220 1538 HZ1 LYS 82 1HZ LYS 82 4.034 16.564 18.507 1539 HZ2 LYS 82 2HZ LYS 82 4.232 14.898 18.724 1540 HZ3 LYS 82 3HZ LYS 82 2.824 15.659 19.254 1541 H VAL 83 H VAL 83 5.071 14.132 11.307 1542 HA VAL 83 HA VAL 83 7.918 13.876 10.563 1543 HB VAL 83 HB VAL 83 7.172 12.606 8.480 1544 HG11 VAL 83 1HG1 VAL 83 8.232 11.416 10.365 1545 HG12 VAL 83 2HG1 VAL 83 7.066 10.398 9.526 1546 HG13 VAL 83 3HG1 VAL 83 6.647 11.126 11.082 1547 HG21 VAL 83 1HG2 VAL 83 4.777 13.162 8.521 1548 HG22 VAL 83 2HG2 VAL 83 4.566 12.228 10.002 1549 HG23 VAL 83 3HG2 VAL 83 5.009 11.413 8.496 1550 H ASP 84 H ASP 84 8.451 15.053 8.665 1551 HA ASP 84 HA ASP 84 6.888 17.435 8.180 1552 HB2 ASP 84 2HB ASP 84 9.446 17.298 8.236 1553 HB3 ASP 84 3HB ASP 84 9.366 16.476 6.683 1554 H GLN 85 H GLN 85 6.531 18.058 5.713 1555 HA GLN 85 HA GLN 85 4.493 16.413 4.772 1556 HB2 GLN 85 2HB GLN 85 4.490 18.785 4.242 1557 HB3 GLN 85 3HB GLN 85 5.964 18.630 3.296 1558 HG2 GLN 85 2HG GLN 85 4.086 18.857 1.798 1559 HG3 GLN 85 3HG GLN 85 4.732 17.229 1.648 1560 HE21 GLN 85 1HE2 GLN 85 2.115 18.232 0.924 1561 HE22 GLN 85 2HE2 GLN 85 0.961 17.288 1.793 1562 HA PRO 86 HA PRO 86 7.400 14.559 1.265 1563 HB2 PRO 86 2HB PRO 86 10.124 14.561 1.790 1564 HB3 PRO 86 3HB PRO 86 9.320 15.800 0.809 1565 HG2 PRO 86 2HG PRO 86 10.057 15.912 3.726 1566 HG3 PRO 86 3HG PRO 86 10.312 17.135 2.457 1567 HD2 PRO 86 2HD PRO 86 8.264 17.366 4.162 1568 HD3 PRO 86 3HD PRO 86 8.056 17.787 2.445 1569 H THR 87 H THR 87 8.303 14.472 4.688 1570 HA THR 87 HA THR 87 9.319 11.811 4.770 1571 HB THR 87 HB THR 87 8.255 13.395 7.147 1572 HG1 THR 87 HG1 THR 87 10.841 13.618 5.966 1573 HG21 THR 87 1HG2 THR 87 10.557 11.412 6.918 1574 HG22 THR 87 2HG2 THR 87 8.988 11.079 7.657 1575 HG23 THR 87 3HG2 THR 87 10.069 12.267 8.383 1576 H LEU 88 H LEU 88 6.100 13.220 5.263 1577 HA LEU 88 HA LEU 88 4.593 11.064 6.188 1578 HB2 LEU 88 2HB LEU 88 4.014 13.438 4.416 1579 HB3 LEU 88 3HB LEU 88 2.786 12.193 4.504 1580 HG LEU 88 HG LEU 88 3.854 13.585 6.988 1581 HD11 LEU 88 1HD1 LEU 88 2.897 15.302 5.522 1582 HD12 LEU 88 2HD1 LEU 88 1.892 15.041 6.945 1583 HD13 LEU 88 3HD1 LEU 88 1.402 14.371 5.385 1584 HD21 LEU 88 1HD2 LEU 88 1.772 12.768 8.014 1585 HD22 LEU 88 2HD2 LEU 88 2.729 11.434 7.379 1586 HD23 LEU 88 3HD2 LEU 88 1.308 11.995 6.494 1587 H PHE 89 H PHE 89 5.390 11.961 2.844 1588 HA PHE 89 HA PHE 89 4.214 9.685 1.606 1589 HB2 PHE 89 2HB PHE 89 6.220 11.724 0.550 1590 HB3 PHE 89 3HB PHE 89 5.470 10.481 -0.449 1591 HD1 PHE 89 HD1 PHE 89 2.893 10.464 -0.631 1592 HD2 PHE 89 HD2 PHE 89 5.079 13.805 0.920 1593 HE1 PHE 89 HE1 PHE 89 0.962 11.925 -1.027 1594 HE2 PHE 89 HE2 PHE 89 3.131 15.260 0.513 1595 HZ PHE 89 HZ PHE 89 1.070 14.316 -0.461 1596 H GLU 90 H GLU 90 7.448 10.320 2.879 1597 HA GLU 90 HA GLU 90 8.806 8.138 1.679 1598 HB2 GLU 90 2HB GLU 90 9.354 9.590 4.302 1599 HB3 GLU 90 3HB GLU 90 10.440 8.393 3.601 1600 HG2 GLU 90 2HG GLU 90 9.643 11.015 2.315 1601 HG3 GLU 90 3HG GLU 90 11.169 10.691 3.128 1602 H LEU 91 H LEU 91 6.900 8.371 4.679 1603 HA LEU 91 HA LEU 91 7.370 5.707 5.602 1604 HB2 LEU 91 2HB LEU 91 5.024 7.562 6.158 1605 HB3 LEU 91 3HB LEU 91 5.325 6.061 7.014 1606 HG LEU 91 HG LEU 91 7.065 8.562 7.114 1607 HD11 LEU 91 1HD1 LEU 91 5.293 7.298 9.238 1608 HD12 LEU 91 2HD1 LEU 91 4.964 8.794 8.361 1609 HD13 LEU 91 3HD1 LEU 91 6.335 8.707 9.462 1610 HD21 LEU 91 1HD2 LEU 91 8.462 6.538 7.269 1611 HD22 LEU 91 2HD2 LEU 91 7.455 5.932 8.587 1612 HD23 LEU 91 3HD2 LEU 91 8.410 7.402 8.805 1613 H ILE 92 H ILE 92 4.953 7.164 3.456 1614 HA ILE 92 HA ILE 92 3.266 4.909 3.076 1615 HB ILE 92 HB ILE 92 3.782 7.292 1.219 1616 HG12 ILE 92 2HG1 ILE 92 1.524 6.818 3.226 1617 HG13 ILE 92 3HG1 ILE 92 2.870 7.923 3.453 1618 HG21 ILE 92 1HG2 ILE 92 1.634 6.726 0.107 1619 HG22 ILE 92 2HG2 ILE 92 1.516 5.265 1.086 1620 HG23 ILE 92 3HG2 ILE 92 2.825 5.435 -0.083 1621 HD11 ILE 92 1HD1 ILE 92 2.073 9.274 1.570 1622 HD12 ILE 92 2HD1 ILE 92 0.868 9.121 2.848 1623 HD13 ILE 92 3HD1 ILE 92 0.704 8.176 1.367 1624 H LEU 93 H LEU 93 6.131 6.105 1.320 1625 HA LEU 93 HA LEU 93 6.117 4.180 -0.784 1626 HB2 LEU 93 2HB LEU 93 8.318 6.010 0.259 1627 HB3 LEU 93 3HB LEU 93 8.509 4.997 -1.162 1628 HG LEU 93 HG LEU 93 6.495 7.268 -0.886 1629 HD11 LEU 93 1HD1 LEU 93 9.068 7.164 -2.496 1630 HD12 LEU 93 2HD1 LEU 93 8.796 8.101 -1.025 1631 HD13 LEU 93 3HD1 LEU 93 7.895 8.487 -2.490 1632 HD21 LEU 93 1HD2 LEU 93 5.635 5.505 -2.356 1633 HD22 LEU 93 2HD2 LEU 93 7.122 5.542 -3.309 1634 HD23 LEU 93 3HD2 LEU 93 6.050 6.947 -3.285 1635 H ALA 94 H ALA 94 7.729 4.341 2.372 1636 HA ALA 94 HA ALA 94 9.406 2.040 2.043 1637 HB1 ALA 94 1HB ALA 94 9.804 2.255 4.464 1638 HB2 ALA 94 2HB ALA 94 8.482 3.421 4.591 1639 HB3 ALA 94 3HB ALA 94 9.926 3.819 3.657 1640 H ALA 95 H ALA 95 6.196 2.585 3.456 1641 HA ALA 95 HA ALA 95 5.794 -0.066 4.461 1642 HB1 ALA 95 1HB ALA 95 3.741 2.067 3.802 1643 HB2 ALA 95 2HB ALA 95 4.598 1.905 5.334 1644 HB3 ALA 95 3HB ALA 95 3.485 0.640 4.815 1645 H ASN 96 H ASN 96 5.138 1.527 1.387 1646 HA ASN 96 HA ASN 96 3.651 -0.604 0.156 1647 HB2 ASN 96 2HB ASN 96 3.447 1.667 -0.712 1648 HB3 ASN 96 3HB ASN 96 5.179 1.785 -0.984 1649 HD21 ASN 96 1HD2 ASN 96 4.720 2.381 -3.155 1650 HD22 ASN 96 2HD2 ASN 96 4.319 1.208 -4.343 1651 H TYR 97 H TYR 97 7.057 0.379 0.188 1652 HA TYR 97 HA TYR 97 8.120 -1.545 -1.588 1653 HB2 TYR 97 2HB TYR 97 9.413 0.431 -1.104 1654 HB3 TYR 97 3HB TYR 97 9.368 0.134 0.626 1655 HD1 TYR 97 HD1 TYR 97 11.364 -0.679 1.598 1656 HD2 TYR 97 HD2 TYR 97 10.599 -1.579 -2.511 1657 HE1 TYR 97 HE1 TYR 97 13.549 -1.802 1.440 1658 HE2 TYR 97 HE2 TYR 97 12.778 -2.699 -2.669 1659 HH TYR 97 HH TYR 97 14.956 -2.701 -1.540 1660 H LEU 98 H LEU 98 7.524 -1.595 1.886 1661 HA LEU 98 HA LEU 98 8.701 -4.284 2.141 1662 HB2 LEU 98 2HB LEU 98 8.045 -2.176 4.222 1663 HB3 LEU 98 3HB LEU 98 8.559 -3.805 4.632 1664 HG LEU 98 HG LEU 98 10.211 -1.775 3.080 1665 HD11 LEU 98 1HD1 LEU 98 10.592 -2.802 5.911 1666 HD12 LEU 98 2HD1 LEU 98 10.044 -1.188 5.450 1667 HD13 LEU 98 3HD1 LEU 98 11.675 -1.710 5.038 1668 HD21 LEU 98 1HD2 LEU 98 12.042 -3.410 3.215 1669 HD22 LEU 98 2HD2 LEU 98 10.679 -4.049 2.304 1670 HD23 LEU 98 3HD2 LEU 98 10.957 -4.585 3.964 1671 H ASP 99 H ASP 99 5.729 -3.050 1.491 1672 HA ASP 99 HA ASP 99 3.610 -3.881 1.505 1673 HB2 ASP 99 2HB ASP 99 5.244 -6.378 1.956 1674 HB3 ASP 99 3HB ASP 99 3.500 -6.505 2.096 1675 H ILE 100 H ILE 100 4.876 -2.916 4.118 1676 HA ILE 100 HA ILE 100 3.434 -4.337 6.197 1677 HB ILE 100 HB ILE 100 4.924 -1.678 6.435 1678 HG12 ILE 100 2HG1 ILE 100 5.941 -4.504 6.963 1679 HG13 ILE 100 3HG1 ILE 100 6.416 -3.485 5.612 1680 HG21 ILE 100 1HG2 ILE 100 5.001 -2.186 8.865 1681 HG22 ILE 100 2HG2 ILE 100 4.074 -3.660 8.592 1682 HG23 ILE 100 3HG2 ILE 100 3.332 -2.088 8.290 1683 HD11 ILE 100 1HD1 ILE 100 7.453 -1.916 7.160 1684 HD12 ILE 100 2HD1 ILE 100 8.119 -3.540 7.311 1685 HD13 ILE 100 3HD1 ILE 100 6.984 -2.943 8.517 1686 H LYS 101 H LYS 101 1.329 -4.161 5.519 1687 HA LYS 101 HA LYS 101 0.005 -1.738 4.898 1688 HB2 LYS 101 2HB LYS 101 -1.173 -4.396 5.759 1689 HB3 LYS 101 3HB LYS 101 -2.077 -3.046 5.077 1690 HG2 LYS 101 2HG LYS 101 -0.540 -3.243 3.025 1691 HG3 LYS 101 3HG LYS 101 -0.022 -4.793 3.704 1692 HD2 LYS 101 2HD LYS 101 -1.806 -5.190 2.105 1693 HD3 LYS 101 3HD LYS 101 -2.411 -5.536 3.727 1694 HE2 LYS 101 2HE LYS 101 -3.473 -3.288 3.782 1695 HE3 LYS 101 3HE LYS 101 -2.904 -2.992 2.140 1696 HZ1 LYS 101 1HZ LYS 101 -4.834 -5.061 3.005 1697 HZ2 LYS 101 2HZ LYS 101 -4.199 -4.938 1.454 1698 HZ3 LYS 101 3HZ LYS 101 -5.154 -3.690 2.064 1699 HA PRO 102 HA PRO 102 -1.311 -1.858 9.803 1700 HB2 PRO 102 2HB PRO 102 1.596 -2.465 10.477 1701 HB3 PRO 102 3HB PRO 102 0.139 -2.717 11.468 1702 HG2 PRO 102 2HG PRO 102 1.220 -4.786 10.220 1703 HG3 PRO 102 3HG PRO 102 -0.549 -4.588 10.243 1704 HD2 PRO 102 2HD PRO 102 1.372 -4.104 7.989 1705 HD3 PRO 102 3HD PRO 102 -0.303 -4.695 7.937 1706 H LEU 103 H LEU 103 1.843 -0.982 8.363 1707 HA LEU 103 HA LEU 103 1.905 1.649 9.572 1708 HB2 LEU 103 2HB LEU 103 3.991 0.412 9.162 1709 HB3 LEU 103 3HB LEU 103 3.659 0.380 7.437 1710 HG LEU 103 HG LEU 103 3.964 2.817 7.287 1711 HD11 LEU 103 1HD1 LEU 103 4.682 4.150 9.216 1712 HD12 LEU 103 2HD1 LEU 103 4.447 2.757 10.275 1713 HD13 LEU 103 3HD1 LEU 103 3.068 3.482 9.440 1714 HD21 LEU 103 1HD2 LEU 103 6.258 1.497 8.778 1715 HD22 LEU 103 2HD2 LEU 103 6.368 2.967 7.805 1716 HD23 LEU 103 3HD2 LEU 103 5.968 1.433 7.037 1717 H LEU 104 H LEU 104 1.406 0.317 6.307 1718 HA LEU 104 HA LEU 104 1.365 2.660 4.796 1719 HB2 LEU 104 2HB LEU 104 1.536 0.378 3.843 1720 HB3 LEU 104 3HB LEU 104 -0.115 0.045 4.309 1721 HG LEU 104 HG LEU 104 -0.867 1.843 2.682 1722 HD11 LEU 104 1HD1 LEU 104 1.188 3.167 2.562 1723 HD12 LEU 104 2HD1 LEU 104 0.700 2.622 0.961 1724 HD13 LEU 104 3HD1 LEU 104 2.035 1.823 1.791 1725 HD21 LEU 104 1HD2 LEU 104 -0.930 -0.553 2.106 1726 HD22 LEU 104 2HD2 LEU 104 0.714 -0.448 1.467 1727 HD23 LEU 104 3HD2 LEU 104 -0.594 0.452 0.697 1728 H ASP 105 H ASP 105 -1.290 0.848 6.254 1729 HA ASP 105 HA ASP 105 -3.436 2.347 5.242 1730 HB2 ASP 105 2HB ASP 105 -3.664 0.040 6.161 1731 HB3 ASP 105 3HB ASP 105 -3.346 0.653 7.786 1732 H VAL 106 H VAL 106 -1.777 2.461 8.396 1733 HA VAL 106 HA VAL 106 -3.390 4.471 9.554 1734 HB VAL 106 HB VAL 106 -0.602 3.437 10.248 1735 HG11 VAL 106 1HG1 VAL 106 -0.806 4.544 12.455 1736 HG12 VAL 106 2HG1 VAL 106 -2.275 5.360 11.916 1737 HG13 VAL 106 3HG1 VAL 106 -0.731 5.722 11.143 1738 HG21 VAL 106 1HG2 VAL 106 -3.317 2.942 11.532 1739 HG22 VAL 106 2HG2 VAL 106 -1.782 2.267 12.085 1740 HG23 VAL 106 3HG2 VAL 106 -2.431 1.811 10.508 1741 H THR 107 H THR 107 -0.216 4.708 7.872 1742 HA THR 107 HA THR 107 0.162 7.494 8.331 1743 HB THR 107 HB THR 107 1.357 5.772 6.108 1744 HG1 THR 107 HG1 THR 107 2.007 4.902 8.026 1745 HG21 THR 107 1HG2 THR 107 3.176 7.452 6.064 1746 HG22 THR 107 2HG2 THR 107 2.319 8.423 7.263 1747 HG23 THR 107 3HG2 THR 107 1.628 8.198 5.655 1748 H CYS 108 H CYS 108 -1.114 5.677 5.531 1749 HA CYS 108 HA CYS 108 -1.707 7.920 3.890 1750 HB2 CYS 108 2HB CYS 108 -2.815 5.089 3.820 1751 HB3 CYS 108 3HB CYS 108 -3.101 6.299 2.567 1752 HG CYS 108 HG CYS 108 -0.348 4.473 3.200 1753 H LYS 109 H LYS 109 -3.448 6.315 6.473 1754 HA LYS 109 HA LYS 109 -6.042 7.395 5.912 1755 HB2 LYS 109 2HB LYS 109 -5.378 5.334 7.447 1756 HB3 LYS 109 3HB LYS 109 -5.177 6.541 8.703 1757 HG2 LYS 109 2HG LYS 109 -7.380 5.547 8.881 1758 HG3 LYS 109 3HG LYS 109 -7.555 7.231 8.376 1759 HD2 LYS 109 2HD LYS 109 -9.080 5.737 7.125 1760 HD3 LYS 109 3HD LYS 109 -7.920 6.519 6.052 1761 HE2 LYS 109 2HE LYS 109 -8.210 4.167 5.437 1762 HE3 LYS 109 3HE LYS 109 -6.567 4.442 6.014 1763 HZ1 LYS 109 1HZ LYS 109 -8.792 3.234 7.571 1764 HZ2 LYS 109 2HZ LYS 109 -7.239 3.531 8.167 1765 HZ3 LYS 109 3HZ LYS 109 -7.461 2.412 6.923 1766 H THR 110 H THR 110 -3.390 8.215 8.132 1767 HA THR 110 HA THR 110 -4.582 10.369 9.479 1768 HB THR 110 HB THR 110 -1.628 9.775 8.979 1769 HG1 THR 110 HG1 THR 110 -1.991 8.279 10.416 1770 HG21 THR 110 1HG2 THR 110 -2.865 11.644 11.046 1771 HG22 THR 110 2HG2 THR 110 -1.871 12.138 9.673 1772 HG23 THR 110 3HG2 THR 110 -1.162 11.180 10.974 1773 H VAL 111 H VAL 111 -2.357 10.371 6.651 1774 HA VAL 111 HA VAL 111 -2.280 13.187 6.341 1775 HB VAL 111 HB VAL 111 -0.544 11.664 5.388 1776 HG11 VAL 111 1HG1 VAL 111 -1.980 9.886 4.505 1777 HG12 VAL 111 2HG1 VAL 111 -0.880 10.494 3.268 1778 HG13 VAL 111 3HG1 VAL 111 -2.577 10.975 3.252 1779 HG21 VAL 111 1HG2 VAL 111 -0.134 12.905 3.294 1780 HG22 VAL 111 2HG2 VAL 111 -0.657 13.982 4.589 1781 HG23 VAL 111 3HG2 VAL 111 -1.795 13.512 3.326 1782 H ALA 112 H ALA 112 -4.453 10.708 5.051 1783 HA ALA 112 HA ALA 112 -5.955 12.400 3.295 1784 HB1 ALA 112 1HB ALA 112 -5.922 9.960 3.038 1785 HB2 ALA 112 2HB ALA 112 -7.573 10.546 3.248 1786 HB3 ALA 112 3HB ALA 112 -6.729 9.769 4.594 1787 H ASN 113 H ASN 113 -6.198 11.535 6.725 1788 HA ASN 113 HA ASN 113 -8.821 12.631 7.151 1789 HB2 ASN 113 2HB ASN 113 -6.656 11.699 9.079 1790 HB3 ASN 113 3HB ASN 113 -8.145 12.437 9.660 1791 HD21 ASN 113 1HD2 ASN 113 -7.126 9.728 10.088 1792 HD22 ASN 113 2HD2 ASN 113 -8.353 8.654 9.518 1793 H MET 114 H MET 114 -5.597 13.970 7.159 1794 HA MET 114 HA MET 114 -6.057 16.331 8.656 1795 HB2 MET 114 2HB MET 114 -4.134 15.938 6.320 1796 HB3 MET 114 3HB MET 114 -4.098 17.292 7.441 1797 HG2 MET 114 2HG MET 114 -3.729 15.551 9.282 1798 HG3 MET 114 3HG MET 114 -3.408 14.408 7.982 1799 HE1 MET 114 1HE MET 114 -1.966 16.627 5.884 1800 HE2 MET 114 2HE MET 114 -1.452 14.950 6.072 1801 HE3 MET 114 3HE MET 114 -0.284 16.254 6.259 1802 H ILE 115 H ILE 115 -6.639 15.526 5.264 1803 HA ILE 115 HA ILE 115 -7.593 18.244 4.641 1804 HB ILE 115 HB ILE 115 -7.629 17.527 2.290 1805 HG12 ILE 115 2HG1 ILE 115 -6.775 14.772 3.307 1806 HG13 ILE 115 3HG1 ILE 115 -8.343 15.161 2.615 1807 HG21 ILE 115 1HG2 ILE 115 -5.485 18.335 3.222 1808 HG22 ILE 115 2HG2 ILE 115 -5.203 17.134 1.961 1809 HG23 ILE 115 3HG2 ILE 115 -5.042 16.682 3.661 1810 HD11 ILE 115 1HD1 ILE 115 -5.702 15.222 1.169 1811 HD12 ILE 115 2HD1 ILE 115 -7.269 15.644 0.475 1812 HD13 ILE 115 3HD1 ILE 115 -6.965 14.000 1.029 1813 H ARG 116 H ARG 116 -8.806 15.095 5.373 1814 HA ARG 116 HA ARG 116 -11.447 15.307 4.249 1815 HB2 ARG 116 2HB ARG 116 -10.369 13.141 4.654 1816 HB3 ARG 116 3HB ARG 116 -10.223 13.495 6.369 1817 HG2 ARG 116 2HG ARG 116 -12.727 13.426 6.543 1818 HG3 ARG 116 3HG ARG 116 -12.791 12.940 4.845 1819 HD2 ARG 116 2HD ARG 116 -11.507 10.914 5.350 1820 HD3 ARG 116 3HD ARG 116 -11.338 11.418 7.036 1821 HE ARG 116 HE ARG 116 -14.065 11.100 6.045 1822 HH11 ARG 116 1HH1 ARG 116 -11.400 9.629 7.815 1823 HH12 ARG 116 2HH1 ARG 116 -12.408 8.448 8.582 1824 HH21 ARG 116 1HH2 ARG 116 -15.368 9.515 7.037 1825 HH22 ARG 116 2HH2 ARG 116 -14.653 8.385 8.142 1826 H GLY 117 H GLY 117 -10.052 15.715 7.499 1827 HA2 GLY 117 2HA GLY 117 -12.496 17.102 8.448 1828 HA3 GLY 117 3HA GLY 117 -11.695 15.866 9.414 Start of MODEL 7 1 H1 SER 2 1H SER 2 -18.422 -15.939 -14.240 2 H2 SER 2 2H SER 2 -17.354 -15.829 -15.535 3 H3 SER 2 3H SER 2 -18.815 -16.646 -15.720 4 HA SER 2 HA SER 2 -18.913 -14.497 -16.770 5 HB2 SER 2 2HB SER 2 -20.976 -15.458 -15.754 6 HB3 SER 2 3HB SER 2 -20.598 -14.662 -14.228 7 HG SER 2 HG SER 2 -21.587 -12.987 -14.990 8 H LEU 3 H LEU 3 -19.335 -12.094 -16.201 9 HA LEU 3 HA LEU 3 -17.027 -10.922 -15.036 10 HB2 LEU 3 2HB LEU 3 -19.739 -9.729 -15.727 11 HB3 LEU 3 3HB LEU 3 -18.318 -8.777 -15.325 12 HG LEU 3 HG LEU 3 -18.476 -10.627 -17.739 13 HD11 LEU 3 1HD1 LEU 3 -18.907 -7.627 -17.642 14 HD12 LEU 3 2HD1 LEU 3 -20.137 -8.852 -17.974 15 HD13 LEU 3 3HD1 LEU 3 -18.805 -8.619 -19.102 16 HD21 LEU 3 1HD2 LEU 3 -16.491 -8.452 -17.014 17 HD22 LEU 3 2HD2 LEU 3 -16.503 -9.388 -18.512 18 HD23 LEU 3 3HD2 LEU 3 -16.194 -10.193 -16.977 19 H VAL 4 H VAL 4 -16.605 -10.750 -12.870 20 HA VAL 4 HA VAL 4 -18.584 -11.191 -10.855 21 HB VAL 4 HB VAL 4 -16.797 -10.580 -9.195 22 HG11 VAL 4 1HG1 VAL 4 -15.956 -12.605 -11.299 23 HG12 VAL 4 2HG1 VAL 4 -17.064 -12.903 -9.957 24 HG13 VAL 4 3HG1 VAL 4 -15.368 -12.542 -9.633 25 HG21 VAL 4 1HG2 VAL 4 -15.531 -8.921 -10.502 26 HG22 VAL 4 2HG2 VAL 4 -15.039 -10.173 -11.646 27 HG23 VAL 4 3HG2 VAL 4 -14.468 -10.230 -9.975 28 H LYS 5 H LYS 5 -19.914 -9.812 -9.980 29 HA LYS 5 HA LYS 5 -20.130 -7.141 -11.050 30 HB2 LYS 5 2HB LYS 5 -21.933 -8.627 -9.098 31 HB3 LYS 5 3HB LYS 5 -22.351 -7.176 -9.987 32 HG2 LYS 5 2HG LYS 5 -22.265 -8.444 -12.111 33 HG3 LYS 5 3HG LYS 5 -21.812 -9.905 -11.219 34 HD2 LYS 5 2HD LYS 5 -23.996 -9.720 -9.955 35 HD3 LYS 5 3HD LYS 5 -24.435 -8.367 -11.004 36 HE2 LYS 5 2HE LYS 5 -23.848 -11.189 -11.965 37 HE3 LYS 5 3HE LYS 5 -25.460 -10.519 -11.717 38 HZ1 LYS 5 1HZ LYS 5 -24.860 -10.405 -14.024 39 HZ2 LYS 5 2HZ LYS 5 -23.443 -9.553 -13.669 40 HZ3 LYS 5 3HZ LYS 5 -24.944 -8.837 -13.401 41 H LEU 6 H LEU 6 -18.281 -6.137 -9.993 42 HA LEU 6 HA LEU 6 -18.128 -5.974 -7.115 43 HB2 LEU 6 2HB LEU 6 -16.628 -4.393 -9.239 44 HB3 LEU 6 3HB LEU 6 -16.287 -4.338 -7.514 45 HG LEU 6 HG LEU 6 -15.861 -6.687 -9.407 46 HD11 LEU 6 1HD1 LEU 6 -13.522 -6.507 -8.683 47 HD12 LEU 6 2HD1 LEU 6 -13.931 -5.103 -7.692 48 HD13 LEU 6 3HD1 LEU 6 -14.095 -5.029 -9.447 49 HD21 LEU 6 1HD2 LEU 6 -16.775 -7.612 -7.349 50 HD22 LEU 6 2HD2 LEU 6 -15.605 -6.708 -6.383 51 HD23 LEU 6 3HD2 LEU 6 -15.057 -7.987 -7.473 52 H GLU 7 H GLU 7 -20.079 -5.202 -6.488 53 HA GLU 7 HA GLU 7 -21.246 -2.738 -7.419 54 HB2 GLU 7 2HB GLU 7 -22.589 -4.701 -6.693 55 HB3 GLU 7 3HB GLU 7 -21.946 -4.537 -5.062 56 HG2 GLU 7 2HG GLU 7 -23.059 -2.351 -4.825 57 HG3 GLU 7 3HG GLU 7 -23.676 -2.476 -6.475 58 H SER 8 H SER 8 -20.471 -0.812 -6.784 59 HA SER 8 HA SER 8 -18.578 -0.466 -4.660 60 HB2 SER 8 2HB SER 8 -18.632 1.931 -5.390 61 HB3 SER 8 3HB SER 8 -18.411 0.819 -6.741 62 HG SER 8 HG SER 8 -20.407 1.226 -7.444 63 H SER 9 H SER 9 -18.830 1.469 -3.153 64 HA SER 9 HA SER 9 -20.934 1.251 -1.314 65 HB2 SER 9 2HB SER 9 -18.685 2.230 -0.816 66 HB3 SER 9 3HB SER 9 -19.095 3.643 -1.791 67 HG SER 9 HG SER 9 -19.946 2.906 0.752 68 H ASP 10 H ASP 10 -20.590 3.153 -4.214 69 HA ASP 10 HA ASP 10 -22.921 4.846 -3.743 70 HB2 ASP 10 2HB ASP 10 -20.842 5.757 -4.776 71 HB3 ASP 10 3HB ASP 10 -21.019 4.633 -6.115 72 H GLU 11 H GLU 11 -22.738 1.730 -4.420 73 HA GLU 11 HA GLU 11 -24.275 0.199 -4.973 74 HB2 GLU 11 2HB GLU 11 -26.055 2.489 -5.904 75 HB3 GLU 11 3HB GLU 11 -26.578 0.822 -5.666 76 HG2 GLU 11 2HG GLU 11 -26.272 0.980 -3.279 77 HG3 GLU 11 3HG GLU 11 -25.470 2.545 -3.416 78 H LYS 12 H LYS 12 -22.666 2.011 -7.213 79 HA LYS 12 HA LYS 12 -23.919 1.012 -9.628 80 HB2 LYS 12 2HB LYS 12 -21.351 2.571 -9.146 81 HB3 LYS 12 3HB LYS 12 -21.835 2.020 -10.751 82 HG2 LYS 12 2HG LYS 12 -23.970 3.299 -10.507 83 HG3 LYS 12 3HG LYS 12 -23.389 3.928 -8.960 84 HD2 LYS 12 2HD LYS 12 -21.574 5.103 -10.052 85 HD3 LYS 12 3HD LYS 12 -21.925 4.333 -11.602 86 HE2 LYS 12 2HE LYS 12 -22.731 6.670 -11.531 87 HE3 LYS 12 3HE LYS 12 -24.067 5.534 -11.733 88 HZ1 LYS 12 1HZ LYS 12 -24.555 7.289 -10.113 89 HZ2 LYS 12 2HZ LYS 12 -23.266 6.779 -9.149 90 HZ3 LYS 12 3HZ LYS 12 -24.590 5.762 -9.395 91 H VAL 13 H VAL 13 -23.536 -0.840 -10.595 92 HA VAL 13 HA VAL 13 -21.805 -2.805 -9.290 93 HB VAL 13 HB VAL 13 -24.028 -3.111 -11.362 94 HG11 VAL 13 1HG1 VAL 13 -22.470 -4.980 -11.545 95 HG12 VAL 13 2HG1 VAL 13 -23.993 -5.523 -10.836 96 HG13 VAL 13 3HG1 VAL 13 -22.580 -5.271 -9.806 97 HG21 VAL 13 1HG2 VAL 13 -24.868 -2.284 -9.193 98 HG22 VAL 13 2HG2 VAL 13 -24.093 -3.638 -8.362 99 HG23 VAL 13 3HG2 VAL 13 -25.416 -3.936 -9.494 100 H PHE 14 H PHE 14 -19.750 -2.644 -10.085 101 HA PHE 14 HA PHE 14 -19.225 -2.284 -12.944 102 HB2 PHE 14 2HB PHE 14 -17.317 -2.404 -10.563 103 HB3 PHE 14 3HB PHE 14 -16.838 -2.065 -12.227 104 HD1 PHE 14 HD1 PHE 14 -17.895 -0.028 -13.392 105 HD2 PHE 14 HD2 PHE 14 -18.036 -0.628 -9.156 106 HE1 PHE 14 HE1 PHE 14 -18.410 2.349 -13.066 107 HE2 PHE 14 HE2 PHE 14 -18.550 1.744 -8.845 108 HZ PHE 14 HZ PHE 14 -18.741 3.236 -10.794 109 H GLU 15 H GLU 15 -19.834 -4.192 -13.842 110 HA GLU 15 HA GLU 15 -18.932 -6.779 -12.982 111 HB2 GLU 15 2HB GLU 15 -20.196 -5.838 -15.593 112 HB3 GLU 15 3HB GLU 15 -19.885 -7.524 -15.194 113 HG2 GLU 15 2HG GLU 15 -21.421 -7.376 -13.278 114 HG3 GLU 15 3HG GLU 15 -21.729 -5.685 -13.640 115 H ILE 16 H ILE 16 -16.670 -6.420 -12.823 116 HA ILE 16 HA ILE 16 -15.103 -6.023 -15.291 117 HB ILE 16 HB ILE 16 -14.433 -4.836 -13.160 118 HG12 ILE 16 2HG1 ILE 16 -11.980 -5.372 -13.229 119 HG13 ILE 16 3HG1 ILE 16 -12.330 -6.816 -14.172 120 HG21 ILE 16 1HG2 ILE 16 -13.400 -6.091 -11.314 121 HG22 ILE 16 2HG2 ILE 16 -13.781 -7.611 -12.126 122 HG23 ILE 16 3HG2 ILE 16 -15.084 -6.566 -11.551 123 HD11 ILE 16 1HD1 ILE 16 -12.850 -3.977 -15.043 124 HD12 ILE 16 2HD1 ILE 16 -13.145 -5.433 -16.000 125 HD13 ILE 16 3HD1 ILE 16 -11.499 -4.993 -15.545 126 H GLU 17 H GLU 17 -13.529 -7.663 -15.955 127 HA GLU 17 HA GLU 17 -14.346 -10.349 -15.836 128 HB2 GLU 17 2HB GLU 17 -11.577 -9.264 -16.511 129 HB3 GLU 17 3HB GLU 17 -12.155 -10.889 -16.882 130 HG2 GLU 17 2HG GLU 17 -13.901 -9.901 -18.364 131 HG3 GLU 17 3HG GLU 17 -13.258 -8.293 -18.018 132 H LYS 18 H LYS 18 -13.773 -12.026 -14.560 133 HA LYS 18 HA LYS 18 -13.185 -11.617 -11.863 134 HB2 LYS 18 2HB LYS 18 -14.426 -13.546 -12.755 135 HB3 LYS 18 3HB LYS 18 -12.962 -14.158 -13.522 136 HG2 LYS 18 2HG LYS 18 -11.948 -14.507 -11.269 137 HG3 LYS 18 3HG LYS 18 -13.437 -13.921 -10.520 138 HD2 LYS 18 2HD LYS 18 -13.158 -16.401 -12.274 139 HD3 LYS 18 3HD LYS 18 -13.390 -16.382 -10.524 140 HE2 LYS 18 2HE LYS 18 -15.612 -15.359 -10.824 141 HE3 LYS 18 3HE LYS 18 -15.375 -15.338 -12.571 142 HZ1 LYS 18 1HZ LYS 18 -15.530 -17.759 -10.864 143 HZ2 LYS 18 2HZ LYS 18 -15.232 -17.754 -12.528 144 HZ3 LYS 18 3HZ LYS 18 -16.715 -17.198 -11.935 145 H GLU 19 H GLU 19 -11.111 -12.684 -14.522 146 HA GLU 19 HA GLU 19 -8.769 -13.304 -13.122 147 HB2 GLU 19 2HB GLU 19 -7.643 -13.067 -15.324 148 HB3 GLU 19 3HB GLU 19 -9.129 -14.008 -15.412 149 HG2 GLU 19 2HG GLU 19 -10.315 -11.985 -16.286 150 HG3 GLU 19 3HG GLU 19 -8.776 -11.122 -16.298 151 H ILE 20 H ILE 20 -10.001 -10.185 -14.189 152 HA ILE 20 HA ILE 20 -7.550 -8.708 -13.660 153 HB ILE 20 HB ILE 20 -10.372 -7.678 -14.228 154 HG12 ILE 20 2HG1 ILE 20 -8.044 -8.152 -16.146 155 HG13 ILE 20 3HG1 ILE 20 -9.529 -9.087 -16.080 156 HG21 ILE 20 1HG2 ILE 20 -8.956 -5.972 -13.150 157 HG22 ILE 20 2HG2 ILE 20 -9.286 -5.545 -14.828 158 HG23 ILE 20 3HG2 ILE 20 -7.712 -6.211 -14.383 159 HD11 ILE 20 1HD1 ILE 20 -9.281 -6.195 -16.903 160 HD12 ILE 20 2HD1 ILE 20 -10.792 -7.104 -16.788 161 HD13 ILE 20 3HD1 ILE 20 -9.559 -7.584 -17.953 162 H ALA 21 H ALA 21 -10.617 -9.390 -12.047 163 HA ALA 21 HA ALA 21 -10.280 -7.630 -9.815 164 HB1 ALA 21 1HB ALA 21 -12.180 -8.840 -8.847 165 HB2 ALA 21 2HB ALA 21 -12.029 -10.094 -10.084 166 HB3 ALA 21 3HB ALA 21 -12.480 -8.450 -10.546 167 H CYS 22 H CYS 22 -8.979 -10.740 -10.613 168 HA CYS 22 HA CYS 22 -8.249 -11.611 -7.999 169 HB2 CYS 22 2HB CYS 22 -7.074 -12.318 -10.708 170 HB3 CYS 22 3HB CYS 22 -6.747 -13.177 -9.200 171 HG CYS 22 HG CYS 22 -10.004 -12.975 -9.732 172 H MET 23 H MET 23 -6.835 -9.330 -10.271 173 HA MET 23 HA MET 23 -4.186 -9.179 -9.297 174 HB2 MET 23 2HB MET 23 -5.903 -6.975 -10.521 175 HB3 MET 23 3HB MET 23 -4.162 -6.874 -10.284 176 HG2 MET 23 2HG MET 23 -3.822 -8.714 -11.865 177 HG3 MET 23 3HG MET 23 -5.569 -8.873 -12.075 178 HE1 MET 23 1HE MET 23 -2.428 -6.515 -12.639 179 HE2 MET 23 2HE MET 23 -3.508 -5.464 -11.721 180 HE3 MET 23 3HE MET 23 -3.181 -5.130 -13.422 181 H SER 24 H SER 24 -7.170 -7.578 -8.282 182 HA SER 24 HA SER 24 -6.105 -6.193 -6.024 183 HB2 SER 24 2HB SER 24 -8.323 -5.617 -6.962 184 HB3 SER 24 3HB SER 24 -8.940 -7.214 -6.540 185 HG SER 24 HG SER 24 -7.831 -5.490 -4.597 186 H VAL 25 H VAL 25 -5.048 -7.273 -4.459 187 HA VAL 25 HA VAL 25 -5.171 -10.054 -4.027 188 HB VAL 25 HB VAL 25 -4.077 -7.890 -2.173 189 HG11 VAL 25 1HG1 VAL 25 -3.530 -10.882 -2.115 190 HG12 VAL 25 2HG1 VAL 25 -4.426 -9.966 -0.903 191 HG13 VAL 25 3HG1 VAL 25 -2.703 -9.672 -1.130 192 HG21 VAL 25 1HG2 VAL 25 -1.869 -8.434 -3.163 193 HG22 VAL 25 2HG2 VAL 25 -3.003 -7.868 -4.391 194 HG23 VAL 25 3HG2 VAL 25 -2.647 -9.590 -4.251 195 H THR 26 H THR 26 -6.703 -7.333 -2.292 196 HA THR 26 HA THR 26 -7.837 -8.791 -0.162 197 HB THR 26 HB THR 26 -8.821 -6.177 -1.375 198 HG1 THR 26 HG1 THR 26 -6.609 -6.820 0.146 199 HG21 THR 26 1HG2 THR 26 -9.222 -7.287 1.433 200 HG22 THR 26 2HG2 THR 26 -10.476 -7.158 0.198 201 HG23 THR 26 3HG2 THR 26 -9.741 -5.700 0.868 202 H ILE 27 H ILE 27 -9.342 -7.721 -3.268 203 HA ILE 27 HA ILE 27 -11.891 -8.886 -2.837 204 HB ILE 27 HB ILE 27 -10.476 -8.169 -5.445 205 HG12 ILE 27 2HG1 ILE 27 -12.649 -6.691 -3.884 206 HG13 ILE 27 3HG1 ILE 27 -10.944 -6.254 -3.928 207 HG21 ILE 27 1HG2 ILE 27 -13.411 -8.906 -5.090 208 HG22 ILE 27 2HG2 ILE 27 -12.197 -9.869 -5.932 209 HG23 ILE 27 3HG2 ILE 27 -12.675 -8.300 -6.578 210 HD11 ILE 27 1HD1 ILE 27 -12.864 -6.181 -6.253 211 HD12 ILE 27 2HD1 ILE 27 -11.141 -5.800 -6.336 212 HD13 ILE 27 3HD1 ILE 27 -12.218 -4.806 -5.357 213 H LYS 28 H LYS 28 -8.929 -10.118 -4.401 214 HA LYS 28 HA LYS 28 -9.915 -12.607 -5.287 215 HB2 LYS 28 2HB LYS 28 -7.742 -11.647 -6.024 216 HB3 LYS 28 3HB LYS 28 -7.079 -11.908 -4.412 217 HG2 LYS 28 2HG LYS 28 -7.393 -14.375 -4.712 218 HG3 LYS 28 3HG LYS 28 -8.006 -14.073 -6.340 219 HD2 LYS 28 2HD LYS 28 -5.663 -14.768 -6.428 220 HD3 LYS 28 3HD LYS 28 -5.827 -13.100 -6.987 221 HE2 LYS 28 2HE LYS 28 -3.858 -13.323 -5.550 222 HE3 LYS 28 3HE LYS 28 -5.049 -12.298 -4.757 223 HZ1 LYS 28 1HZ LYS 28 -5.699 -14.178 -3.379 224 HZ2 LYS 28 2HZ LYS 28 -4.039 -13.895 -3.235 225 HZ3 LYS 28 3HZ LYS 28 -4.595 -15.180 -4.175 226 H ASN 29 H ASN 29 -8.545 -11.577 -2.163 227 HA ASN 29 HA ASN 29 -8.480 -14.184 -0.990 228 HB2 ASN 29 2HB ASN 29 -8.373 -11.417 0.274 229 HB3 ASN 29 3HB ASN 29 -8.264 -12.896 1.220 230 HD21 ASN 29 1HD2 ASN 29 -6.627 -14.302 -0.841 231 HD22 ASN 29 2HD2 ASN 29 -5.068 -13.576 -0.731 232 H MET 30 H MET 30 -10.952 -11.674 -1.238 233 HA MET 30 HA MET 30 -12.831 -12.788 0.612 234 HB2 MET 30 2HB MET 30 -13.263 -10.963 -1.798 235 HB3 MET 30 3HB MET 30 -14.535 -11.400 -0.663 236 HG2 MET 30 2HG MET 30 -13.325 -10.283 1.148 237 HG3 MET 30 3HG MET 30 -12.017 -9.866 0.034 238 HE1 MET 30 1HE MET 30 -13.815 -6.395 0.678 239 HE2 MET 30 2HE MET 30 -12.286 -7.267 0.773 240 HE3 MET 30 3HE MET 30 -13.614 -7.694 1.853 241 H ILE 31 H ILE 31 -12.240 -13.191 -2.846 242 HA ILE 31 HA ILE 31 -14.361 -14.936 -3.519 243 HB ILE 31 HB ILE 31 -11.589 -14.537 -4.738 244 HG12 ILE 31 2HG1 ILE 31 -14.313 -13.553 -5.706 245 HG13 ILE 31 3HG1 ILE 31 -13.174 -12.578 -4.789 246 HG21 ILE 31 1HG2 ILE 31 -12.385 -15.688 -6.776 247 HG22 ILE 31 2HG2 ILE 31 -13.886 -16.109 -5.951 248 HG23 ILE 31 3HG2 ILE 31 -12.352 -16.776 -5.387 249 HD11 ILE 31 1HD1 ILE 31 -12.752 -13.683 -7.566 250 HD12 ILE 31 2HD1 ILE 31 -11.556 -12.765 -6.643 251 HD13 ILE 31 3HD1 ILE 31 -13.074 -12.009 -7.118 252 H GLU 32 H GLU 32 -10.963 -15.596 -2.638 253 HA GLU 32 HA GLU 32 -11.057 -18.425 -2.701 254 HB2 GLU 32 2HB GLU 32 -9.113 -16.563 -1.260 255 HB3 GLU 32 3HB GLU 32 -8.852 -18.292 -1.504 256 HG2 GLU 32 2HG GLU 32 -8.688 -18.006 -3.901 257 HG3 GLU 32 3HG GLU 32 -9.185 -16.319 -3.788 258 H ASP 33 H ASP 33 -11.797 -16.078 -0.224 259 HA ASP 33 HA ASP 33 -11.687 -17.665 2.104 260 HB2 ASP 33 2HB ASP 33 -11.827 -15.192 2.145 261 HB3 ASP 33 3HB ASP 33 -13.454 -15.257 1.483 262 H ILE 34 H ILE 34 -14.306 -16.983 -0.154 263 HA ILE 34 HA ILE 34 -16.200 -18.811 1.157 264 HB ILE 34 HB ILE 34 -16.608 -17.112 -1.364 265 HG12 ILE 34 2HG1 ILE 34 -17.170 -16.300 1.530 266 HG13 ILE 34 3HG1 ILE 34 -15.878 -15.656 0.527 267 HG21 ILE 34 1HG2 ILE 34 -19.014 -17.226 -0.816 268 HG22 ILE 34 2HG2 ILE 34 -18.658 -18.225 0.595 269 HG23 ILE 34 3HG2 ILE 34 -18.341 -18.843 -1.027 270 HD11 ILE 34 1HD1 ILE 34 -18.840 -15.292 0.055 271 HD12 ILE 34 2HD1 ILE 34 -17.547 -14.659 -0.967 272 HD13 ILE 34 3HD1 ILE 34 -17.714 -14.096 0.693 273 H GLY 35 H GLY 35 -13.610 -19.468 -0.552 274 HA2 GLY 35 2HA GLY 35 -13.011 -21.328 -1.816 275 HA3 GLY 35 3HA GLY 35 -14.706 -21.683 -2.134 276 H GLU 36 H GLU 36 -15.853 -19.998 -3.468 277 HA GLU 36 HA GLU 36 -14.291 -18.124 -4.991 278 HB2 GLU 36 2HB GLU 36 -14.175 -20.267 -6.366 279 HB3 GLU 36 3HB GLU 36 -15.925 -20.180 -6.549 280 HG2 GLU 36 2HG GLU 36 -15.684 -17.980 -7.666 281 HG3 GLU 36 3HG GLU 36 -13.931 -18.098 -7.504 282 H SER 37 H SER 37 -15.632 -16.477 -5.962 283 HA SER 37 HA SER 37 -18.523 -16.533 -5.432 284 HB2 SER 37 2HB SER 37 -16.657 -14.384 -4.333 285 HB3 SER 37 3HB SER 37 -18.419 -14.308 -4.296 286 HG SER 37 HG SER 37 -17.523 -16.634 -3.237 287 H ASP 38 H ASP 38 -18.706 -16.639 -7.673 288 HA ASP 38 HA ASP 38 -17.789 -14.604 -9.487 289 HB2 ASP 38 2HB ASP 38 -18.365 -16.980 -10.134 290 HB3 ASP 38 3HB ASP 38 -20.054 -16.640 -9.800 291 H SER 39 H SER 39 -20.472 -15.080 -7.380 292 HA SER 39 HA SER 39 -22.437 -13.336 -8.351 293 HB2 SER 39 2HB SER 39 -23.302 -13.531 -5.977 294 HB3 SER 39 3HB SER 39 -22.920 -15.077 -6.732 295 HG SER 39 HG SER 39 -21.287 -13.647 -4.895 296 HA PRO 40 HA PRO 40 -21.365 -9.106 -7.470 297 HB2 PRO 40 2HB PRO 40 -23.426 -8.257 -5.691 298 HB3 PRO 40 3HB PRO 40 -23.479 -8.231 -7.465 299 HG2 PRO 40 2HG PRO 40 -24.547 -10.308 -5.584 300 HG3 PRO 40 3HG PRO 40 -25.260 -9.660 -7.080 301 HD2 PRO 40 2HD PRO 40 -24.103 -12.046 -7.122 302 HD3 PRO 40 3HD PRO 40 -23.827 -10.924 -8.472 303 H ILE 41 H ILE 41 -19.509 -8.920 -6.387 304 HA ILE 41 HA ILE 41 -19.328 -9.209 -3.487 305 HB ILE 41 HB ILE 41 -17.213 -8.413 -5.541 306 HG12 ILE 41 2HG1 ILE 41 -17.896 -10.754 -5.822 307 HG13 ILE 41 3HG1 ILE 41 -16.268 -10.687 -5.157 308 HG21 ILE 41 1HG2 ILE 41 -16.831 -9.011 -2.579 309 HG22 ILE 41 2HG2 ILE 41 -16.638 -7.441 -3.364 310 HG23 ILE 41 3HG2 ILE 41 -15.533 -8.760 -3.751 311 HD11 ILE 41 1HD1 ILE 41 -17.187 -11.188 -2.921 312 HD12 ILE 41 2HD1 ILE 41 -17.548 -12.426 -4.117 313 HD13 ILE 41 3HD1 ILE 41 -18.802 -11.292 -3.636 314 HA PRO 42 HA PRO 42 -20.180 -4.716 -3.345 315 HB2 PRO 42 2HB PRO 42 -20.813 -4.962 -0.518 316 HB3 PRO 42 3HB PRO 42 -21.940 -4.768 -1.870 317 HG2 PRO 42 2HG PRO 42 -21.765 -7.046 -0.326 318 HG3 PRO 42 3HG PRO 42 -22.406 -7.004 -1.984 319 HD2 PRO 42 2HD PRO 42 -19.653 -7.807 -1.047 320 HD3 PRO 42 3HD PRO 42 -20.694 -8.569 -2.275 321 H LEU 43 H LEU 43 -18.575 -3.276 -3.137 322 HA LEU 43 HA LEU 43 -16.593 -3.484 -0.952 323 HB2 LEU 43 2HB LEU 43 -16.442 -1.884 -3.548 324 HB3 LEU 43 3HB LEU 43 -15.233 -1.861 -2.283 325 HG LEU 43 HG LEU 43 -14.331 -3.226 -4.006 326 HD11 LEU 43 1HD1 LEU 43 -14.033 -5.413 -3.003 327 HD12 LEU 43 2HD1 LEU 43 -15.421 -5.153 -1.944 328 HD13 LEU 43 3HD1 LEU 43 -13.976 -4.148 -1.776 329 HD21 LEU 43 1HD2 LEU 43 -16.921 -4.796 -4.123 330 HD22 LEU 43 2HD2 LEU 43 -15.465 -5.113 -5.073 331 HD23 LEU 43 3HD2 LEU 43 -16.359 -3.614 -5.308 332 HA PRO 44 HA PRO 44 -19.596 -0.203 0.325 333 HB2 PRO 44 2HB PRO 44 -19.490 -0.589 3.018 334 HB3 PRO 44 3HB PRO 44 -20.354 -1.718 1.948 335 HG2 PRO 44 2HG PRO 44 -17.592 -1.983 3.117 336 HG3 PRO 44 3HG PRO 44 -18.898 -3.190 3.035 337 HD2 PRO 44 2HD PRO 44 -16.833 -3.134 1.233 338 HD3 PRO 44 3HD PRO 44 -18.458 -3.721 0.814 339 H ASN 45 H ASN 45 -16.243 -0.532 0.999 340 HA ASN 45 HA ASN 45 -15.887 1.941 2.447 341 HB2 ASN 45 2HB ASN 45 -14.319 0.099 2.802 342 HB3 ASN 45 3HB ASN 45 -13.909 0.064 1.096 343 HD21 ASN 45 1HD2 ASN 45 -13.518 1.841 4.092 344 HD22 ASN 45 2HD2 ASN 45 -12.160 2.775 3.576 345 H VAL 46 H VAL 46 -15.047 0.847 -0.874 346 HA VAL 46 HA VAL 46 -14.283 3.573 -1.615 347 HB VAL 46 HB VAL 46 -12.754 1.715 -2.180 348 HG11 VAL 46 1HG1 VAL 46 -14.922 0.688 -4.035 349 HG12 VAL 46 2HG1 VAL 46 -14.374 -0.088 -2.547 350 HG13 VAL 46 3HG1 VAL 46 -13.273 0.065 -3.920 351 HG21 VAL 46 1HG2 VAL 46 -12.680 3.726 -3.574 352 HG22 VAL 46 2HG2 VAL 46 -13.906 3.052 -4.653 353 HG23 VAL 46 3HG2 VAL 46 -12.314 2.295 -4.542 354 H THR 47 H THR 47 -15.357 4.853 -3.013 355 HA THR 47 HA THR 47 -18.120 4.293 -3.695 356 HB THR 47 HB THR 47 -18.080 6.653 -4.604 357 HG1 THR 47 HG1 THR 47 -16.188 7.845 -4.413 358 HG21 THR 47 1HG2 THR 47 -16.965 6.347 -1.783 359 HG22 THR 47 2HG2 THR 47 -18.672 6.290 -2.233 360 HG23 THR 47 3HG2 THR 47 -17.761 7.787 -2.425 361 H SER 48 H SER 48 -18.782 5.235 -5.980 362 HA SER 48 HA SER 48 -18.009 3.242 -7.830 363 HB2 SER 48 2HB SER 48 -19.579 4.452 -9.373 364 HB3 SER 48 3HB SER 48 -20.280 4.123 -7.787 365 HG SER 48 HG SER 48 -20.661 6.269 -8.492 366 H THR 49 H THR 49 -17.411 6.757 -7.748 367 HA THR 49 HA THR 49 -16.264 7.070 -10.289 368 HB THR 49 HB THR 49 -15.287 9.202 -9.321 369 HG1 THR 49 HG1 THR 49 -15.471 9.589 -7.161 370 HG21 THR 49 1HG2 THR 49 -17.616 9.224 -10.163 371 HG22 THR 49 2HG2 THR 49 -17.455 10.269 -8.752 372 HG23 THR 49 3HG2 THR 49 -18.203 8.680 -8.586 373 H ILE 50 H ILE 50 -14.782 6.395 -7.141 374 HA ILE 50 HA ILE 50 -12.071 6.508 -8.080 375 HB ILE 50 HB ILE 50 -13.189 5.413 -5.461 376 HG12 ILE 50 2HG1 ILE 50 -13.790 7.786 -5.759 377 HG13 ILE 50 3HG1 ILE 50 -12.581 7.633 -4.492 378 HG21 ILE 50 1HG2 ILE 50 -10.924 4.568 -5.880 379 HG22 ILE 50 2HG2 ILE 50 -10.905 5.733 -4.554 380 HG23 ILE 50 3HG2 ILE 50 -10.338 6.211 -6.156 381 HD11 ILE 50 1HD1 ILE 50 -12.145 9.556 -5.872 382 HD12 ILE 50 2HD1 ILE 50 -12.095 8.562 -7.327 383 HD13 ILE 50 3HD1 ILE 50 -10.850 8.379 -6.084 384 H LEU 51 H LEU 51 -14.323 3.866 -7.155 385 HA LEU 51 HA LEU 51 -12.552 1.697 -7.515 386 HB2 LEU 51 2HB LEU 51 -14.699 1.542 -6.257 387 HB3 LEU 51 3HB LEU 51 -15.589 1.719 -7.760 388 HG LEU 51 HG LEU 51 -14.654 -0.463 -8.561 389 HD11 LEU 51 1HD1 LEU 51 -13.496 -1.971 -7.026 390 HD12 LEU 51 2HD1 LEU 51 -13.434 -0.702 -5.800 391 HD13 LEU 51 3HD1 LEU 51 -12.556 -0.509 -7.320 392 HD21 LEU 51 1HD2 LEU 51 -16.084 -0.656 -5.894 393 HD22 LEU 51 2HD2 LEU 51 -15.990 -1.925 -7.122 394 HD23 LEU 51 3HD2 LEU 51 -16.843 -0.423 -7.473 395 H GLU 52 H GLU 52 -14.737 3.331 -9.773 396 HA GLU 52 HA GLU 52 -14.663 1.605 -11.973 397 HB2 GLU 52 2HB GLU 52 -16.243 3.481 -11.819 398 HB3 GLU 52 3HB GLU 52 -14.920 4.639 -11.889 399 HG2 GLU 52 2HG GLU 52 -14.416 3.967 -14.198 400 HG3 GLU 52 3HG GLU 52 -15.681 2.738 -14.134 401 H LYS 53 H LYS 53 -12.684 4.462 -11.250 402 HA LYS 53 HA LYS 53 -10.937 4.312 -13.447 403 HB2 LYS 53 2HB LYS 53 -10.946 5.777 -10.825 404 HB3 LYS 53 3HB LYS 53 -9.408 5.674 -11.666 405 HG2 LYS 53 2HG LYS 53 -10.499 6.677 -13.693 406 HG3 LYS 53 3HG LYS 53 -11.967 6.916 -12.739 407 HD2 LYS 53 2HD LYS 53 -9.241 8.095 -12.040 408 HD3 LYS 53 3HD LYS 53 -10.502 8.962 -12.922 409 HE2 LYS 53 2HE LYS 53 -10.756 7.882 -10.090 410 HE3 LYS 53 3HE LYS 53 -10.495 9.571 -10.540 411 HZ1 LYS 53 1HZ LYS 53 -12.614 9.560 -11.699 412 HZ2 LYS 53 2HZ LYS 53 -12.820 9.123 -10.082 413 HZ3 LYS 53 3HZ LYS 53 -12.870 7.941 -11.282 414 H VAL 54 H VAL 54 -10.641 2.987 -10.149 415 HA VAL 54 HA VAL 54 -7.960 2.095 -10.373 416 HB VAL 54 HB VAL 54 -10.200 1.255 -8.474 417 HG11 VAL 54 1HG1 VAL 54 -8.458 0.251 -7.030 418 HG12 VAL 54 2HG1 VAL 54 -7.242 0.573 -8.269 419 HG13 VAL 54 3HG1 VAL 54 -8.545 -0.574 -8.587 420 HG21 VAL 54 1HG2 VAL 54 -9.469 3.618 -8.284 421 HG22 VAL 54 2HG2 VAL 54 -7.803 3.086 -8.049 422 HG23 VAL 54 3HG2 VAL 54 -9.031 2.698 -6.842 423 H LEU 55 H LEU 55 -11.073 0.468 -11.039 424 HA LEU 55 HA LEU 55 -9.937 -2.117 -11.589 425 HB2 LEU 55 2HB LEU 55 -12.658 -0.960 -12.297 426 HB3 LEU 55 3HB LEU 55 -12.204 -2.638 -12.575 427 HG LEU 55 HG LEU 55 -12.450 -1.285 -9.859 428 HD11 LEU 55 1HD1 LEU 55 -14.392 -2.738 -9.528 429 HD12 LEU 55 2HD1 LEU 55 -14.221 -3.369 -11.169 430 HD13 LEU 55 3HD1 LEU 55 -14.620 -1.667 -10.909 431 HD21 LEU 55 1HD2 LEU 55 -12.079 -3.516 -8.899 432 HD22 LEU 55 2HD2 LEU 55 -10.677 -2.967 -9.809 433 HD23 LEU 55 3HD2 LEU 55 -11.764 -4.171 -10.509 434 H ASP 56 H ASP 56 -10.769 0.706 -13.518 435 HA ASP 56 HA ASP 56 -10.465 -0.518 -16.104 436 HB2 ASP 56 2HB ASP 56 -11.871 1.524 -15.659 437 HB3 ASP 56 3HB ASP 56 -10.405 2.442 -15.340 438 H TYR 57 H TYR 57 -8.359 1.203 -13.863 439 HA TYR 57 HA TYR 57 -6.078 1.413 -15.573 440 HB2 TYR 57 2HB TYR 57 -6.360 2.853 -13.555 441 HB3 TYR 57 3HB TYR 57 -6.215 1.437 -12.521 442 HD1 TYR 57 HD1 TYR 57 -3.999 0.404 -12.103 443 HD2 TYR 57 HD2 TYR 57 -4.374 3.749 -14.751 444 HE1 TYR 57 HE1 TYR 57 -1.558 0.669 -12.112 445 HE2 TYR 57 HE2 TYR 57 -1.935 4.014 -14.755 446 HH TYR 57 HH TYR 57 -0.002 3.427 -13.413 447 H CYS 58 H CYS 58 -7.076 -0.851 -12.999 448 HA CYS 58 HA CYS 58 -4.862 -2.585 -13.116 449 HB2 CYS 58 2HB CYS 58 -7.717 -3.096 -12.212 450 HB3 CYS 58 3HB CYS 58 -6.393 -4.242 -11.983 451 HG CYS 58 HG CYS 58 -7.297 -1.820 -10.054 452 H ARG 59 H ARG 59 -7.840 -2.431 -15.001 453 HA ARG 59 HA ARG 59 -7.543 -4.859 -16.426 454 HB2 ARG 59 2HB ARG 59 -9.687 -3.803 -16.482 455 HB3 ARG 59 3HB ARG 59 -9.022 -2.294 -17.097 456 HG2 ARG 59 2HG ARG 59 -8.677 -3.218 -19.289 457 HG3 ARG 59 3HG ARG 59 -8.918 -4.867 -18.712 458 HD2 ARG 59 2HD ARG 59 -10.847 -3.908 -20.022 459 HD3 ARG 59 3HD ARG 59 -11.259 -4.527 -18.420 460 HE ARG 59 HE ARG 59 -10.697 -1.686 -18.508 461 HH11 ARG 59 1HH1 ARG 59 -13.229 -4.132 -18.829 462 HH12 ARG 59 2HH1 ARG 59 -14.500 -3.016 -18.462 463 HH21 ARG 59 1HH2 ARG 59 -12.382 -0.266 -18.006 464 HH22 ARG 59 2HH2 ARG 59 -14.017 -0.828 -17.995 465 H HIS 60 H HIS 60 -6.458 -1.518 -17.150 466 HA HIS 60 HA HIS 60 -5.243 -2.132 -19.645 467 HB2 HIS 60 2HB HIS 60 -5.801 0.201 -18.992 468 HB3 HIS 60 3HB HIS 60 -4.572 0.151 -17.729 469 HD1 HIS 60 HD1 HIS 60 -2.473 1.321 -18.465 470 HD2 HIS 60 HD2 HIS 60 -4.439 -0.482 -21.658 471 HE1 HIS 60 HE1 HIS 60 -1.005 1.679 -20.465 472 HE2 HIS 60 HE2 HIS 60 -2.330 0.778 -22.402 473 H HIS 61 H HIS 61 -4.072 -2.247 -16.326 474 HA HIS 61 HA HIS 61 -1.333 -2.863 -16.996 475 HB2 HIS 61 2HB HIS 61 -2.140 -1.661 -14.861 476 HB3 HIS 61 3HB HIS 61 -2.670 -3.234 -14.281 477 HD1 HIS 61 HD1 HIS 61 -0.673 -5.069 -14.007 478 HD2 HIS 61 HD2 HIS 61 0.510 -1.107 -14.410 479 HE1 HIS 61 HE1 HIS 61 1.699 -4.990 -13.195 480 HE2 HIS 61 HE2 HIS 61 2.371 -2.573 -13.388 481 H HIS 62 H HIS 62 -4.271 -4.646 -16.691 482 HA HIS 62 HA HIS 62 -3.045 -7.253 -16.348 483 HB2 HIS 62 2HB HIS 62 -5.384 -6.731 -15.579 484 HB3 HIS 62 3HB HIS 62 -5.869 -6.531 -17.255 485 HD1 HIS 62 HD1 HIS 62 -5.051 -9.129 -14.696 486 HD2 HIS 62 HD2 HIS 62 -6.205 -8.931 -18.679 487 HE1 HIS 62 HE1 HIS 62 -5.772 -11.455 -15.311 488 HE2 HIS 62 HE2 HIS 62 -6.243 -11.335 -17.776 489 H GLN 63 H GLN 63 -4.223 -5.224 -19.000 490 HA GLN 63 HA GLN 63 -3.843 -7.122 -21.109 491 HB2 GLN 63 2HB GLN 63 -3.836 -4.077 -21.360 492 HB3 GLN 63 3HB GLN 63 -4.118 -5.240 -22.646 493 HG2 GLN 63 2HG GLN 63 -5.960 -4.530 -20.354 494 HG3 GLN 63 3HG GLN 63 -6.222 -4.255 -22.067 495 HE21 GLN 63 1HE2 GLN 63 -6.761 -6.033 -23.399 496 HE22 GLN 63 2HE2 GLN 63 -7.422 -7.487 -22.739 497 H HIS 64 H HIS 64 -1.835 -4.726 -19.512 498 HA HIS 64 HA HIS 64 0.581 -5.719 -20.908 499 HB2 HIS 64 2HB HIS 64 0.085 -2.797 -20.135 500 HB3 HIS 64 3HB HIS 64 1.524 -3.434 -20.924 501 HD1 HIS 64 HD1 HIS 64 1.292 -4.091 -23.462 502 HD2 HIS 64 HD2 HIS 64 -2.046 -2.234 -21.835 503 HE1 HIS 64 HE1 HIS 64 -0.133 -3.429 -25.414 504 HE2 HIS 64 HE2 HIS 64 -2.228 -2.485 -24.385 505 HA PRO 65 HA PRO 65 0.909 -6.413 -16.311 506 HB2 PRO 65 2HB PRO 65 2.875 -8.380 -16.502 507 HB3 PRO 65 3HB PRO 65 1.131 -8.705 -16.641 508 HG2 PRO 65 2HG PRO 65 3.152 -8.295 -18.836 509 HG3 PRO 65 3HG PRO 65 1.882 -9.535 -18.694 510 HD2 PRO 65 2HD PRO 65 1.509 -7.387 -20.258 511 HD3 PRO 65 3HD PRO 65 0.165 -8.043 -19.301 512 H GLY 66 H GLY 66 3.257 -5.393 -18.638 513 HA2 GLY 66 2HA GLY 66 4.698 -3.919 -16.513 514 HA3 GLY 66 3HA GLY 66 5.613 -4.822 -17.718 515 H GLY 67 H GLY 67 4.048 -4.320 -19.979 516 HA2 GLY 67 2HA GLY 67 3.399 -2.678 -21.505 517 HA3 GLY 67 3HA GLY 67 3.911 -1.417 -20.392 518 H SER 68 H SER 68 4.561 -2.282 -23.340 519 HA SER 68 HA SER 68 7.391 -2.762 -23.386 520 HB2 SER 68 2HB SER 68 5.549 -1.827 -25.629 521 HB3 SER 68 3HB SER 68 7.166 -2.508 -25.830 522 HG SER 68 HG SER 68 6.414 -4.473 -25.405 523 H GLY 69 H GLY 69 5.665 0.017 -22.693 524 HA2 GLY 69 2HA GLY 69 7.121 2.080 -23.974 525 HA3 GLY 69 3HA GLY 69 6.117 2.239 -22.541 526 H LEU 70 H LEU 70 9.324 2.037 -23.728 527 HA LEU 70 HA LEU 70 10.734 1.592 -21.290 528 HB2 LEU 70 2HB LEU 70 12.614 2.936 -22.701 529 HB3 LEU 70 3HB LEU 70 12.232 1.255 -22.970 530 HG LEU 70 HG LEU 70 10.836 1.882 -24.950 531 HD11 LEU 70 1HD1 LEU 70 10.148 4.139 -24.339 532 HD12 LEU 70 2HD1 LEU 70 10.936 4.132 -25.915 533 HD13 LEU 70 3HD1 LEU 70 11.813 4.710 -24.494 534 HD21 LEU 70 1HD2 LEU 70 12.686 2.463 -26.448 535 HD22 LEU 70 2HD2 LEU 70 13.178 1.253 -25.265 536 HD23 LEU 70 3HD2 LEU 70 13.674 2.936 -25.062 537 H ASP 71 H ASP 71 9.775 2.816 -19.694 538 HA ASP 71 HA ASP 71 9.285 4.527 -18.291 539 HB2 ASP 71 2HB ASP 71 11.691 5.077 -18.468 540 HB3 ASP 71 3HB ASP 71 11.381 6.053 -19.895 541 H ASP 72 H ASP 72 8.141 4.260 -21.138 542 HA ASP 72 HA ASP 72 7.164 6.943 -21.753 543 HB2 ASP 72 2HB ASP 72 8.114 5.703 -23.634 544 HB3 ASP 72 3HB ASP 72 7.103 4.309 -23.291 545 H ILE 73 H ILE 73 5.691 7.253 -20.205 546 HA ILE 73 HA ILE 73 3.666 5.420 -19.371 547 HB ILE 73 HB ILE 73 3.829 8.446 -19.000 548 HG12 ILE 73 2HG1 ILE 73 4.740 6.237 -17.094 549 HG13 ILE 73 3HG1 ILE 73 5.809 7.245 -18.063 550 HG21 ILE 73 1HG2 ILE 73 2.268 8.135 -17.100 551 HG22 ILE 73 2HG2 ILE 73 2.151 6.415 -17.472 552 HG23 ILE 73 3HG2 ILE 73 1.536 7.608 -18.618 553 HD11 ILE 73 1HD1 ILE 73 3.998 8.210 -15.850 554 HD12 ILE 73 2HD1 ILE 73 5.060 9.222 -16.833 555 HD13 ILE 73 3HD1 ILE 73 5.746 7.996 -15.768 556 HA PRO 74 HA PRO 74 1.041 6.190 -23.055 557 HB2 PRO 74 2HB PRO 74 -1.003 4.682 -21.440 558 HB3 PRO 74 3HB PRO 74 -0.407 4.361 -23.085 559 HG2 PRO 74 2HG PRO 74 0.345 2.797 -21.070 560 HG3 PRO 74 3HG PRO 74 1.514 3.264 -22.331 561 HD2 PRO 74 2HD PRO 74 1.182 4.409 -19.552 562 HD3 PRO 74 3HD PRO 74 2.675 3.960 -20.414 563 HA PRO 75 HA PRO 75 -1.093 9.936 -21.981 564 HB2 PRO 75 2HB PRO 75 -3.303 9.007 -23.821 565 HB3 PRO 75 3HB PRO 75 -2.411 10.547 -23.810 566 HG2 PRO 75 2HG PRO 75 -1.833 8.723 -25.642 567 HG3 PRO 75 3HG PRO 75 -0.530 9.635 -24.845 568 HD2 PRO 75 2HD PRO 75 -1.418 6.801 -24.351 569 HD3 PRO 75 3HD PRO 75 0.226 7.485 -24.386 570 H TYR 76 H TYR 76 -3.145 7.029 -22.013 571 HA TYR 76 HA TYR 76 -5.272 7.875 -20.424 572 HB2 TYR 76 2HB TYR 76 -5.508 5.737 -21.494 573 HB3 TYR 76 3HB TYR 76 -4.010 5.131 -20.797 574 HD1 TYR 76 HD1 TYR 76 -7.345 6.455 -19.633 575 HD2 TYR 76 HD2 TYR 76 -4.218 3.608 -18.968 576 HE1 TYR 76 HE1 TYR 76 -8.589 5.534 -17.735 577 HE2 TYR 76 HE2 TYR 76 -5.473 2.682 -17.064 578 HH TYR 76 HH TYR 76 -8.729 3.482 -16.425 579 H ASP 77 H ASP 77 -2.246 6.293 -19.437 580 HA ASP 77 HA ASP 77 -2.937 6.129 -16.673 581 HB2 ASP 77 2HB ASP 77 -0.202 5.773 -17.985 582 HB3 ASP 77 3HB ASP 77 -0.680 5.192 -16.389 583 H ARG 78 H ARG 78 -1.213 8.452 -18.631 584 HA ARG 78 HA ARG 78 0.044 9.927 -16.530 585 HB2 ARG 78 2HB ARG 78 0.828 9.991 -18.896 586 HB3 ARG 78 3HB ARG 78 -0.664 10.801 -19.368 587 HG2 ARG 78 2HG ARG 78 -0.055 12.737 -17.930 588 HG3 ARG 78 3HG ARG 78 1.445 11.920 -17.484 589 HD2 ARG 78 2HD ARG 78 2.167 11.979 -19.857 590 HD3 ARG 78 3HD ARG 78 0.670 12.822 -20.286 591 HE ARG 78 HE ARG 78 2.422 14.021 -18.260 592 HH11 ARG 78 1HH1 ARG 78 1.236 14.157 -21.566 593 HH12 ARG 78 2HH1 ARG 78 1.782 15.780 -21.820 594 HH21 ARG 78 1HH2 ARG 78 3.099 16.148 -18.595 595 HH22 ARG 78 2HH2 ARG 78 2.840 16.910 -20.128 596 H ASP 79 H ASP 79 -2.903 10.492 -18.491 597 HA ASP 79 HA ASP 79 -3.760 12.802 -17.015 598 HB2 ASP 79 2HB ASP 79 -5.148 11.038 -19.069 599 HB3 ASP 79 3HB ASP 79 -5.971 12.392 -18.302 600 H PHE 80 H PHE 80 -4.164 9.393 -16.596 601 HA PHE 80 HA PHE 80 -6.384 9.219 -14.895 602 HB2 PHE 80 2HB PHE 80 -5.208 7.254 -15.881 603 HB3 PHE 80 3HB PHE 80 -3.801 7.577 -14.879 604 HD1 PHE 80 HD1 PHE 80 -3.850 7.101 -12.451 605 HD2 PHE 80 HD2 PHE 80 -7.207 6.250 -14.960 606 HE1 PHE 80 HE1 PHE 80 -4.819 5.718 -10.683 607 HE2 PHE 80 HE2 PHE 80 -8.162 4.871 -13.184 608 HZ PHE 80 HZ PHE 80 -6.983 4.600 -11.042 609 H CYS 81 H CYS 81 -2.967 9.834 -14.230 610 HA CYS 81 HA CYS 81 -3.168 10.042 -11.398 611 HB2 CYS 81 2HB CYS 81 -0.997 10.993 -13.299 612 HB3 CYS 81 3HB CYS 81 -0.831 10.838 -11.552 613 HG CYS 81 HG CYS 81 -1.692 8.088 -13.361 614 H LYS 82 H LYS 82 -3.852 12.252 -13.972 615 HA LYS 82 HA LYS 82 -3.567 14.679 -12.417 616 HB2 LYS 82 2HB LYS 82 -4.914 14.226 -15.110 617 HB3 LYS 82 3HB LYS 82 -4.601 15.798 -14.371 618 HG2 LYS 82 2HG LYS 82 -2.150 15.322 -14.478 619 HG3 LYS 82 3HG LYS 82 -2.514 13.797 -15.304 620 HD2 LYS 82 2HD LYS 82 -3.624 15.077 -17.140 621 HD3 LYS 82 3HD LYS 82 -3.222 16.587 -16.318 622 HE2 LYS 82 2HE LYS 82 -0.799 16.010 -16.576 623 HE3 LYS 82 3HE LYS 82 -1.272 14.586 -17.507 624 HZ1 LYS 82 1HZ LYS 82 -1.873 17.412 -18.226 625 HZ2 LYS 82 2HZ LYS 82 -2.343 16.055 -19.112 626 HZ3 LYS 82 3HZ LYS 82 -0.705 16.435 -18.958 627 H VAL 83 H VAL 83 -4.833 13.850 -10.659 628 HA VAL 83 HA VAL 83 -7.711 14.520 -10.921 629 HB VAL 83 HB VAL 83 -8.107 12.974 -8.958 630 HG11 VAL 83 1HG1 VAL 83 -8.074 10.858 -10.233 631 HG12 VAL 83 2HG1 VAL 83 -7.012 11.591 -11.439 632 HG13 VAL 83 3HG1 VAL 83 -8.655 12.199 -11.225 633 HG21 VAL 83 1HG2 VAL 83 -5.263 12.026 -9.496 634 HG22 VAL 83 2HG2 VAL 83 -6.414 11.252 -8.400 635 HG23 VAL 83 3HG2 VAL 83 -5.823 12.877 -8.055 636 H ASP 84 H ASP 84 -8.557 15.210 -8.637 637 HA ASP 84 HA ASP 84 -7.048 17.421 -7.655 638 HB2 ASP 84 2HB ASP 84 -9.376 16.002 -6.286 639 HB3 ASP 84 3HB ASP 84 -8.809 17.633 -5.948 640 H GLN 85 H GLN 85 -6.262 17.665 -5.399 641 HA GLN 85 HA GLN 85 -4.477 15.605 -4.689 642 HB2 GLN 85 2HB GLN 85 -4.044 18.008 -4.231 643 HB3 GLN 85 3HB GLN 85 -5.282 17.988 -2.981 644 HG2 GLN 85 2HG GLN 85 -3.033 17.862 -2.012 645 HG3 GLN 85 3HG GLN 85 -3.947 16.400 -1.650 646 HE21 GLN 85 1HE2 GLN 85 -3.304 14.443 -2.629 647 HE22 GLN 85 2HE2 GLN 85 -1.761 14.265 -3.374 648 HA PRO 86 HA PRO 86 -7.676 14.390 -1.087 649 HB2 PRO 86 2HB PRO 86 -10.345 14.814 -1.861 650 HB3 PRO 86 3HB PRO 86 -9.450 15.855 -0.731 651 HG2 PRO 86 2HG PRO 86 -9.891 16.220 -3.682 652 HG3 PRO 86 3HG PRO 86 -10.016 17.416 -2.369 653 HD2 PRO 86 2HD PRO 86 -7.839 17.358 -3.903 654 HD3 PRO 86 3HD PRO 86 -7.675 17.624 -2.155 655 H THR 87 H THR 87 -8.775 14.448 -4.488 656 HA THR 87 HA THR 87 -9.878 11.848 -4.596 657 HB THR 87 HB THR 87 -8.766 13.469 -6.929 658 HG1 THR 87 HG1 THR 87 -11.473 13.615 -6.265 659 HG21 THR 87 1HG2 THR 87 -10.537 12.349 -8.247 660 HG22 THR 87 2HG2 THR 87 -11.021 11.421 -6.827 661 HG23 THR 87 3HG2 THR 87 -9.431 11.164 -7.551 662 H LEU 88 H LEU 88 -6.624 13.052 -5.006 663 HA LEU 88 HA LEU 88 -5.420 10.816 -6.280 664 HB2 LEU 88 2HB LEU 88 -4.581 13.245 -6.118 665 HB3 LEU 88 3HB LEU 88 -4.057 12.873 -4.491 666 HG LEU 88 HG LEU 88 -3.005 11.341 -6.910 667 HD11 LEU 88 1HD1 LEU 88 -1.046 12.815 -6.928 668 HD12 LEU 88 2HD1 LEU 88 -1.784 13.835 -5.687 669 HD13 LEU 88 3HD1 LEU 88 -2.523 13.709 -7.286 670 HD21 LEU 88 1HD2 LEU 88 -1.834 11.731 -4.133 671 HD22 LEU 88 2HD2 LEU 88 -1.084 10.830 -5.455 672 HD23 LEU 88 3HD2 LEU 88 -2.590 10.258 -4.746 673 H PHE 89 H PHE 89 -5.705 11.898 -2.902 674 HA PHE 89 HA PHE 89 -4.464 9.621 -1.742 675 HB2 PHE 89 2HB PHE 89 -6.298 11.733 -0.556 676 HB3 PHE 89 3HB PHE 89 -5.569 10.450 0.410 677 HD1 PHE 89 HD1 PHE 89 -2.961 10.888 -1.703 678 HD2 PHE 89 HD2 PHE 89 -5.085 13.182 1.224 679 HE1 PHE 89 HE1 PHE 89 -0.979 12.276 -1.344 680 HE2 PHE 89 HE2 PHE 89 -3.093 14.557 1.569 681 HZ PHE 89 HZ PHE 89 -1.046 14.115 0.288 682 H GLU 90 H GLU 90 -7.786 10.296 -2.732 683 HA GLU 90 HA GLU 90 -9.073 8.092 -1.533 684 HB2 GLU 90 2HB GLU 90 -9.650 9.599 -4.106 685 HB3 GLU 90 3HB GLU 90 -10.704 8.319 -3.516 686 HG2 GLU 90 2HG GLU 90 -10.053 10.877 -2.021 687 HG3 GLU 90 3HG GLU 90 -11.512 10.593 -2.967 688 H LEU 91 H LEU 91 -7.330 8.397 -4.634 689 HA LEU 91 HA LEU 91 -7.739 5.740 -5.547 690 HB2 LEU 91 2HB LEU 91 -5.482 7.686 -6.165 691 HB3 LEU 91 3HB LEU 91 -5.758 6.184 -7.034 692 HG LEU 91 HG LEU 91 -7.660 8.572 -6.987 693 HD11 LEU 91 1HD1 LEU 91 -5.868 7.570 -9.224 694 HD12 LEU 91 2HD1 LEU 91 -5.616 9.033 -8.264 695 HD13 LEU 91 3HD1 LEU 91 -7.019 8.909 -9.322 696 HD21 LEU 91 1HD2 LEU 91 -7.857 5.984 -8.568 697 HD22 LEU 91 2HD2 LEU 91 -8.929 7.382 -8.719 698 HD23 LEU 91 3HD2 LEU 91 -8.893 6.464 -7.217 699 H ILE 92 H ILE 92 -5.140 7.250 -3.609 700 HA ILE 92 HA ILE 92 -3.463 5.015 -3.236 701 HB ILE 92 HB ILE 92 -3.934 7.442 -1.442 702 HG12 ILE 92 2HG1 ILE 92 -1.718 6.810 -3.450 703 HG13 ILE 92 3HG1 ILE 92 -2.983 8.018 -3.635 704 HG21 ILE 92 1HG2 ILE 92 -1.826 6.894 -0.265 705 HG22 ILE 92 2HG2 ILE 92 -1.708 5.385 -1.173 706 HG23 ILE 92 3HG2 ILE 92 -3.037 5.632 -0.039 707 HD11 ILE 92 1HD1 ILE 92 -0.891 9.071 -3.094 708 HD12 ILE 92 2HD1 ILE 92 -0.717 8.091 -1.641 709 HD13 ILE 92 3HD1 ILE 92 -2.014 9.285 -1.750 710 H LEU 93 H LEU 93 -6.314 6.129 -1.424 711 HA LEU 93 HA LEU 93 -6.128 4.190 0.677 712 HB2 LEU 93 2HB LEU 93 -8.373 6.067 -0.143 713 HB3 LEU 93 3HB LEU 93 -8.478 5.002 1.252 714 HG LEU 93 HG LEU 93 -6.413 7.219 0.925 715 HD11 LEU 93 1HD1 LEU 93 -7.697 8.465 2.588 716 HD12 LEU 93 2HD1 LEU 93 -8.928 7.198 2.619 717 HD13 LEU 93 3HD1 LEU 93 -8.664 8.144 1.149 718 HD21 LEU 93 1HD2 LEU 93 -5.582 5.399 2.336 719 HD22 LEU 93 2HD2 LEU 93 -7.039 5.472 3.334 720 HD23 LEU 93 3HD2 LEU 93 -5.914 6.834 3.302 721 H ALA 94 H ALA 94 -7.692 4.311 -2.460 722 HA ALA 94 HA ALA 94 -9.424 2.062 -2.132 723 HB1 ALA 94 1HB ALA 94 -9.570 2.083 -4.597 724 HB2 ALA 94 2HB ALA 94 -8.236 3.240 -4.669 725 HB3 ALA 94 3HB ALA 94 -9.767 3.705 -3.926 726 H ALA 95 H ALA 95 -6.151 2.483 -3.464 727 HA ALA 95 HA ALA 95 -5.660 -0.278 -4.031 728 HB1 ALA 95 1HB ALA 95 -3.703 2.009 -3.663 729 HB2 ALA 95 2HB ALA 95 -4.454 1.516 -5.181 730 HB3 ALA 95 3HB ALA 95 -3.330 0.433 -4.364 731 H ASN 96 H ASN 96 -5.268 1.743 -1.217 732 HA ASN 96 HA ASN 96 -3.617 0.058 0.402 733 HB2 ASN 96 2HB ASN 96 -4.071 2.553 0.695 734 HB3 ASN 96 3HB ASN 96 -5.673 2.149 1.276 735 HD21 ASN 96 1HD2 ASN 96 -3.642 3.653 2.597 736 HD22 ASN 96 2HD2 ASN 96 -3.270 2.838 4.071 737 H TYR 97 H TYR 97 -7.103 0.500 0.003 738 HA TYR 97 HA TYR 97 -7.969 -1.434 1.942 739 HB2 TYR 97 2HB TYR 97 -9.444 0.409 1.468 740 HB3 TYR 97 3HB TYR 97 -9.368 0.130 -0.264 741 HD1 TYR 97 HD1 TYR 97 -11.322 -0.760 -1.221 742 HD2 TYR 97 HD2 TYR 97 -10.420 -1.791 2.834 743 HE1 TYR 97 HE1 TYR 97 -13.406 -2.053 -1.089 744 HE2 TYR 97 HE2 TYR 97 -12.504 -3.091 2.959 745 HH TYR 97 HH TYR 97 -14.325 -3.946 0.242 746 H LEU 98 H LEU 98 -7.308 -1.520 -1.528 747 HA LEU 98 HA LEU 98 -8.479 -4.224 -1.780 748 HB2 LEU 98 2HB LEU 98 -7.651 -2.200 -3.894 749 HB3 LEU 98 3HB LEU 98 -8.283 -3.799 -4.254 750 HG LEU 98 HG LEU 98 -9.810 -1.577 -2.834 751 HD11 LEU 98 1HD1 LEU 98 -10.158 -2.681 -5.640 752 HD12 LEU 98 2HD1 LEU 98 -9.517 -1.092 -5.208 753 HD13 LEU 98 3HD1 LEU 98 -11.197 -1.484 -4.855 754 HD21 LEU 98 1HD2 LEU 98 -10.722 -4.358 -3.632 755 HD22 LEU 98 2HD2 LEU 98 -11.766 -3.071 -3.021 756 HD23 LEU 98 3HD2 LEU 98 -10.508 -3.743 -1.989 757 H ASP 99 H ASP 99 -5.492 -2.898 -1.180 758 HA ASP 99 HA ASP 99 -3.319 -3.496 -1.321 759 HB2 ASP 99 2HB ASP 99 -4.600 -6.249 -1.418 760 HB3 ASP 99 3HB ASP 99 -2.858 -6.026 -1.287 761 H ILE 100 H ILE 100 -4.580 -2.786 -3.804 762 HA ILE 100 HA ILE 100 -3.393 -4.408 -5.891 763 HB ILE 100 HB ILE 100 -4.742 -1.673 -6.083 764 HG12 ILE 100 2HG1 ILE 100 -5.804 -4.478 -6.653 765 HG13 ILE 100 3HG1 ILE 100 -6.273 -3.449 -5.307 766 HG21 ILE 100 1HG2 ILE 100 -3.187 -2.048 -7.974 767 HG22 ILE 100 2HG2 ILE 100 -4.861 -2.069 -8.516 768 HG23 ILE 100 3HG2 ILE 100 -3.975 -3.586 -8.335 769 HD11 ILE 100 1HD1 ILE 100 -6.828 -2.904 -8.225 770 HD12 ILE 100 2HD1 ILE 100 -7.298 -1.877 -6.869 771 HD13 ILE 100 3HD1 ILE 100 -7.975 -3.496 -7.023 772 H LYS 101 H LYS 101 -1.252 -4.437 -5.589 773 HA LYS 101 HA LYS 101 0.469 -2.383 -4.873 774 HB2 LYS 101 2HB LYS 101 1.025 -4.908 -6.458 775 HB3 LYS 101 3HB LYS 101 2.284 -3.843 -5.836 776 HG2 LYS 101 2HG LYS 101 1.544 -4.289 -3.529 777 HG3 LYS 101 3HG LYS 101 0.250 -5.330 -4.131 778 HD2 LYS 101 2HD LYS 101 2.211 -6.615 -3.302 779 HD3 LYS 101 3HD LYS 101 1.877 -6.915 -5.011 780 HE2 LYS 101 2HE LYS 101 4.301 -6.669 -4.541 781 HE3 LYS 101 3HE LYS 101 3.721 -5.440 -5.663 782 HZ1 LYS 101 1HZ LYS 101 3.596 -3.899 -3.760 783 HZ2 LYS 101 2HZ LYS 101 5.166 -4.444 -4.042 784 HZ3 LYS 101 3HZ LYS 101 4.267 -5.082 -2.767 785 HA PRO 102 HA PRO 102 1.169 -1.637 -9.851 786 HB2 PRO 102 2HB PRO 102 -1.798 -1.957 -10.415 787 HB3 PRO 102 3HB PRO 102 -0.410 -2.176 -11.510 788 HG2 PRO 102 2HG PRO 102 -1.597 -4.305 -10.491 789 HG3 PRO 102 3HG PRO 102 0.179 -4.241 -10.588 790 HD2 PRO 102 2HD PRO 102 -1.583 -3.910 -8.181 791 HD3 PRO 102 3HD PRO 102 0.018 -4.662 -8.316 792 H LEU 103 H LEU 103 -1.987 -0.804 -8.363 793 HA LEU 103 HA LEU 103 -1.975 1.889 -9.381 794 HB2 LEU 103 2HB LEU 103 -4.024 0.385 -8.949 795 HB3 LEU 103 3HB LEU 103 -3.828 0.741 -7.248 796 HG LEU 103 HG LEU 103 -5.626 2.062 -8.512 797 HD11 LEU 103 1HD1 LEU 103 -5.239 4.209 -7.409 798 HD12 LEU 103 2HD1 LEU 103 -3.575 3.734 -7.053 799 HD13 LEU 103 3HD1 LEU 103 -4.920 2.850 -6.334 800 HD21 LEU 103 1HD2 LEU 103 -4.374 2.473 -10.556 801 HD22 LEU 103 2HD2 LEU 103 -3.245 3.513 -9.683 802 HD23 LEU 103 3HD2 LEU 103 -4.940 3.977 -9.843 803 H LEU 104 H LEU 104 -1.365 0.339 -6.252 804 HA LEU 104 HA LEU 104 -1.163 2.616 -4.599 805 HB2 LEU 104 2HB LEU 104 -1.378 0.263 -3.777 806 HB3 LEU 104 3HB LEU 104 0.247 -0.074 -4.347 807 HG LEU 104 HG LEU 104 1.090 1.691 -2.701 808 HD11 LEU 104 1HD1 LEU 104 -0.971 2.940 -2.378 809 HD12 LEU 104 2HD1 LEU 104 -0.381 2.320 -0.837 810 HD13 LEU 104 3HD1 LEU 104 -1.744 1.533 -1.642 811 HD21 LEU 104 1HD2 LEU 104 1.295 -0.707 -2.251 812 HD22 LEU 104 2HD2 LEU 104 -0.316 -0.724 -1.525 813 HD23 LEU 104 3HD2 LEU 104 0.988 0.194 -0.766 814 H ASP 105 H ASP 105 1.277 0.750 -6.376 815 HA ASP 105 HA ASP 105 3.605 2.062 -5.547 816 HB2 ASP 105 2HB ASP 105 3.650 -0.117 -6.699 817 HB3 ASP 105 3HB ASP 105 3.022 0.615 -8.166 818 H VAL 106 H VAL 106 1.609 2.585 -8.443 819 HA VAL 106 HA VAL 106 3.246 4.631 -9.552 820 HB VAL 106 HB VAL 106 0.417 3.695 -10.177 821 HG11 VAL 106 1HG1 VAL 106 0.612 6.024 -10.949 822 HG12 VAL 106 2HG1 VAL 106 0.570 4.917 -12.322 823 HG13 VAL 106 3HG1 VAL 106 2.104 5.629 -11.810 824 HG21 VAL 106 1HG2 VAL 106 1.497 2.585 -12.114 825 HG22 VAL 106 2HG2 VAL 106 2.194 2.033 -10.589 826 HG23 VAL 106 3HG2 VAL 106 3.069 3.195 -11.590 827 H THR 107 H THR 107 0.095 4.808 -7.804 828 HA THR 107 HA THR 107 -0.256 7.602 -8.262 829 HB THR 107 HB THR 107 -1.648 5.844 -6.194 830 HG1 THR 107 HG1 THR 107 -2.193 4.929 -8.083 831 HG21 THR 107 1HG2 THR 107 -2.046 8.257 -5.787 832 HG22 THR 107 2HG2 THR 107 -3.510 7.459 -6.364 833 HG23 THR 107 3HG2 THR 107 -2.557 8.457 -7.464 834 H CYS 108 H CYS 108 0.973 5.768 -5.440 835 HA CYS 108 HA CYS 108 1.360 8.042 -3.737 836 HB2 CYS 108 2HB CYS 108 2.675 5.304 -3.629 837 HB3 CYS 108 3HB CYS 108 2.713 6.505 -2.338 838 HG CYS 108 HG CYS 108 0.326 4.321 -3.159 839 H LYS 109 H LYS 109 3.293 6.451 -6.193 840 HA LYS 109 HA LYS 109 5.786 7.758 -5.625 841 HB2 LYS 109 2HB LYS 109 5.504 5.547 -6.774 842 HB3 LYS 109 3HB LYS 109 4.855 6.386 -8.173 843 HG2 LYS 109 2HG LYS 109 6.998 7.419 -8.630 844 HG3 LYS 109 3HG LYS 109 7.660 6.840 -7.097 845 HD2 LYS 109 2HD LYS 109 6.754 5.065 -9.406 846 HD3 LYS 109 3HD LYS 109 8.431 5.455 -9.015 847 HE2 LYS 109 2HE LYS 109 8.250 4.282 -6.884 848 HE3 LYS 109 3HE LYS 109 6.526 4.007 -7.137 849 HZ1 LYS 109 1HZ LYS 109 7.795 2.048 -7.639 850 HZ2 LYS 109 2HZ LYS 109 8.712 2.878 -8.789 851 HZ3 LYS 109 3HZ LYS 109 7.059 2.636 -9.037 852 H THR 110 H THR 110 2.964 8.437 -7.636 853 HA THR 110 HA THR 110 4.093 10.511 -9.232 854 HB THR 110 HB THR 110 1.179 9.886 -8.579 855 HG1 THR 110 HG1 THR 110 2.713 8.430 -9.900 856 HG21 THR 110 1HG2 THR 110 2.283 11.720 -10.745 857 HG22 THR 110 2HG2 THR 110 1.386 12.246 -9.320 858 HG23 THR 110 3HG2 THR 110 0.590 11.265 -10.547 859 H VAL 111 H VAL 111 2.102 10.536 -6.228 860 HA VAL 111 HA VAL 111 2.035 13.354 -5.942 861 HB VAL 111 HB VAL 111 0.539 11.670 -4.734 862 HG11 VAL 111 1HG1 VAL 111 2.210 10.203 -3.758 863 HG12 VAL 111 2HG1 VAL 111 1.162 10.878 -2.512 864 HG13 VAL 111 3HG1 VAL 111 2.792 11.520 -2.737 865 HG21 VAL 111 1HG2 VAL 111 0.359 14.047 -4.279 866 HG22 VAL 111 2HG2 VAL 111 1.672 13.945 -3.102 867 HG23 VAL 111 3HG2 VAL 111 0.139 13.127 -2.787 868 H ALA 112 H ALA 112 4.359 10.904 -4.950 869 HA ALA 112 HA ALA 112 6.146 12.533 -3.495 870 HB1 ALA 112 1HB ALA 112 6.724 10.059 -5.153 871 HB2 ALA 112 2HB ALA 112 6.243 10.079 -3.455 872 HB3 ALA 112 3HB ALA 112 7.797 10.762 -3.939 873 H ASN 113 H ASN 113 5.992 11.713 -6.999 874 HA ASN 113 HA ASN 113 8.317 13.072 -7.843 875 HB2 ASN 113 2HB ASN 113 5.778 12.471 -9.430 876 HB3 ASN 113 3HB ASN 113 7.277 13.050 -10.152 877 HD21 ASN 113 1HD2 ASN 113 5.804 10.581 -10.652 878 HD22 ASN 113 2HD2 ASN 113 6.918 9.297 -10.360 879 H MET 114 H MET 114 5.043 14.227 -7.275 880 HA MET 114 HA MET 114 5.261 16.731 -8.605 881 HB2 MET 114 2HB MET 114 3.375 15.916 -6.360 882 HB3 MET 114 3HB MET 114 3.220 17.375 -7.328 883 HG2 MET 114 2HG MET 114 3.031 15.832 -9.358 884 HG3 MET 114 3HG MET 114 2.822 14.515 -8.202 885 HE1 MET 114 1HE MET 114 1.213 16.560 -5.933 886 HE2 MET 114 2HE MET 114 0.885 14.839 -6.143 887 HE3 MET 114 3HE MET 114 -0.425 16.009 -6.280 888 H ILE 115 H ILE 115 5.738 15.759 -5.189 889 HA ILE 115 HA ILE 115 6.388 18.448 -4.324 890 HB ILE 115 HB ILE 115 6.965 17.492 -2.142 891 HG12 ILE 115 2HG1 ILE 115 6.592 14.729 -3.387 892 HG13 ILE 115 3HG1 ILE 115 8.142 15.440 -2.966 893 HG21 ILE 115 1HG2 ILE 115 4.449 16.183 -3.249 894 HG22 ILE 115 2HG2 ILE 115 4.579 17.830 -2.627 895 HG23 ILE 115 3HG2 ILE 115 4.803 16.461 -1.538 896 HD11 ILE 115 1HD1 ILE 115 7.444 13.821 -1.330 897 HD12 ILE 115 2HD1 ILE 115 5.957 14.716 -1.023 898 HD13 ILE 115 3HD1 ILE 115 7.521 15.428 -0.614 899 H ARG 116 H ARG 116 8.200 15.696 -5.550 900 HA ARG 116 HA ARG 116 10.817 16.687 -4.816 901 HB2 ARG 116 2HB ARG 116 9.976 14.485 -6.757 902 HB3 ARG 116 3HB ARG 116 11.647 14.838 -6.321 903 HG2 ARG 116 2HG ARG 116 9.506 13.966 -4.345 904 HG3 ARG 116 3HG ARG 116 10.656 12.875 -5.118 905 HD2 ARG 116 2HD ARG 116 11.454 15.219 -3.372 906 HD3 ARG 116 3HD ARG 116 11.266 13.566 -2.787 907 HE ARG 116 HE ARG 116 13.387 14.603 -4.517 908 HH11 ARG 116 1HH1 ARG 116 11.967 11.791 -2.926 909 HH12 ARG 116 2HH1 ARG 116 13.393 10.823 -3.095 910 HH21 ARG 116 1HH2 ARG 116 15.254 13.317 -4.723 911 HH22 ARG 116 2HH2 ARG 116 15.260 11.691 -4.115 912 H GLY 117 H GLY 117 10.785 18.786 -5.639 913 HA2 GLY 117 2HA GLY 117 11.437 18.968 -8.537 914 HA3 GLY 117 3HA GLY 117 10.405 20.163 -7.753 915 H1 SER 2 1H SER 2 18.708 -15.763 14.099 916 H2 SER 2 2H SER 2 17.662 -15.688 15.413 917 H3 SER 2 3H SER 2 19.149 -16.465 15.564 918 HA SER 2 HA SER 2 19.183 -14.323 16.629 919 HB2 SER 2 2HB SER 2 21.252 -15.274 15.581 920 HB3 SER 2 3HB SER 2 20.888 -14.395 14.096 921 HG SER 2 HG SER 2 21.957 -12.837 14.991 922 H LEU 3 H LEU 3 19.566 -11.901 16.056 923 HA LEU 3 HA LEU 3 17.225 -10.766 14.914 924 HB2 LEU 3 2HB LEU 3 19.919 -9.521 15.597 925 HB3 LEU 3 3HB LEU 3 18.481 -8.592 15.200 926 HG LEU 3 HG LEU 3 18.694 -10.433 17.618 927 HD11 LEU 3 1HD1 LEU 3 19.034 -7.420 17.506 928 HD12 LEU 3 2HD1 LEU 3 20.303 -8.605 17.836 929 HD13 LEU 3 3HD1 LEU 3 18.971 -8.408 18.973 930 HD21 LEU 3 1HD2 LEU 3 16.644 -8.319 16.905 931 HD22 LEU 3 2HD2 LEU 3 16.694 -9.250 18.408 932 HD23 LEU 3 3HD2 LEU 3 16.394 -10.068 16.876 933 H VAL 4 H VAL 4 16.782 -10.556 12.748 934 HA VAL 4 HA VAL 4 18.770 -10.954 10.727 935 HB VAL 4 HB VAL 4 16.973 -10.352 9.074 936 HG11 VAL 4 1HG1 VAL 4 16.174 -12.414 11.163 937 HG12 VAL 4 2HG1 VAL 4 17.285 -12.677 9.816 938 HG13 VAL 4 3HG1 VAL 4 15.581 -12.348 9.499 939 HG21 VAL 4 1HG2 VAL 4 15.686 -8.729 10.403 940 HG22 VAL 4 2HG2 VAL 4 15.219 -10.000 11.538 941 HG23 VAL 4 3HG2 VAL 4 14.642 -10.049 9.869 942 H LYS 5 H LYS 5 20.087 -9.553 9.881 943 HA LYS 5 HA LYS 5 20.260 -6.883 10.957 944 HB2 LYS 5 2HB LYS 5 22.082 -8.325 8.989 945 HB3 LYS 5 3HB LYS 5 22.477 -6.870 9.880 946 HG2 LYS 5 2HG LYS 5 22.425 -8.147 12.000 947 HG3 LYS 5 3HG LYS 5 21.995 -9.612 11.106 948 HD2 LYS 5 2HD LYS 5 24.168 -9.390 9.830 949 HD3 LYS 5 3HD LYS 5 24.590 -8.027 10.872 950 HE2 LYS 5 2HE LYS 5 24.066 -10.859 11.844 951 HE3 LYS 5 3HE LYS 5 25.663 -10.162 11.585 952 HZ1 LYS 5 1HZ LYS 5 25.065 -10.066 13.901 953 HZ2 LYS 5 2HZ LYS 5 23.643 -9.226 13.554 954 HZ3 LYS 5 3HZ LYS 5 25.140 -8.498 13.283 955 H LEU 6 H LEU 6 18.394 -5.895 9.911 956 HA LEU 6 HA LEU 6 18.228 -5.719 7.035 957 HB2 LEU 6 2HB LEU 6 16.715 -4.176 9.177 958 HB3 LEU 6 3HB LEU 6 16.366 -4.109 7.453 959 HG LEU 6 HG LEU 6 15.981 -6.479 9.329 960 HD11 LEU 6 1HD1 LEU 6 13.637 -6.334 8.616 961 HD12 LEU 6 2HD1 LEU 6 14.017 -4.916 7.631 962 HD13 LEU 6 3HD1 LEU 6 14.187 -4.849 9.388 963 HD21 LEU 6 1HD2 LEU 6 16.899 -7.375 7.260 964 HD22 LEU 6 2HD2 LEU 6 15.711 -6.484 6.306 965 HD23 LEU 6 3HD2 LEU 6 15.190 -7.779 7.390 966 H GLU 7 H GLU 7 20.174 -4.913 6.404 967 HA GLU 7 HA GLU 7 21.302 -2.433 7.349 968 HB2 GLU 7 2HB GLU 7 22.693 -4.352 6.581 969 HB3 GLU 7 3HB GLU 7 22.027 -4.189 4.961 970 HG2 GLU 7 2HG GLU 7 23.067 -1.960 4.754 971 HG3 GLU 7 3HG GLU 7 23.724 -2.106 6.384 972 H SER 8 H SER 8 20.480 -0.516 6.735 973 HA SER 8 HA SER 8 18.574 -0.190 4.622 974 HB2 SER 8 2HB SER 8 18.588 2.205 5.365 975 HB3 SER 8 3HB SER 8 18.393 1.083 6.711 976 HG SER 8 HG SER 8 20.403 1.507 7.391 977 H SER 9 H SER 9 18.779 1.764 3.137 978 HA SER 9 HA SER 9 20.855 1.607 1.265 979 HB2 SER 9 2HB SER 9 18.570 2.544 0.839 980 HB3 SER 9 3HB SER 9 18.974 3.952 1.819 981 HG SER 9 HG SER 9 19.872 3.212 -0.729 982 H ASP 10 H ASP 10 20.524 3.471 4.193 983 HA ASP 10 HA ASP 10 22.836 5.202 3.721 984 HB2 ASP 10 2HB ASP 10 20.741 6.079 4.759 985 HB3 ASP 10 3HB ASP 10 20.923 4.940 6.083 986 H GLU 11 H GLU 11 22.712 2.089 4.352 987 HA GLU 11 HA GLU 11 24.260 0.578 4.903 988 HB2 GLU 11 2HB GLU 11 26.001 2.895 5.836 989 HB3 GLU 11 3HB GLU 11 26.549 1.235 5.627 990 HG2 GLU 11 2HG GLU 11 26.215 1.367 3.222 991 HG3 GLU 11 3HG GLU 11 25.502 2.979 3.362 992 H LYS 12 H LYS 12 22.618 2.341 7.163 993 HA LYS 12 HA LYS 12 23.911 1.352 9.559 994 HB2 LYS 12 2HB LYS 12 21.320 2.880 9.116 995 HB3 LYS 12 3HB LYS 12 21.814 2.303 10.709 996 HG2 LYS 12 2HG LYS 12 23.934 3.616 10.487 997 HG3 LYS 12 3HG LYS 12 23.338 4.268 8.952 998 HD2 LYS 12 2HD LYS 12 21.489 5.376 10.080 999 HD3 LYS 12 3HD LYS 12 21.885 4.594 11.612 1000 HE2 LYS 12 2HE LYS 12 22.629 6.951 11.560 1001 HE3 LYS 12 3HE LYS 12 23.992 5.845 11.726 1002 HZ1 LYS 12 1HZ LYS 12 24.412 7.632 10.126 1003 HZ2 LYS 12 2HZ LYS 12 23.120 7.101 9.177 1004 HZ3 LYS 12 3HZ LYS 12 24.474 6.114 9.385 1005 H VAL 13 H VAL 13 23.578 -0.508 10.491 1006 HA VAL 13 HA VAL 13 21.849 -2.482 9.217 1007 HB VAL 13 HB VAL 13 24.090 -2.782 11.271 1008 HG11 VAL 13 1HG1 VAL 13 22.542 -4.668 11.430 1009 HG12 VAL 13 2HG1 VAL 13 24.068 -5.188 10.710 1010 HG13 VAL 13 3HG1 VAL 13 22.650 -4.934 9.687 1011 HG21 VAL 13 1HG2 VAL 13 24.909 -1.923 9.103 1012 HG22 VAL 13 2HG2 VAL 13 24.147 -3.279 8.267 1013 HG23 VAL 13 3HG2 VAL 13 25.478 -3.570 9.391 1014 H PHE 14 H PHE 14 19.822 -2.425 10.023 1015 HA PHE 14 HA PHE 14 19.287 -2.051 12.883 1016 HB2 PHE 14 2HB PHE 14 17.373 -2.199 10.502 1017 HB3 PHE 14 3HB PHE 14 16.898 -1.864 12.169 1018 HD1 PHE 14 HD1 PHE 14 17.937 0.179 13.321 1019 HD2 PHE 14 HD2 PHE 14 18.042 -0.397 9.088 1020 HE1 PHE 14 HE1 PHE 14 18.401 2.563 13.010 1021 HE2 PHE 14 HE2 PHE 14 18.511 1.991 8.784 1022 HZ PHE 14 HZ PHE 14 18.697 3.471 10.744 1023 H GLU 15 H GLU 15 19.942 -3.968 13.756 1024 HA GLU 15 HA GLU 15 19.057 -6.555 12.897 1025 HB2 GLU 15 2HB GLU 15 20.306 -5.607 15.511 1026 HB3 GLU 15 3HB GLU 15 20.006 -7.294 15.112 1027 HG2 GLU 15 2HG GLU 15 21.552 -7.134 13.204 1028 HG3 GLU 15 3HG GLU 15 21.855 -5.444 13.582 1029 H ILE 16 H ILE 16 16.791 -6.237 12.743 1030 HA ILE 16 HA ILE 16 15.221 -5.892 15.223 1031 HB ILE 16 HB ILE 16 14.531 -4.691 13.104 1032 HG12 ILE 16 2HG1 ILE 16 12.086 -5.267 13.171 1033 HG13 ILE 16 3HG1 ILE 16 12.465 -6.715 14.103 1034 HG21 ILE 16 1HG2 ILE 16 13.515 -5.942 11.248 1035 HG22 ILE 16 2HG2 ILE 16 13.925 -7.465 12.037 1036 HG23 ILE 16 3HG2 ILE 16 15.207 -6.389 11.474 1037 HD11 ILE 16 1HD1 ILE 16 12.938 -3.873 14.996 1038 HD12 ILE 16 2HD1 ILE 16 13.260 -5.332 15.940 1039 HD13 ILE 16 3HD1 ILE 16 11.606 -4.916 15.494 1040 H GLU 17 H GLU 17 13.687 -7.561 15.876 1041 HA GLU 17 HA GLU 17 14.551 -10.230 15.719 1042 HB2 GLU 17 2HB GLU 17 11.769 -9.208 16.441 1043 HB3 GLU 17 3HB GLU 17 12.374 -10.831 16.772 1044 HG2 GLU 17 2HG GLU 17 14.127 -9.841 18.252 1045 HG3 GLU 17 3HG GLU 17 13.446 -8.243 17.948 1046 H LYS 18 H LYS 18 14.018 -11.881 14.419 1047 HA LYS 18 HA LYS 18 13.408 -11.479 11.743 1048 HB2 LYS 18 2HB LYS 18 14.684 -13.390 12.632 1049 HB3 LYS 18 3HB LYS 18 13.233 -14.027 13.400 1050 HG2 LYS 18 2HG LYS 18 12.217 -14.381 11.148 1051 HG3 LYS 18 3HG LYS 18 13.700 -13.776 10.400 1052 HD2 LYS 18 2HD LYS 18 13.447 -16.275 12.134 1053 HD3 LYS 18 3HD LYS 18 13.671 -16.237 10.382 1054 HE2 LYS 18 2HE LYS 18 15.884 -15.197 10.678 1055 HE3 LYS 18 3HE LYS 18 15.658 -15.184 12.425 1056 HZ1 LYS 18 1HZ LYS 18 15.839 -17.601 10.714 1057 HZ2 LYS 18 2HZ LYS 18 15.571 -17.600 12.384 1058 HZ3 LYS 18 3HZ LYS 18 17.030 -17.015 11.764 1059 H GLU 19 H GLU 19 11.361 -12.620 14.398 1060 HA GLU 19 HA GLU 19 9.015 -13.266 13.025 1061 HB2 GLU 19 2HB GLU 19 7.901 -13.030 15.243 1062 HB3 GLU 19 3HB GLU 19 9.390 -13.966 15.321 1063 HG2 GLU 19 2HG GLU 19 10.578 -11.911 16.157 1064 HG3 GLU 19 3HG GLU 19 9.026 -11.078 16.208 1065 H ILE 20 H ILE 20 10.194 -10.124 14.109 1066 HA ILE 20 HA ILE 20 7.720 -8.687 13.595 1067 HB ILE 20 HB ILE 20 10.528 -7.606 14.153 1068 HG12 ILE 20 2HG1 ILE 20 8.223 -8.138 16.083 1069 HG13 ILE 20 3HG1 ILE 20 9.726 -9.046 15.999 1070 HG21 ILE 20 1HG2 ILE 20 9.070 -5.919 13.100 1071 HG22 ILE 20 2HG2 ILE 20 9.403 -5.498 14.779 1072 HG23 ILE 20 3HG2 ILE 20 7.840 -6.192 14.337 1073 HD11 ILE 20 1HD1 ILE 20 9.432 -6.165 16.845 1074 HD12 ILE 20 2HD1 ILE 20 10.955 -7.048 16.718 1075 HD13 ILE 20 3HD1 ILE 20 9.737 -7.557 17.885 1076 H ALA 21 H ALA 21 10.789 -9.304 11.962 1077 HA ALA 21 HA ALA 21 10.408 -7.532 9.745 1078 HB1 ALA 21 1HB ALA 21 12.327 -8.696 8.761 1079 HB2 ALA 21 2HB ALA 21 12.206 -9.961 9.990 1080 HB3 ALA 21 3HB ALA 21 12.628 -8.312 10.461 1081 H CYS 22 H CYS 22 9.173 -10.671 10.528 1082 HA CYS 22 HA CYS 22 8.447 -11.541 7.912 1083 HB2 CYS 22 2HB CYS 22 7.253 -12.268 10.607 1084 HB3 CYS 22 3HB CYS 22 6.971 -13.132 9.094 1085 HG CYS 22 HG CYS 22 10.211 -12.922 9.629 1086 H MET 23 H MET 23 7.014 -9.287 10.199 1087 HA MET 23 HA MET 23 4.358 -9.181 9.231 1088 HB2 MET 23 2HB MET 23 6.031 -6.972 10.502 1089 HB3 MET 23 3HB MET 23 4.292 -6.885 10.247 1090 HG2 MET 23 2HG MET 23 3.957 -8.760 11.791 1091 HG3 MET 23 3HG MET 23 5.701 -8.898 12.020 1092 HE1 MET 23 1HE MET 23 2.529 -6.563 12.592 1093 HE2 MET 23 2HE MET 23 3.623 -5.502 11.703 1094 HE3 MET 23 3HE MET 23 3.276 -5.192 13.407 1095 H SER 24 H SER 24 7.312 -7.522 8.228 1096 HA SER 24 HA SER 24 6.214 -6.127 5.991 1097 HB2 SER 24 2HB SER 24 8.427 -5.524 6.924 1098 HB3 SER 24 3HB SER 24 9.070 -7.106 6.481 1099 HG SER 24 HG SER 24 7.915 -5.387 4.559 1100 H VAL 25 H VAL 25 5.163 -7.211 4.430 1101 HA VAL 25 HA VAL 25 5.326 -9.981 3.967 1102 HB VAL 25 HB VAL 25 4.189 -7.808 2.149 1103 HG11 VAL 25 1HG1 VAL 25 3.687 -10.805 2.051 1104 HG12 VAL 25 2HG1 VAL 25 4.566 -9.860 0.848 1105 HG13 VAL 25 3HG1 VAL 25 2.838 -9.592 1.085 1106 HG21 VAL 25 1HG2 VAL 25 1.995 -8.408 3.141 1107 HG22 VAL 25 2HG2 VAL 25 3.124 -7.832 4.370 1108 HG23 VAL 25 3HG2 VAL 25 2.799 -9.561 4.212 1109 H THR 26 H THR 26 6.802 -7.222 2.241 1110 HA THR 26 HA THR 26 7.950 -8.645 0.097 1111 HB THR 26 HB THR 26 8.901 -6.025 1.324 1112 HG1 THR 26 HG1 THR 26 6.679 -6.683 -0.153 1113 HG21 THR 26 1HG2 THR 26 9.308 -7.112 -1.492 1114 HG22 THR 26 2HG2 THR 26 10.565 -6.971 -0.260 1115 HG23 THR 26 3HG2 THR 26 9.806 -5.519 -0.919 1116 H ILE 27 H ILE 27 9.450 -7.579 3.207 1117 HA ILE 27 HA ILE 27 12.016 -8.696 2.755 1118 HB ILE 27 HB ILE 27 10.606 -8.024 5.376 1119 HG12 ILE 27 2HG1 ILE 27 12.745 -6.499 3.814 1120 HG13 ILE 27 3HG1 ILE 27 11.035 -6.090 3.872 1121 HG21 ILE 27 1HG2 ILE 27 13.550 -8.710 5.000 1122 HG22 ILE 27 2HG2 ILE 27 12.355 -9.699 5.840 1123 HG23 ILE 27 3HG2 ILE 27 12.811 -8.128 6.498 1124 HD11 ILE 27 1HD1 ILE 27 12.965 -6.005 6.188 1125 HD12 ILE 27 2HD1 ILE 27 11.237 -5.651 6.281 1126 HD13 ILE 27 3HD1 ILE 27 12.293 -4.633 5.305 1127 H LYS 28 H LYS 28 9.083 -9.992 4.308 1128 HA LYS 28 HA LYS 28 10.115 -12.467 5.184 1129 HB2 LYS 28 2HB LYS 28 7.929 -11.550 5.928 1130 HB3 LYS 28 3HB LYS 28 7.269 -11.808 4.317 1131 HG2 LYS 28 2HG LYS 28 7.622 -14.271 4.594 1132 HG3 LYS 28 3HG LYS 28 8.232 -13.975 6.224 1133 HD2 LYS 28 2HD LYS 28 5.904 -14.702 6.320 1134 HD3 LYS 28 3HD LYS 28 6.037 -13.032 6.877 1135 HE2 LYS 28 2HE LYS 28 4.072 -13.291 5.447 1136 HE3 LYS 28 3HE LYS 28 5.246 -12.253 4.641 1137 HZ1 LYS 28 1HZ LYS 28 5.923 -14.130 3.282 1138 HZ2 LYS 28 2HZ LYS 28 4.260 -13.886 3.144 1139 HZ3 LYS 28 3HZ LYS 28 4.846 -15.150 4.092 1140 H ASN 29 H ASN 29 8.718 -11.441 2.075 1141 HA ASN 29 HA ASN 29 8.693 -14.037 0.889 1142 HB2 ASN 29 2HB ASN 29 8.553 -11.268 -0.365 1143 HB3 ASN 29 3HB ASN 29 8.435 -12.753 -1.305 1144 HD21 ASN 29 1HD2 ASN 29 6.852 -14.165 0.771 1145 HD22 ASN 29 2HD2 ASN 29 5.276 -13.464 0.683 1146 H MET 30 H MET 30 11.125 -11.485 1.128 1147 HA MET 30 HA MET 30 13.018 -12.563 -0.727 1148 HB2 MET 30 2HB MET 30 13.426 -10.750 1.696 1149 HB3 MET 30 3HB MET 30 14.700 -11.152 0.552 1150 HG2 MET 30 2HG MET 30 13.462 -10.039 -1.245 1151 HG3 MET 30 3HG MET 30 12.151 -9.660 -0.123 1152 HE1 MET 30 1HE MET 30 13.883 -6.155 -0.767 1153 HE2 MET 30 2HE MET 30 12.371 -7.055 -0.862 1154 HE3 MET 30 3HE MET 30 13.708 -7.459 -1.939 1155 H ILE 31 H ILE 31 12.437 -12.999 2.729 1156 HA ILE 31 HA ILE 31 14.589 -14.711 3.387 1157 HB ILE 31 HB ILE 31 11.817 -14.365 4.619 1158 HG12 ILE 31 2HG1 ILE 31 14.531 -13.346 5.581 1159 HG13 ILE 31 3HG1 ILE 31 13.369 -12.382 4.679 1160 HG21 ILE 31 1HG2 ILE 31 12.639 -15.520 6.644 1161 HG22 ILE 31 2HG2 ILE 31 14.146 -15.909 5.809 1162 HG23 ILE 31 3HG2 ILE 31 12.621 -16.597 5.246 1163 HD11 ILE 31 1HD1 ILE 31 12.982 -13.517 7.450 1164 HD12 ILE 31 2HD1 ILE 31 11.766 -12.611 6.541 1165 HD13 ILE 31 3HD1 ILE 31 13.275 -11.834 7.014 1166 H GLU 32 H GLU 32 11.204 -15.428 2.517 1167 HA GLU 32 HA GLU 32 11.350 -18.253 2.547 1168 HB2 GLU 32 2HB GLU 32 9.374 -16.409 1.123 1169 HB3 GLU 32 3HB GLU 32 9.147 -18.144 1.341 1170 HG2 GLU 32 2HG GLU 32 8.956 -17.898 3.734 1171 HG3 GLU 32 3HG GLU 32 9.434 -16.203 3.655 1172 H ASP 33 H ASP 33 12.072 -15.864 0.115 1173 HA ASP 33 HA ASP 33 11.953 -17.418 -2.239 1174 HB2 ASP 33 2HB ASP 33 12.053 -14.925 -2.183 1175 HB3 ASP 33 3HB ASP 33 13.721 -15.006 -1.637 1176 H ILE 34 H ILE 34 14.574 -16.713 0.008 1177 HA ILE 34 HA ILE 34 16.487 -18.495 -1.347 1178 HB ILE 34 HB ILE 34 16.883 -16.801 1.180 1179 HG12 ILE 34 2HG1 ILE 34 17.457 -15.995 -1.716 1180 HG13 ILE 34 3HG1 ILE 34 16.154 -15.357 -0.721 1181 HG21 ILE 34 1HG2 ILE 34 19.292 -16.913 0.654 1182 HG22 ILE 34 2HG2 ILE 34 18.950 -17.907 -0.763 1183 HG23 ILE 34 3HG2 ILE 34 18.621 -18.533 0.852 1184 HD11 ILE 34 1HD1 ILE 34 19.111 -14.970 -0.231 1185 HD12 ILE 34 2HD1 ILE 34 17.808 -14.355 0.791 1186 HD13 ILE 34 3HD1 ILE 34 17.974 -13.782 -0.867 1187 H GLY 35 H GLY 35 13.922 -19.158 0.421 1188 HA2 GLY 35 2HA GLY 35 13.366 -21.073 1.624 1189 HA3 GLY 35 3HA GLY 35 15.066 -21.409 1.921 1190 H GLU 36 H GLU 36 16.189 -19.732 3.302 1191 HA GLU 36 HA GLU 36 14.590 -17.902 4.839 1192 HB2 GLU 36 2HB GLU 36 14.486 -20.073 6.183 1193 HB3 GLU 36 3HB GLU 36 16.232 -19.962 6.389 1194 HG2 GLU 36 2HG GLU 36 15.962 -17.792 7.546 1195 HG3 GLU 36 3HG GLU 36 14.215 -17.894 7.331 1196 H SER 37 H SER 37 15.896 -16.235 5.790 1197 HA SER 37 HA SER 37 18.787 -16.268 5.281 1198 HB2 SER 37 2HB SER 37 16.878 -14.191 4.130 1199 HB3 SER 37 3HB SER 37 18.633 -13.999 4.180 1200 HG SER 37 HG SER 37 17.561 -16.322 3.030 1201 H ASP 38 H ASP 38 18.999 -16.367 7.507 1202 HA ASP 38 HA ASP 38 18.052 -14.360 9.339 1203 HB2 ASP 38 2HB ASP 38 18.702 -16.735 9.948 1204 HB3 ASP 38 3HB ASP 38 20.382 -16.327 9.633 1205 H SER 39 H SER 39 20.744 -14.792 7.234 1206 HA SER 39 HA SER 39 22.663 -12.996 8.189 1207 HB2 SER 39 2HB SER 39 23.523 -13.186 5.801 1208 HB3 SER 39 3HB SER 39 23.200 -14.731 6.585 1209 HG SER 39 HG SER 39 21.557 -13.385 4.699 1210 HA PRO 40 HA PRO 40 21.512 -8.797 7.353 1211 HB2 PRO 40 2HB PRO 40 23.548 -7.894 5.561 1212 HB3 PRO 40 3HB PRO 40 23.603 -7.870 7.334 1213 HG2 PRO 40 2HG PRO 40 24.716 -9.917 5.449 1214 HG3 PRO 40 3HG PRO 40 25.413 -9.265 6.952 1215 HD2 PRO 40 2HD PRO 40 24.308 -11.677 6.968 1216 HD3 PRO 40 3HD PRO 40 24.004 -10.574 8.329 1217 H ILE 41 H ILE 41 19.642 -8.623 6.278 1218 HA ILE 41 HA ILE 41 19.456 -8.889 3.374 1219 HB ILE 41 HB ILE 41 17.331 -8.157 5.441 1220 HG12 ILE 41 2HG1 ILE 41 18.069 -10.487 5.700 1221 HG13 ILE 41 3HG1 ILE 41 16.433 -10.448 5.050 1222 HG21 ILE 41 1HG2 ILE 41 16.957 -8.742 2.478 1223 HG22 ILE 41 2HG2 ILE 41 16.734 -7.180 3.273 1224 HG23 ILE 41 3HG2 ILE 41 15.656 -8.523 3.654 1225 HD11 ILE 41 1HD1 ILE 41 17.346 -10.911 2.801 1226 HD12 ILE 41 2HD1 ILE 41 17.736 -12.153 3.984 1227 HD13 ILE 41 3HD1 ILE 41 18.967 -10.994 3.505 1228 HA PRO 42 HA PRO 42 20.225 -4.380 3.275 1229 HB2 PRO 42 2HB PRO 42 20.882 -4.570 0.452 1230 HB3 PRO 42 3HB PRO 42 22.001 -4.390 1.814 1231 HG2 PRO 42 2HG PRO 42 21.845 -6.649 0.224 1232 HG3 PRO 42 3HG PRO 42 22.494 -6.624 1.878 1233 HD2 PRO 42 2HD PRO 42 19.749 -7.449 0.944 1234 HD3 PRO 42 3HD PRO 42 20.803 -8.210 2.161 1235 H LEU 43 H LEU 43 18.597 -2.969 3.084 1236 HA LEU 43 HA LEU 43 16.618 -3.189 0.897 1237 HB2 LEU 43 2HB LEU 43 16.442 -1.618 3.508 1238 HB3 LEU 43 3HB LEU 43 15.230 -1.607 2.244 1239 HG LEU 43 HG LEU 43 14.359 -3.007 3.959 1240 HD11 LEU 43 1HD1 LEU 43 14.100 -5.190 2.937 1241 HD12 LEU 43 2HD1 LEU 43 15.481 -4.893 1.877 1242 HD13 LEU 43 3HD1 LEU 43 14.017 -3.916 1.721 1243 HD21 LEU 43 1HD2 LEU 43 16.980 -4.528 4.051 1244 HD22 LEU 43 2HD2 LEU 43 15.534 -4.880 5.005 1245 HD23 LEU 43 3HD2 LEU 43 16.402 -3.365 5.249 1246 HA PRO 44 HA PRO 44 19.562 0.159 -0.359 1247 HB2 PRO 44 2HB PRO 44 19.462 -0.212 -3.055 1248 HB3 PRO 44 3HB PRO 44 20.346 -1.330 -1.991 1249 HG2 PRO 44 2HG PRO 44 17.591 -1.642 -3.164 1250 HG3 PRO 44 3HG PRO 44 18.917 -2.826 -3.084 1251 HD2 PRO 44 2HD PRO 44 16.849 -2.813 -1.288 1252 HD3 PRO 44 3HD PRO 44 18.481 -3.377 -0.870 1253 H ASN 45 H ASN 45 16.213 -0.209 -1.003 1254 HA ASN 45 HA ASN 45 15.804 2.264 -2.444 1255 HB2 ASN 45 2HB ASN 45 14.279 0.382 -2.813 1256 HB3 ASN 45 3HB ASN 45 13.859 0.339 -1.109 1257 HD21 ASN 45 1HD2 ASN 45 13.441 2.072 -4.117 1258 HD22 ASN 45 2HD2 ASN 45 12.084 3.016 -3.613 1259 H VAL 46 H VAL 46 15.008 1.125 0.859 1260 HA VAL 46 HA VAL 46 14.179 3.821 1.638 1261 HB VAL 46 HB VAL 46 12.700 1.920 2.184 1262 HG11 VAL 46 1HG1 VAL 46 14.897 0.917 4.017 1263 HG12 VAL 46 2HG1 VAL 46 14.353 0.145 2.524 1264 HG13 VAL 46 3HG1 VAL 46 13.260 0.262 3.906 1265 HG21 VAL 46 1HG2 VAL 46 12.589 3.915 3.592 1266 HG22 VAL 46 2HG2 VAL 46 13.829 3.259 4.664 1267 HG23 VAL 46 3HG2 VAL 46 12.251 2.472 4.550 1268 H THR 47 H THR 47 15.254 5.118 3.008 1269 HA THR 47 HA THR 47 18.024 4.610 3.677 1270 HB THR 47 HB THR 47 17.934 6.969 4.594 1271 HG1 THR 47 HG1 THR 47 16.031 8.080 4.549 1272 HG21 THR 47 1HG2 THR 47 16.792 6.646 1.785 1273 HG22 THR 47 2HG2 THR 47 18.506 6.620 2.211 1274 HG23 THR 47 3HG2 THR 47 17.568 8.100 2.422 1275 H SER 48 H SER 48 18.680 5.538 5.981 1276 HA SER 48 HA SER 48 17.930 3.497 7.795 1277 HB2 SER 48 2HB SER 48 19.492 4.651 9.362 1278 HB3 SER 48 3HB SER 48 20.197 4.414 7.762 1279 HG SER 48 HG SER 48 20.576 6.506 8.517 1280 H THR 49 H THR 49 17.285 7.002 7.753 1281 HA THR 49 HA THR 49 16.142 7.269 10.299 1282 HB THR 49 HB THR 49 15.135 9.398 9.375 1283 HG1 THR 49 HG1 THR 49 15.231 9.807 7.232 1284 HG21 THR 49 1HG2 THR 49 17.463 9.437 10.198 1285 HG22 THR 49 2HG2 THR 49 17.283 10.502 8.802 1286 HG23 THR 49 3HG2 THR 49 18.048 8.922 8.612 1287 H ILE 50 H ILE 50 14.661 6.592 7.161 1288 HA ILE 50 HA ILE 50 11.951 6.655 8.107 1289 HB ILE 50 HB ILE 50 13.081 5.583 5.484 1290 HG12 ILE 50 2HG1 ILE 50 13.637 7.970 5.789 1291 HG13 ILE 50 3HG1 ILE 50 12.436 7.790 4.516 1292 HG21 ILE 50 1HG2 ILE 50 10.831 4.702 5.899 1293 HG22 ILE 50 2HG2 ILE 50 10.789 5.875 4.582 1294 HG23 ILE 50 3HG2 ILE 50 10.218 6.332 6.190 1295 HD11 ILE 50 1HD1 ILE 50 11.954 9.702 5.899 1296 HD12 ILE 50 2HD1 ILE 50 11.918 8.704 7.350 1297 HD13 ILE 50 3HD1 ILE 50 10.683 8.498 6.101 1298 H LEU 51 H LEU 51 14.251 4.060 7.168 1299 HA LEU 51 HA LEU 51 12.519 1.857 7.513 1300 HB2 LEU 51 2HB LEU 51 14.666 1.752 6.249 1301 HB3 LEU 51 3HB LEU 51 15.555 1.929 7.752 1302 HG LEU 51 HG LEU 51 14.663 -0.277 8.534 1303 HD11 LEU 51 1HD1 LEU 51 13.525 -1.792 6.994 1304 HD12 LEU 51 2HD1 LEU 51 13.434 -0.516 5.777 1305 HD13 LEU 51 3HD1 LEU 51 12.560 -0.350 7.302 1306 HD21 LEU 51 1HD2 LEU 51 16.081 -0.421 5.858 1307 HD22 LEU 51 2HD2 LEU 51 16.018 -1.700 7.077 1308 HD23 LEU 51 3HD2 LEU 51 16.845 -0.187 7.435 1309 H GLU 52 H GLU 52 14.694 3.498 9.780 1310 HA GLU 52 HA GLU 52 14.653 1.757 11.966 1311 HB2 GLU 52 2HB GLU 52 16.197 3.663 11.801 1312 HB3 GLU 52 3HB GLU 52 14.855 4.796 11.896 1313 HG2 GLU 52 2HG GLU 52 14.398 4.096 14.212 1314 HG3 GLU 52 3HG GLU 52 15.697 2.904 14.122 1315 H LYS 53 H LYS 53 12.628 4.586 11.270 1316 HA LYS 53 HA LYS 53 10.889 4.395 13.467 1317 HB2 LYS 53 2HB LYS 53 10.853 5.865 10.846 1318 HB3 LYS 53 3HB LYS 53 9.328 5.738 11.707 1319 HG2 LYS 53 2HG LYS 53 10.422 6.756 13.719 1320 HG3 LYS 53 3HG LYS 53 11.879 7.017 12.751 1321 HD2 LYS 53 2HD LYS 53 9.128 8.139 12.057 1322 HD3 LYS 53 3HD LYS 53 10.362 9.034 12.947 1323 HE2 LYS 53 2HE LYS 53 10.659 7.970 10.114 1324 HE3 LYS 53 3HE LYS 53 10.344 9.649 10.566 1325 HZ1 LYS 53 1HZ LYS 53 12.455 9.706 11.728 1326 HZ2 LYS 53 2HZ LYS 53 12.679 9.273 10.112 1327 HZ3 LYS 53 3HZ LYS 53 12.764 8.095 11.317 1328 H VAL 54 H VAL 54 10.604 3.080 10.165 1329 HA VAL 54 HA VAL 54 7.936 2.144 10.397 1330 HB VAL 54 HB VAL 54 10.180 1.358 8.481 1331 HG11 VAL 54 1HG1 VAL 54 8.449 0.341 7.031 1332 HG12 VAL 54 2HG1 VAL 54 7.233 0.630 8.278 1333 HG13 VAL 54 3HG1 VAL 54 8.555 -0.498 8.582 1334 HG21 VAL 54 1HG2 VAL 54 9.410 3.712 8.316 1335 HG22 VAL 54 2HG2 VAL 54 7.753 3.157 8.083 1336 HG23 VAL 54 3HG2 VAL 54 8.983 2.799 6.867 1337 H LEU 55 H LEU 55 11.081 0.577 11.044 1338 HA LEU 55 HA LEU 55 10.002 -2.034 11.573 1339 HB2 LEU 55 2HB LEU 55 12.700 -0.828 12.287 1340 HB3 LEU 55 3HB LEU 55 12.282 -2.516 12.556 1341 HG LEU 55 HG LEU 55 12.497 -1.141 9.849 1342 HD11 LEU 55 1HD1 LEU 55 14.459 -2.561 9.504 1343 HD12 LEU 55 2HD1 LEU 55 14.301 -3.208 11.141 1344 HD13 LEU 55 3HD1 LEU 55 14.672 -1.497 10.894 1345 HD21 LEU 55 1HD2 LEU 55 12.163 -3.370 8.869 1346 HD22 LEU 55 2HD2 LEU 55 10.752 -2.852 9.786 1347 HD23 LEU 55 3HD2 LEU 55 11.859 -4.044 10.475 1348 H ASP 56 H ASP 56 10.788 0.785 13.530 1349 HA ASP 56 HA ASP 56 10.500 -0.477 16.095 1350 HB2 ASP 56 2HB ASP 56 11.880 1.583 15.686 1351 HB3 ASP 56 3HB ASP 56 10.403 2.487 15.373 1352 H TYR 57 H TYR 57 8.364 1.238 13.876 1353 HA TYR 57 HA TYR 57 6.086 1.396 15.596 1354 HB2 TYR 57 2HB TYR 57 6.337 2.856 13.587 1355 HB3 TYR 57 3HB TYR 57 6.207 1.446 12.544 1356 HD1 TYR 57 HD1 TYR 57 4.008 0.385 12.126 1357 HD2 TYR 57 HD2 TYR 57 4.341 3.715 14.796 1358 HE1 TYR 57 HE1 TYR 57 1.563 0.614 12.144 1359 HE2 TYR 57 HE2 TYR 57 1.901 3.944 14.811 1360 HH TYR 57 HH TYR 57 -0.032 3.337 13.445 1361 H CYS 58 H CYS 58 7.108 -0.831 13.001 1362 HA CYS 58 HA CYS 58 4.923 -2.605 13.112 1363 HB2 CYS 58 2HB CYS 58 7.784 -3.059 12.194 1364 HB3 CYS 58 3HB CYS 58 6.479 -4.225 11.960 1365 HG CYS 58 HG CYS 58 7.335 -1.775 10.047 1366 H ARG 59 H ARG 59 7.902 -2.408 14.986 1367 HA ARG 59 HA ARG 59 7.652 -4.857 16.383 1368 HB2 ARG 59 2HB ARG 59 9.779 -3.771 16.445 1369 HB3 ARG 59 3HB ARG 59 9.095 -2.277 17.075 1370 HG2 ARG 59 2HG ARG 59 8.765 -3.222 19.259 1371 HG3 ARG 59 3HG ARG 59 9.024 -4.865 18.668 1372 HD2 ARG 59 2HD ARG 59 10.945 -3.909 19.975 1373 HD3 ARG 59 3HD ARG 59 11.357 -4.488 18.358 1374 HE ARG 59 HE ARG 59 10.758 -1.662 18.503 1375 HH11 ARG 59 1HH1 ARG 59 13.319 -4.067 18.781 1376 HH12 ARG 59 2HH1 ARG 59 14.583 -2.936 18.440 1377 HH21 ARG 59 1HH2 ARG 59 12.431 -0.213 18.036 1378 HH22 ARG 59 2HH2 ARG 59 14.072 -0.746 18.017 1379 H HIS 60 H HIS 60 6.511 -1.540 17.140 1380 HA HIS 60 HA HIS 60 5.324 -2.195 19.636 1381 HB2 HIS 60 2HB HIS 60 5.839 0.150 18.996 1382 HB3 HIS 60 3HB HIS 60 4.600 0.089 17.740 1383 HD1 HIS 60 HD1 HIS 60 2.486 1.206 18.496 1384 HD2 HIS 60 HD2 HIS 60 4.508 -0.555 21.674 1385 HE1 HIS 60 HE1 HIS 60 1.034 1.553 20.503 1386 HE2 HIS 60 HE2 HIS 60 2.380 0.674 22.433 1387 H HIS 61 H HIS 61 4.144 -2.308 16.331 1388 HA HIS 61 HA HIS 61 1.419 -2.982 17.003 1389 HB2 HIS 61 2HB HIS 61 2.189 -1.739 14.887 1390 HB3 HIS 61 3HB HIS 61 2.760 -3.288 14.283 1391 HD1 HIS 61 HD1 HIS 61 0.801 -5.169 14.011 1392 HD2 HIS 61 HD2 HIS 61 -0.459 -1.238 14.425 1393 HE1 HIS 61 HE1 HIS 61 -1.577 -5.141 13.215 1394 HE2 HIS 61 HE2 HIS 61 -2.297 -2.739 13.419 1395 H HIS 62 H HIS 62 4.384 -4.705 16.675 1396 HA HIS 62 HA HIS 62 3.219 -7.334 16.299 1397 HB2 HIS 62 2HB HIS 62 5.547 -6.769 15.548 1398 HB3 HIS 62 3HB HIS 62 6.021 -6.545 17.226 1399 HD1 HIS 62 HD1 HIS 62 5.279 -9.170 14.678 1400 HD2 HIS 62 HD2 HIS 62 6.413 -8.939 18.668 1401 HE1 HIS 62 HE1 HIS 62 6.034 -11.478 15.310 1402 HE2 HIS 62 HE2 HIS 62 6.496 -11.345 17.767 1403 H GLN 63 H GLN 63 4.368 -5.317 18.976 1404 HA GLN 63 HA GLN 63 4.017 -7.242 21.057 1405 HB2 GLN 63 2HB GLN 63 3.973 -4.201 21.335 1406 HB3 GLN 63 3HB GLN 63 4.272 -5.368 22.616 1407 HG2 GLN 63 2HG GLN 63 6.101 -4.634 20.314 1408 HG3 GLN 63 3HG GLN 63 6.361 -4.352 22.027 1409 HE21 GLN 63 1HE2 GLN 63 7.020 -6.092 23.335 1410 HE22 GLN 63 2HE2 GLN 63 7.675 -7.546 22.670 1411 H HIS 64 H HIS 64 1.980 -4.841 19.506 1412 HA HIS 64 HA HIS 64 -0.421 -5.888 20.895 1413 HB2 HIS 64 2HB HIS 64 0.037 -2.962 20.127 1414 HB3 HIS 64 3HB HIS 64 -1.381 -3.621 20.936 1415 HD1 HIS 64 HD1 HIS 64 -1.121 -4.258 23.457 1416 HD2 HIS 64 HD2 HIS 64 2.216 -2.419 21.809 1417 HE1 HIS 64 HE1 HIS 64 0.331 -3.630 25.394 1418 HE2 HIS 64 HE2 HIS 64 2.416 -2.684 24.362 1419 HA PRO 65 HA PRO 65 -0.768 -6.582 16.301 1420 HB2 PRO 65 2HB PRO 65 -2.697 -8.580 16.489 1421 HB3 PRO 65 3HB PRO 65 -0.949 -8.873 16.643 1422 HG2 PRO 65 2HG PRO 65 -2.997 -8.505 18.818 1423 HG3 PRO 65 3HG PRO 65 -1.695 -9.713 18.693 1424 HD2 PRO 65 2HD PRO 65 -1.408 -7.539 20.253 1425 HD3 PRO 65 3HD PRO 65 -0.030 -8.190 19.338 1426 H GLY 66 H GLY 66 -3.078 -5.520 18.612 1427 HA2 GLY 66 2HA GLY 66 -4.529 -4.058 16.496 1428 HA3 GLY 66 3HA GLY 66 -5.459 -4.993 17.664 1429 H GLY 67 H GLY 67 -3.911 -4.513 19.962 1430 HA2 GLY 67 2HA GLY 67 -3.316 -2.896 21.534 1431 HA3 GLY 67 3HA GLY 67 -3.857 -1.624 20.447 1432 H SER 68 H SER 68 -4.485 -2.511 23.354 1433 HA SER 68 HA SER 68 -7.308 -3.056 23.423 1434 HB2 SER 68 2HB SER 68 -5.451 -2.109 25.651 1435 HB3 SER 68 3HB SER 68 -7.060 -2.806 25.869 1436 HG SER 68 HG SER 68 -6.285 -4.761 25.466 1437 H GLY 69 H GLY 69 -5.593 -0.259 22.750 1438 HA2 GLY 69 2HA GLY 69 -7.074 1.785 24.017 1439 HA3 GLY 69 3HA GLY 69 -6.087 1.952 22.575 1440 H LEU 70 H LEU 70 -9.288 1.651 23.802 1441 HA LEU 70 HA LEU 70 -10.707 1.247 21.369 1442 HB2 LEU 70 2HB LEU 70 -12.589 2.560 22.817 1443 HB3 LEU 70 3HB LEU 70 -12.200 0.871 23.042 1444 HG LEU 70 HG LEU 70 -10.790 1.457 25.026 1445 HD11 LEU 70 1HD1 LEU 70 -10.113 3.729 24.462 1446 HD12 LEU 70 2HD1 LEU 70 -10.889 3.682 26.044 1447 HD13 LEU 70 3HD1 LEU 70 -11.778 4.289 24.644 1448 HD21 LEU 70 1HD2 LEU 70 -12.633 2.009 26.549 1449 HD22 LEU 70 2HD2 LEU 70 -13.117 0.807 25.355 1450 HD23 LEU 70 3HD2 LEU 70 -13.635 2.486 25.175 1451 H ASP 71 H ASP 71 -9.788 2.494 19.789 1452 HA ASP 71 HA ASP 71 -9.335 4.225 18.401 1453 HB2 ASP 71 2HB ASP 71 -11.750 4.761 18.621 1454 HB3 ASP 71 3HB ASP 71 -11.417 5.724 20.056 1455 H ASP 72 H ASP 72 -8.166 3.957 21.266 1456 HA ASP 72 HA ASP 72 -7.217 6.650 21.875 1457 HB2 ASP 72 2HB ASP 72 -8.124 5.416 23.777 1458 HB3 ASP 72 3HB ASP 72 -7.117 4.023 23.417 1459 H ILE 73 H ILE 73 -5.768 6.982 20.310 1460 HA ILE 73 HA ILE 73 -3.713 5.192 19.465 1461 HB ILE 73 HB ILE 73 -3.929 8.217 19.123 1462 HG12 ILE 73 2HG1 ILE 73 -4.799 6.007 17.201 1463 HG13 ILE 73 3HG1 ILE 73 -5.884 7.011 18.160 1464 HG21 ILE 73 1HG2 ILE 73 -2.359 7.957 17.226 1465 HG22 ILE 73 2HG2 ILE 73 -2.210 6.236 17.582 1466 HG23 ILE 73 3HG2 ILE 73 -1.622 7.431 18.740 1467 HD11 ILE 73 1HD1 ILE 73 -4.058 7.987 15.960 1468 HD12 ILE 73 2HD1 ILE 73 -5.139 8.991 16.933 1469 HD13 ILE 73 3HD1 ILE 73 -5.803 7.759 15.863 1470 HA PRO 74 HA PRO 74 -1.081 5.991 23.136 1471 HB2 PRO 74 2HB PRO 74 0.980 4.528 21.504 1472 HB3 PRO 74 3HB PRO 74 0.401 4.192 23.152 1473 HG2 PRO 74 2HG PRO 74 -0.338 2.619 21.139 1474 HG3 PRO 74 3HG PRO 74 -1.509 3.064 22.405 1475 HD2 PRO 74 2HD PRO 74 -1.204 4.226 19.629 1476 HD3 PRO 74 3HD PRO 74 -2.686 3.743 20.490 1477 HA PRO 75 HA PRO 75 0.976 9.792 22.075 1478 HB2 PRO 75 2HB PRO 75 3.192 8.889 23.926 1479 HB3 PRO 75 3HB PRO 75 2.281 10.416 23.910 1480 HG2 PRO 75 2HG PRO 75 1.714 8.582 25.737 1481 HG3 PRO 75 3HG PRO 75 0.404 9.481 24.934 1482 HD2 PRO 75 2HD PRO 75 1.328 6.662 24.438 1483 HD3 PRO 75 3HD PRO 75 -0.322 7.324 24.460 1484 H TYR 76 H TYR 76 3.066 6.902 22.078 1485 HA TYR 76 HA TYR 76 5.177 7.809 20.491 1486 HB2 TYR 76 2HB TYR 76 5.450 5.661 21.529 1487 HB3 TYR 76 3HB TYR 76 3.960 5.041 20.826 1488 HD1 TYR 76 HD1 TYR 76 7.252 6.460 19.650 1489 HD2 TYR 76 HD2 TYR 76 4.205 3.527 19.005 1490 HE1 TYR 76 HE1 TYR 76 8.510 5.580 17.739 1491 HE2 TYR 76 HE2 TYR 76 5.469 2.640 17.089 1492 HH TYR 76 HH TYR 76 8.703 3.516 16.439 1493 H ASP 77 H ASP 77 2.178 6.180 19.506 1494 HA ASP 77 HA ASP 77 2.852 6.052 16.737 1495 HB2 ASP 77 2HB ASP 77 0.140 5.633 18.076 1496 HB3 ASP 77 3HB ASP 77 0.602 5.086 16.464 1497 H ARG 78 H ARG 78 1.104 8.323 18.727 1498 HA ARG 78 HA ARG 78 -0.187 9.801 16.650 1499 HB2 ARG 78 2HB ARG 78 -0.957 9.826 19.019 1500 HB3 ARG 78 3HB ARG 78 0.529 10.649 19.492 1501 HG2 ARG 78 2HG ARG 78 -0.112 12.595 18.086 1502 HG3 ARG 78 3HG ARG 78 -1.601 11.763 17.632 1503 HD2 ARG 78 2HD ARG 78 -2.315 11.767 20.006 1504 HD3 ARG 78 3HD ARG 78 -0.827 12.617 20.445 1505 HE ARG 78 HE ARG 78 -2.626 13.839 18.473 1506 HH11 ARG 78 1HH1 ARG 78 -1.338 13.925 21.758 1507 HH12 ARG 78 2HH1 ARG 78 -1.893 15.536 22.055 1508 HH21 ARG 78 1HH2 ARG 78 -3.324 15.947 18.881 1509 HH22 ARG 78 2HH2 ARG 78 -3.027 16.686 20.416 1510 H ASP 79 H ASP 79 2.750 10.395 18.609 1511 HA ASP 79 HA ASP 79 3.567 12.728 17.153 1512 HB2 ASP 79 2HB ASP 79 4.965 10.973 19.205 1513 HB3 ASP 79 3HB ASP 79 5.794 12.323 18.435 1514 H PHE 80 H PHE 80 4.034 9.329 16.704 1515 HA PHE 80 HA PHE 80 6.254 9.210 14.999 1516 HB2 PHE 80 2HB PHE 80 5.114 7.210 15.960 1517 HB3 PHE 80 3HB PHE 80 3.698 7.526 14.968 1518 HD1 PHE 80 HD1 PHE 80 3.745 7.075 12.529 1519 HD2 PHE 80 HD2 PHE 80 7.126 6.249 15.014 1520 HE1 PHE 80 HE1 PHE 80 4.730 5.727 10.743 1521 HE2 PHE 80 HE2 PHE 80 8.096 4.907 13.221 1522 HZ PHE 80 HZ PHE 80 6.913 4.640 11.080 1523 H CYS 81 H CYS 81 2.827 9.772 14.338 1524 HA CYS 81 HA CYS 81 3.025 9.994 11.506 1525 HB2 CYS 81 2HB CYS 81 0.842 10.900 13.416 1526 HB3 CYS 81 3HB CYS 81 0.676 10.755 11.668 1527 HG CYS 81 HG CYS 81 1.591 8.005 13.456 1528 H LYS 82 H LYS 82 3.668 12.202 14.094 1529 HA LYS 82 HA LYS 82 3.317 14.634 12.566 1530 HB2 LYS 82 2HB LYS 82 4.705 14.186 15.240 1531 HB3 LYS 82 3HB LYS 82 4.369 15.759 14.512 1532 HG2 LYS 82 2HG LYS 82 1.926 15.247 14.622 1533 HG3 LYS 82 3HG LYS 82 2.314 13.734 15.457 1534 HD2 LYS 82 2HD LYS 82 3.402 15.036 17.283 1535 HD3 LYS 82 3HD LYS 82 2.988 16.539 16.450 1536 HE2 LYS 82 2HE LYS 82 0.570 15.918 16.671 1537 HE3 LYS 82 3HE LYS 82 1.061 14.514 17.626 1538 HZ1 LYS 82 1HZ LYS 82 1.582 17.358 18.317 1539 HZ2 LYS 82 2HZ LYS 82 2.089 16.021 19.215 1540 HZ3 LYS 82 3HZ LYS 82 0.441 16.347 19.051 1541 H VAL 83 H VAL 83 4.604 13.840 10.777 1542 HA VAL 83 HA VAL 83 7.482 14.561 11.046 1543 HB VAL 83 HB VAL 83 7.891 13.032 9.064 1544 HG11 VAL 83 1HG1 VAL 83 7.892 10.908 10.332 1545 HG12 VAL 83 2HG1 VAL 83 6.825 11.621 11.547 1546 HG13 VAL 83 3HG1 VAL 83 8.458 12.253 11.327 1547 HG21 VAL 83 1HG2 VAL 83 5.061 12.043 9.608 1548 HG22 VAL 83 2HG2 VAL 83 6.219 11.296 8.501 1549 HG23 VAL 83 3HG2 VAL 83 5.604 12.914 8.170 1550 H ASP 84 H ASP 84 8.326 15.295 8.761 1551 HA ASP 84 HA ASP 84 6.780 17.481 7.787 1552 HB2 ASP 84 2HB ASP 84 9.122 16.092 6.399 1553 HB3 ASP 84 3HB ASP 84 8.513 17.702 6.034 1554 H GLN 85 H GLN 85 5.926 17.724 5.568 1555 HA GLN 85 HA GLN 85 4.187 15.634 4.847 1556 HB2 GLN 85 2HB GLN 85 3.703 18.025 4.400 1557 HB3 GLN 85 3HB GLN 85 4.949 18.040 3.159 1558 HG2 GLN 85 2HG GLN 85 2.723 17.875 2.164 1559 HG3 GLN 85 3HG GLN 85 3.665 16.430 1.810 1560 HE21 GLN 85 1HE2 GLN 85 3.037 14.454 2.778 1561 HE22 GLN 85 2HE2 GLN 85 1.485 14.251 3.499 1562 HA PRO 86 HA PRO 86 7.406 14.526 1.219 1563 HB2 PRO 86 2HB PRO 86 10.063 14.992 2.021 1564 HB3 PRO 86 3HB PRO 86 9.157 16.014 0.885 1565 HG2 PRO 86 2HG PRO 86 9.571 16.385 3.835 1566 HG3 PRO 86 3HG PRO 86 9.678 17.587 2.522 1567 HD2 PRO 86 2HD PRO 86 7.497 17.483 4.045 1568 HD3 PRO 86 3HD PRO 86 7.333 17.741 2.297 1569 H THR 87 H THR 87 8.503 14.550 4.617 1570 HA THR 87 HA THR 87 9.649 11.963 4.668 1571 HB THR 87 HB THR 87 8.553 13.542 7.035 1572 HG1 THR 87 HG1 THR 87 11.244 13.751 6.380 1573 HG21 THR 87 1HG2 THR 87 10.351 12.422 8.313 1574 HG22 THR 87 2HG2 THR 87 10.837 11.529 6.872 1575 HG23 THR 87 3HG2 THR 87 9.259 11.230 7.606 1576 H LEU 88 H LEU 88 6.387 13.126 5.130 1577 HA LEU 88 HA LEU 88 5.219 10.859 6.380 1578 HB2 LEU 88 2HB LEU 88 4.342 13.276 6.245 1579 HB3 LEU 88 3HB LEU 88 3.815 12.912 4.617 1580 HG LEU 88 HG LEU 88 2.801 11.340 7.028 1581 HD11 LEU 88 1HD1 LEU 88 0.819 12.785 7.067 1582 HD12 LEU 88 2HD1 LEU 88 1.537 13.825 5.831 1583 HD13 LEU 88 3HD1 LEU 88 2.286 13.697 7.426 1584 HD21 LEU 88 1HD2 LEU 88 1.610 11.737 4.259 1585 HD22 LEU 88 2HD2 LEU 88 0.881 10.813 5.577 1586 HD23 LEU 88 3HD2 LEU 88 2.392 10.269 4.856 1587 H PHE 89 H PHE 89 5.474 11.976 3.007 1588 HA PHE 89 HA PHE 89 4.263 9.686 1.837 1589 HB2 PHE 89 2HB PHE 89 6.056 11.834 0.650 1590 HB3 PHE 89 3HB PHE 89 5.329 10.550 -0.316 1591 HD1 PHE 89 HD1 PHE 89 2.733 10.940 1.814 1592 HD2 PHE 89 HD2 PHE 89 4.816 13.293 -1.092 1593 HE1 PHE 89 HE1 PHE 89 0.733 12.309 1.481 1594 HE2 PHE 89 HE2 PHE 89 2.807 14.651 -1.413 1595 HZ PHE 89 HZ PHE 89 0.769 14.172 -0.128 1596 H GLU 90 H GLU 90 7.580 10.420 2.812 1597 HA GLU 90 HA GLU 90 8.899 8.244 1.591 1598 HB2 GLU 90 2HB GLU 90 9.475 9.749 4.164 1599 HB3 GLU 90 3HB GLU 90 10.536 8.481 3.562 1600 HG2 GLU 90 2HG GLU 90 9.856 11.040 2.084 1601 HG3 GLU 90 3HG GLU 90 11.324 10.762 3.017 1602 H LEU 91 H LEU 91 7.167 8.493 4.704 1603 HA LEU 91 HA LEU 91 7.632 5.838 5.592 1604 HB2 LEU 91 2HB LEU 91 5.341 7.735 6.242 1605 HB3 LEU 91 3HB LEU 91 5.653 6.230 7.094 1606 HG LEU 91 HG LEU 91 7.509 8.651 7.061 1607 HD11 LEU 91 1HD1 LEU 91 5.742 7.604 9.297 1608 HD12 LEU 91 2HD1 LEU 91 5.465 9.068 8.349 1609 HD13 LEU 91 3HD1 LEU 91 6.873 8.960 9.401 1610 HD21 LEU 91 1HD2 LEU 91 7.758 6.056 8.620 1611 HD22 LEU 91 2HD2 LEU 91 8.807 7.470 8.778 1612 HD23 LEU 91 3HD2 LEU 91 8.777 6.563 7.269 1613 H ILE 92 H ILE 92 4.993 7.312 3.685 1614 HA ILE 92 HA ILE 92 3.354 5.051 3.303 1615 HB ILE 92 HB ILE 92 3.777 7.500 1.524 1616 HG12 ILE 92 2HG1 ILE 92 1.578 6.815 3.533 1617 HG13 ILE 92 3HG1 ILE 92 2.825 8.041 3.727 1618 HG21 ILE 92 1HG2 ILE 92 1.674 6.927 0.351 1619 HG22 ILE 92 2HG2 ILE 92 1.586 5.407 1.248 1620 HG23 ILE 92 3HG2 ILE 92 2.905 5.687 0.110 1621 HD11 ILE 92 1HD1 ILE 92 0.716 9.067 3.200 1622 HD12 ILE 92 2HD1 ILE 92 0.552 8.095 1.739 1623 HD13 ILE 92 3HD1 ILE 92 1.830 9.309 1.854 1624 H LEU 93 H LEU 93 6.179 6.226 1.492 1625 HA LEU 93 HA LEU 93 6.015 4.299 -0.627 1626 HB2 LEU 93 2HB LEU 93 8.227 6.213 0.197 1627 HB3 LEU 93 3HB LEU 93 8.345 5.163 -1.207 1628 HG LEU 93 HG LEU 93 6.230 7.326 -0.850 1629 HD11 LEU 93 1HD1 LEU 93 7.476 8.626 -2.494 1630 HD12 LEU 93 2HD1 LEU 93 8.737 7.391 -2.544 1631 HD13 LEU 93 3HD1 LEU 93 8.454 8.309 -1.061 1632 HD21 LEU 93 1HD2 LEU 93 5.444 5.505 -2.283 1633 HD22 LEU 93 2HD2 LEU 93 6.898 5.627 -3.278 1634 HD23 LEU 93 3HD2 LEU 93 5.739 6.959 -3.233 1635 H ALA 94 H ALA 94 7.594 4.425 2.503 1636 HA ALA 94 HA ALA 94 9.363 2.211 2.148 1637 HB1 ALA 94 1HB ALA 94 9.520 2.216 4.613 1638 HB2 ALA 94 2HB ALA 94 8.167 3.349 4.700 1639 HB3 ALA 94 3HB ALA 94 9.686 3.846 3.953 1640 H ALA 95 H ALA 95 6.092 2.564 3.505 1641 HA ALA 95 HA ALA 95 5.649 -0.208 4.048 1642 HB1 ALA 95 1HB ALA 95 3.652 2.048 3.706 1643 HB2 ALA 95 2HB ALA 95 4.419 1.558 5.218 1644 HB3 ALA 95 3HB ALA 95 3.309 0.460 4.399 1645 H ASN 96 H ASN 96 5.213 1.828 1.253 1646 HA ASN 96 HA ASN 96 3.580 0.129 -0.367 1647 HB2 ASN 96 2HB ASN 96 3.994 2.640 -0.638 1648 HB3 ASN 96 3HB ASN 96 5.591 2.259 -1.252 1649 HD21 ASN 96 1HD2 ASN 96 3.560 3.758 -2.544 1650 HD22 ASN 96 2HD2 ASN 96 3.154 2.942 -4.009 1651 H TYR 97 H TYR 97 7.063 0.627 0.011 1652 HA TYR 97 HA TYR 97 7.947 -1.278 -1.953 1653 HB2 TYR 97 2HB TYR 97 9.396 0.583 -1.471 1654 HB3 TYR 97 3HB TYR 97 9.334 0.290 0.259 1655 HD1 TYR 97 HD1 TYR 97 11.306 -0.576 1.201 1656 HD2 TYR 97 HD2 TYR 97 10.405 -1.583 -2.859 1657 HE1 TYR 97 HE1 TYR 97 13.412 -1.826 1.048 1658 HE2 TYR 97 HE2 TYR 97 12.512 -2.841 -3.007 1659 HH TYR 97 HH TYR 97 14.360 -3.687 -0.303 1660 H LEU 98 H LEU 98 7.294 -1.407 1.517 1661 HA LEU 98 HA LEU 98 8.526 -4.085 1.746 1662 HB2 LEU 98 2HB LEU 98 7.671 -2.095 3.880 1663 HB3 LEU 98 3HB LEU 98 8.333 -3.686 4.226 1664 HG LEU 98 HG LEU 98 9.815 -1.425 2.818 1665 HD11 LEU 98 1HD1 LEU 98 10.193 -2.548 5.613 1666 HD12 LEU 98 2HD1 LEU 98 9.524 -0.967 5.199 1667 HD13 LEU 98 3HD1 LEU 98 11.209 -1.327 4.835 1668 HD21 LEU 98 1HD2 LEU 98 10.779 -4.194 3.588 1669 HD22 LEU 98 2HD2 LEU 98 11.796 -2.884 2.984 1670 HD23 LEU 98 3HD2 LEU 98 10.548 -3.570 1.951 1671 H ASP 99 H ASP 99 5.517 -2.813 1.168 1672 HA ASP 99 HA ASP 99 3.358 -3.450 1.304 1673 HB2 ASP 99 2HB ASP 99 4.690 -6.175 1.396 1674 HB3 ASP 99 3HB ASP 99 2.943 -5.993 1.283 1675 H ILE 100 H ILE 100 4.625 -2.740 3.806 1676 HA ILE 100 HA ILE 100 3.466 -4.398 5.878 1677 HB ILE 100 HB ILE 100 4.760 -1.640 6.091 1678 HG12 ILE 100 2HG1 ILE 100 5.878 -4.428 6.631 1679 HG13 ILE 100 3HG1 ILE 100 6.321 -3.379 5.294 1680 HG21 ILE 100 1HG2 ILE 100 3.219 -2.056 7.983 1681 HG22 ILE 100 2HG2 ILE 100 4.895 -2.050 8.521 1682 HG23 ILE 100 3HG2 ILE 100 4.037 -3.581 8.332 1683 HD11 ILE 100 1HD1 ILE 100 6.882 -2.849 8.212 1684 HD12 ILE 100 2HD1 ILE 100 7.328 -1.803 6.861 1685 HD13 ILE 100 3HD1 ILE 100 8.033 -3.411 7.000 1686 H LYS 101 H LYS 101 1.319 -4.467 5.568 1687 HA LYS 101 HA LYS 101 -0.444 -2.434 4.893 1688 HB2 LYS 101 2HB LYS 101 -0.954 -4.978 6.464 1689 HB3 LYS 101 3HB LYS 101 -2.231 -3.929 5.851 1690 HG2 LYS 101 2HG LYS 101 -1.489 -4.346 3.541 1691 HG3 LYS 101 3HG LYS 101 -0.176 -5.369 4.131 1692 HD2 LYS 101 2HD LYS 101 -2.112 -6.682 3.292 1693 HD3 LYS 101 3HD LYS 101 -1.776 -6.992 4.999 1694 HE2 LYS 101 2HE LYS 101 -4.203 -6.786 4.533 1695 HE3 LYS 101 3HE LYS 101 -3.645 -5.551 5.660 1696 HZ1 LYS 101 1HZ LYS 101 -3.548 -3.996 3.770 1697 HZ2 LYS 101 2HZ LYS 101 -5.109 -4.572 4.045 1698 HZ3 LYS 101 3HZ LYS 101 -4.193 -5.185 2.767 1699 HA PRO 102 HA PRO 102 -1.123 -1.730 9.877 1700 HB2 PRO 102 2HB PRO 102 1.851 -2.010 10.426 1701 HB3 PRO 102 3HB PRO 102 0.471 -2.254 11.525 1702 HG2 PRO 102 2HG PRO 102 1.678 -4.362 10.488 1703 HG3 PRO 102 3HG PRO 102 -0.098 -4.319 10.588 1704 HD2 PRO 102 2HD PRO 102 1.655 -3.940 8.180 1705 HD3 PRO 102 3HD PRO 102 0.069 -4.722 8.312 1706 H LEU 103 H LEU 103 2.010 -0.832 8.386 1707 HA LEU 103 HA LEU 103 1.951 1.851 9.423 1708 HB2 LEU 103 2HB LEU 103 4.021 0.386 8.966 1709 HB3 LEU 103 3HB LEU 103 3.811 0.756 7.271 1710 HG LEU 103 HG LEU 103 5.592 2.094 8.542 1711 HD11 LEU 103 1HD1 LEU 103 5.166 4.244 7.462 1712 HD12 LEU 103 2HD1 LEU 103 3.510 3.747 7.105 1713 HD13 LEU 103 3HD1 LEU 103 4.869 2.893 6.375 1714 HD21 LEU 103 1HD2 LEU 103 4.342 2.464 10.595 1715 HD22 LEU 103 2HD2 LEU 103 3.191 3.494 9.737 1716 HD23 LEU 103 3HD2 LEU 103 4.878 3.986 9.894 1717 H LEU 104 H LEU 104 1.347 0.313 6.289 1718 HA LEU 104 HA LEU 104 1.103 2.602 4.653 1719 HB2 LEU 104 2HB LEU 104 1.353 0.261 3.808 1720 HB3 LEU 104 3HB LEU 104 -0.265 -0.107 4.382 1721 HG LEU 104 HG LEU 104 -1.144 1.657 2.752 1722 HD11 LEU 104 1HD1 LEU 104 0.897 2.941 2.429 1723 HD12 LEU 104 2HD1 LEU 104 0.311 2.325 0.886 1724 HD13 LEU 104 3HD1 LEU 104 1.687 1.551 1.679 1725 HD21 LEU 104 1HD2 LEU 104 -1.305 -0.743 2.287 1726 HD22 LEU 104 2HD2 LEU 104 0.302 -0.724 1.555 1727 HD23 LEU 104 3HD2 LEU 104 -1.023 0.173 0.806 1728 H ASP 105 H ASP 105 -1.303 0.690 6.422 1729 HA ASP 105 HA ASP 105 -3.646 1.977 5.602 1730 HB2 ASP 105 2HB ASP 105 -3.669 -0.207 6.712 1731 HB3 ASP 105 3HB ASP 105 -3.027 0.493 8.192 1732 H VAL 106 H VAL 106 -1.659 2.489 8.507 1733 HA VAL 106 HA VAL 106 -3.313 4.500 9.646 1734 HB VAL 106 HB VAL 106 -0.458 3.622 10.232 1735 HG11 VAL 106 1HG1 VAL 106 -0.698 5.933 11.039 1736 HG12 VAL 106 2HG1 VAL 106 -0.625 4.810 12.398 1737 HG13 VAL 106 3HG1 VAL 106 -2.176 5.496 11.903 1738 HG21 VAL 106 1HG2 VAL 106 -1.489 2.461 12.166 1739 HG22 VAL 106 2HG2 VAL 106 -2.185 1.909 10.641 1740 HG23 VAL 106 3HG2 VAL 106 -3.080 3.036 11.661 1741 H THR 107 H THR 107 -0.180 4.745 7.871 1742 HA THR 107 HA THR 107 0.125 7.544 8.355 1743 HB THR 107 HB THR 107 1.541 5.824 6.269 1744 HG1 THR 107 HG1 THR 107 2.120 4.904 8.140 1745 HG21 THR 107 1HG2 THR 107 1.894 8.249 5.882 1746 HG22 THR 107 2HG2 THR 107 3.373 7.470 6.446 1747 HG23 THR 107 3HG2 THR 107 2.408 8.441 7.560 1748 H CYS 108 H CYS 108 -1.092 5.709 5.529 1749 HA CYS 108 HA CYS 108 -1.522 7.990 3.846 1750 HB2 CYS 108 2HB CYS 108 -2.785 5.229 3.717 1751 HB3 CYS 108 3HB CYS 108 -2.851 6.442 2.438 1752 HG CYS 108 HG CYS 108 -0.421 4.296 3.226 1753 H LYS 109 H LYS 109 -3.423 6.346 6.291 1754 HA LYS 109 HA LYS 109 -5.940 7.621 5.750 1755 HB2 LYS 109 2HB LYS 109 -5.613 5.408 6.880 1756 HB3 LYS 109 3HB LYS 109 -4.970 6.245 8.281 1757 HG2 LYS 109 2HG LYS 109 -7.126 7.239 8.760 1758 HG3 LYS 109 3HG LYS 109 -7.791 6.653 7.229 1759 HD2 LYS 109 2HD LYS 109 -6.829 4.890 9.524 1760 HD3 LYS 109 3HD LYS 109 -8.518 5.238 9.143 1761 HE2 LYS 109 2HE LYS 109 -8.307 4.084 6.997 1762 HE3 LYS 109 3HE LYS 109 -6.580 3.840 7.257 1763 HZ1 LYS 109 1HZ LYS 109 -7.800 1.849 7.741 1764 HZ2 LYS 109 2HZ LYS 109 -8.764 2.649 8.876 1765 HZ3 LYS 109 3HZ LYS 109 -7.109 2.449 9.160 1766 H THR 110 H THR 110 -3.115 8.327 7.750 1767 HA THR 110 HA THR 110 -4.269 10.370 9.369 1768 HB THR 110 HB THR 110 -1.348 9.796 8.697 1769 HG1 THR 110 HG1 THR 110 -2.859 8.303 10.021 1770 HG21 THR 110 1HG2 THR 110 -2.468 11.594 10.883 1771 HG22 THR 110 2HG2 THR 110 -1.580 12.142 9.461 1772 HG23 THR 110 3HG2 THR 110 -0.773 11.162 10.683 1773 H VAL 111 H VAL 111 -2.297 10.457 6.352 1774 HA VAL 111 HA VAL 111 -2.283 13.281 6.097 1775 HB VAL 111 HB VAL 111 -0.757 11.648 4.867 1776 HG11 VAL 111 1HG1 VAL 111 -2.397 10.142 3.893 1777 HG12 VAL 111 2HG1 VAL 111 -1.369 10.847 2.646 1778 HG13 VAL 111 3HG1 VAL 111 -3.014 11.448 2.879 1779 HG21 VAL 111 1HG2 VAL 111 -0.637 14.032 4.425 1780 HG22 VAL 111 2HG2 VAL 111 -1.954 13.907 3.256 1781 HG23 VAL 111 3HG2 VAL 111 -0.403 13.127 2.926 1782 H ALA 112 H ALA 112 -4.563 10.792 5.087 1783 HA ALA 112 HA ALA 112 -6.386 12.402 3.653 1784 HB1 ALA 112 1HB ALA 112 -6.920 9.900 5.284 1785 HB2 ALA 112 2HB ALA 112 -6.438 9.946 3.587 1786 HB3 ALA 112 3HB ALA 112 -8.004 10.597 4.075 1787 H ASN 113 H ASN 113 -6.212 11.537 7.140 1788 HA ASN 113 HA ASN 113 -8.552 12.851 8.001 1789 HB2 ASN 113 2HB ASN 113 -6.002 12.284 9.580 1790 HB3 ASN 113 3HB ASN 113 -7.506 12.843 10.305 1791 HD21 ASN 113 1HD2 ASN 113 -5.979 10.399 10.786 1792 HD22 ASN 113 2HD2 ASN 113 -7.070 9.090 10.499 1793 H MET 114 H MET 114 -5.292 14.073 7.426 1794 HA MET 114 HA MET 114 -5.553 16.554 8.796 1795 HB2 MET 114 2HB MET 114 -3.649 15.824 6.532 1796 HB3 MET 114 3HB MET 114 -3.522 17.264 7.538 1797 HG2 MET 114 2HG MET 114 -3.300 15.683 9.531 1798 HG3 MET 114 3HG MET 114 -3.084 14.388 8.353 1799 HE1 MET 114 1HE MET 114 -1.502 16.511 6.124 1800 HE2 MET 114 2HE MET 114 -1.145 14.791 6.279 1801 HE3 MET 114 3HE MET 114 0.148 15.978 6.448 1802 H ILE 115 H ILE 115 -6.025 15.615 5.374 1803 HA ILE 115 HA ILE 115 -6.704 18.299 4.524 1804 HB ILE 115 HB ILE 115 -7.271 17.351 2.334 1805 HG12 ILE 115 2HG1 ILE 115 -6.856 14.581 3.554 1806 HG13 ILE 115 3HG1 ILE 115 -8.420 15.273 3.149 1807 HG21 ILE 115 1HG2 ILE 115 -4.743 16.065 3.438 1808 HG22 ILE 115 2HG2 ILE 115 -4.890 17.715 2.831 1809 HG23 ILE 115 3HG2 ILE 115 -5.094 16.353 1.728 1810 HD11 ILE 115 1HD1 ILE 115 -7.705 13.686 1.483 1811 HD12 ILE 115 2HD1 ILE 115 -6.232 14.607 1.186 1812 HD13 ILE 115 3HD1 ILE 115 -7.808 15.303 0.792 1813 H ARG 116 H ARG 116 -8.468 15.515 5.730 1814 HA ARG 116 HA ARG 116 -11.094 16.496 5.029 1815 HB2 ARG 116 2HB ARG 116 -10.232 14.270 6.930 1816 HB3 ARG 116 3HB ARG 116 -11.902 14.619 6.498 1817 HG2 ARG 116 2HG ARG 116 -9.765 13.803 4.494 1818 HG3 ARG 116 3HG ARG 116 -10.884 12.679 5.266 1819 HD2 ARG 116 2HD ARG 116 -11.753 15.030 3.555 1820 HD3 ARG 116 3HD ARG 116 -11.543 13.386 2.950 1821 HE ARG 116 HE ARG 116 -13.661 14.364 4.715 1822 HH11 ARG 116 1HH1 ARG 116 -12.195 11.566 3.124 1823 HH12 ARG 116 2HH1 ARG 116 -13.597 10.567 3.329 1824 HH21 ARG 116 1HH2 ARG 116 -15.499 13.034 4.940 1825 HH22 ARG 116 2HH2 ARG 116 -15.465 11.402 4.352 1826 H GLY 117 H GLY 117 -11.118 18.576 5.874 1827 HA2 GLY 117 2HA GLY 117 -11.716 18.727 8.782 1828 HA3 GLY 117 3HA GLY 117 -10.730 19.954 7.988 Start of MODEL 8 1 H1 SER 2 1H SER 2 -17.728 -14.005 -17.507 2 H2 SER 2 2H SER 2 -18.262 -13.024 -18.778 3 H3 SER 2 3H SER 2 -18.953 -14.545 -18.533 4 HA SER 2 HA SER 2 -20.387 -12.763 -17.805 5 HB2 SER 2 2HB SER 2 -19.338 -14.513 -15.538 6 HB3 SER 2 3HB SER 2 -20.923 -13.736 -15.603 7 HG SER 2 HG SER 2 -20.615 -16.070 -16.324 8 H LEU 3 H LEU 3 -20.722 -10.956 -16.579 9 HA LEU 3 HA LEU 3 -18.392 -9.505 -15.604 10 HB2 LEU 3 2HB LEU 3 -21.311 -8.667 -15.829 11 HB3 LEU 3 3HB LEU 3 -19.968 -7.604 -15.445 12 HG LEU 3 HG LEU 3 -20.379 -9.020 -18.107 13 HD11 LEU 3 1HD1 LEU 3 -20.754 -6.101 -17.371 14 HD12 LEU 3 2HD1 LEU 3 -22.031 -7.262 -17.741 15 HD13 LEU 3 3HD1 LEU 3 -20.889 -6.789 -18.993 16 HD21 LEU 3 1HD2 LEU 3 -18.250 -7.016 -17.284 17 HD22 LEU 3 2HD2 LEU 3 -18.524 -7.605 -18.926 18 HD23 LEU 3 3HD2 LEU 3 -17.998 -8.721 -17.669 19 H VAL 4 H VAL 4 -17.820 -9.713 -13.498 20 HA VAL 4 HA VAL 4 -19.673 -10.553 -11.430 21 HB VAL 4 HB VAL 4 -17.673 -10.045 -9.839 22 HG11 VAL 4 1HG1 VAL 4 -16.531 -12.156 -10.435 23 HG12 VAL 4 2HG1 VAL 4 -17.344 -12.159 -12.002 24 HG13 VAL 4 3HG1 VAL 4 -18.287 -12.322 -10.519 25 HG21 VAL 4 1HG2 VAL 4 -16.193 -9.844 -12.494 26 HG22 VAL 4 2HG2 VAL 4 -15.437 -9.946 -10.902 27 HG23 VAL 4 3HG2 VAL 4 -16.410 -8.539 -11.326 28 H LYS 5 H LYS 5 -20.794 -9.327 -10.118 29 HA LYS 5 HA LYS 5 -21.116 -6.522 -10.713 30 HB2 LYS 5 2HB LYS 5 -22.584 -8.380 -8.790 31 HB3 LYS 5 3HB LYS 5 -23.087 -6.737 -9.174 32 HG2 LYS 5 2HG LYS 5 -23.528 -7.357 -11.491 33 HG3 LYS 5 3HG LYS 5 -22.884 -8.981 -11.215 34 HD2 LYS 5 2HD LYS 5 -24.719 -9.455 -9.627 35 HD3 LYS 5 3HD LYS 5 -25.348 -7.819 -9.846 36 HE2 LYS 5 2HE LYS 5 -25.104 -9.846 -12.091 37 HE3 LYS 5 3HE LYS 5 -26.566 -9.599 -11.142 38 HZ1 LYS 5 1HZ LYS 5 -25.240 -7.461 -12.702 39 HZ2 LYS 5 2HZ LYS 5 -26.757 -7.395 -11.961 40 HZ3 LYS 5 3HZ LYS 5 -26.513 -8.402 -13.294 41 H LEU 6 H LEU 6 -19.264 -5.494 -9.874 42 HA LEU 6 HA LEU 6 -18.637 -5.695 -7.010 43 HB2 LEU 6 2HB LEU 6 -17.273 -4.463 -9.401 44 HB3 LEU 6 3HB LEU 6 -16.909 -3.805 -7.816 45 HG LEU 6 HG LEU 6 -16.120 -6.005 -7.048 46 HD11 LEU 6 1HD1 LEU 6 -17.495 -7.494 -8.405 47 HD12 LEU 6 2HD1 LEU 6 -15.785 -7.882 -8.581 48 HD13 LEU 6 3HD1 LEU 6 -16.625 -6.997 -9.859 49 HD21 LEU 6 1HD2 LEU 6 -14.511 -4.449 -7.991 50 HD22 LEU 6 2HD2 LEU 6 -14.804 -5.088 -9.611 51 HD23 LEU 6 3HD2 LEU 6 -14.061 -6.110 -8.378 52 H GLU 7 H GLU 7 -20.445 -4.809 -6.067 53 HA GLU 7 HA GLU 7 -21.356 -2.137 -6.691 54 HB2 GLU 7 2HB GLU 7 -22.928 -3.831 -5.807 55 HB3 GLU 7 3HB GLU 7 -22.007 -3.937 -4.305 56 HG2 GLU 7 2HG GLU 7 -22.517 -1.579 -3.805 57 HG3 GLU 7 3HG GLU 7 -23.400 -1.427 -5.319 58 H SER 8 H SER 8 -20.486 -0.325 -5.935 59 HA SER 8 HA SER 8 -18.267 -0.241 -4.083 60 HB2 SER 8 2HB SER 8 -18.388 2.239 -4.603 61 HB3 SER 8 3HB SER 8 -18.275 1.227 -6.041 62 HG SER 8 HG SER 8 -20.258 1.745 -6.601 63 H SER 9 H SER 9 -18.348 1.555 -2.358 64 HA SER 9 HA SER 9 -20.387 1.120 -0.440 65 HB2 SER 9 2HB SER 9 -19.276 3.009 0.798 66 HB3 SER 9 3HB SER 9 -18.141 1.775 0.252 67 HG SER 9 HG SER 9 -18.148 4.381 -0.288 68 H ASP 10 H ASP 10 -20.143 3.308 -3.119 69 HA ASP 10 HA ASP 10 -22.340 5.042 -2.276 70 HB2 ASP 10 2HB ASP 10 -20.332 5.893 -3.555 71 HB3 ASP 10 3HB ASP 10 -20.843 4.929 -4.932 72 H GLU 11 H GLU 11 -22.406 1.976 -3.041 73 HA GLU 11 HA GLU 11 -24.023 0.498 -3.549 74 HB2 GLU 11 2HB GLU 11 -25.769 2.970 -3.816 75 HB3 GLU 11 3HB GLU 11 -26.389 1.324 -3.871 76 HG2 GLU 11 2HG GLU 11 -25.651 0.945 -1.557 77 HG3 GLU 11 3HG GLU 11 -24.954 2.565 -1.501 78 H LYS 12 H LYS 12 -22.472 2.113 -5.757 79 HA LYS 12 HA LYS 12 -24.187 1.661 -8.095 80 HB2 LYS 12 2HB LYS 12 -21.373 2.826 -7.922 81 HB3 LYS 12 3HB LYS 12 -22.371 2.770 -9.371 82 HG2 LYS 12 2HG LYS 12 -22.988 4.333 -6.847 83 HG3 LYS 12 3HG LYS 12 -22.382 5.003 -8.365 84 HD2 LYS 12 2HD LYS 12 -24.462 4.312 -9.506 85 HD3 LYS 12 3HD LYS 12 -25.065 3.617 -7.997 86 HE2 LYS 12 2HE LYS 12 -24.439 6.556 -8.467 87 HE3 LYS 12 3HE LYS 12 -26.047 5.838 -8.415 88 HZ1 LYS 12 1HZ LYS 12 -25.638 5.210 -6.107 89 HZ2 LYS 12 2HZ LYS 12 -25.517 6.880 -6.325 90 HZ3 LYS 12 3HZ LYS 12 -24.117 5.946 -6.158 91 H VAL 13 H VAL 13 -24.072 -0.132 -9.278 92 HA VAL 13 HA VAL 13 -22.219 -2.252 -8.488 93 HB VAL 13 HB VAL 13 -24.682 -2.364 -10.301 94 HG11 VAL 13 1HG1 VAL 13 -23.108 -4.624 -9.013 95 HG12 VAL 13 2HG1 VAL 13 -23.122 -4.214 -10.729 96 HG13 VAL 13 3HG1 VAL 13 -24.592 -4.803 -9.955 97 HG21 VAL 13 1HG2 VAL 13 -25.291 -1.672 -8.005 98 HG22 VAL 13 2HG2 VAL 13 -24.459 -3.083 -7.346 99 HG23 VAL 13 3HG2 VAL 13 -25.889 -3.296 -8.359 100 H PHE 14 H PHE 14 -20.294 -1.882 -9.535 101 HA PHE 14 HA PHE 14 -20.182 -1.392 -12.423 102 HB2 PHE 14 2HB PHE 14 -17.966 -1.634 -10.333 103 HB3 PHE 14 3HB PHE 14 -17.710 -1.246 -12.034 104 HD1 PHE 14 HD1 PHE 14 -18.517 0.914 -12.966 105 HD2 PHE 14 HD2 PHE 14 -18.762 0.050 -8.786 106 HE1 PHE 14 HE1 PHE 14 -18.865 3.297 -12.487 107 HE2 PHE 14 HE2 PHE 14 -19.105 2.430 -8.320 108 HZ PHE 14 HZ PHE 14 -19.162 4.054 -10.167 109 H GLU 15 H GLU 15 -20.846 -3.233 -13.349 110 HA GLU 15 HA GLU 15 -19.894 -5.859 -12.646 111 HB2 GLU 15 2HB GLU 15 -21.497 -4.889 -15.043 112 HB3 GLU 15 3HB GLU 15 -21.252 -6.574 -14.591 113 HG2 GLU 15 2HG GLU 15 -22.491 -6.220 -12.503 114 HG3 GLU 15 3HG GLU 15 -22.689 -4.517 -12.898 115 H ILE 16 H ILE 16 -17.633 -5.556 -12.845 116 HA ILE 16 HA ILE 16 -16.415 -5.036 -15.454 117 HB ILE 16 HB ILE 16 -15.315 -4.164 -13.400 118 HG12 ILE 16 2HG1 ILE 16 -13.682 -6.262 -14.910 119 HG13 ILE 16 3HG1 ILE 16 -13.850 -4.561 -15.316 120 HG21 ILE 16 1HG2 ILE 16 -14.242 -5.635 -11.748 121 HG22 ILE 16 2HG2 ILE 16 -14.862 -7.056 -12.589 122 HG23 ILE 16 3HG2 ILE 16 -15.983 -5.934 -11.818 123 HD11 ILE 16 1HD1 ILE 16 -11.694 -4.950 -14.375 124 HD12 ILE 16 2HD1 ILE 16 -12.388 -5.724 -12.953 125 HD13 ILE 16 3HD1 ILE 16 -12.636 -4.000 -13.232 126 H GLU 17 H GLU 17 -15.043 -6.616 -16.518 127 HA GLU 17 HA GLU 17 -16.010 -9.241 -16.737 128 HB2 GLU 17 2HB GLU 17 -13.274 -8.165 -17.557 129 HB3 GLU 17 3HB GLU 17 -13.947 -9.706 -18.070 130 HG2 GLU 17 2HG GLU 17 -14.299 -8.311 -19.916 131 HG3 GLU 17 3HG GLU 17 -15.865 -8.328 -19.120 132 H LYS 18 H LYS 18 -15.391 -11.137 -15.835 133 HA LYS 18 HA LYS 18 -14.648 -11.036 -13.127 134 HB2 LYS 18 2HB LYS 18 -16.276 -12.612 -14.085 135 HB3 LYS 18 3HB LYS 18 -14.995 -13.416 -14.986 136 HG2 LYS 18 2HG LYS 18 -14.013 -14.276 -12.959 137 HG3 LYS 18 3HG LYS 18 -15.083 -13.286 -11.958 138 HD2 LYS 18 2HD LYS 18 -17.041 -14.560 -12.771 139 HD3 LYS 18 3HD LYS 18 -15.989 -15.539 -13.800 140 HE2 LYS 18 2HE LYS 18 -15.792 -15.406 -10.777 141 HE3 LYS 18 3HE LYS 18 -16.640 -16.665 -11.674 142 HZ1 LYS 18 1HZ LYS 18 -13.739 -16.063 -11.881 143 HZ2 LYS 18 2HZ LYS 18 -14.554 -17.286 -12.716 144 HZ3 LYS 18 3HZ LYS 18 -14.420 -17.355 -11.032 145 H GLU 19 H GLU 19 -12.872 -12.097 -15.994 146 HA GLU 19 HA GLU 19 -10.607 -13.206 -14.702 147 HB2 GLU 19 2HB GLU 19 -9.491 -13.018 -16.910 148 HB3 GLU 19 3HB GLU 19 -11.110 -13.691 -17.048 149 HG2 GLU 19 2HG GLU 19 -11.951 -11.469 -17.790 150 HG3 GLU 19 3HG GLU 19 -10.305 -10.837 -17.707 151 H ILE 20 H ILE 20 -11.463 -9.906 -15.488 152 HA ILE 20 HA ILE 20 -8.811 -8.791 -15.094 153 HB ILE 20 HB ILE 20 -11.471 -7.316 -15.370 154 HG12 ILE 20 2HG1 ILE 20 -9.489 -8.198 -17.521 155 HG13 ILE 20 3HG1 ILE 20 -11.160 -8.714 -17.356 156 HG21 ILE 20 1HG2 ILE 20 -10.089 -5.392 -16.050 157 HG22 ILE 20 2HG2 ILE 20 -8.624 -6.340 -15.797 158 HG23 ILE 20 3HG2 ILE 20 -9.660 -5.936 -14.427 159 HD11 ILE 20 1HD1 ILE 20 -10.917 -7.152 -19.171 160 HD12 ILE 20 2HD1 ILE 20 -10.219 -5.945 -18.095 161 HD13 ILE 20 3HD1 ILE 20 -11.904 -6.439 -17.897 162 H ALA 21 H ALA 21 -11.810 -9.106 -13.227 163 HA ALA 21 HA ALA 21 -11.176 -7.446 -11.029 164 HB1 ALA 21 1HB ALA 21 -12.933 -8.671 -9.831 165 HB2 ALA 21 2HB ALA 21 -12.920 -9.927 -11.073 166 HB3 ALA 21 3HB ALA 21 -13.441 -8.292 -11.478 167 H CYS 22 H CYS 22 -10.185 -10.684 -11.844 168 HA CYS 22 HA CYS 22 -9.191 -11.565 -9.354 169 HB2 CYS 22 2HB CYS 22 -8.416 -12.368 -12.173 170 HB3 CYS 22 3HB CYS 22 -8.002 -13.269 -10.711 171 HG CYS 22 HG CYS 22 -11.281 -12.630 -11.127 172 H MET 23 H MET 23 -7.866 -9.328 -11.679 173 HA MET 23 HA MET 23 -5.095 -9.528 -11.087 174 HB2 MET 23 2HB MET 23 -6.726 -7.173 -12.098 175 HB3 MET 23 3HB MET 23 -4.970 -7.183 -12.011 176 HG2 MET 23 2HG MET 23 -4.889 -9.041 -13.617 177 HG3 MET 23 3HG MET 23 -6.654 -9.048 -13.696 178 HE1 MET 23 1HE MET 23 -3.430 -6.800 -14.284 179 HE2 MET 23 2HE MET 23 -4.495 -5.732 -13.363 180 HE3 MET 23 3HE MET 23 -4.155 -5.395 -15.060 181 H SER 24 H SER 24 -7.705 -7.918 -9.427 182 HA SER 24 HA SER 24 -5.997 -6.600 -7.480 183 HB2 SER 24 2HB SER 24 -8.180 -5.616 -7.897 184 HB3 SER 24 3HB SER 24 -8.995 -7.154 -7.591 185 HG SER 24 HG SER 24 -7.473 -5.725 -5.664 186 H VAL 25 H VAL 25 -5.196 -7.562 -5.658 187 HA VAL 25 HA VAL 25 -5.260 -10.362 -5.294 188 HB VAL 25 HB VAL 25 -4.438 -8.251 -3.234 189 HG11 VAL 25 1HG1 VAL 25 -3.718 -11.207 -3.391 190 HG12 VAL 25 2HG1 VAL 25 -4.769 -10.454 -2.190 191 HG13 VAL 25 3HG1 VAL 25 -3.051 -10.053 -2.232 192 HG21 VAL 25 1HG2 VAL 25 -3.188 -7.968 -5.334 193 HG22 VAL 25 2HG2 VAL 25 -2.725 -9.669 -5.305 194 HG23 VAL 25 3HG2 VAL 25 -2.129 -8.571 -4.058 195 H THR 26 H THR 26 -6.783 -7.718 -3.437 196 HA THR 26 HA THR 26 -8.070 -9.288 -1.510 197 HB THR 26 HB THR 26 -8.805 -6.511 -2.524 198 HG1 THR 26 HG1 THR 26 -7.652 -6.025 -0.454 199 HG21 THR 26 1HG2 THR 26 -9.916 -6.185 -0.328 200 HG22 THR 26 2HG2 THR 26 -9.643 -7.882 0.064 201 HG23 THR 26 3HG2 THR 26 -10.717 -7.447 -1.267 202 H ILE 27 H ILE 27 -9.369 -8.006 -4.622 203 HA ILE 27 HA ILE 27 -12.024 -8.972 -4.273 204 HB ILE 27 HB ILE 27 -10.557 -8.322 -6.872 205 HG12 ILE 27 2HG1 ILE 27 -12.515 -6.594 -5.285 206 HG13 ILE 27 3HG1 ILE 27 -10.766 -6.418 -5.221 207 HG21 ILE 27 1HG2 ILE 27 -12.508 -9.761 -7.335 208 HG22 ILE 27 2HG2 ILE 27 -12.803 -8.122 -7.915 209 HG23 ILE 27 3HG2 ILE 27 -13.550 -8.671 -6.414 210 HD11 ILE 27 1HD1 ILE 27 -11.810 -4.760 -6.666 211 HD12 ILE 27 2HD1 ILE 27 -12.454 -6.044 -7.689 212 HD13 ILE 27 3HD1 ILE 27 -10.712 -5.806 -7.561 213 H LYS 28 H LYS 28 -9.162 -10.350 -5.919 214 HA LYS 28 HA LYS 28 -10.268 -12.716 -6.954 215 HB2 LYS 28 2HB LYS 28 -7.995 -11.870 -7.516 216 HB3 LYS 28 3HB LYS 28 -7.452 -12.238 -5.884 217 HG2 LYS 28 2HG LYS 28 -7.924 -14.676 -6.347 218 HG3 LYS 28 3HG LYS 28 -8.302 -14.232 -8.013 219 HD2 LYS 28 2HD LYS 28 -5.999 -15.074 -7.848 220 HD3 LYS 28 3HD LYS 28 -5.998 -13.369 -8.317 221 HE2 LYS 28 2HE LYS 28 -4.253 -13.859 -6.639 222 HE3 LYS 28 3HE LYS 28 -5.441 -12.722 -6.002 223 HZ1 LYS 28 1HZ LYS 28 -4.980 -14.311 -4.327 224 HZ2 LYS 28 2HZ LYS 28 -5.185 -15.613 -5.383 225 HZ3 LYS 28 3HZ LYS 28 -6.519 -14.688 -4.916 226 H ASN 29 H ASN 29 -8.755 -12.040 -3.822 227 HA ASN 29 HA ASN 29 -8.953 -14.643 -2.694 228 HB2 ASN 29 2HB ASN 29 -8.481 -11.890 -1.463 229 HB3 ASN 29 3HB ASN 29 -8.523 -13.361 -0.491 230 HD21 ASN 29 1HD2 ASN 29 -6.350 -12.967 0.139 231 HD22 ASN 29 2HD2 ASN 29 -5.029 -13.282 -0.927 232 H MET 30 H MET 30 -11.130 -11.864 -2.757 233 HA MET 30 HA MET 30 -12.997 -12.751 -0.810 234 HB2 MET 30 2HB MET 30 -13.306 -10.885 -3.201 235 HB3 MET 30 3HB MET 30 -14.656 -11.267 -2.141 236 HG2 MET 30 2HG MET 30 -12.086 -9.930 -1.268 237 HG3 MET 30 3HG MET 30 -13.619 -9.115 -1.580 238 HE1 MET 30 1HE MET 30 -13.326 -8.895 2.339 239 HE2 MET 30 2HE MET 30 -13.532 -7.978 0.845 240 HE3 MET 30 3HE MET 30 -11.997 -8.779 1.190 241 H ILE 31 H ILE 31 -12.894 -13.075 -4.367 242 HA ILE 31 HA ILE 31 -15.235 -14.577 -4.756 243 HB ILE 31 HB ILE 31 -12.675 -14.597 -6.444 244 HG12 ILE 31 2HG1 ILE 31 -15.234 -12.965 -6.819 245 HG13 ILE 31 3HG1 ILE 31 -13.730 -12.330 -6.170 246 HG21 ILE 31 1HG2 ILE 31 -14.098 -15.402 -8.318 247 HG22 ILE 31 2HG2 ILE 31 -15.474 -15.518 -7.221 248 HG23 ILE 31 3HG2 ILE 31 -14.070 -16.559 -6.984 249 HD11 ILE 31 1HD1 ILE 31 -14.155 -13.366 -8.975 250 HD12 ILE 31 2HD1 ILE 31 -12.630 -12.760 -8.323 251 HD13 ILE 31 3HD1 ILE 31 -14.015 -11.681 -8.474 252 H GLU 32 H GLU 32 -11.873 -15.628 -4.172 253 HA GLU 32 HA GLU 32 -12.301 -18.431 -4.413 254 HB2 GLU 32 2HB GLU 32 -10.094 -16.894 -2.981 255 HB3 GLU 32 3HB GLU 32 -10.063 -18.632 -3.274 256 HG2 GLU 32 2HG GLU 32 -10.049 -18.262 -5.699 257 HG3 GLU 32 3HG GLU 32 -10.168 -16.519 -5.451 258 H ASP 33 H ASP 33 -12.317 -16.249 -1.600 259 HA ASP 33 HA ASP 33 -12.443 -18.227 0.448 260 HB2 ASP 33 2HB ASP 33 -11.733 -15.840 0.822 261 HB3 ASP 33 3HB ASP 33 -13.388 -15.318 0.550 262 H ILE 34 H ILE 34 -14.902 -16.334 -1.228 263 HA ILE 34 HA ILE 34 -17.202 -17.412 0.097 264 HB ILE 34 HB ILE 34 -16.898 -15.906 -2.556 265 HG12 ILE 34 2HG1 ILE 34 -17.806 -14.896 0.189 266 HG13 ILE 34 3HG1 ILE 34 -16.209 -14.637 -0.501 267 HG21 ILE 34 1HG2 ILE 34 -19.471 -16.475 -1.039 268 HG22 ILE 34 2HG2 ILE 34 -19.011 -17.171 -2.593 269 HG23 ILE 34 3HG2 ILE 34 -19.322 -15.441 -2.461 270 HD11 ILE 34 1HD1 ILE 34 -18.810 -13.551 -1.580 271 HD12 ILE 34 2HD1 ILE 34 -17.223 -13.333 -2.321 272 HD13 ILE 34 3HD1 ILE 34 -17.552 -12.655 -0.728 273 H GLY 35 H GLY 35 -15.144 -18.534 -2.464 274 HA2 GLY 35 2HA GLY 35 -15.054 -20.669 -3.396 275 HA3 GLY 35 3HA GLY 35 -16.650 -21.026 -2.756 276 H GLU 36 H GLU 36 -16.324 -18.068 -4.376 277 HA GLU 36 HA GLU 36 -16.829 -17.153 -6.325 278 HB2 GLU 36 2HB GLU 36 -15.519 -18.913 -7.457 279 HB3 GLU 36 3HB GLU 36 -16.929 -19.967 -7.489 280 HG2 GLU 36 2HG GLU 36 -18.107 -18.333 -8.924 281 HG3 GLU 36 3HG GLU 36 -16.681 -17.296 -8.919 282 H SER 37 H SER 37 -18.696 -16.167 -6.425 283 HA SER 37 HA SER 37 -21.229 -17.611 -6.761 284 HB2 SER 37 2HB SER 37 -20.694 -15.596 -4.518 285 HB3 SER 37 3HB SER 37 -22.288 -16.216 -4.949 286 HG SER 37 HG SER 37 -21.561 -18.299 -4.408 287 H ASP 38 H ASP 38 -22.835 -16.340 -7.749 288 HA ASP 38 HA ASP 38 -21.906 -14.101 -9.349 289 HB2 ASP 38 2HB ASP 38 -24.121 -14.251 -10.449 290 HB3 ASP 38 3HB ASP 38 -23.350 -15.827 -10.371 291 H SER 39 H SER 39 -23.100 -14.366 -6.263 292 HA SER 39 HA SER 39 -24.866 -12.317 -5.787 293 HB2 SER 39 2HB SER 39 -22.511 -13.161 -4.036 294 HB3 SER 39 3HB SER 39 -23.955 -12.307 -3.479 295 HG SER 39 HG SER 39 -25.181 -14.123 -4.173 296 HA PRO 40 HA PRO 40 -22.558 -8.577 -6.962 297 HB2 PRO 40 2HB PRO 40 -24.489 -7.200 -5.102 298 HB3 PRO 40 3HB PRO 40 -24.145 -6.872 -6.816 299 HG2 PRO 40 2HG PRO 40 -26.422 -8.060 -6.104 300 HG3 PRO 40 3HG PRO 40 -25.556 -8.573 -7.572 301 HD2 PRO 40 2HD PRO 40 -25.618 -9.891 -4.858 302 HD3 PRO 40 3HD PRO 40 -25.712 -10.632 -6.473 303 H ILE 41 H ILE 41 -20.590 -8.609 -6.041 304 HA ILE 41 HA ILE 41 -20.001 -8.887 -3.287 305 HB ILE 41 HB ILE 41 -18.169 -7.885 -5.521 306 HG12 ILE 41 2HG1 ILE 41 -19.084 -10.107 -6.086 307 HG13 ILE 41 3HG1 ILE 41 -17.374 -10.245 -5.702 308 HG21 ILE 41 1HG2 ILE 41 -17.233 -7.367 -3.308 309 HG22 ILE 41 2HG2 ILE 41 -16.292 -8.643 -4.079 310 HG23 ILE 41 3HG2 ILE 41 -17.439 -9.046 -2.800 311 HD11 ILE 41 1HD1 ILE 41 -18.598 -12.103 -4.777 312 HD12 ILE 41 2HD1 ILE 41 -19.689 -11.020 -3.920 313 HD13 ILE 41 3HD1 ILE 41 -17.987 -11.106 -3.457 314 HA PRO 42 HA PRO 42 -20.562 -4.412 -2.510 315 HB2 PRO 42 2HB PRO 42 -21.115 -4.534 0.139 316 HB3 PRO 42 3HB PRO 42 -22.295 -5.074 -1.072 317 HG2 PRO 42 2HG PRO 42 -20.525 -6.717 0.683 318 HG3 PRO 42 3HG PRO 42 -22.188 -7.032 0.149 319 HD2 PRO 42 2HD PRO 42 -19.862 -8.136 -1.006 320 HD3 PRO 42 3HD PRO 42 -21.478 -8.123 -1.741 321 H LEU 43 H LEU 43 -18.973 -2.978 -2.141 322 HA LEU 43 HA LEU 43 -16.645 -3.687 -0.450 323 HB2 LEU 43 2HB LEU 43 -16.686 -1.979 -2.978 324 HB3 LEU 43 3HB LEU 43 -15.279 -2.226 -1.955 325 HG LEU 43 HG LEU 43 -16.692 -4.403 -3.555 326 HD11 LEU 43 1HD1 LEU 43 -15.495 -2.868 -5.023 327 HD12 LEU 43 2HD1 LEU 43 -14.694 -4.436 -4.980 328 HD13 LEU 43 3HD1 LEU 43 -14.016 -3.074 -4.081 329 HD21 LEU 43 1HD2 LEU 43 -14.184 -4.585 -1.852 330 HD22 LEU 43 2HD2 LEU 43 -14.789 -5.856 -2.919 331 HD23 LEU 43 3HD2 LEU 43 -15.742 -5.350 -1.527 332 HA PRO 44 HA PRO 44 -18.775 -0.060 1.475 333 HB2 PRO 44 2HB PRO 44 -18.606 -0.832 4.058 334 HB3 PRO 44 3HB PRO 44 -19.701 -1.673 2.939 335 HG2 PRO 44 2HG PRO 44 -16.981 -2.514 3.888 336 HG3 PRO 44 3HG PRO 44 -18.460 -3.485 3.721 337 HD2 PRO 44 2HD PRO 44 -16.437 -3.425 1.826 338 HD3 PRO 44 3HD PRO 44 -18.126 -3.849 1.470 339 H ASN 45 H ASN 45 -16.450 0.619 0.453 340 HA ASN 45 HA ASN 45 -15.054 2.197 2.422 341 HB2 ASN 45 2HB ASN 45 -13.942 -0.069 2.653 342 HB3 ASN 45 3HB ASN 45 -13.488 0.006 0.960 343 HD21 ASN 45 1HD2 ASN 45 -11.774 -0.260 3.260 344 HD22 ASN 45 2HD2 ASN 45 -10.685 1.079 3.235 345 H VAL 46 H VAL 46 -14.512 0.728 -0.798 346 HA VAL 46 HA VAL 46 -13.505 3.206 -1.890 347 HB VAL 46 HB VAL 46 -12.480 1.067 -2.555 348 HG11 VAL 46 1HG1 VAL 46 -13.579 -0.544 -4.035 349 HG12 VAL 46 2HG1 VAL 46 -15.087 0.366 -3.934 350 HG13 VAL 46 3HG1 VAL 46 -14.430 -0.413 -2.493 351 HG21 VAL 46 1HG2 VAL 46 -13.792 2.479 -4.904 352 HG22 VAL 46 2HG2 VAL 46 -12.370 1.436 -4.994 353 HG23 VAL 46 3HG2 VAL 46 -12.294 2.954 -4.099 354 H THR 47 H THR 47 -14.671 4.724 -2.877 355 HA THR 47 HA THR 47 -17.549 4.557 -3.069 356 HB THR 47 HB THR 47 -17.384 6.943 -3.792 357 HG1 THR 47 HG1 THR 47 -15.414 7.863 -4.169 358 HG21 THR 47 1HG2 THR 47 -16.368 7.867 -1.732 359 HG22 THR 47 2HG2 THR 47 -15.633 6.301 -1.383 360 HG23 THR 47 3HG2 THR 47 -17.392 6.479 -1.364 361 H SER 48 H SER 48 -18.505 5.684 -5.187 362 HA SER 48 HA SER 48 -18.248 3.730 -7.216 363 HB2 SER 48 2HB SER 48 -19.867 5.145 -8.488 364 HB3 SER 48 3HB SER 48 -20.375 4.845 -6.828 365 HG SER 48 HG SER 48 -20.681 6.997 -7.232 366 H THR 49 H THR 49 -17.210 7.131 -7.079 367 HA THR 49 HA THR 49 -16.240 7.395 -9.707 368 HB THR 49 HB THR 49 -14.894 9.333 -8.748 369 HG1 THR 49 HG1 THR 49 -15.286 9.773 -6.500 370 HG21 THR 49 1HG2 THR 49 -17.812 9.232 -7.875 371 HG22 THR 49 2HG2 THR 49 -17.236 9.696 -9.479 372 HG23 THR 49 3HG2 THR 49 -16.841 10.693 -8.079 373 H ILE 50 H ILE 50 -14.643 6.388 -6.704 374 HA ILE 50 HA ILE 50 -11.999 6.298 -7.805 375 HB ILE 50 HB ILE 50 -13.091 5.144 -5.197 376 HG12 ILE 50 2HG1 ILE 50 -13.373 7.578 -5.292 377 HG13 ILE 50 3HG1 ILE 50 -12.084 7.196 -4.159 378 HG21 ILE 50 1HG2 ILE 50 -10.202 5.595 -6.017 379 HG22 ILE 50 2HG2 ILE 50 -10.988 4.032 -5.799 380 HG23 ILE 50 3HG2 ILE 50 -10.747 5.096 -4.415 381 HD11 ILE 50 1HD1 ILE 50 -10.423 7.798 -5.896 382 HD12 ILE 50 2HD1 ILE 50 -11.504 9.125 -5.478 383 HD13 ILE 50 3HD1 ILE 50 -11.752 8.237 -6.978 384 H LEU 51 H LEU 51 -14.470 3.826 -7.016 385 HA LEU 51 HA LEU 51 -12.948 1.556 -7.757 386 HB2 LEU 51 2HB LEU 51 -15.013 1.485 -6.326 387 HB3 LEU 51 3HB LEU 51 -15.986 1.821 -7.749 388 HG LEU 51 HG LEU 51 -15.234 -0.344 -8.761 389 HD11 LEU 51 1HD1 LEU 51 -13.815 -0.828 -6.122 390 HD12 LEU 51 2HD1 LEU 51 -13.049 -0.574 -7.691 391 HD13 LEU 51 3HD1 LEU 51 -14.030 -2.009 -7.416 392 HD21 LEU 51 1HD2 LEU 51 -16.535 -1.850 -7.324 393 HD22 LEU 51 2HD2 LEU 51 -17.339 -0.291 -7.493 394 HD23 LEU 51 3HD2 LEU 51 -16.470 -0.679 -6.004 395 H GLU 52 H GLU 52 -15.046 3.719 -9.589 396 HA GLU 52 HA GLU 52 -15.257 2.392 -12.044 397 HB2 GLU 52 2HB GLU 52 -16.518 4.430 -11.409 398 HB3 GLU 52 3HB GLU 52 -15.051 5.389 -11.467 399 HG2 GLU 52 2HG GLU 52 -16.048 3.948 -13.930 400 HG3 GLU 52 3HG GLU 52 -16.758 5.479 -13.451 401 H LYS 53 H LYS 53 -12.813 4.708 -10.902 402 HA LYS 53 HA LYS 53 -11.116 4.738 -13.145 403 HB2 LYS 53 2HB LYS 53 -10.426 5.201 -10.210 404 HB3 LYS 53 3HB LYS 53 -9.389 5.631 -11.566 405 HG2 LYS 53 2HG LYS 53 -11.095 7.253 -12.343 406 HG3 LYS 53 3HG LYS 53 -12.107 6.830 -10.957 407 HD2 LYS 53 2HD LYS 53 -10.250 7.559 -9.433 408 HD3 LYS 53 3HD LYS 53 -9.329 8.075 -10.849 409 HE2 LYS 53 2HE LYS 53 -11.978 9.196 -9.899 410 HE3 LYS 53 3HE LYS 53 -10.403 9.985 -9.823 411 HZ1 LYS 53 1HZ LYS 53 -11.862 9.256 -12.308 412 HZ2 LYS 53 2HZ LYS 53 -10.335 9.974 -12.252 413 HZ3 LYS 53 3HZ LYS 53 -11.687 10.817 -11.679 414 H VAL 54 H VAL 54 -11.003 2.821 -10.152 415 HA VAL 54 HA VAL 54 -8.523 1.578 -10.496 416 HB VAL 54 HB VAL 54 -10.973 0.735 -8.877 417 HG11 VAL 54 1HG1 VAL 54 -9.487 -0.838 -7.643 418 HG12 VAL 54 2HG1 VAL 54 -8.204 -0.527 -8.811 419 HG13 VAL 54 3HG1 VAL 54 -9.698 -1.308 -9.331 420 HG21 VAL 54 1HG2 VAL 54 -9.661 1.550 -6.939 421 HG22 VAL 54 2HG2 VAL 54 -9.868 2.825 -8.139 422 HG23 VAL 54 3HG2 VAL 54 -8.327 1.979 -8.016 423 H LEU 55 H LEU 55 -11.793 0.437 -11.349 424 HA LEU 55 HA LEU 55 -10.948 -2.125 -12.306 425 HB2 LEU 55 2HB LEU 55 -13.575 -0.648 -12.731 426 HB3 LEU 55 3HB LEU 55 -13.296 -2.339 -13.113 427 HG LEU 55 HG LEU 55 -13.341 -1.083 -10.344 428 HD11 LEU 55 1HD1 LEU 55 -15.158 -3.147 -11.614 429 HD12 LEU 55 2HD1 LEU 55 -15.549 -1.455 -11.301 430 HD13 LEU 55 3HD1 LEU 55 -15.264 -2.554 -9.954 431 HD21 LEU 55 1HD2 LEU 55 -11.562 -2.761 -10.374 432 HD22 LEU 55 2HD2 LEU 55 -12.671 -3.962 -11.040 433 HD23 LEU 55 3HD2 LEU 55 -12.928 -3.322 -9.415 434 H ASP 56 H ASP 56 -11.404 1.008 -13.804 435 HA ASP 56 HA ASP 56 -11.383 0.142 -16.538 436 HB2 ASP 56 2HB ASP 56 -12.194 2.430 -15.486 437 HB3 ASP 56 3HB ASP 56 -10.512 2.919 -15.638 438 H TYR 57 H TYR 57 -8.933 1.274 -14.234 439 HA TYR 57 HA TYR 57 -6.710 1.254 -16.036 440 HB2 TYR 57 2HB TYR 57 -6.724 2.615 -13.967 441 HB3 TYR 57 3HB TYR 57 -6.740 1.155 -12.987 442 HD1 TYR 57 HD1 TYR 57 -4.658 0.111 -12.375 443 HD2 TYR 57 HD2 TYR 57 -4.673 3.036 -15.495 444 HE1 TYR 57 HE1 TYR 57 -2.202 0.083 -12.408 445 HE2 TYR 57 HE2 TYR 57 -2.214 3.014 -15.521 446 HH TYR 57 HH TYR 57 -0.349 2.423 -14.062 447 H CYS 58 H CYS 58 -8.052 -1.090 -13.733 448 HA CYS 58 HA CYS 58 -6.095 -3.095 -13.939 449 HB2 CYS 58 2HB CYS 58 -9.078 -3.320 -13.377 450 HB3 CYS 58 3HB CYS 58 -7.943 -4.660 -13.214 451 HG CYS 58 HG CYS 58 -7.353 -1.794 -11.480 452 H ARG 59 H ARG 59 -8.991 -2.374 -15.905 453 HA ARG 59 HA ARG 59 -8.836 -4.526 -17.713 454 HB2 ARG 59 2HB ARG 59 -10.834 -3.163 -17.634 455 HB3 ARG 59 3HB ARG 59 -9.937 -1.714 -18.086 456 HG2 ARG 59 2HG ARG 59 -9.501 -2.659 -20.324 457 HG3 ARG 59 3HG ARG 59 -10.343 -4.143 -19.873 458 HD2 ARG 59 2HD ARG 59 -11.602 -1.389 -20.013 459 HD3 ARG 59 3HD ARG 59 -11.736 -2.637 -21.255 460 HE ARG 59 HE ARG 59 -12.842 -4.034 -19.514 461 HH11 ARG 59 1HH1 ARG 59 -12.974 -0.534 -19.225 462 HH12 ARG 59 2HH1 ARG 59 -14.441 -0.553 -18.301 463 HH21 ARG 59 1HH2 ARG 59 -14.743 -4.060 -18.337 464 HH22 ARG 59 2HH2 ARG 59 -15.451 -2.568 -17.792 465 H HIS 60 H HIS 60 -7.453 -1.240 -17.904 466 HA HIS 60 HA HIS 60 -6.224 -1.346 -20.399 467 HB2 HIS 60 2HB HIS 60 -6.364 0.753 -19.228 468 HB3 HIS 60 3HB HIS 60 -5.476 0.125 -17.845 469 HD1 HIS 60 HD1 HIS 60 -4.908 1.152 -21.454 470 HD2 HIS 60 HD2 HIS 60 -2.762 0.514 -17.955 471 HE1 HIS 60 HE1 HIS 60 -2.570 1.933 -21.936 472 HE2 HIS 60 HE2 HIS 60 -1.413 1.812 -19.713 473 H HIS 61 H HIS 61 -4.875 -2.253 -17.241 474 HA HIS 61 HA HIS 61 -2.327 -3.087 -18.268 475 HB2 HIS 61 2HB HIS 61 -2.790 -2.170 -15.925 476 HB3 HIS 61 3HB HIS 61 -3.529 -3.717 -15.536 477 HD1 HIS 61 HD1 HIS 61 -1.793 -5.846 -15.822 478 HD2 HIS 61 HD2 HIS 61 -0.104 -2.069 -15.447 479 HE1 HIS 61 HE1 HIS 61 0.595 -6.246 -15.164 480 HE2 HIS 61 HE2 HIS 61 1.558 -3.951 -14.833 481 H HIS 62 H HIS 62 -5.432 -4.618 -17.969 482 HA HIS 62 HA HIS 62 -4.460 -7.350 -17.990 483 HB2 HIS 62 2HB HIS 62 -6.713 -6.605 -17.035 484 HB3 HIS 62 3HB HIS 62 -7.271 -6.380 -18.689 485 HD1 HIS 62 HD1 HIS 62 -6.694 -8.951 -16.099 486 HD2 HIS 62 HD2 HIS 62 -7.575 -8.844 -20.155 487 HE1 HIS 62 HE1 HIS 62 -7.439 -11.272 -16.694 488 HE2 HIS 62 HE2 HIS 62 -7.839 -11.203 -19.168 489 H GLN 63 H GLN 63 -5.690 -4.998 -20.334 490 HA GLN 63 HA GLN 63 -5.706 -6.792 -22.591 491 HB2 GLN 63 2HB GLN 63 -5.837 -3.739 -22.558 492 HB3 GLN 63 3HB GLN 63 -6.233 -4.775 -23.923 493 HG2 GLN 63 2HG GLN 63 -7.759 -4.523 -21.323 494 HG3 GLN 63 3HG GLN 63 -8.276 -3.983 -22.914 495 HE21 GLN 63 1HE2 GLN 63 -9.029 -5.527 -24.397 496 HE22 GLN 63 2HE2 GLN 63 -9.467 -7.128 -23.927 497 H HIS 64 H HIS 64 -3.452 -4.563 -21.131 498 HA HIS 64 HA HIS 64 -1.337 -5.445 -23.008 499 HB2 HIS 64 2HB HIS 64 -1.567 -2.706 -21.663 500 HB3 HIS 64 3HB HIS 64 -0.202 -3.240 -22.642 501 HD1 HIS 64 HD1 HIS 64 -0.404 -2.941 -25.161 502 HD2 HIS 64 HD2 HIS 64 -4.007 -2.265 -23.198 503 HE1 HIS 64 HE1 HIS 64 -1.954 -2.010 -26.897 504 HE2 HIS 64 HE2 HIS 64 -4.158 -1.743 -25.721 505 HA PRO 65 HA PRO 65 -0.202 -6.650 -18.643 506 HB2 PRO 65 2HB PRO 65 -0.512 -9.308 -18.743 507 HB3 PRO 65 3HB PRO 65 -1.943 -8.254 -18.758 508 HG2 PRO 65 2HG PRO 65 -0.710 -9.775 -21.006 509 HG3 PRO 65 3HG PRO 65 -2.418 -9.385 -20.712 510 HD2 PRO 65 2HD PRO 65 -0.587 -7.957 -22.414 511 HD3 PRO 65 3HD PRO 65 -2.259 -7.512 -22.012 512 H GLY 66 H GLY 66 1.483 -6.325 -21.222 513 HA2 GLY 66 2HA GLY 66 3.525 -8.285 -21.267 514 HA3 GLY 66 3HA GLY 66 3.640 -6.653 -21.908 515 H GLY 67 H GLY 67 3.856 -4.897 -20.176 516 HA2 GLY 67 2HA GLY 67 4.871 -3.934 -18.356 517 HA3 GLY 67 3HA GLY 67 4.924 -5.513 -17.592 518 H SER 68 H SER 68 6.441 -5.860 -20.524 519 HA SER 68 HA SER 68 9.079 -5.947 -19.319 520 HB2 SER 68 2HB SER 68 9.663 -6.952 -21.620 521 HB3 SER 68 3HB SER 68 8.474 -7.849 -20.677 522 HG SER 68 HG SER 68 7.883 -7.553 -22.898 523 H GLY 69 H GLY 69 9.080 -3.614 -18.991 524 HA2 GLY 69 2HA GLY 69 10.140 -1.622 -19.474 525 HA3 GLY 69 3HA GLY 69 10.308 -2.103 -21.154 526 H LEU 70 H LEU 70 7.674 -2.663 -21.824 527 HA LEU 70 HA LEU 70 6.119 -1.654 -23.042 528 HB2 LEU 70 2HB LEU 70 4.291 -0.519 -21.774 529 HB3 LEU 70 3HB LEU 70 4.772 -2.074 -21.147 530 HG LEU 70 HG LEU 70 6.089 -0.775 -19.326 531 HD11 LEU 70 1HD1 LEU 70 5.296 1.474 -18.748 532 HD12 LEU 70 2HD1 LEU 70 4.347 1.534 -20.237 533 HD13 LEU 70 3HD1 LEU 70 6.108 1.451 -20.313 534 HD21 LEU 70 1HD2 LEU 70 4.092 -0.511 -17.899 535 HD22 LEU 70 2HD2 LEU 70 4.046 -2.010 -18.822 536 HD23 LEU 70 3HD2 LEU 70 3.055 -0.639 -19.324 537 H ASP 71 H ASP 71 8.589 -0.308 -23.118 538 HA ASP 71 HA ASP 71 9.645 1.501 -23.894 539 HB2 ASP 71 2HB ASP 71 6.862 2.240 -24.874 540 HB3 ASP 71 3HB ASP 71 8.275 3.213 -25.244 541 H ASP 72 H ASP 72 6.681 3.235 -23.011 542 HA ASP 72 HA ASP 72 7.856 4.455 -20.658 543 HB2 ASP 72 2HB ASP 72 7.171 6.002 -23.201 544 HB3 ASP 72 3HB ASP 72 7.119 6.779 -21.629 545 H ILE 73 H ILE 73 6.162 5.733 -19.541 546 HA ILE 73 HA ILE 73 3.708 4.416 -19.302 547 HB ILE 73 HB ILE 73 4.566 7.209 -18.459 548 HG12 ILE 73 2HG1 ILE 73 5.831 5.383 -17.380 549 HG13 ILE 73 3HG1 ILE 73 4.819 6.201 -16.200 550 HG21 ILE 73 1HG2 ILE 73 2.041 5.742 -17.626 551 HG22 ILE 73 2HG2 ILE 73 2.126 7.216 -18.590 552 HG23 ILE 73 3HG2 ILE 73 2.629 7.239 -16.899 553 HD11 ILE 73 1HD1 ILE 73 4.245 3.527 -17.492 554 HD12 ILE 73 2HD1 ILE 73 3.199 4.345 -16.328 555 HD13 ILE 73 3HD1 ILE 73 4.806 3.806 -15.844 556 HA PRO 74 HA PRO 74 1.684 6.066 -23.094 557 HB2 PRO 74 2HB PRO 74 -0.710 4.713 -21.840 558 HB3 PRO 74 3HB PRO 74 -0.047 4.534 -23.479 559 HG2 PRO 74 2HG PRO 74 0.302 2.606 -21.692 560 HG3 PRO 74 3HG PRO 74 1.635 3.055 -22.786 561 HD2 PRO 74 2HD PRO 74 1.232 3.813 -19.889 562 HD3 PRO 74 3HD PRO 74 2.715 3.289 -20.723 563 HA PRO 75 HA PRO 75 -0.292 9.918 -21.846 564 HB2 PRO 75 2HB PRO 75 -2.338 9.215 -23.977 565 HB3 PRO 75 3HB PRO 75 -1.450 10.736 -23.718 566 HG2 PRO 75 2HG PRO 75 -0.676 9.103 -25.649 567 HG3 PRO 75 3HG PRO 75 0.541 9.900 -24.622 568 HD2 PRO 75 2HD PRO 75 -0.425 7.052 -24.543 569 HD3 PRO 75 3HD PRO 75 1.213 7.700 -24.292 570 H TYR 76 H TYR 76 -2.465 7.133 -22.369 571 HA TYR 76 HA TYR 76 -4.720 7.906 -20.957 572 HB2 TYR 76 2HB TYR 76 -4.830 5.862 -22.226 573 HB3 TYR 76 3HB TYR 76 -3.486 5.148 -21.345 574 HD1 TYR 76 HD1 TYR 76 -3.851 4.010 -19.218 575 HD2 TYR 76 HD2 TYR 76 -7.109 6.026 -21.118 576 HE1 TYR 76 HE1 TYR 76 -5.406 2.980 -17.630 577 HE2 TYR 76 HE2 TYR 76 -8.670 4.981 -19.523 578 HH TYR 76 HH TYR 76 -8.766 3.029 -18.014 579 H ASP 77 H ASP 77 -1.829 6.252 -19.711 580 HA ASP 77 HA ASP 77 -2.814 5.806 -17.079 581 HB2 ASP 77 2HB ASP 77 0.051 5.800 -18.115 582 HB3 ASP 77 3HB ASP 77 -0.468 5.146 -16.562 583 H ARG 78 H ARG 78 -0.859 8.334 -18.551 584 HA ARG 78 HA ARG 78 -0.218 9.823 -16.226 585 HB2 ARG 78 2HB ARG 78 -0.580 10.722 -19.124 586 HB3 ARG 78 3HB ARG 78 0.046 11.765 -17.843 587 HG2 ARG 78 2HG ARG 78 1.917 10.203 -17.492 588 HG3 ARG 78 3HG ARG 78 1.321 9.185 -18.805 589 HD2 ARG 78 2HD ARG 78 1.719 10.946 -20.421 590 HD3 ARG 78 3HD ARG 78 2.134 12.095 -19.149 591 HE ARG 78 HE ARG 78 3.790 9.883 -20.156 592 HH11 ARG 78 1HH1 ARG 78 3.494 12.599 -17.933 593 HH12 ARG 78 2HH1 ARG 78 5.197 12.667 -17.599 594 HH21 ARG 78 1HH2 ARG 78 6.032 9.982 -19.681 595 HH22 ARG 78 2HH2 ARG 78 6.626 11.192 -18.584 596 H ASP 79 H ASP 79 -2.912 10.057 -18.537 597 HA ASP 79 HA ASP 79 -4.240 12.180 -17.190 598 HB2 ASP 79 2HB ASP 79 -5.054 10.322 -19.440 599 HB3 ASP 79 3HB ASP 79 -6.222 11.447 -18.747 600 H PHE 80 H PHE 80 -4.305 8.740 -16.789 601 HA PHE 80 HA PHE 80 -6.652 8.446 -15.222 602 HB2 PHE 80 2HB PHE 80 -5.582 6.440 -16.086 603 HB3 PHE 80 3HB PHE 80 -4.043 6.854 -15.342 604 HD1 PHE 80 HD1 PHE 80 -7.574 5.932 -14.499 605 HD2 PHE 80 HD2 PHE 80 -3.496 5.973 -13.197 606 HE1 PHE 80 HE1 PHE 80 -8.178 4.626 -12.512 607 HE2 PHE 80 HE2 PHE 80 -4.121 4.662 -11.209 608 HZ PHE 80 HZ PHE 80 -6.466 3.992 -10.866 609 H CYS 81 H CYS 81 -3.303 9.255 -14.476 610 HA CYS 81 HA CYS 81 -3.665 9.386 -11.622 611 HB2 CYS 81 2HB CYS 81 -1.344 10.215 -13.403 612 HB3 CYS 81 3HB CYS 81 -1.289 10.117 -11.642 613 HG CYS 81 HG CYS 81 -2.019 7.400 -13.581 614 H LYS 82 H LYS 82 -4.092 11.630 -14.260 615 HA LYS 82 HA LYS 82 -3.843 14.072 -12.729 616 HB2 LYS 82 2HB LYS 82 -5.202 13.543 -15.408 617 HB3 LYS 82 3HB LYS 82 -4.974 15.144 -14.710 618 HG2 LYS 82 2HG LYS 82 -2.559 14.939 -14.905 619 HG3 LYS 82 3HG LYS 82 -2.714 13.265 -15.452 620 HD2 LYS 82 2HD LYS 82 -4.088 14.167 -17.421 621 HD3 LYS 82 3HD LYS 82 -3.576 15.783 -16.927 622 HE2 LYS 82 2HE LYS 82 -1.246 15.217 -17.332 623 HE3 LYS 82 3HE LYS 82 -1.672 13.529 -17.649 624 HZ1 LYS 82 1HZ LYS 82 -1.340 14.729 -19.704 625 HZ2 LYS 82 2HZ LYS 82 -2.502 15.874 -19.280 626 HZ3 LYS 82 3HZ LYS 82 -2.963 14.271 -19.577 627 H VAL 83 H VAL 83 -5.131 13.520 -10.918 628 HA VAL 83 HA VAL 83 -8.076 13.730 -11.294 629 HB VAL 83 HB VAL 83 -8.334 12.270 -9.252 630 HG11 VAL 83 1HG1 VAL 83 -7.879 10.105 -10.350 631 HG12 VAL 83 2HG1 VAL 83 -6.857 10.913 -11.540 632 HG13 VAL 83 3HG1 VAL 83 -8.585 11.260 -11.482 633 HG21 VAL 83 1HG2 VAL 83 -5.345 11.771 -9.561 634 HG22 VAL 83 2HG2 VAL 83 -6.419 10.896 -8.465 635 HG23 VAL 83 3HG2 VAL 83 -6.128 12.619 -8.224 636 H ASP 84 H ASP 84 -9.084 14.336 -9.055 637 HA ASP 84 HA ASP 84 -8.085 16.858 -8.177 638 HB2 ASP 84 2HB ASP 84 -10.457 16.470 -8.137 639 HB3 ASP 84 3HB ASP 84 -10.278 14.987 -7.216 640 H GLN 85 H GLN 85 -7.358 17.348 -5.915 641 HA GLN 85 HA GLN 85 -4.989 15.869 -5.574 642 HB2 GLN 85 2HB GLN 85 -5.500 18.430 -5.122 643 HB3 GLN 85 3HB GLN 85 -5.852 17.901 -3.486 644 HG2 GLN 85 2HG GLN 85 -3.210 17.412 -4.904 645 HG3 GLN 85 3HG GLN 85 -3.524 18.796 -3.867 646 HE21 GLN 85 1HE2 GLN 85 -5.002 17.303 -1.836 647 HE22 GLN 85 2HE2 GLN 85 -3.832 16.353 -0.999 648 HA PRO 86 HA PRO 86 -6.735 13.981 -1.436 649 HB2 PRO 86 2HB PRO 86 -9.468 14.072 -0.988 650 HB3 PRO 86 3HB PRO 86 -8.308 15.223 -0.298 651 HG2 PRO 86 2HG PRO 86 -10.050 15.543 -2.714 652 HG3 PRO 86 3HG PRO 86 -9.693 16.707 -1.417 653 HD2 PRO 86 2HD PRO 86 -8.454 16.848 -3.821 654 HD3 PRO 86 3HD PRO 86 -7.618 17.284 -2.313 655 H THR 87 H THR 87 -8.738 13.975 -4.352 656 HA THR 87 HA THR 87 -9.745 11.347 -4.265 657 HB THR 87 HB THR 87 -9.121 13.143 -6.641 658 HG1 THR 87 HG1 THR 87 -10.686 14.029 -5.294 659 HG21 THR 87 1HG2 THR 87 -10.908 10.688 -6.592 660 HG22 THR 87 2HG2 THR 87 -9.349 10.790 -7.409 661 HG23 THR 87 3HG2 THR 87 -10.700 11.790 -7.952 662 H LEU 88 H LEU 88 -6.627 12.617 -5.295 663 HA LEU 88 HA LEU 88 -5.509 10.370 -6.570 664 HB2 LEU 88 2HB LEU 88 -4.648 12.785 -6.467 665 HB3 LEU 88 3HB LEU 88 -4.008 12.423 -4.880 666 HG LEU 88 HG LEU 88 -3.127 10.874 -7.359 667 HD11 LEU 88 1HD1 LEU 88 -2.678 13.244 -7.787 668 HD12 LEU 88 2HD1 LEU 88 -1.177 12.360 -7.532 669 HD13 LEU 88 3HD1 LEU 88 -1.824 13.385 -6.248 670 HD21 LEU 88 1HD2 LEU 88 -2.564 9.811 -5.217 671 HD22 LEU 88 2HD2 LEU 88 -1.761 11.284 -4.676 672 HD23 LEU 88 3HD2 LEU 88 -1.109 10.373 -6.041 673 H PHE 89 H PHE 89 -5.635 11.351 -3.172 674 HA PHE 89 HA PHE 89 -4.126 9.125 -2.166 675 HB2 PHE 89 2HB PHE 89 -5.804 11.263 -0.813 676 HB3 PHE 89 3HB PHE 89 -4.969 9.991 0.087 677 HD1 PHE 89 HD1 PHE 89 -2.718 10.283 0.694 678 HD2 PHE 89 HD2 PHE 89 -4.343 12.723 -2.414 679 HE1 PHE 89 HE1 PHE 89 -0.676 11.632 0.661 680 HE2 PHE 89 HE2 PHE 89 -2.289 14.080 -2.424 681 HZ PHE 89 HZ PHE 89 -0.460 13.529 -0.872 682 H GLU 90 H GLU 90 -7.555 9.799 -2.632 683 HA GLU 90 HA GLU 90 -8.620 7.576 -1.238 684 HB2 GLU 90 2HB GLU 90 -9.695 8.982 -3.719 685 HB3 GLU 90 3HB GLU 90 -10.615 7.896 -2.685 686 HG2 GLU 90 2HG GLU 90 -9.400 10.502 -1.769 687 HG3 GLU 90 3HG GLU 90 -11.059 10.332 -2.314 688 H LEU 91 H LEU 91 -7.250 7.948 -4.465 689 HA LEU 91 HA LEU 91 -7.714 5.292 -5.408 690 HB2 LEU 91 2HB LEU 91 -5.784 7.487 -6.239 691 HB3 LEU 91 3HB LEU 91 -5.786 5.922 -7.031 692 HG LEU 91 HG LEU 91 -8.140 7.855 -6.980 693 HD11 LEU 91 1HD1 LEU 91 -7.642 8.225 -9.368 694 HD12 LEU 91 2HD1 LEU 91 -6.208 7.203 -9.239 695 HD13 LEU 91 3HD1 LEU 91 -6.295 8.724 -8.347 696 HD21 LEU 91 1HD2 LEU 91 -9.161 6.335 -8.614 697 HD22 LEU 91 2HD2 LEU 91 -8.860 5.513 -7.089 698 HD23 LEU 91 3HD2 LEU 91 -7.793 5.228 -8.466 699 H ILE 92 H ILE 92 -5.014 6.831 -3.631 700 HA ILE 92 HA ILE 92 -3.230 4.628 -3.553 701 HB ILE 92 HB ILE 92 -3.598 6.922 -1.554 702 HG12 ILE 92 2HG1 ILE 92 -1.546 6.556 -3.790 703 HG13 ILE 92 3HG1 ILE 92 -2.916 7.658 -3.825 704 HG21 ILE 92 1HG2 ILE 92 -1.278 4.957 -1.692 705 HG22 ILE 92 2HG2 ILE 92 -2.481 5.053 -0.404 706 HG23 ILE 92 3HG2 ILE 92 -1.354 6.384 -0.656 707 HD11 ILE 92 1HD1 ILE 92 -0.873 8.854 -3.379 708 HD12 ILE 92 2HD1 ILE 92 -0.536 7.839 -1.978 709 HD13 ILE 92 3HD1 ILE 92 -1.927 8.927 -1.967 710 H LEU 93 H LEU 93 -5.919 5.612 -1.452 711 HA LEU 93 HA LEU 93 -5.553 3.639 0.577 712 HB2 LEU 93 2HB LEU 93 -8.006 5.319 -0.105 713 HB3 LEU 93 3HB LEU 93 -7.841 4.342 1.344 714 HG LEU 93 HG LEU 93 -6.212 6.808 0.640 715 HD11 LEU 93 1HD1 LEU 93 -7.267 7.826 2.612 716 HD12 LEU 93 2HD1 LEU 93 -8.244 6.373 2.844 717 HD13 LEU 93 3HD1 LEU 93 -8.455 7.359 1.395 718 HD21 LEU 93 1HD2 LEU 93 -5.126 6.563 2.838 719 HD22 LEU 93 2HD2 LEU 93 -4.737 5.242 1.741 720 HD23 LEU 93 3HD2 LEU 93 -5.905 4.992 3.039 721 H ALA 94 H ALA 94 -7.535 3.837 -2.351 722 HA ALA 94 HA ALA 94 -8.974 1.381 -1.949 723 HB1 ALA 94 1HB ALA 94 -9.887 3.200 -3.321 724 HB2 ALA 94 2HB ALA 94 -9.759 1.708 -4.251 725 HB3 ALA 94 3HB ALA 94 -8.578 3.003 -4.489 726 H ALA 95 H ALA 95 -5.983 2.288 -3.562 727 HA ALA 95 HA ALA 95 -5.566 -0.216 -4.916 728 HB1 ALA 95 1HB ALA 95 -4.564 1.884 -5.717 729 HB2 ALA 95 2HB ALA 95 -3.342 0.648 -5.420 730 HB3 ALA 95 3HB ALA 95 -3.565 1.967 -4.266 731 H ASN 96 H ASN 96 -4.709 1.102 -1.755 732 HA ASN 96 HA ASN 96 -3.132 -1.165 -0.896 733 HB2 ASN 96 2HB ASN 96 -2.819 1.096 0.086 734 HB3 ASN 96 3HB ASN 96 -4.470 1.080 0.698 735 HD21 ASN 96 1HD2 ASN 96 -3.651 1.426 2.820 736 HD22 ASN 96 2HD2 ASN 96 -2.911 0.156 3.732 737 H TYR 97 H TYR 97 -6.499 -0.144 -0.663 738 HA TYR 97 HA TYR 97 -7.517 -2.109 1.114 739 HB2 TYR 97 2HB TYR 97 -8.782 -0.082 0.729 740 HB3 TYR 97 3HB TYR 97 -8.840 -0.361 -1.004 741 HD1 TYR 97 HD1 TYR 97 -10.944 -1.014 -1.832 742 HD2 TYR 97 HD2 TYR 97 -9.907 -2.172 2.152 743 HE1 TYR 97 HE1 TYR 97 -13.160 -2.053 -1.561 744 HE2 TYR 97 HE2 TYR 97 -12.119 -3.210 2.416 745 HH TYR 97 HH TYR 97 -14.402 -2.985 1.436 746 H LEU 98 H LEU 98 -7.122 -2.021 -2.387 747 HA LEU 98 HA LEU 98 -8.246 -4.725 -2.704 748 HB2 LEU 98 2HB LEU 98 -7.598 -2.567 -4.758 749 HB3 LEU 98 3HB LEU 98 -8.234 -4.157 -5.151 750 HG LEU 98 HG LEU 98 -9.677 -2.011 -3.538 751 HD11 LEU 98 1HD1 LEU 98 -9.619 -1.489 -5.922 752 HD12 LEU 98 2HD1 LEU 98 -11.252 -1.920 -5.425 753 HD13 LEU 98 3HD1 LEU 98 -10.267 -3.083 -6.317 754 HD21 LEU 98 1HD2 LEU 98 -10.618 -4.800 -4.273 755 HD22 LEU 98 2HD2 LEU 98 -11.632 -3.538 -3.571 756 HD23 LEU 98 3HD2 LEU 98 -10.278 -4.192 -2.653 757 H ASP 99 H ASP 99 -5.309 -3.146 -2.370 758 HA ASP 99 HA ASP 99 -3.163 -3.732 -2.360 759 HB2 ASP 99 2HB ASP 99 -4.170 -5.626 -1.006 760 HB3 ASP 99 3HB ASP 99 -4.136 -6.614 -2.463 761 H ILE 100 H ILE 100 -4.186 -3.076 -4.861 762 HA ILE 100 HA ILE 100 -3.037 -4.825 -6.894 763 HB ILE 100 HB ILE 100 -4.197 -2.016 -7.223 764 HG12 ILE 100 2HG1 ILE 100 -5.570 -4.715 -7.615 765 HG13 ILE 100 3HG1 ILE 100 -5.859 -3.621 -6.270 766 HG21 ILE 100 1HG2 ILE 100 -2.732 -2.690 -9.099 767 HG22 ILE 100 2HG2 ILE 100 -4.416 -2.614 -9.621 768 HG23 ILE 100 3HG2 ILE 100 -3.662 -4.179 -9.305 769 HD11 ILE 100 1HD1 ILE 100 -6.488 -3.087 -9.167 770 HD12 ILE 100 2HD1 ILE 100 -6.737 -1.953 -7.838 771 HD13 ILE 100 3HD1 ILE 100 -7.626 -3.473 -7.878 772 H LYS 101 H LYS 101 -0.849 -4.862 -6.925 773 HA LYS 101 HA LYS 101 0.862 -2.955 -5.803 774 HB2 LYS 101 2HB LYS 101 1.668 -5.001 -7.910 775 HB3 LYS 101 3HB LYS 101 2.733 -4.221 -6.750 776 HG2 LYS 101 2HG LYS 101 0.533 -6.202 -6.123 777 HG3 LYS 101 3HG LYS 101 2.266 -6.528 -6.102 778 HD2 LYS 101 2HD LYS 101 2.512 -4.885 -4.222 779 HD3 LYS 101 3HD LYS 101 0.760 -4.649 -4.238 780 HE2 LYS 101 2HE LYS 101 0.457 -7.070 -3.725 781 HE3 LYS 101 3HE LYS 101 2.213 -7.249 -3.630 782 HZ1 LYS 101 1HZ LYS 101 1.254 -6.973 -1.447 783 HZ2 LYS 101 2HZ LYS 101 0.531 -5.522 -1.908 784 HZ3 LYS 101 3HZ LYS 101 2.212 -5.624 -1.812 785 HA PRO 102 HA PRO 102 1.874 -1.373 -10.444 786 HB2 PRO 102 2HB PRO 102 -0.858 -1.811 -11.672 787 HB3 PRO 102 3HB PRO 102 0.753 -1.926 -12.421 788 HG2 PRO 102 2HG PRO 102 -0.586 -4.138 -11.835 789 HG3 PRO 102 3HG PRO 102 1.169 -4.049 -11.550 790 HD2 PRO 102 2HD PRO 102 -1.082 -3.826 -9.557 791 HD3 PRO 102 3HD PRO 102 0.474 -4.675 -9.417 792 H LEU 103 H LEU 103 -1.570 -1.104 -9.452 793 HA LEU 103 HA LEU 103 -1.859 1.625 -10.176 794 HB2 LEU 103 2HB LEU 103 -3.651 -0.255 -9.759 795 HB3 LEU 103 3HB LEU 103 -3.617 0.289 -8.095 796 HG LEU 103 HG LEU 103 -4.269 2.145 -10.429 797 HD11 LEU 103 1HD1 LEU 103 -5.899 0.341 -10.429 798 HD12 LEU 103 2HD1 LEU 103 -6.645 1.845 -9.900 799 HD13 LEU 103 3HD1 LEU 103 -6.235 0.599 -8.716 800 HD21 LEU 103 1HD2 LEU 103 -3.605 3.337 -8.388 801 HD22 LEU 103 2HD2 LEU 103 -4.831 2.472 -7.460 802 HD23 LEU 103 3HD2 LEU 103 -5.314 3.593 -8.739 803 H LEU 104 H LEU 104 -1.158 0.018 -7.073 804 HA LEU 104 HA LEU 104 -1.295 2.289 -5.400 805 HB2 LEU 104 2HB LEU 104 -1.380 -0.054 -4.577 806 HB3 LEU 104 3HB LEU 104 0.299 -0.279 -5.018 807 HG LEU 104 HG LEU 104 0.986 1.359 -3.283 808 HD11 LEU 104 1HD1 LEU 104 -1.962 1.553 -2.573 809 HD12 LEU 104 2HD1 LEU 104 -0.972 2.832 -3.287 810 HD13 LEU 104 3HD1 LEU 104 -0.622 2.257 -1.659 811 HD21 LEU 104 1HD2 LEU 104 -0.839 -0.814 -2.192 812 HD22 LEU 104 2HD2 LEU 104 0.453 0.003 -1.305 813 HD23 LEU 104 3HD2 LEU 104 0.846 -1.021 -2.682 814 H ASP 105 H ASP 105 1.385 0.790 -7.183 815 HA ASP 105 HA ASP 105 3.472 2.423 -6.147 816 HB2 ASP 105 2HB ASP 105 3.865 0.216 -7.272 817 HB3 ASP 105 3HB ASP 105 3.388 0.919 -8.814 818 H VAL 106 H VAL 106 1.640 2.545 -9.224 819 HA VAL 106 HA VAL 106 2.911 4.754 -10.380 820 HB VAL 106 HB VAL 106 0.127 3.592 -10.843 821 HG11 VAL 106 1HG1 VAL 106 1.496 5.720 -12.541 822 HG12 VAL 106 2HG1 VAL 106 0.041 5.942 -11.567 823 HG13 VAL 106 3HG1 VAL 106 0.007 4.867 -12.961 824 HG21 VAL 106 1HG2 VAL 106 1.135 2.626 -12.883 825 HG22 VAL 106 2HG2 VAL 106 2.015 2.116 -11.441 826 HG23 VAL 106 3HG2 VAL 106 2.686 3.373 -12.481 827 H THR 107 H THR 107 -0.059 4.652 -8.380 828 HA THR 107 HA THR 107 -0.644 7.437 -8.663 829 HB THR 107 HB THR 107 -1.740 5.460 -6.612 830 HG1 THR 107 HG1 THR 107 -2.325 4.646 -8.548 831 HG21 THR 107 1HG2 THR 107 -3.707 6.954 -6.539 832 HG22 THR 107 2HG2 THR 107 -2.914 8.072 -7.648 833 HG23 THR 107 3HG2 THR 107 -2.257 7.820 -6.030 834 H CYS 108 H CYS 108 0.932 5.506 -6.088 835 HA CYS 108 HA CYS 108 1.345 7.652 -4.258 836 HB2 CYS 108 2HB CYS 108 2.833 5.014 -4.537 837 HB3 CYS 108 3HB CYS 108 3.073 6.148 -3.206 838 HG CYS 108 HG CYS 108 0.988 3.723 -3.356 839 H LYS 109 H LYS 109 3.148 6.483 -7.045 840 HA LYS 109 HA LYS 109 5.497 8.080 -6.643 841 HB2 LYS 109 2HB LYS 109 4.486 6.280 -8.808 842 HB3 LYS 109 3HB LYS 109 5.491 7.603 -9.383 843 HG2 LYS 109 2HG LYS 109 6.797 5.550 -9.002 844 HG3 LYS 109 3HG LYS 109 7.347 6.878 -7.977 845 HD2 LYS 109 2HD LYS 109 6.124 5.899 -6.059 846 HD3 LYS 109 3HD LYS 109 5.553 4.585 -7.094 847 HE2 LYS 109 2HE LYS 109 8.453 5.165 -6.405 848 HE3 LYS 109 3HE LYS 109 7.466 3.882 -5.707 849 HZ1 LYS 109 1HZ LYS 109 7.225 2.966 -7.975 850 HZ2 LYS 109 2HZ LYS 109 8.819 2.967 -7.418 851 HZ3 LYS 109 3HZ LYS 109 8.320 4.126 -8.537 852 H THR 110 H THR 110 2.431 8.548 -8.376 853 HA THR 110 HA THR 110 3.038 10.843 -9.845 854 HB THR 110 HB THR 110 0.378 9.998 -8.620 855 HG1 THR 110 HG1 THR 110 0.608 8.520 -10.120 856 HG21 THR 110 1HG2 THR 110 0.902 12.015 -10.841 857 HG22 THR 110 2HG2 THR 110 0.261 12.387 -9.238 858 HG23 THR 110 3HG2 THR 110 -0.687 11.414 -10.362 859 H VAL 111 H VAL 111 1.667 10.607 -6.532 860 HA VAL 111 HA VAL 111 1.715 13.440 -6.079 861 HB VAL 111 HB VAL 111 0.124 12.036 -4.855 862 HG11 VAL 111 1HG1 VAL 111 0.774 10.541 -3.024 863 HG12 VAL 111 2HG1 VAL 111 2.479 10.813 -3.394 864 HG13 VAL 111 3HG1 VAL 111 1.442 9.994 -4.566 865 HG21 VAL 111 1HG2 VAL 111 2.065 13.432 -2.989 866 HG22 VAL 111 2HG2 VAL 111 0.403 12.997 -2.602 867 HG23 VAL 111 3HG2 VAL 111 0.728 14.183 -3.863 868 H ALA 112 H ALA 112 3.965 10.788 -5.428 869 HA ALA 112 HA ALA 112 5.725 12.060 -3.649 870 HB1 ALA 112 1HB ALA 112 6.352 9.889 -5.670 871 HB2 ALA 112 2HB ALA 112 5.747 9.641 -4.032 872 HB3 ALA 112 3HB ALA 112 7.351 10.332 -4.277 873 H ASN 113 H ASN 113 5.751 11.902 -7.220 874 HA ASN 113 HA ASN 113 8.303 12.994 -7.684 875 HB2 ASN 113 2HB ASN 113 5.854 13.049 -9.513 876 HB3 ASN 113 3HB ASN 113 7.502 13.392 -10.032 877 HD21 ASN 113 1HD2 ASN 113 5.646 11.322 -10.940 878 HD22 ASN 113 2HD2 ASN 113 6.450 9.818 -10.689 879 H MET 114 H MET 114 5.255 14.570 -7.041 880 HA MET 114 HA MET 114 5.862 17.193 -7.986 881 HB2 MET 114 2HB MET 114 3.958 16.444 -5.720 882 HB3 MET 114 3HB MET 114 3.936 17.928 -6.662 883 HG2 MET 114 2HG MET 114 3.399 16.536 -8.694 884 HG3 MET 114 3HG MET 114 3.234 15.147 -7.619 885 HE1 MET 114 1HE MET 114 0.179 16.441 -5.345 886 HE2 MET 114 2HE MET 114 1.880 16.763 -5.014 887 HE3 MET 114 3HE MET 114 1.372 15.157 -5.534 888 H ILE 115 H ILE 115 6.250 15.566 -4.866 889 HA ILE 115 HA ILE 115 7.468 17.959 -3.614 890 HB ILE 115 HB ILE 115 7.034 16.814 -1.452 891 HG12 ILE 115 2HG1 ILE 115 5.805 14.592 -3.159 892 HG13 ILE 115 3HG1 ILE 115 7.311 14.470 -2.260 893 HG21 ILE 115 1HG2 ILE 115 5.250 18.267 -2.357 894 HG22 ILE 115 2HG2 ILE 115 4.553 16.916 -1.465 895 HG23 ILE 115 3HG2 ILE 115 4.557 16.896 -3.229 896 HD11 ILE 115 1HD1 ILE 115 6.069 14.718 -0.167 897 HD12 ILE 115 2HD1 ILE 115 5.547 13.329 -1.117 898 HD13 ILE 115 3HD1 ILE 115 4.560 14.791 -1.086 899 H ARG 116 H ARG 116 8.492 15.234 -5.219 900 HA ARG 116 HA ARG 116 10.877 14.696 -3.570 901 HB2 ARG 116 2HB ARG 116 9.227 12.927 -4.765 902 HB3 ARG 116 3HB ARG 116 10.251 13.216 -6.152 903 HG2 ARG 116 2HG ARG 116 11.306 12.270 -3.468 904 HG3 ARG 116 3HG ARG 116 10.765 11.170 -4.729 905 HD2 ARG 116 2HD ARG 116 12.512 12.033 -6.242 906 HD3 ARG 116 3HD ARG 116 13.044 13.163 -4.993 907 HE ARG 116 HE ARG 116 13.081 10.383 -4.204 908 HH11 ARG 116 1HH1 ARG 116 14.965 12.980 -5.683 909 HH12 ARG 116 2HH1 ARG 116 16.483 12.223 -5.324 910 HH21 ARG 116 1HH2 ARG 116 15.072 9.439 -3.761 911 HH22 ARG 116 2HH2 ARG 116 16.545 10.226 -4.241 912 H GLY 117 H GLY 117 10.656 17.230 -4.758 913 HA2 GLY 117 2HA GLY 117 11.689 17.969 -7.119 914 HA3 GLY 117 3HA GLY 117 12.076 18.777 -5.617 915 H1 SER 2 1H SER 2 17.125 -14.112 17.782 916 H2 SER 2 2H SER 2 17.542 -13.159 19.112 917 H3 SER 2 3H SER 2 18.268 -14.669 18.896 918 HA SER 2 HA SER 2 19.735 -12.859 18.320 919 HB2 SER 2 2HB SER 2 18.897 -14.557 15.928 920 HB3 SER 2 3HB SER 2 20.469 -13.778 16.156 921 HG SER 2 HG SER 2 20.382 -16.035 16.759 922 H LEU 3 H LEU 3 20.151 -11.021 17.196 923 HA LEU 3 HA LEU 3 17.900 -9.545 16.073 924 HB2 LEU 3 2HB LEU 3 20.777 -8.708 16.612 925 HB3 LEU 3 3HB LEU 3 19.473 -7.633 16.136 926 HG LEU 3 HG LEU 3 19.638 -9.147 18.769 927 HD11 LEU 3 1HD1 LEU 3 20.024 -6.193 18.184 928 HD12 LEU 3 2HD1 LEU 3 21.284 -7.349 18.628 929 HD13 LEU 3 3HD1 LEU 3 20.017 -6.948 19.781 930 HD21 LEU 3 1HD2 LEU 3 17.569 -7.142 17.811 931 HD22 LEU 3 2HD2 LEU 3 17.687 -7.801 19.447 932 HD23 LEU 3 3HD2 LEU 3 17.314 -8.867 18.095 933 H VAL 4 H VAL 4 17.529 -9.694 13.920 934 HA VAL 4 HA VAL 4 19.575 -10.418 11.999 935 HB VAL 4 HB VAL 4 17.714 -9.882 10.257 936 HG11 VAL 4 1HG1 VAL 4 16.565 -12.031 10.669 937 HG12 VAL 4 2HG1 VAL 4 17.233 -12.080 12.303 938 HG13 VAL 4 3HG1 VAL 4 18.309 -12.172 10.908 939 HG21 VAL 4 1HG2 VAL 4 16.002 -9.801 12.775 940 HG22 VAL 4 2HG2 VAL 4 15.389 -9.853 11.118 941 HG23 VAL 4 3HG2 VAL 4 16.300 -8.449 11.680 942 H LYS 5 H LYS 5 20.805 -9.124 10.873 943 HA LYS 5 HA LYS 5 21.002 -6.336 11.571 944 HB2 LYS 5 2HB LYS 5 22.665 -8.096 9.716 945 HB3 LYS 5 3HB LYS 5 23.096 -6.458 10.195 946 HG2 LYS 5 2HG LYS 5 23.359 -7.142 12.514 947 HG3 LYS 5 3HG LYS 5 22.767 -8.765 12.141 948 HD2 LYS 5 2HD LYS 5 24.736 -9.165 10.701 949 HD3 LYS 5 3HD LYS 5 25.322 -7.530 11.021 950 HE2 LYS 5 2HE LYS 5 24.904 -9.611 13.193 951 HE3 LYS 5 3HE LYS 5 26.440 -9.345 12.372 952 HZ1 LYS 5 1HZ LYS 5 24.969 -7.254 13.871 953 HZ2 LYS 5 2HZ LYS 5 26.520 -7.120 13.212 954 HZ3 LYS 5 3HZ LYS 5 26.238 -8.168 14.510 955 H LEU 6 H LEU 6 19.209 -5.310 10.610 956 HA LEU 6 HA LEU 6 18.845 -5.417 7.698 957 HB2 LEU 6 2HB LEU 6 17.253 -4.292 9.998 958 HB3 LEU 6 3HB LEU 6 17.024 -3.576 8.412 959 HG LEU 6 HG LEU 6 16.352 -5.752 7.489 960 HD11 LEU 6 1HD1 LEU 6 17.620 -7.273 8.905 961 HD12 LEU 6 2HD1 LEU 6 15.909 -7.694 8.911 962 HD13 LEU 6 3HD1 LEU 6 16.615 -6.850 10.292 963 HD21 LEU 6 1HD2 LEU 6 14.626 -4.267 8.331 964 HD22 LEU 6 2HD2 LEU 6 14.778 -4.962 9.947 965 HD23 LEU 6 3HD2 LEU 6 14.179 -5.949 8.612 966 H GLU 7 H GLU 7 20.716 -4.475 6.953 967 HA GLU 7 HA GLU 7 21.522 -1.814 7.751 968 HB2 GLU 7 2HB GLU 7 23.193 -3.455 6.967 969 HB3 GLU 7 3HB GLU 7 22.405 -3.537 5.390 970 HG2 GLU 7 2HG GLU 7 22.935 -1.153 4.992 971 HG3 GLU 7 3HG GLU 7 23.695 -1.047 6.576 972 H SER 8 H SER 8 20.711 0.015 6.973 973 HA SER 8 HA SER 8 18.669 0.129 4.933 974 HB2 SER 8 2HB SER 8 18.688 2.587 5.542 975 HB3 SER 8 3HB SER 8 18.471 1.526 6.931 976 HG SER 8 HG SER 8 20.390 2.051 7.679 977 H SER 9 H SER 9 18.880 2.007 3.304 978 HA SER 9 HA SER 9 21.084 1.680 1.551 979 HB2 SER 9 2HB SER 9 20.022 3.613 0.312 980 HB3 SER 9 3HB SER 9 18.904 2.302 0.680 981 HG SER 9 HG SER 9 18.782 4.878 1.412 982 H ASP 10 H ASP 10 20.548 3.759 4.264 983 HA ASP 10 HA ASP 10 22.768 5.571 3.702 984 HB2 ASP 10 2HB ASP 10 20.628 6.312 4.816 985 HB3 ASP 10 3HB ASP 10 21.017 5.278 6.186 986 H GLU 11 H GLU 11 22.833 2.459 4.354 987 HA GLU 11 HA GLU 11 24.435 0.993 4.952 988 HB2 GLU 11 2HB GLU 11 26.097 3.490 5.478 989 HB3 GLU 11 3HB GLU 11 26.745 1.851 5.514 990 HG2 GLU 11 2HG GLU 11 26.233 1.553 3.140 991 HG3 GLU 11 3HG GLU 11 25.464 3.139 3.083 992 H LYS 12 H LYS 12 22.650 2.490 7.069 993 HA LYS 12 HA LYS 12 24.154 1.967 9.537 994 HB2 LYS 12 2HB LYS 12 21.346 3.101 9.148 995 HB3 LYS 12 3HB LYS 12 22.202 2.994 10.682 996 HG2 LYS 12 2HG LYS 12 23.023 4.677 8.297 997 HG3 LYS 12 3HG LYS 12 22.267 5.273 9.776 998 HD2 LYS 12 2HD LYS 12 24.245 4.572 11.077 999 HD3 LYS 12 3HD LYS 12 24.995 3.935 9.611 1000 HE2 LYS 12 2HE LYS 12 24.297 6.848 10.122 1001 HE3 LYS 12 3HE LYS 12 25.909 6.143 10.202 1002 HZ1 LYS 12 1HZ LYS 12 25.748 5.607 7.849 1003 HZ2 LYS 12 2HZ LYS 12 25.549 7.267 8.108 1004 HZ3 LYS 12 3HZ LYS 12 24.207 6.294 7.775 1005 H VAL 13 H VAL 13 23.976 0.129 10.622 1006 HA VAL 13 HA VAL 13 22.233 -1.990 9.621 1007 HB VAL 13 HB VAL 13 24.517 -2.121 11.649 1008 HG11 VAL 13 1HG1 VAL 13 23.121 -4.358 10.141 1009 HG12 VAL 13 2HG1 VAL 13 22.977 -4.017 11.865 1010 HG13 VAL 13 3HG1 VAL 13 24.520 -4.548 11.201 1011 HG21 VAL 13 1HG2 VAL 13 25.323 -1.328 9.454 1012 HG22 VAL 13 2HG2 VAL 13 24.584 -2.724 8.665 1013 HG23 VAL 13 3HG2 VAL 13 25.920 -2.954 9.798 1014 H PHE 14 H PHE 14 20.214 -1.670 10.498 1015 HA PHE 14 HA PHE 14 19.827 -1.281 13.379 1016 HB2 PHE 14 2HB PHE 14 17.820 -1.470 11.082 1017 HB3 PHE 14 3HB PHE 14 17.394 -1.159 12.763 1018 HD1 PHE 14 HD1 PHE 14 18.080 0.972 13.860 1019 HD2 PHE 14 HD2 PHE 14 18.724 0.286 9.687 1020 HE1 PHE 14 HE1 PHE 14 18.453 3.378 13.516 1021 HE2 PHE 14 HE2 PHE 14 19.091 2.683 9.354 1022 HZ PHE 14 HZ PHE 14 18.963 4.233 11.264 1023 H GLU 15 H GLU 15 20.395 -3.141 14.341 1024 HA GLU 15 HA GLU 15 19.602 -5.756 13.393 1025 HB2 GLU 15 2HB GLU 15 20.967 -4.881 15.968 1026 HB3 GLU 15 3HB GLU 15 20.790 -6.548 15.429 1027 HG2 GLU 15 2HG GLU 15 22.201 -6.101 13.483 1028 HG3 GLU 15 3HG GLU 15 22.327 -4.405 13.941 1029 H ILE 16 H ILE 16 17.327 -5.507 13.402 1030 HA ILE 16 HA ILE 16 15.864 -5.119 15.907 1031 HB ILE 16 HB ILE 16 14.942 -4.178 13.797 1032 HG12 ILE 16 2HG1 ILE 16 13.217 -6.355 15.072 1033 HG13 ILE 16 3HG1 ILE 16 13.317 -4.668 15.554 1034 HG21 ILE 16 1HG2 ILE 16 14.047 -5.598 11.999 1035 HG22 ILE 16 2HG2 ILE 16 14.615 -7.041 12.841 1036 HG23 ILE 16 3HG2 ILE 16 15.780 -5.872 12.217 1037 HD11 ILE 16 1HD1 ILE 16 11.261 -5.050 14.410 1038 HD12 ILE 16 2HD1 ILE 16 12.094 -5.760 13.028 1039 HD13 ILE 16 3HD1 ILE 16 12.287 -4.044 13.392 1040 H GLU 17 H GLU 17 14.437 -6.746 16.776 1041 HA GLU 17 HA GLU 17 15.417 -9.365 16.986 1042 HB2 GLU 17 2HB GLU 17 12.612 -8.344 17.605 1043 HB3 GLU 17 3HB GLU 17 13.264 -9.890 18.130 1044 HG2 GLU 17 2HG GLU 17 13.436 -8.530 20.033 1045 HG3 GLU 17 3HG GLU 17 15.067 -8.537 19.377 1046 H LYS 18 H LYS 18 14.929 -11.225 15.960 1047 HA LYS 18 HA LYS 18 14.414 -11.034 13.209 1048 HB2 LYS 18 2HB LYS 18 15.978 -12.626 14.235 1049 HB3 LYS 18 3HB LYS 18 14.641 -13.481 14.996 1050 HG2 LYS 18 2HG LYS 18 13.848 -14.292 12.868 1051 HG3 LYS 18 3HG LYS 18 14.963 -13.235 11.990 1052 HD2 LYS 18 2HD LYS 18 16.892 -14.482 12.916 1053 HD3 LYS 18 3HD LYS 18 15.789 -15.534 13.812 1054 HE2 LYS 18 2HE LYS 18 15.852 -15.284 10.790 1055 HE3 LYS 18 3HE LYS 18 16.650 -16.556 11.714 1056 HZ1 LYS 18 1HZ LYS 18 13.731 -16.033 11.638 1057 HZ2 LYS 18 2HZ LYS 18 14.479 -17.241 12.551 1058 HZ3 LYS 18 3HZ LYS 18 14.536 -17.300 10.862 1059 H GLU 19 H GLU 19 12.415 -12.246 15.858 1060 HA GLU 19 HA GLU 19 10.287 -13.327 14.345 1061 HB2 GLU 19 2HB GLU 19 8.987 -13.200 16.460 1062 HB3 GLU 19 3HB GLU 19 10.593 -13.873 16.705 1063 HG2 GLU 19 2HG GLU 19 11.362 -11.640 17.540 1064 HG3 GLU 19 3HG GLU 19 9.709 -11.047 17.386 1065 H ILE 20 H ILE 20 11.014 -10.045 15.311 1066 HA ILE 20 HA ILE 20 8.391 -8.954 14.723 1067 HB ILE 20 HB ILE 20 10.989 -7.458 15.308 1068 HG12 ILE 20 2HG1 ILE 20 8.830 -8.453 17.230 1069 HG13 ILE 20 3HG1 ILE 20 10.515 -8.947 17.196 1070 HG21 ILE 20 1HG2 ILE 20 9.521 -5.583 15.930 1071 HG22 ILE 20 2HG2 ILE 20 8.099 -6.538 15.506 1072 HG23 ILE 20 3HG2 ILE 20 9.249 -6.065 14.254 1073 HD11 ILE 20 1HD1 ILE 20 10.087 -7.470 19.052 1074 HD12 ILE 20 2HD1 ILE 20 9.476 -6.222 17.971 1075 HD13 ILE 20 3HD1 ILE 20 11.177 -6.691 17.907 1076 H ALA 21 H ALA 21 11.551 -9.165 13.125 1077 HA ALA 21 HA ALA 21 11.084 -7.433 10.940 1078 HB1 ALA 21 1HB ALA 21 12.962 -8.583 9.858 1079 HB2 ALA 21 2HB ALA 21 12.864 -9.885 11.047 1080 HB3 ALA 21 3HB ALA 21 13.316 -8.258 11.555 1081 H CYS 22 H CYS 22 10.071 -10.707 11.553 1082 HA CYS 22 HA CYS 22 9.343 -11.530 8.949 1083 HB2 CYS 22 2HB CYS 22 8.273 -12.430 11.646 1084 HB3 CYS 22 3HB CYS 22 8.075 -13.302 10.124 1085 HG CYS 22 HG CYS 22 11.271 -12.624 10.846 1086 H MET 23 H MET 23 7.747 -9.402 11.214 1087 HA MET 23 HA MET 23 5.049 -9.629 10.378 1088 HB2 MET 23 2HB MET 23 6.543 -7.253 11.550 1089 HB3 MET 23 3HB MET 23 4.800 -7.304 11.329 1090 HG2 MET 23 2HG MET 23 4.637 -9.178 12.898 1091 HG3 MET 23 3HG MET 23 6.393 -9.168 13.100 1092 HE1 MET 23 1HE MET 23 3.096 -7.017 13.514 1093 HE2 MET 23 2HE MET 23 4.175 -5.877 12.704 1094 HE3 MET 23 3HE MET 23 3.714 -5.615 14.385 1095 H SER 24 H SER 24 7.751 -7.846 9.041 1096 HA SER 24 HA SER 24 6.229 -6.524 6.961 1097 HB2 SER 24 2HB SER 24 8.346 -5.528 7.632 1098 HB3 SER 24 3HB SER 24 9.212 -7.040 7.343 1099 HG SER 24 HG SER 24 7.851 -5.557 5.338 1100 H VAL 25 H VAL 25 5.624 -7.430 5.052 1101 HA VAL 25 HA VAL 25 5.778 -10.218 4.608 1102 HB VAL 25 HB VAL 25 5.064 -8.049 2.569 1103 HG11 VAL 25 1HG1 VAL 25 4.405 -11.023 2.570 1104 HG12 VAL 25 2HG1 VAL 25 5.534 -10.206 1.486 1105 HG13 VAL 25 3HG1 VAL 25 3.812 -9.840 1.399 1106 HG21 VAL 25 1HG2 VAL 25 3.642 -7.872 4.579 1107 HG22 VAL 25 2HG2 VAL 25 3.219 -9.580 4.450 1108 HG23 VAL 25 3HG2 VAL 25 2.703 -8.446 3.199 1109 H THR 26 H THR 26 7.409 -7.473 2.996 1110 HA THR 26 HA THR 26 8.890 -8.946 1.124 1111 HB THR 26 HB THR 26 9.479 -6.202 2.311 1112 HG1 THR 26 HG1 THR 26 8.514 -5.681 0.132 1113 HG21 THR 26 1HG2 THR 26 10.777 -5.770 0.240 1114 HG22 THR 26 2HG2 THR 26 10.569 -7.453 -0.244 1115 HG23 THR 26 3HG2 THR 26 11.513 -7.062 1.194 1116 H ILE 27 H ILE 27 9.890 -7.757 4.377 1117 HA ILE 27 HA ILE 27 12.577 -8.679 4.238 1118 HB ILE 27 HB ILE 27 10.867 -8.149 6.715 1119 HG12 ILE 27 2HG1 ILE 27 12.930 -6.330 5.379 1120 HG13 ILE 27 3HG1 ILE 27 11.190 -6.181 5.159 1121 HG21 ILE 27 1HG2 ILE 27 12.795 -9.574 7.301 1122 HG22 ILE 27 2HG2 ILE 27 13.007 -7.955 7.964 1123 HG23 ILE 27 3HG2 ILE 27 13.896 -8.437 6.518 1124 HD11 ILE 27 1HD1 ILE 27 12.064 -4.565 6.756 1125 HD12 ILE 27 2HD1 ILE 27 12.635 -5.876 7.786 1126 HD13 ILE 27 3HD1 ILE 27 10.909 -5.661 7.505 1127 H LYS 28 H LYS 28 9.600 -10.153 5.556 1128 HA LYS 28 HA LYS 28 10.649 -12.540 6.604 1129 HB2 LYS 28 2HB LYS 28 8.324 -11.749 6.991 1130 HB3 LYS 28 3HB LYS 28 7.934 -12.057 5.303 1131 HG2 LYS 28 2HG LYS 28 8.408 -14.507 5.710 1132 HG3 LYS 28 3HG LYS 28 8.626 -14.125 7.420 1133 HD2 LYS 28 2HD LYS 28 6.365 -14.999 6.998 1134 HD3 LYS 28 3HD LYS 28 6.292 -13.324 7.555 1135 HE2 LYS 28 2HE LYS 28 4.715 -13.753 5.701 1136 HE3 LYS 28 3HE LYS 28 5.926 -12.552 5.250 1137 HZ1 LYS 28 1HZ LYS 28 5.640 -14.055 3.451 1138 HZ2 LYS 28 2HZ LYS 28 5.829 -15.402 4.445 1139 HZ3 LYS 28 3HZ LYS 28 7.148 -14.401 4.135 1140 H ASN 29 H ASN 29 9.415 -11.775 3.362 1141 HA ASN 29 HA ASN 29 9.771 -14.339 2.182 1142 HB2 ASN 29 2HB ASN 29 9.363 -11.564 0.988 1143 HB3 ASN 29 3HB ASN 29 9.539 -12.998 -0.022 1144 HD21 ASN 29 1HD2 ASN 29 7.437 -12.646 -0.861 1145 HD22 ASN 29 2HD2 ASN 29 6.020 -13.018 0.054 1146 H MET 30 H MET 30 11.878 -11.532 2.536 1147 HA MET 30 HA MET 30 13.940 -12.326 0.753 1148 HB2 MET 30 2HB MET 30 13.977 -10.535 3.222 1149 HB3 MET 30 3HB MET 30 15.433 -10.863 2.290 1150 HG2 MET 30 2HG MET 30 12.936 -9.550 1.198 1151 HG3 MET 30 3HG MET 30 14.409 -8.714 1.688 1152 HE1 MET 30 1HE MET 30 14.520 -8.395 -2.231 1153 HE2 MET 30 2HE MET 30 14.567 -7.518 -0.701 1154 HE3 MET 30 3HE MET 30 13.084 -8.327 -1.214 1155 H ILE 31 H ILE 31 13.509 -12.780 4.273 1156 HA ILE 31 HA ILE 31 15.829 -14.267 4.821 1157 HB ILE 31 HB ILE 31 13.126 -14.367 6.263 1158 HG12 ILE 31 2HG1 ILE 31 15.620 -12.731 6.936 1159 HG13 ILE 31 3HG1 ILE 31 14.178 -12.086 6.168 1160 HG21 ILE 31 1HG2 ILE 31 14.372 -15.231 8.234 1161 HG22 ILE 31 2HG2 ILE 31 15.845 -15.304 7.268 1162 HG23 ILE 31 3HG2 ILE 31 14.479 -16.342 6.863 1163 HD11 ILE 31 1HD1 ILE 31 14.349 -13.215 8.962 1164 HD12 ILE 31 2HD1 ILE 31 12.884 -12.602 8.190 1165 HD13 ILE 31 3HD1 ILE 31 14.234 -11.514 8.508 1166 H GLU 32 H GLU 32 12.551 -15.321 3.887 1167 HA GLU 32 HA GLU 32 12.982 -18.129 4.088 1168 HB2 GLU 32 2HB GLU 32 10.910 -16.562 2.491 1169 HB3 GLU 32 3HB GLU 32 10.875 -18.309 2.721 1170 HG2 GLU 32 2HG GLU 32 10.620 -18.029 5.137 1171 HG3 GLU 32 3HG GLU 32 10.748 -16.278 4.967 1172 H ASP 33 H ASP 33 13.275 -15.844 1.382 1173 HA ASP 33 HA ASP 33 13.586 -17.753 -0.718 1174 HB2 ASP 33 2HB ASP 33 12.886 -15.348 -1.048 1175 HB3 ASP 33 3HB ASP 33 14.529 -14.838 -0.683 1176 H ILE 34 H ILE 34 15.860 -15.865 1.217 1177 HA ILE 34 HA ILE 34 18.283 -16.862 0.072 1178 HB ILE 34 HB ILE 34 17.730 -15.481 2.748 1179 HG12 ILE 34 2HG1 ILE 34 18.841 -14.339 0.134 1180 HG13 ILE 34 3HG1 ILE 34 17.186 -14.139 0.695 1181 HG21 ILE 34 1HG2 ILE 34 20.434 -15.948 1.431 1182 HG22 ILE 34 2HG2 ILE 34 19.857 -16.712 2.913 1183 HG23 ILE 34 3HG2 ILE 34 20.151 -14.973 2.876 1184 HD11 ILE 34 1HD1 ILE 34 19.660 -13.057 2.040 1185 HD12 ILE 34 2HD1 ILE 34 18.009 -12.891 2.642 1186 HD13 ILE 34 3HD1 ILE 34 18.469 -12.147 1.112 1187 H GLY 35 H GLY 35 16.032 -18.118 2.396 1188 HA2 GLY 35 2HA GLY 35 15.889 -20.287 3.233 1189 HA3 GLY 35 3HA GLY 35 17.539 -20.604 2.712 1190 H GLU 36 H GLU 36 17.002 -17.722 4.427 1191 HA GLU 36 HA GLU 36 17.323 -16.883 6.444 1192 HB2 GLU 36 2HB GLU 36 15.950 -18.717 7.377 1193 HB3 GLU 36 3HB GLU 36 17.384 -19.732 7.505 1194 HG2 GLU 36 2HG GLU 36 18.377 -18.140 9.104 1195 HG3 GLU 36 3HG GLU 36 16.947 -17.115 8.988 1196 H SER 37 H SER 37 19.155 -15.868 6.720 1197 HA SER 37 HA SER 37 21.671 -17.274 7.270 1198 HB2 SER 37 2HB SER 37 21.326 -15.197 5.051 1199 HB3 SER 37 3HB SER 37 22.882 -15.791 5.627 1200 HG SER 37 HG SER 37 22.183 -17.903 5.017 1201 H ASP 38 H ASP 38 23.158 -16.003 8.430 1202 HA ASP 38 HA ASP 38 22.046 -13.846 10.022 1203 HB2 ASP 38 2HB ASP 38 24.161 -13.987 11.299 1204 HB3 ASP 38 3HB ASP 38 23.449 -15.580 11.090 1205 H SER 39 H SER 39 23.533 -13.987 7.036 1206 HA SER 39 HA SER 39 25.295 -11.894 6.801 1207 HB2 SER 39 2HB SER 39 23.117 -12.675 4.810 1208 HB3 SER 39 3HB SER 39 24.600 -11.795 4.428 1209 HG SER 39 HG SER 39 25.735 -13.672 5.229 1210 HA PRO 40 HA PRO 40 22.813 -8.230 7.896 1211 HB2 PRO 40 2HB PRO 40 24.879 -6.755 6.270 1212 HB3 PRO 40 3HB PRO 40 24.373 -6.500 7.956 1213 HG2 PRO 40 2HG PRO 40 26.726 -7.625 7.411 1214 HG3 PRO 40 3HG PRO 40 25.741 -8.204 8.777 1215 HD2 PRO 40 2HD PRO 40 26.079 -9.426 6.038 1216 HD3 PRO 40 3HD PRO 40 26.031 -10.219 7.630 1217 H ILE 41 H ILE 41 20.938 -8.249 6.798 1218 HA ILE 41 HA ILE 41 20.611 -8.435 3.988 1219 HB ILE 41 HB ILE 41 18.562 -7.554 6.081 1220 HG12 ILE 41 2HG1 ILE 41 19.469 -9.779 6.646 1221 HG13 ILE 41 3HG1 ILE 41 17.805 -9.932 6.102 1222 HG21 ILE 41 1HG2 ILE 41 17.823 -6.969 3.813 1223 HG22 ILE 41 2HG2 ILE 41 16.842 -8.287 4.448 1224 HG23 ILE 41 3HG2 ILE 41 18.107 -8.622 3.264 1225 HD11 ILE 41 1HD1 ILE 41 19.145 -11.733 5.226 1226 HD12 ILE 41 2HD1 ILE 41 20.286 -10.598 4.511 1227 HD13 ILE 41 3HD1 ILE 41 18.635 -10.695 3.893 1228 HA PRO 42 HA PRO 42 21.154 -3.920 3.450 1229 HB2 PRO 42 2HB PRO 42 21.982 -3.930 0.869 1230 HB3 PRO 42 3HB PRO 42 23.041 -4.499 2.175 1231 HG2 PRO 42 2HG PRO 42 21.498 -6.095 0.180 1232 HG3 PRO 42 3HG PRO 42 23.099 -6.410 0.880 1233 HD2 PRO 42 2HD PRO 42 20.673 -7.584 1.730 1234 HD3 PRO 42 3HD PRO 42 22.204 -7.594 2.629 1235 H LEU 43 H LEU 43 19.564 -2.512 2.989 1236 HA LEU 43 HA LEU 43 17.435 -3.198 1.042 1237 HB2 LEU 43 2HB LEU 43 17.199 -1.579 3.621 1238 HB3 LEU 43 3HB LEU 43 15.900 -1.817 2.461 1239 HG LEU 43 HG LEU 43 17.202 -4.022 4.114 1240 HD11 LEU 43 1HD1 LEU 43 15.849 -2.564 5.525 1241 HD12 LEU 43 2HD1 LEU 43 15.083 -4.142 5.352 1242 HD13 LEU 43 3HD1 LEU 43 14.464 -2.756 4.445 1243 HD21 LEU 43 1HD2 LEU 43 14.860 -4.187 2.186 1244 HD22 LEU 43 2HD2 LEU 43 15.391 -5.483 3.263 1245 HD23 LEU 43 3HD2 LEU 43 16.457 -4.915 1.980 1246 HA PRO 44 HA PRO 44 19.653 0.543 -0.557 1247 HB2 PRO 44 2HB PRO 44 19.726 -0.137 -3.171 1248 HB3 PRO 44 3HB PRO 44 20.734 -0.993 -1.987 1249 HG2 PRO 44 2HG PRO 44 18.130 -1.855 -3.198 1250 HG3 PRO 44 3HG PRO 44 19.611 -2.801 -2.933 1251 HD2 PRO 44 2HD PRO 44 17.427 -2.850 -1.226 1252 HD3 PRO 44 3HD PRO 44 19.087 -3.251 -0.734 1253 H ASN 45 H ASN 45 17.257 1.150 0.275 1254 HA ASN 45 HA ASN 45 15.985 2.761 -1.740 1255 HB2 ASN 45 2HB ASN 45 14.951 0.505 -2.176 1256 HB3 ASN 45 3HB ASN 45 14.394 0.447 -0.513 1257 HD21 ASN 45 1HD2 ASN 45 12.890 0.331 -3.026 1258 HD22 ASN 45 2HD2 ASN 45 11.717 1.596 -2.941 1259 H VAL 46 H VAL 46 15.188 1.169 1.365 1260 HA VAL 46 HA VAL 46 14.055 3.598 2.442 1261 HB VAL 46 HB VAL 46 13.008 1.427 2.938 1262 HG11 VAL 46 1HG1 VAL 46 13.996 -0.227 4.450 1263 HG12 VAL 46 2HG1 VAL 46 15.491 0.708 4.522 1264 HG13 VAL 46 3HG1 VAL 46 14.981 -0.023 2.998 1265 HG21 VAL 46 1HG2 VAL 46 14.079 2.771 5.442 1266 HG22 VAL 46 2HG2 VAL 46 12.673 1.706 5.368 1267 HG23 VAL 46 3HG2 VAL 46 12.653 3.253 4.520 1268 H THR 47 H THR 47 15.112 5.105 3.576 1269 HA THR 47 HA THR 47 17.958 4.965 4.049 1270 HB THR 47 HB THR 47 17.688 7.314 4.865 1271 HG1 THR 47 HG1 THR 47 15.644 8.204 5.009 1272 HG21 THR 47 1HG2 THR 47 16.857 8.313 2.759 1273 HG22 THR 47 2HG2 THR 47 16.175 6.758 2.281 1274 HG23 THR 47 3HG2 THR 47 17.925 6.946 2.430 1275 H SER 48 H SER 48 18.688 6.016 6.283 1276 HA SER 48 HA SER 48 18.263 3.988 8.208 1277 HB2 SER 48 2HB SER 48 19.745 5.368 9.676 1278 HB3 SER 48 3HB SER 48 20.412 5.110 8.065 1279 HG SER 48 HG SER 48 20.665 7.254 8.616 1280 H THR 49 H THR 49 17.197 7.383 8.082 1281 HA THR 49 HA THR 49 15.983 7.554 10.614 1282 HB THR 49 HB THR 49 14.670 9.484 9.570 1283 HG1 THR 49 HG1 THR 49 15.283 10.022 7.402 1284 HG21 THR 49 1HG2 THR 49 17.666 9.499 9.043 1285 HG22 THR 49 2HG2 THR 49 16.896 9.886 10.583 1286 HG23 THR 49 3HG2 THR 49 16.632 10.924 9.181 1287 H ILE 50 H ILE 50 14.686 6.602 7.456 1288 HA ILE 50 HA ILE 50 11.953 6.443 8.310 1289 HB ILE 50 HB ILE 50 13.297 5.400 5.773 1290 HG12 ILE 50 2HG1 ILE 50 13.526 7.830 5.980 1291 HG13 ILE 50 3HG1 ILE 50 12.355 7.471 4.718 1292 HG21 ILE 50 1HG2 ILE 50 10.336 5.776 6.341 1293 HG22 ILE 50 2HG2 ILE 50 11.169 4.234 6.141 1294 HG23 ILE 50 3HG2 ILE 50 11.035 5.346 4.779 1295 HD11 ILE 50 1HD1 ILE 50 10.529 7.992 6.310 1296 HD12 ILE 50 2HD1 ILE 50 11.624 9.346 6.037 1297 HD13 ILE 50 3HD1 ILE 50 11.742 8.412 7.525 1298 H LEU 51 H LEU 51 14.525 4.040 7.651 1299 HA LEU 51 HA LEU 51 12.987 1.720 8.165 1300 HB2 LEU 51 2HB LEU 51 15.177 1.732 6.928 1301 HB3 LEU 51 3HB LEU 51 16.007 2.033 8.446 1302 HG LEU 51 HG LEU 51 15.207 -0.177 9.310 1303 HD11 LEU 51 1HD1 LEU 51 14.043 -0.588 6.537 1304 HD12 LEU 51 2HD1 LEU 51 13.134 -0.404 8.039 1305 HD13 LEU 51 3HD1 LEU 51 14.162 -1.814 7.804 1306 HD21 LEU 51 1HD2 LEU 51 16.663 -1.611 7.949 1307 HD22 LEU 51 2HD2 LEU 51 17.417 -0.046 8.248 1308 HD23 LEU 51 3HD2 LEU 51 16.699 -0.391 6.671 1309 H GLU 52 H GLU 52 14.870 3.849 10.246 1310 HA GLU 52 HA GLU 52 14.881 2.439 12.664 1311 HB2 GLU 52 2HB GLU 52 16.153 4.531 12.186 1312 HB3 GLU 52 3HB GLU 52 14.663 5.454 12.199 1313 HG2 GLU 52 2HG GLU 52 15.589 3.922 14.637 1314 HG3 GLU 52 3HG GLU 52 16.211 5.526 14.281 1315 H LYS 53 H LYS 53 12.508 4.764 11.384 1316 HA LYS 53 HA LYS 53 10.618 4.682 13.460 1317 HB2 LYS 53 2HB LYS 53 10.174 5.228 10.494 1318 HB3 LYS 53 3HB LYS 53 9.019 5.595 11.772 1319 HG2 LYS 53 2HG LYS 53 10.614 7.210 12.748 1320 HG3 LYS 53 3HG LYS 53 11.758 6.850 11.449 1321 HD2 LYS 53 2HD LYS 53 10.048 7.614 9.783 1322 HD3 LYS 53 3HD LYS 53 8.982 8.058 11.119 1323 HE2 LYS 53 2HE LYS 53 11.685 9.265 10.475 1324 HE3 LYS 53 3HE LYS 53 10.108 10.026 10.271 1325 HZ1 LYS 53 1HZ LYS 53 11.339 9.233 12.861 1326 HZ2 LYS 53 2HZ LYS 53 9.808 9.924 12.685 1327 HZ3 LYS 53 3HZ LYS 53 11.189 10.814 12.269 1328 H VAL 54 H VAL 54 10.807 2.865 10.415 1329 HA VAL 54 HA VAL 54 8.331 1.574 10.494 1330 HB VAL 54 HB VAL 54 10.931 0.828 9.077 1331 HG11 VAL 54 1HG1 VAL 54 9.593 -0.721 7.660 1332 HG12 VAL 54 2HG1 VAL 54 8.204 -0.470 8.717 1333 HG13 VAL 54 3HG1 VAL 54 9.659 -1.246 9.343 1334 HG21 VAL 54 1HG2 VAL 54 9.788 1.693 7.054 1335 HG22 VAL 54 2HG2 VAL 54 9.862 2.927 8.313 1336 HG23 VAL 54 3HG2 VAL 54 8.353 2.065 8.019 1337 H LEU 55 H LEU 55 11.533 0.442 11.593 1338 HA LEU 55 HA LEU 55 10.653 -2.164 12.376 1339 HB2 LEU 55 2HB LEU 55 13.195 -0.660 13.098 1340 HB3 LEU 55 3HB LEU 55 12.919 -2.369 13.392 1341 HG LEU 55 HG LEU 55 13.192 -1.007 10.689 1342 HD11 LEU 55 1HD1 LEU 55 14.928 -3.089 12.039 1343 HD12 LEU 55 2HD1 LEU 55 15.311 -1.380 11.824 1344 HD13 LEU 55 3HD1 LEU 55 15.168 -2.430 10.418 1345 HD21 LEU 55 1HD2 LEU 55 11.450 -2.711 10.492 1346 HD22 LEU 55 2HD2 LEU 55 12.516 -3.921 11.211 1347 HD23 LEU 55 3HD2 LEU 55 12.908 -3.213 9.642 1348 H ASP 56 H ASP 56 10.901 0.909 14.021 1349 HA ASP 56 HA ASP 56 10.663 -0.051 16.715 1350 HB2 ASP 56 2HB ASP 56 11.519 2.276 15.795 1351 HB3 ASP 56 3HB ASP 56 9.823 2.735 15.822 1352 H TYR 57 H TYR 57 8.403 1.127 14.247 1353 HA TYR 57 HA TYR 57 6.030 1.003 15.840 1354 HB2 TYR 57 2HB TYR 57 6.221 2.444 13.834 1355 HB3 TYR 57 3HB TYR 57 6.344 1.025 12.805 1356 HD1 TYR 57 HD1 TYR 57 4.339 -0.011 11.965 1357 HD2 TYR 57 HD2 TYR 57 4.043 2.794 15.178 1358 HE1 TYR 57 HE1 TYR 57 1.893 -0.042 11.758 1359 HE2 TYR 57 HE2 TYR 57 1.593 2.771 14.967 1360 HH TYR 57 HH TYR 57 -0.106 2.257 13.300 1361 H CYS 58 H CYS 58 7.616 -1.223 13.573 1362 HA CYS 58 HA CYS 58 5.689 -3.266 13.529 1363 HB2 CYS 58 2HB CYS 58 8.715 -3.420 13.232 1364 HB3 CYS 58 3HB CYS 58 7.626 -4.770 12.915 1365 HG CYS 58 HG CYS 58 7.138 -1.847 11.246 1366 H ARG 59 H ARG 59 8.397 -2.585 15.771 1367 HA ARG 59 HA ARG 59 8.104 -4.803 17.478 1368 HB2 ARG 59 2HB ARG 59 10.084 -3.415 17.637 1369 HB3 ARG 59 3HB ARG 59 9.124 -1.997 18.066 1370 HG2 ARG 59 2HG ARG 59 8.489 -3.066 20.211 1371 HG3 ARG 59 3HG ARG 59 9.422 -4.499 19.779 1372 HD2 ARG 59 2HD ARG 59 10.576 -1.719 20.160 1373 HD3 ARG 59 3HD ARG 59 10.619 -3.014 21.362 1374 HE ARG 59 HE ARG 59 11.931 -4.311 19.705 1375 HH11 ARG 59 1HH1 ARG 59 11.982 -0.808 19.494 1376 HH12 ARG 59 2HH1 ARG 59 13.522 -0.767 18.704 1377 HH21 ARG 59 1HH2 ARG 59 13.903 -4.265 18.691 1378 HH22 ARG 59 2HH2 ARG 59 14.626 -2.751 18.239 1379 H HIS 60 H HIS 60 6.662 -1.547 17.651 1380 HA HIS 60 HA HIS 60 5.221 -1.751 20.021 1381 HB2 HIS 60 2HB HIS 60 5.443 0.390 18.937 1382 HB3 HIS 60 3HB HIS 60 4.677 -0.197 17.464 1383 HD1 HIS 60 HD1 HIS 60 3.799 0.703 21.046 1384 HD2 HIS 60 HD2 HIS 60 1.972 0.160 17.362 1385 HE1 HIS 60 HE1 HIS 60 1.415 1.431 21.358 1386 HE2 HIS 60 HE2 HIS 60 0.452 1.364 19.041 1387 H HIS 61 H HIS 61 4.165 -2.563 16.732 1388 HA HIS 61 HA HIS 61 1.552 -3.468 17.500 1389 HB2 HIS 61 2HB HIS 61 2.202 -2.459 15.246 1390 HB3 HIS 61 3HB HIS 61 3.007 -3.977 14.871 1391 HD1 HIS 61 HD1 HIS 61 1.312 -6.148 14.907 1392 HD2 HIS 61 HD2 HIS 61 -0.437 -2.405 14.573 1393 HE1 HIS 61 HE1 HIS 61 -0.996 -6.566 14.035 1394 HE2 HIS 61 HE2 HIS 61 -1.985 -4.281 13.706 1395 H HIS 62 H HIS 62 4.691 -4.947 17.446 1396 HA HIS 62 HA HIS 62 3.766 -7.696 17.284 1397 HB2 HIS 62 2HB HIS 62 6.075 -6.879 16.535 1398 HB3 HIS 62 3HB HIS 62 6.497 -6.709 18.235 1399 HD1 HIS 62 HD1 HIS 62 6.168 -9.176 15.520 1400 HD2 HIS 62 HD2 HIS 62 6.699 -9.244 19.637 1401 HE1 HIS 62 HE1 HIS 62 6.918 -11.503 16.066 1402 HE2 HIS 62 HE2 HIS 62 7.090 -11.558 18.566 1403 H GLN 63 H GLN 63 4.725 -5.401 19.793 1404 HA GLN 63 HA GLN 63 4.601 -7.265 21.992 1405 HB2 GLN 63 2HB GLN 63 4.643 -4.212 22.079 1406 HB3 GLN 63 3HB GLN 63 4.957 -5.294 23.429 1407 HG2 GLN 63 2HG GLN 63 6.695 -4.854 20.990 1408 HG3 GLN 63 3HG GLN 63 7.056 -4.411 22.652 1409 HE21 GLN 63 1HE2 GLN 63 7.637 -6.065 24.121 1410 HE22 GLN 63 2HE2 GLN 63 8.209 -7.600 23.577 1411 H HIS 64 H HIS 64 2.432 -5.044 20.399 1412 HA HIS 64 HA HIS 64 0.174 -6.044 22.040 1413 HB2 HIS 64 2HB HIS 64 0.453 -3.252 20.824 1414 HB3 HIS 64 3HB HIS 64 -0.976 -3.856 21.655 1415 HD1 HIS 64 HD1 HIS 64 -1.012 -3.664 24.185 1416 HD2 HIS 64 HD2 HIS 64 2.725 -2.795 22.581 1417 HE1 HIS 64 HE1 HIS 64 0.351 -2.757 26.088 1418 HE2 HIS 64 HE2 HIS 64 2.644 -2.407 25.130 1419 HA PRO 65 HA PRO 65 -0.556 -7.085 17.554 1420 HB2 PRO 65 2HB PRO 65 -0.180 -9.731 17.577 1421 HB3 PRO 65 3HB PRO 65 1.214 -8.649 17.775 1422 HG2 PRO 65 2HG PRO 65 -0.195 -10.290 19.830 1423 HG3 PRO 65 3HG PRO 65 1.525 -9.857 19.717 1424 HD2 PRO 65 2HD PRO 65 -0.495 -8.531 21.286 1425 HD3 PRO 65 3HD PRO 65 1.199 -8.042 21.071 1426 H GLY 66 H GLY 66 -2.485 -6.808 19.905 1427 HA2 GLY 66 2HA GLY 66 -4.463 -8.850 19.769 1428 HA3 GLY 66 3HA GLY 66 -4.672 -7.234 20.427 1429 H GLY 67 H GLY 67 -4.739 -5.454 18.711 1430 HA2 GLY 67 2HA GLY 67 -5.621 -4.451 16.854 1431 HA3 GLY 67 3HA GLY 67 -5.585 -6.005 16.041 1432 H SER 68 H SER 68 -7.334 -6.487 18.806 1433 HA SER 68 HA SER 68 -9.868 -6.532 17.409 1434 HB2 SER 68 2HB SER 68 -10.619 -7.613 19.618 1435 HB3 SER 68 3HB SER 68 -9.339 -8.471 18.760 1436 HG SER 68 HG SER 68 -8.937 -8.236 21.019 1437 H GLY 69 H GLY 69 -9.875 -4.192 17.157 1438 HA2 GLY 69 2HA GLY 69 -11.017 -2.246 17.621 1439 HA3 GLY 69 3HA GLY 69 -11.311 -2.792 19.264 1440 H LEU 70 H LEU 70 -8.724 -3.321 20.119 1441 HA LEU 70 HA LEU 70 -7.325 -2.334 21.525 1442 HB2 LEU 70 2HB LEU 70 -5.408 -1.126 20.476 1443 HB3 LEU 70 3HB LEU 70 -5.804 -2.664 19.752 1444 HG LEU 70 HG LEU 70 -6.964 -1.315 17.864 1445 HD11 LEU 70 1HD1 LEU 70 -6.161 0.960 17.444 1446 HD12 LEU 70 2HD1 LEU 70 -5.351 0.981 19.013 1447 HD13 LEU 70 3HD1 LEU 70 -7.111 0.870 18.926 1448 HD21 LEU 70 1HD2 LEU 70 -4.846 -0.980 16.643 1449 HD22 LEU 70 2HD2 LEU 70 -4.861 -2.506 17.520 1450 HD23 LEU 70 3HD2 LEU 70 -3.944 -1.139 18.154 1451 H ASP 71 H ASP 71 -9.821 -1.028 21.409 1452 HA ASP 71 HA ASP 71 -10.988 0.727 22.147 1453 HB2 ASP 71 2HB ASP 71 -8.332 1.494 23.416 1454 HB3 ASP 71 3HB ASP 71 -9.811 2.400 23.697 1455 H ASP 72 H ASP 72 -7.979 2.544 21.642 1456 HA ASP 72 HA ASP 72 -8.939 3.824 19.218 1457 HB2 ASP 72 2HB ASP 72 -8.506 5.296 21.857 1458 HB3 ASP 72 3HB ASP 72 -8.334 6.122 20.315 1459 H ILE 73 H ILE 73 -7.184 5.190 18.332 1460 HA ILE 73 HA ILE 73 -4.702 3.901 18.245 1461 HB ILE 73 HB ILE 73 -5.538 6.705 17.420 1462 HG12 ILE 73 2HG1 ILE 73 -6.665 4.891 16.172 1463 HG13 ILE 73 3HG1 ILE 73 -5.569 5.770 15.115 1464 HG21 ILE 73 1HG2 ILE 73 -2.918 5.311 16.769 1465 HG22 ILE 73 2HG2 ILE 73 -3.119 6.749 17.768 1466 HG23 ILE 73 3HG2 ILE 73 -3.469 6.822 16.042 1467 HD11 ILE 73 1HD1 ILE 73 -5.053 3.064 16.361 1468 HD12 ILE 73 2HD1 ILE 73 -3.926 3.943 15.325 1469 HD13 ILE 73 3HD1 ILE 73 -5.470 3.391 14.680 1470 HA PRO 74 HA PRO 74 -3.055 5.411 22.250 1471 HB2 PRO 74 2HB PRO 74 -0.539 4.165 21.126 1472 HB3 PRO 74 3HB PRO 74 -1.323 3.903 22.700 1473 HG2 PRO 74 2HG PRO 74 -1.494 2.049 20.820 1474 HG3 PRO 74 3HG PRO 74 -2.918 2.437 21.820 1475 HD2 PRO 74 2HD PRO 74 -2.296 3.313 19.000 1476 HD3 PRO 74 3HD PRO 74 -3.832 2.737 19.691 1477 HA PRO 75 HA PRO 75 -1.072 9.358 21.333 1478 HB2 PRO 75 2HB PRO 75 0.770 8.579 23.617 1479 HB3 PRO 75 3HB PRO 75 -0.085 10.112 23.327 1480 HG2 PRO 75 2HG PRO 75 -1.040 8.417 25.120 1481 HG3 PRO 75 3HG PRO 75 -2.154 9.257 24.014 1482 HD2 PRO 75 2HD PRO 75 -1.202 6.407 23.931 1483 HD3 PRO 75 3HD PRO 75 -2.800 7.076 23.530 1484 H TYR 76 H TYR 76 1.116 6.585 21.980 1485 HA TYR 76 HA TYR 76 3.463 7.448 20.792 1486 HB2 TYR 76 2HB TYR 76 3.506 5.359 21.997 1487 HB3 TYR 76 3HB TYR 76 2.274 4.646 20.964 1488 HD1 TYR 76 HD1 TYR 76 2.874 3.605 18.837 1489 HD2 TYR 76 HD2 TYR 76 5.874 5.622 21.129 1490 HE1 TYR 76 HE1 TYR 76 4.608 2.681 17.370 1491 HE2 TYR 76 HE2 TYR 76 7.612 4.685 19.653 1492 HH TYR 76 HH TYR 76 7.879 2.721 18.104 1493 H ASP 77 H ASP 77 0.746 5.770 19.220 1494 HA ASP 77 HA ASP 77 1.968 5.456 16.673 1495 HB2 ASP 77 2HB ASP 77 -0.979 5.375 17.442 1496 HB3 ASP 77 3HB ASP 77 -0.317 4.793 15.914 1497 H ARG 78 H ARG 78 -0.135 7.906 18.060 1498 HA ARG 78 HA ARG 78 -0.609 9.469 15.737 1499 HB2 ARG 78 2HB ARG 78 -0.513 10.257 18.686 1500 HB3 ARG 78 3HB ARG 78 -1.043 11.343 17.399 1501 HG2 ARG 78 2HG ARG 78 -2.854 9.778 16.832 1502 HG3 ARG 78 3HG ARG 78 -2.355 8.712 18.145 1503 HD2 ARG 78 2HD ARG 78 -2.910 10.407 19.799 1504 HD3 ARG 78 3HD ARG 78 -3.239 11.596 18.538 1505 HE ARG 78 HE ARG 78 -4.938 9.344 19.339 1506 HH11 ARG 78 1HH1 ARG 78 -4.482 12.082 17.166 1507 HH12 ARG 78 2HH1 ARG 78 -6.149 12.121 16.675 1508 HH21 ARG 78 1HH2 ARG 78 -7.129 9.413 18.666 1509 HH22 ARG 78 2HH2 ARG 78 -7.633 10.619 17.523 1510 H ASP 79 H ASP 79 1.884 9.638 18.273 1511 HA ASP 79 HA ASP 79 3.280 11.849 17.145 1512 HB2 ASP 79 2HB ASP 79 3.985 9.885 19.349 1513 HB3 ASP 79 3HB ASP 79 5.126 11.122 18.825 1514 H PHE 80 H PHE 80 3.441 8.428 16.630 1515 HA PHE 80 HA PHE 80 5.913 8.225 15.256 1516 HB2 PHE 80 2HB PHE 80 4.814 6.175 15.959 1517 HB3 PHE 80 3HB PHE 80 3.336 6.585 15.097 1518 HD1 PHE 80 HD1 PHE 80 6.945 5.747 14.539 1519 HD2 PHE 80 HD2 PHE 80 3.001 5.779 12.876 1520 HE1 PHE 80 HE1 PHE 80 7.751 4.530 12.570 1521 HE2 PHE 80 HE2 PHE 80 3.827 4.556 10.906 1522 HZ PHE 80 HZ PHE 80 6.206 3.934 10.752 1523 H CYS 81 H CYS 81 2.627 9.018 14.255 1524 HA CYS 81 HA CYS 81 3.240 9.290 11.445 1525 HB2 CYS 81 2HB CYS 81 0.746 9.993 13.040 1526 HB3 CYS 81 3HB CYS 81 0.858 9.960 11.279 1527 HG CYS 81 HG CYS 81 1.478 7.190 13.175 1528 H LYS 82 H LYS 82 3.421 11.389 14.207 1529 HA LYS 82 HA LYS 82 3.289 13.892 12.757 1530 HB2 LYS 82 2HB LYS 82 4.381 13.278 15.530 1531 HB3 LYS 82 3HB LYS 82 4.194 14.899 14.862 1532 HG2 LYS 82 2HG LYS 82 1.777 14.655 14.803 1533 HG3 LYS 82 3HG LYS 82 1.900 12.967 15.316 1534 HD2 LYS 82 2HD LYS 82 3.056 13.833 17.437 1535 HD3 LYS 82 3HD LYS 82 2.568 15.454 16.936 1536 HE2 LYS 82 2HE LYS 82 0.221 14.848 17.104 1537 HE3 LYS 82 3HE LYS 82 0.641 13.157 17.409 1538 HZ1 LYS 82 1HZ LYS 82 0.115 14.265 19.468 1539 HZ2 LYS 82 2HZ LYS 82 1.268 15.462 19.176 1540 HZ3 LYS 82 3HZ LYS 82 1.762 13.868 19.458 1541 H VAL 83 H VAL 83 4.720 13.433 11.057 1542 HA VAL 83 HA VAL 83 7.611 13.686 11.684 1543 HB VAL 83 HB VAL 83 8.079 12.310 9.626 1544 HG11 VAL 83 1HG1 VAL 83 7.581 10.091 10.588 1545 HG12 VAL 83 2HG1 VAL 83 6.444 10.829 11.719 1546 HG13 VAL 83 3HG1 VAL 83 8.163 11.210 11.824 1547 HG21 VAL 83 1HG2 VAL 83 5.086 11.742 9.641 1548 HG22 VAL 83 2HG2 VAL 83 6.275 10.930 8.617 1549 HG23 VAL 83 3HG2 VAL 83 5.971 12.656 8.415 1550 H ASP 84 H ASP 84 8.787 14.394 9.572 1551 HA ASP 84 HA ASP 84 7.819 16.922 8.689 1552 HB2 ASP 84 2HB ASP 84 10.195 16.559 8.850 1553 HB3 ASP 84 3HB ASP 84 10.126 15.121 7.844 1554 H GLN 85 H GLN 85 7.281 17.487 6.399 1555 HA GLN 85 HA GLN 85 4.974 15.992 5.782 1556 HB2 GLN 85 2HB GLN 85 5.469 18.568 5.482 1557 HB3 GLN 85 3HB GLN 85 6.014 18.120 3.874 1558 HG2 GLN 85 2HG GLN 85 3.240 17.551 4.975 1559 HG3 GLN 85 3HG GLN 85 3.649 18.960 4.007 1560 HE21 GLN 85 1HE2 GLN 85 5.355 17.508 2.100 1561 HE22 GLN 85 2HE2 GLN 85 4.288 16.556 1.134 1562 HA PRO 86 HA PRO 86 7.080 14.291 1.736 1563 HB2 PRO 86 2HB PRO 86 9.835 14.452 1.498 1564 HB3 PRO 86 3HB PRO 86 8.712 15.626 0.782 1565 HG2 PRO 86 2HG PRO 86 10.256 15.831 3.349 1566 HG3 PRO 86 3HG PRO 86 10.006 17.058 2.084 1567 HD2 PRO 86 2HD PRO 86 8.566 17.085 4.371 1568 HD3 PRO 86 3HD PRO 86 7.852 17.576 2.817 1569 H THR 87 H THR 87 8.856 14.212 4.820 1570 HA THR 87 HA THR 87 9.929 11.610 4.744 1571 HB THR 87 HB THR 87 9.027 13.282 7.122 1572 HG1 THR 87 HG1 THR 87 10.659 14.299 5.983 1573 HG21 THR 87 1HG2 THR 87 10.898 10.888 7.129 1574 HG22 THR 87 2HG2 THR 87 9.280 10.919 7.831 1575 HG23 THR 87 3HG2 THR 87 10.555 11.935 8.508 1576 H LEU 88 H LEU 88 6.706 12.770 5.529 1577 HA LEU 88 HA LEU 88 5.529 10.457 6.616 1578 HB2 LEU 88 2HB LEU 88 4.636 12.862 6.536 1579 HB3 LEU 88 3HB LEU 88 4.142 12.559 4.886 1580 HG LEU 88 HG LEU 88 3.079 10.901 7.218 1581 HD11 LEU 88 1HD1 LEU 88 2.536 13.243 7.684 1582 HD12 LEU 88 2HD1 LEU 88 1.087 12.338 7.258 1583 HD13 LEU 88 3HD1 LEU 88 1.827 13.423 6.075 1584 HD21 LEU 88 1HD2 LEU 88 2.738 9.901 5.006 1585 HD22 LEU 88 2HD2 LEU 88 1.957 11.378 4.438 1586 HD23 LEU 88 3HD2 LEU 88 1.202 10.409 5.708 1587 H PHE 89 H PHE 89 5.919 11.582 3.284 1588 HA PHE 89 HA PHE 89 4.564 9.371 2.053 1589 HB2 PHE 89 2HB PHE 89 6.338 11.578 0.948 1590 HB3 PHE 89 3HB PHE 89 5.620 10.331 -0.074 1591 HD1 PHE 89 HD1 PHE 89 3.419 10.580 -0.877 1592 HD2 PHE 89 HD2 PHE 89 4.720 13.016 2.393 1593 HE1 PHE 89 HE1 PHE 89 1.364 11.898 -1.023 1594 HE2 PHE 89 HE2 PHE 89 2.649 14.338 2.226 1595 HZ PHE 89 HZ PHE 89 0.972 13.771 0.505 1596 H GLU 90 H GLU 90 7.910 10.076 2.885 1597 HA GLU 90 HA GLU 90 9.151 7.936 1.512 1598 HB2 GLU 90 2HB GLU 90 9.952 9.276 4.129 1599 HB3 GLU 90 3HB GLU 90 10.998 8.242 3.161 1600 HG2 GLU 90 2HG GLU 90 9.810 10.849 2.201 1601 HG3 GLU 90 3HG GLU 90 11.420 10.689 2.878 1602 H LEU 91 H LEU 91 7.488 8.151 4.612 1603 HA LEU 91 HA LEU 91 7.923 5.470 5.488 1604 HB2 LEU 91 2HB LEU 91 5.878 7.591 6.219 1605 HB3 LEU 91 3HB LEU 91 5.843 5.999 6.951 1606 HG LEU 91 HG LEU 91 8.154 7.974 7.180 1607 HD11 LEU 91 1HD1 LEU 91 7.436 8.241 9.527 1608 HD12 LEU 91 2HD1 LEU 91 6.038 7.204 9.229 1609 HD13 LEU 91 3HD1 LEU 91 6.178 8.760 8.407 1610 HD21 LEU 91 1HD2 LEU 91 9.052 6.407 8.844 1611 HD22 LEU 91 2HD2 LEU 91 8.908 5.643 7.267 1612 HD23 LEU 91 3HD2 LEU 91 7.725 5.286 8.530 1613 H ILE 92 H ILE 92 5.359 7.029 3.534 1614 HA ILE 92 HA ILE 92 3.639 4.800 3.205 1615 HB ILE 92 HB ILE 92 4.141 7.173 1.335 1616 HG12 ILE 92 2HG1 ILE 92 1.903 6.692 3.362 1617 HG13 ILE 92 3HG1 ILE 92 3.244 7.812 3.559 1618 HG21 ILE 92 1HG2 ILE 92 1.858 5.166 1.192 1619 HG22 ILE 92 2HG2 ILE 92 3.168 5.331 0.022 1620 HG23 ILE 92 3HG2 ILE 92 1.998 6.633 0.219 1621 HD11 ILE 92 1HD1 ILE 92 1.228 8.994 2.972 1622 HD12 ILE 92 2HD1 ILE 92 1.039 8.026 1.511 1623 HD13 ILE 92 3HD1 ILE 92 2.405 9.136 1.667 1624 H LEU 93 H LEU 93 6.477 5.914 1.375 1625 HA LEU 93 HA LEU 93 6.335 4.002 -0.738 1626 HB2 LEU 93 2HB LEU 93 8.674 5.714 0.215 1627 HB3 LEU 93 3HB LEU 93 8.676 4.770 -1.267 1628 HG LEU 93 HG LEU 93 6.903 7.170 -0.670 1629 HD11 LEU 93 1HD1 LEU 93 8.150 8.296 -2.462 1630 HD12 LEU 93 2HD1 LEU 93 9.186 6.878 -2.644 1631 HD13 LEU 93 3HD1 LEU 93 9.210 7.804 -1.142 1632 HD21 LEU 93 1HD2 LEU 93 6.087 6.982 -2.991 1633 HD22 LEU 93 2HD2 LEU 93 5.627 5.596 -2.008 1634 HD23 LEU 93 3HD2 LEU 93 6.950 5.450 -3.169 1635 H ALA 94 H ALA 94 8.036 4.129 2.371 1636 HA ALA 94 HA ALA 94 9.563 1.715 2.012 1637 HB1 ALA 94 1HB ALA 94 10.314 3.492 3.533 1638 HB2 ALA 94 2HB ALA 94 10.128 1.962 4.387 1639 HB3 ALA 94 3HB ALA 94 8.907 3.228 4.565 1640 H ALA 95 H ALA 95 6.416 2.509 3.375 1641 HA ALA 95 HA ALA 95 5.932 -0.050 4.599 1642 HB1 ALA 95 1HB ALA 95 4.824 2.000 5.384 1643 HB2 ALA 95 2HB ALA 95 3.654 0.758 4.936 1644 HB3 ALA 95 3HB ALA 95 3.954 2.124 3.853 1645 H ASN 96 H ASN 96 5.296 1.376 1.422 1646 HA ASN 96 HA ASN 96 3.883 -0.898 0.353 1647 HB2 ASN 96 2HB ASN 96 3.601 1.393 -0.578 1648 HB3 ASN 96 3HB ASN 96 5.293 1.423 -1.056 1649 HD21 ASN 96 1HD2 ASN 96 4.591 1.845 -3.215 1650 HD22 ASN 96 2HD2 ASN 96 3.968 0.593 -4.226 1651 H TYR 97 H TYR 97 7.240 0.207 0.448 1652 HA TYR 97 HA TYR 97 8.446 -1.687 -1.285 1653 HB2 TYR 97 2HB TYR 97 9.640 0.339 -0.708 1654 HB3 TYR 97 3HB TYR 97 9.546 -0.006 1.010 1655 HD1 TYR 97 HD1 TYR 97 11.582 -0.664 1.997 1656 HD2 TYR 97 HD2 TYR 97 10.910 -1.684 -2.103 1657 HE1 TYR 97 HE1 TYR 97 13.828 -1.665 1.882 1658 HE2 TYR 97 HE2 TYR 97 13.151 -2.686 -2.212 1659 HH TYR 97 HH TYR 97 15.335 -2.470 -1.033 1660 H LEU 98 H LEU 98 7.733 -1.734 2.168 1661 HA LEU 98 HA LEU 98 8.870 -4.433 2.487 1662 HB2 LEU 98 2HB LEU 98 8.004 -2.369 4.555 1663 HB3 LEU 98 3HB LEU 98 8.630 -3.964 4.941 1664 HG LEU 98 HG LEU 98 10.172 -1.736 3.546 1665 HD11 LEU 98 1HD1 LEU 98 9.891 -1.302 5.931 1666 HD12 LEU 98 2HD1 LEU 98 11.571 -1.690 5.567 1667 HD13 LEU 98 3HD1 LEU 98 10.530 -2.901 6.326 1668 HD21 LEU 98 1HD2 LEU 98 11.093 -4.535 4.264 1669 HD22 LEU 98 2HD2 LEU 98 12.143 -3.234 3.700 1670 HD23 LEU 98 3HD2 LEU 98 10.889 -3.873 2.641 1671 H ASP 99 H ASP 99 5.950 -2.885 1.939 1672 HA ASP 99 HA ASP 99 3.824 -3.516 1.688 1673 HB2 ASP 99 2HB ASP 99 5.033 -5.346 0.394 1674 HB3 ASP 99 3HB ASP 99 4.834 -6.386 1.800 1675 H ILE 100 H ILE 100 4.621 -2.949 4.313 1676 HA ILE 100 HA ILE 100 3.316 -4.784 6.166 1677 HB ILE 100 HB ILE 100 4.388 -1.968 6.695 1678 HG12 ILE 100 2HG1 ILE 100 5.770 -4.656 7.122 1679 HG13 ILE 100 3HG1 ILE 100 6.163 -3.506 5.850 1680 HG21 ILE 100 1HG2 ILE 100 2.772 -2.724 8.407 1681 HG22 ILE 100 2HG2 ILE 100 4.398 -2.643 9.082 1682 HG23 ILE 100 3HG2 ILE 100 3.704 -4.205 8.649 1683 HD11 ILE 100 1HD1 ILE 100 6.503 -3.070 8.812 1684 HD12 ILE 100 2HD1 ILE 100 6.852 -1.882 7.553 1685 HD13 ILE 100 3HD1 ILE 100 7.767 -3.386 7.625 1686 H LYS 101 H LYS 101 1.141 -4.852 6.030 1687 HA LYS 101 HA LYS 101 -0.506 -2.944 4.812 1688 HB2 LYS 101 2HB LYS 101 -1.452 -5.063 6.790 1689 HB3 LYS 101 3HB LYS 101 -2.423 -4.274 5.556 1690 HG2 LYS 101 2HG LYS 101 -0.137 -6.199 5.089 1691 HG3 LYS 101 3HG LYS 101 -1.854 -6.548 4.886 1692 HD2 LYS 101 2HD LYS 101 -1.948 -4.863 3.036 1693 HD3 LYS 101 3HD LYS 101 -0.216 -4.575 3.242 1694 HE2 LYS 101 2HE LYS 101 0.210 -6.982 2.704 1695 HE3 LYS 101 3HE LYS 101 -1.519 -7.185 2.388 1696 HZ1 LYS 101 1HZ LYS 101 -0.330 -6.802 0.352 1697 HZ2 LYS 101 2HZ LYS 101 0.337 -5.375 0.951 1698 HZ3 LYS 101 3HZ LYS 101 -1.325 -5.470 0.664 1699 HA PRO 102 HA PRO 102 -1.966 -1.535 9.390 1700 HB2 PRO 102 2HB PRO 102 0.652 -1.972 10.844 1701 HB3 PRO 102 3HB PRO 102 -1.016 -2.135 11.442 1702 HG2 PRO 102 2HG PRO 102 0.406 -4.309 10.907 1703 HG3 PRO 102 3HG PRO 102 -1.317 -4.235 10.465 1704 HD2 PRO 102 2HD PRO 102 1.101 -3.914 8.697 1705 HD3 PRO 102 3HD PRO 102 -0.421 -4.776 8.385 1706 H LEU 103 H LEU 103 1.545 -1.173 8.727 1707 HA LEU 103 HA LEU 103 1.719 1.530 9.576 1708 HB2 LEU 103 2HB LEU 103 3.578 -0.305 9.253 1709 HB3 LEU 103 3HB LEU 103 3.681 0.299 7.611 1710 HG LEU 103 HG LEU 103 4.088 2.080 10.059 1711 HD11 LEU 103 1HD1 LEU 103 5.741 0.296 10.143 1712 HD12 LEU 103 2HD1 LEU 103 6.507 1.829 9.739 1713 HD13 LEU 103 3HD1 LEU 103 6.226 0.624 8.478 1714 HD21 LEU 103 1HD2 LEU 103 3.594 3.334 8.006 1715 HD22 LEU 103 2HD2 LEU 103 4.914 2.519 7.165 1716 HD23 LEU 103 3HD2 LEU 103 5.260 3.601 8.520 1717 H LEU 104 H LEU 104 1.337 0.031 6.367 1718 HA LEU 104 HA LEU 104 1.590 2.368 4.802 1719 HB2 LEU 104 2HB LEU 104 1.813 0.061 3.911 1720 HB3 LEU 104 3HB LEU 104 0.099 -0.212 4.173 1721 HG LEU 104 HG LEU 104 -0.450 1.476 2.436 1722 HD11 LEU 104 1HD1 LEU 104 2.544 1.765 2.026 1723 HD12 LEU 104 2HD1 LEU 104 1.460 2.989 2.693 1724 HD13 LEU 104 3HD1 LEU 104 1.278 2.477 1.019 1725 HD21 LEU 104 1HD2 LEU 104 1.530 -0.611 1.456 1726 HD22 LEU 104 2HD2 LEU 104 0.317 0.213 0.473 1727 HD23 LEU 104 3HD2 LEU 104 -0.189 -0.872 1.765 1728 H ASP 105 H ASP 105 -1.224 0.760 6.261 1729 HA ASP 105 HA ASP 105 -3.227 2.415 5.092 1730 HB2 ASP 105 2HB ASP 105 -3.677 0.145 6.088 1731 HB3 ASP 105 3HB ASP 105 -3.388 0.813 7.694 1732 H VAL 106 H VAL 106 -1.678 2.430 8.325 1733 HA VAL 106 HA VAL 106 -3.087 4.574 9.448 1734 HB VAL 106 HB VAL 106 -0.335 3.438 10.126 1735 HG11 VAL 106 1HG1 VAL 106 -1.899 5.480 11.760 1736 HG12 VAL 106 2HG1 VAL 106 -0.365 5.764 10.934 1737 HG13 VAL 106 3HG1 VAL 106 -0.438 4.639 12.289 1738 HG21 VAL 106 1HG2 VAL 106 -1.507 2.385 12.028 1739 HG22 VAL 106 2HG2 VAL 106 -2.244 1.915 10.496 1740 HG23 VAL 106 3HG2 VAL 106 -3.028 3.123 11.513 1741 H THR 107 H THR 107 0.051 4.598 7.726 1742 HA THR 107 HA THR 107 0.557 7.378 8.176 1743 HB THR 107 HB THR 107 1.858 5.500 6.153 1744 HG1 THR 107 HG1 THR 107 2.294 4.614 8.093 1745 HG21 THR 107 1HG2 THR 107 3.798 7.022 6.309 1746 HG22 THR 107 2HG2 THR 107 2.891 8.087 7.383 1747 HG23 THR 107 3HG2 THR 107 2.384 7.885 5.705 1748 H CYS 108 H CYS 108 -0.742 5.529 5.394 1749 HA CYS 108 HA CYS 108 -1.041 7.742 3.626 1750 HB2 CYS 108 2HB CYS 108 -2.481 5.066 3.662 1751 HB3 CYS 108 3HB CYS 108 -2.618 6.246 2.357 1752 HG CYS 108 HG CYS 108 -0.525 3.849 2.583 1753 H LYS 109 H LYS 109 -3.073 6.426 6.189 1754 HA LYS 109 HA LYS 109 -5.402 8.009 5.639 1755 HB2 LYS 109 2HB LYS 109 -4.567 6.140 7.820 1756 HB3 LYS 109 3HB LYS 109 -5.620 7.439 8.362 1757 HG2 LYS 109 2HG LYS 109 -6.889 5.410 7.808 1758 HG3 LYS 109 3HG LYS 109 -7.350 6.759 6.765 1759 HD2 LYS 109 2HD LYS 109 -5.935 5.830 4.959 1760 HD3 LYS 109 3HD LYS 109 -5.471 4.488 6.009 1761 HE2 LYS 109 2HE LYS 109 -8.289 5.087 5.048 1762 HE3 LYS 109 3HE LYS 109 -7.226 3.838 4.403 1763 HZ1 LYS 109 1HZ LYS 109 -7.213 2.820 6.625 1764 HZ2 LYS 109 2HZ LYS 109 -8.754 2.865 5.935 1765 HZ3 LYS 109 3HZ LYS 109 -8.341 3.963 7.149 1766 H THR 110 H THR 110 -2.499 8.466 7.640 1767 HA THR 110 HA THR 110 -3.288 10.685 9.150 1768 HB THR 110 HB THR 110 -0.512 9.944 8.127 1769 HG1 THR 110 HG1 THR 110 -0.828 8.409 9.547 1770 HG21 THR 110 1HG2 THR 110 -1.264 11.872 10.365 1771 HG22 THR 110 2HG2 THR 110 -0.489 12.310 8.842 1772 HG23 THR 110 3HG2 THR 110 0.373 11.312 10.012 1773 H VAL 111 H VAL 111 -1.649 10.598 5.970 1774 HA VAL 111 HA VAL 111 -1.697 13.447 5.612 1775 HB VAL 111 HB VAL 111 0.041 12.103 4.543 1776 HG11 VAL 111 1HG1 VAL 111 -0.389 10.643 2.611 1777 HG12 VAL 111 2HG1 VAL 111 -2.125 10.870 2.824 1778 HG13 VAL 111 3HG1 VAL 111 -1.186 10.048 4.071 1779 HG21 VAL 111 1HG2 VAL 111 -1.704 13.516 2.500 1780 HG22 VAL 111 2HG2 VAL 111 -0.006 13.099 2.278 1781 HG23 VAL 111 3HG2 VAL 111 -0.471 14.258 3.521 1782 H ALA 112 H ALA 112 -3.818 10.775 4.658 1783 HA ALA 112 HA ALA 112 -5.427 12.092 2.766 1784 HB1 ALA 112 1HB ALA 112 -6.197 9.827 4.629 1785 HB2 ALA 112 2HB ALA 112 -5.439 9.656 3.048 1786 HB3 ALA 112 3HB ALA 112 -7.072 10.313 3.169 1787 H ASN 113 H ASN 113 -5.779 11.789 6.310 1788 HA ASN 113 HA ASN 113 -8.378 12.823 6.593 1789 HB2 ASN 113 2HB ASN 113 -6.088 12.834 8.623 1790 HB3 ASN 113 3HB ASN 113 -7.769 13.175 9.018 1791 HD21 ASN 113 1HD2 ASN 113 -5.999 11.061 10.015 1792 HD22 ASN 113 2HD2 ASN 113 -6.791 9.569 9.662 1793 H MET 114 H MET 114 -5.326 14.471 6.237 1794 HA MET 114 HA MET 114 -6.031 17.040 7.249 1795 HB2 MET 114 2HB MET 114 -3.944 16.377 5.122 1796 HB3 MET 114 3HB MET 114 -4.009 17.840 6.098 1797 HG2 MET 114 2HG MET 114 -3.653 16.390 8.131 1798 HG3 MET 114 3HG MET 114 -3.369 15.039 7.036 1799 HE1 MET 114 1HE MET 114 -0.132 16.438 5.089 1800 HE2 MET 114 2HE MET 114 -1.797 16.758 4.611 1801 HE3 MET 114 3HE MET 114 -1.321 15.139 5.118 1802 H ILE 115 H ILE 115 -6.152 15.540 4.054 1803 HA ILE 115 HA ILE 115 -7.206 18.004 2.791 1804 HB ILE 115 HB ILE 115 -6.596 16.891 0.631 1805 HG12 ILE 115 2HG1 ILE 115 -5.537 14.668 2.442 1806 HG13 ILE 115 3HG1 ILE 115 -6.907 14.541 1.347 1807 HG21 ILE 115 1HG2 ILE 115 -4.931 18.354 1.735 1808 HG22 ILE 115 2HG2 ILE 115 -4.140 17.041 0.865 1809 HG23 ILE 115 3HG2 ILE 115 -4.292 16.968 2.622 1810 HD11 ILE 115 1HD1 ILE 115 -5.395 14.865 -0.543 1811 HD12 ILE 115 2HD1 ILE 115 -5.017 13.446 0.426 1812 HD13 ILE 115 3HD1 ILE 115 -4.028 14.900 0.574 1813 H ARG 116 H ARG 116 -8.415 15.152 4.086 1814 HA ARG 116 HA ARG 116 -10.381 14.520 2.031 1815 HB2 ARG 116 2HB ARG 116 -9.082 12.906 3.686 1816 HB3 ARG 116 3HB ARG 116 -10.350 13.298 4.823 1817 HG2 ARG 116 2HG ARG 116 -10.992 12.172 2.081 1818 HG3 ARG 116 3HG ARG 116 -10.511 11.121 3.407 1819 HD2 ARG 116 2HD ARG 116 -12.417 11.831 4.731 1820 HD3 ARG 116 3HD ARG 116 -12.889 13.008 3.500 1821 HE ARG 116 HE ARG 116 -12.752 10.267 2.573 1822 HH11 ARG 116 1HH1 ARG 116 -14.821 12.745 3.973 1823 HH12 ARG 116 2HH1 ARG 116 -16.290 11.980 3.453 1824 HH21 ARG 116 1HH2 ARG 116 -14.669 9.258 1.951 1825 HH22 ARG 116 2HH2 ARG 116 -16.204 9.997 2.302 1826 H GLY 117 H GLY 117 -10.151 16.775 4.488 1827 HA2 GLY 117 2HA GLY 117 -11.619 18.071 5.728 1828 HA3 GLY 117 3HA GLY 117 -12.142 18.403 4.094 Start of MODEL 9 1 H1 SER 2 1H SER 2 -17.927 -15.358 -18.872 2 H2 SER 2 2H SER 2 -16.976 -14.768 -17.606 3 H3 SER 2 3H SER 2 -17.024 -13.945 -19.076 4 HA SER 2 HA SER 2 -19.275 -13.360 -18.780 5 HB2 SER 2 2HB SER 2 -19.119 -14.900 -16.152 6 HB3 SER 2 3HB SER 2 -20.509 -13.967 -16.703 7 HG SER 2 HG SER 2 -21.081 -15.581 -17.908 8 H LEU 3 H LEU 3 -19.784 -11.389 -17.802 9 HA LEU 3 HA LEU 3 -17.622 -9.941 -16.525 10 HB2 LEU 3 2HB LEU 3 -20.482 -9.064 -17.106 11 HB3 LEU 3 3HB LEU 3 -19.163 -8.006 -16.630 12 HG LEU 3 HG LEU 3 -19.291 -9.553 -19.251 13 HD11 LEU 3 1HD1 LEU 3 -20.989 -7.792 -19.173 14 HD12 LEU 3 2HD1 LEU 3 -19.708 -7.378 -20.306 15 HD13 LEU 3 3HD1 LEU 3 -19.765 -6.601 -18.720 16 HD21 LEU 3 1HD2 LEU 3 -17.382 -8.162 -19.924 17 HD22 LEU 3 2HD2 LEU 3 -16.987 -9.175 -18.540 18 HD23 LEU 3 3HD2 LEU 3 -17.315 -7.454 -18.307 19 H VAL 4 H VAL 4 -17.371 -9.686 -14.359 20 HA VAL 4 HA VAL 4 -19.451 -10.619 -12.516 21 HB VAL 4 HB VAL 4 -17.697 -10.184 -10.709 22 HG11 VAL 4 1HG1 VAL 4 -18.123 -12.437 -11.607 23 HG12 VAL 4 2HG1 VAL 4 -16.410 -12.234 -11.240 24 HG13 VAL 4 3HG1 VAL 4 -16.967 -12.157 -12.914 25 HG21 VAL 4 1HG2 VAL 4 -16.285 -8.556 -11.909 26 HG22 VAL 4 2HG2 VAL 4 -15.845 -9.787 -13.095 27 HG23 VAL 4 3HG2 VAL 4 -15.331 -9.956 -11.413 28 H LYS 5 H LYS 5 -20.748 -9.342 -11.439 29 HA LYS 5 HA LYS 5 -20.886 -6.520 -12.053 30 HB2 LYS 5 2HB LYS 5 -22.711 -8.368 -10.446 31 HB3 LYS 5 3HB LYS 5 -23.084 -6.688 -10.821 32 HG2 LYS 5 2HG LYS 5 -23.131 -7.200 -13.219 33 HG3 LYS 5 3HG LYS 5 -22.680 -8.878 -12.891 34 HD2 LYS 5 2HD LYS 5 -24.789 -9.263 -11.714 35 HD3 LYS 5 3HD LYS 5 -25.228 -7.556 -11.859 36 HE2 LYS 5 2HE LYS 5 -26.423 -8.971 -13.504 37 HE3 LYS 5 3HE LYS 5 -25.395 -7.773 -14.289 38 HZ1 LYS 5 1HZ LYS 5 -23.736 -9.499 -14.636 39 HZ2 LYS 5 2HZ LYS 5 -25.206 -9.919 -15.354 40 HZ3 LYS 5 3HZ LYS 5 -24.737 -10.646 -13.907 41 H LEU 6 H LEU 6 -19.605 -5.198 -10.866 42 HA LEU 6 HA LEU 6 -19.335 -5.606 -7.940 43 HB2 LEU 6 2HB LEU 6 -17.610 -4.215 -10.009 44 HB3 LEU 6 3HB LEU 6 -17.508 -3.736 -8.323 45 HG LEU 6 HG LEU 6 -16.873 -6.068 -7.702 46 HD11 LEU 6 1HD1 LEU 6 -16.141 -7.669 -9.394 47 HD12 LEU 6 2HD1 LEU 6 -16.732 -6.605 -10.674 48 HD13 LEU 6 3HD1 LEU 6 -17.866 -7.330 -9.534 49 HD21 LEU 6 1HD2 LEU 6 -14.585 -5.938 -8.551 50 HD22 LEU 6 2HD2 LEU 6 -15.177 -4.363 -8.027 51 HD23 LEU 6 3HD2 LEU 6 -15.088 -4.745 -9.751 52 H GLU 7 H GLU 7 -21.170 -4.660 -7.143 53 HA GLU 7 HA GLU 7 -22.045 -2.016 -7.948 54 HB2 GLU 7 2HB GLU 7 -23.677 -3.699 -7.135 55 HB3 GLU 7 3HB GLU 7 -22.872 -3.742 -5.567 56 HG2 GLU 7 2HG GLU 7 -23.425 -1.304 -5.280 57 HG3 GLU 7 3HG GLU 7 -24.338 -1.370 -6.783 58 H SER 8 H SER 8 -21.200 -0.169 -7.184 59 HA SER 8 HA SER 8 -19.154 -0.116 -5.130 60 HB2 SER 8 2HB SER 8 -19.002 2.303 -5.809 61 HB3 SER 8 3HB SER 8 -18.860 1.198 -7.176 62 HG SER 8 HG SER 8 -20.718 1.865 -7.946 63 H SER 9 H SER 9 -19.307 1.966 -3.668 64 HA SER 9 HA SER 9 -21.432 1.709 -1.803 65 HB2 SER 9 2HB SER 9 -19.381 3.946 -2.067 66 HB3 SER 9 3HB SER 9 -20.347 3.584 -0.628 67 HG SER 9 HG SER 9 -18.997 1.403 -1.551 68 H ASP 10 H ASP 10 -21.099 3.536 -4.671 69 HA ASP 10 HA ASP 10 -23.284 5.406 -4.061 70 HB2 ASP 10 2HB ASP 10 -21.137 6.152 -5.202 71 HB3 ASP 10 3HB ASP 10 -21.572 5.141 -6.574 72 H GLU 11 H GLU 11 -23.321 2.306 -4.641 73 HA GLU 11 HA GLU 11 -24.840 0.797 -5.328 74 HB2 GLU 11 2HB GLU 11 -26.558 3.240 -5.921 75 HB3 GLU 11 3HB GLU 11 -27.154 1.582 -5.936 76 HG2 GLU 11 2HG GLU 11 -26.715 1.342 -3.556 77 HG3 GLU 11 3HG GLU 11 -25.937 2.921 -3.498 78 H LYS 12 H LYS 12 -22.991 2.275 -7.334 79 HA LYS 12 HA LYS 12 -24.370 1.801 -9.887 80 HB2 LYS 12 2HB LYS 12 -21.615 2.964 -9.290 81 HB3 LYS 12 3HB LYS 12 -22.352 2.869 -10.890 82 HG2 LYS 12 2HG LYS 12 -23.446 4.453 -8.547 83 HG3 LYS 12 3HG LYS 12 -22.526 5.122 -9.897 84 HD2 LYS 12 2HD LYS 12 -24.300 4.506 -11.464 85 HD3 LYS 12 3HD LYS 12 -25.203 3.701 -10.176 86 HE2 LYS 12 2HE LYS 12 -26.096 5.963 -10.742 87 HE3 LYS 12 3HE LYS 12 -25.598 5.821 -9.057 88 HZ1 LYS 12 1HZ LYS 12 -23.920 7.019 -11.196 89 HZ2 LYS 12 2HZ LYS 12 -23.595 7.002 -9.540 90 HZ3 LYS 12 3HZ LYS 12 -24.895 7.904 -10.133 91 H VAL 13 H VAL 13 -24.152 -0.052 -10.939 92 HA VAL 13 HA VAL 13 -22.271 -2.095 -10.024 93 HB VAL 13 HB VAL 13 -24.547 -2.294 -12.059 94 HG11 VAL 13 1HG1 VAL 13 -23.002 -4.491 -10.637 95 HG12 VAL 13 2HG1 VAL 13 -22.879 -4.069 -12.348 96 HG13 VAL 13 3HG1 VAL 13 -24.386 -4.729 -11.711 97 HG21 VAL 13 1HG2 VAL 13 -25.897 -3.283 -10.245 98 HG22 VAL 13 2HG2 VAL 13 -25.402 -1.639 -9.836 99 HG23 VAL 13 3HG2 VAL 13 -24.578 -3.016 -9.099 100 H PHE 14 H PHE 14 -20.371 -2.310 -11.026 101 HA PHE 14 HA PHE 14 -20.022 -1.531 -13.860 102 HB2 PHE 14 2HB PHE 14 -17.930 -1.738 -11.634 103 HB3 PHE 14 3HB PHE 14 -17.622 -1.235 -13.295 104 HD1 PHE 14 HD1 PHE 14 -18.468 -0.094 -10.006 105 HD2 PHE 14 HD2 PHE 14 -18.906 0.866 -14.154 106 HE1 PHE 14 HE1 PHE 14 -18.992 2.232 -9.417 107 HE2 PHE 14 HE2 PHE 14 -19.423 3.194 -13.553 108 HZ PHE 14 HZ PHE 14 -19.474 3.876 -11.189 109 H GLU 15 H GLU 15 -20.319 -3.324 -14.998 110 HA GLU 15 HA GLU 15 -19.657 -5.978 -14.036 111 HB2 GLU 15 2HB GLU 15 -20.758 -5.138 -16.746 112 HB3 GLU 15 3HB GLU 15 -20.754 -6.765 -16.071 113 HG2 GLU 15 2HG GLU 15 -22.321 -6.023 -14.298 114 HG3 GLU 15 3HG GLU 15 -22.318 -4.403 -14.990 115 H ILE 16 H ILE 16 -17.381 -5.576 -13.854 116 HA ILE 16 HA ILE 16 -15.741 -5.125 -16.207 117 HB ILE 16 HB ILE 16 -14.950 -4.238 -14.058 118 HG12 ILE 16 2HG1 ILE 16 -13.171 -6.474 -15.146 119 HG13 ILE 16 3HG1 ILE 16 -13.188 -4.795 -15.657 120 HG21 ILE 16 1HG2 ILE 16 -14.820 -7.097 -13.049 121 HG22 ILE 16 2HG2 ILE 16 -15.971 -5.864 -12.534 122 HG23 ILE 16 3HG2 ILE 16 -14.253 -5.669 -12.174 123 HD11 ILE 16 1HD1 ILE 16 -12.287 -4.134 -13.483 124 HD12 ILE 16 2HD1 ILE 16 -11.242 -5.275 -14.321 125 HD13 ILE 16 3HD1 ILE 16 -12.250 -5.827 -12.984 126 H GLU 17 H GLU 17 -14.426 -6.631 -17.215 127 HA GLU 17 HA GLU 17 -15.090 -9.331 -17.448 128 HB2 GLU 17 2HB GLU 17 -12.413 -7.969 -18.004 129 HB3 GLU 17 3HB GLU 17 -12.896 -9.546 -18.632 130 HG2 GLU 17 2HG GLU 17 -14.692 -8.520 -19.939 131 HG3 GLU 17 3HG GLU 17 -14.338 -6.946 -19.236 132 H LYS 18 H LYS 18 -14.701 -11.051 -16.201 133 HA LYS 18 HA LYS 18 -13.916 -10.839 -13.547 134 HB2 LYS 18 2HB LYS 18 -15.409 -12.614 -14.326 135 HB3 LYS 18 3HB LYS 18 -14.118 -13.321 -15.297 136 HG2 LYS 18 2HG LYS 18 -12.854 -13.809 -13.184 137 HG3 LYS 18 3HG LYS 18 -14.227 -13.197 -12.257 138 HD2 LYS 18 2HD LYS 18 -15.661 -14.989 -13.098 139 HD3 LYS 18 3HD LYS 18 -14.399 -15.529 -14.209 140 HE2 LYS 18 2HE LYS 18 -12.964 -16.101 -12.258 141 HE3 LYS 18 3HE LYS 18 -14.285 -15.633 -11.181 142 HZ1 LYS 18 1HZ LYS 18 -15.619 -17.383 -12.013 143 HZ2 LYS 18 2HZ LYS 18 -14.134 -18.052 -11.633 144 HZ3 LYS 18 3HZ LYS 18 -14.540 -17.747 -13.252 145 H GLU 19 H GLU 19 -12.057 -11.974 -16.352 146 HA GLU 19 HA GLU 19 -9.772 -13.023 -15.094 147 HB2 GLU 19 2HB GLU 19 -10.257 -13.416 -17.467 148 HB3 GLU 19 3HB GLU 19 -10.082 -11.704 -17.835 149 HG2 GLU 19 2HG GLU 19 -7.672 -11.830 -17.302 150 HG3 GLU 19 3HG GLU 19 -7.847 -13.533 -16.886 151 H ILE 20 H ILE 20 -10.628 -9.748 -15.920 152 HA ILE 20 HA ILE 20 -8.049 -8.570 -15.322 153 HB ILE 20 HB ILE 20 -10.747 -7.287 -15.949 154 HG12 ILE 20 2HG1 ILE 20 -8.362 -7.925 -17.755 155 HG13 ILE 20 3HG1 ILE 20 -9.939 -8.700 -17.804 156 HG21 ILE 20 1HG2 ILE 20 -9.268 -5.740 -14.745 157 HG22 ILE 20 2HG2 ILE 20 -9.477 -5.242 -16.420 158 HG23 ILE 20 3HG2 ILE 20 -7.984 -6.036 -15.923 159 HD11 ILE 20 1HD1 ILE 20 -9.710 -7.181 -19.636 160 HD12 ILE 20 2HD1 ILE 20 -9.321 -5.848 -18.553 161 HD13 ILE 20 3HD1 ILE 20 -10.933 -6.564 -18.528 162 H ALA 21 H ALA 21 -11.217 -8.902 -13.749 163 HA ALA 21 HA ALA 21 -10.712 -7.312 -11.443 164 HB1 ALA 21 1HB ALA 21 -12.636 -9.638 -11.788 165 HB2 ALA 21 2HB ALA 21 -12.980 -7.947 -12.158 166 HB3 ALA 21 3HB ALA 21 -12.684 -8.437 -10.489 167 H CYS 22 H CYS 22 -9.624 -10.444 -12.371 168 HA CYS 22 HA CYS 22 -9.048 -11.567 -9.831 169 HB2 CYS 22 2HB CYS 22 -7.893 -12.143 -12.575 170 HB3 CYS 22 3HB CYS 22 -7.598 -13.133 -11.144 171 HG CYS 22 HG CYS 22 -10.852 -12.648 -11.704 172 H MET 23 H MET 23 -7.344 -9.186 -11.782 173 HA MET 23 HA MET 23 -4.757 -9.444 -10.601 174 HB2 MET 23 2HB MET 23 -6.003 -6.925 -11.771 175 HB3 MET 23 3HB MET 23 -4.293 -7.177 -11.454 176 HG2 MET 23 2HG MET 23 -4.561 -9.184 -13.135 177 HG3 MET 23 3HG MET 23 -5.999 -8.306 -13.653 178 HE1 MET 23 1HE MET 23 -4.515 -5.248 -12.841 179 HE2 MET 23 2HE MET 23 -5.699 -5.480 -14.132 180 HE3 MET 23 3HE MET 23 -4.125 -4.773 -14.495 181 H SER 24 H SER 24 -7.671 -7.744 -9.650 182 HA SER 24 HA SER 24 -6.561 -6.599 -7.247 183 HB2 SER 24 2HB SER 24 -8.610 -5.633 -8.249 184 HB3 SER 24 3HB SER 24 -9.463 -7.160 -8.010 185 HG SER 24 HG SER 24 -8.268 -5.745 -5.868 186 H VAL 25 H VAL 25 -5.902 -7.842 -5.605 187 HA VAL 25 HA VAL 25 -6.268 -10.633 -5.513 188 HB VAL 25 HB VAL 25 -5.298 -8.847 -3.227 189 HG11 VAL 25 1HG1 VAL 25 -4.053 -10.859 -2.473 190 HG12 VAL 25 2HG1 VAL 25 -4.790 -11.799 -3.773 191 HG13 VAL 25 3HG1 VAL 25 -5.798 -11.136 -2.485 192 HG21 VAL 25 1HG2 VAL 25 -3.001 -9.229 -4.093 193 HG22 VAL 25 2HG2 VAL 25 -4.002 -8.374 -5.269 194 HG23 VAL 25 3HG2 VAL 25 -3.672 -10.093 -5.484 195 H THR 26 H THR 26 -7.703 -7.998 -3.550 196 HA THR 26 HA THR 26 -9.202 -9.602 -1.782 197 HB THR 26 HB THR 26 -9.742 -6.732 -2.663 198 HG1 THR 26 HG1 THR 26 -8.625 -6.251 -0.707 199 HG21 THR 26 1HG2 THR 26 -10.766 -8.182 -0.187 200 HG22 THR 26 2HG2 THR 26 -11.751 -7.687 -1.568 201 HG23 THR 26 3HG2 THR 26 -10.983 -6.469 -0.548 202 H ILE 27 H ILE 27 -10.253 -7.971 -4.827 203 HA ILE 27 HA ILE 27 -12.974 -8.756 -4.744 204 HB ILE 27 HB ILE 27 -11.216 -8.040 -7.137 205 HG12 ILE 27 2HG1 ILE 27 -13.280 -6.325 -5.673 206 HG13 ILE 27 3HG1 ILE 27 -11.548 -6.256 -5.374 207 HG21 ILE 27 1HG2 ILE 27 -14.251 -8.285 -7.078 208 HG22 ILE 27 2HG2 ILE 27 -13.139 -9.338 -7.952 209 HG23 ILE 27 3HG2 ILE 27 -13.303 -7.648 -8.425 210 HD11 ILE 27 1HD1 ILE 27 -12.857 -5.613 -8.015 211 HD12 ILE 27 2HD1 ILE 27 -11.149 -5.451 -7.611 212 HD13 ILE 27 3HD1 ILE 27 -12.342 -4.439 -6.805 213 H LYS 28 H LYS 28 -10.127 -10.237 -6.310 214 HA LYS 28 HA LYS 28 -11.320 -12.459 -7.533 215 HB2 LYS 28 2HB LYS 28 -8.986 -11.743 -7.948 216 HB3 LYS 28 3HB LYS 28 -8.540 -12.194 -6.307 217 HG2 LYS 28 2HG LYS 28 -9.106 -14.587 -6.883 218 HG3 LYS 28 3HG LYS 28 -9.389 -14.063 -8.546 219 HD2 LYS 28 2HD LYS 28 -7.136 -15.032 -8.288 220 HD3 LYS 28 3HD LYS 28 -7.045 -13.327 -8.740 221 HE2 LYS 28 2HE LYS 28 -5.388 -13.900 -7.011 222 HE3 LYS 28 3HE LYS 28 -6.552 -12.723 -6.401 223 HZ1 LYS 28 1HZ LYS 28 -6.106 -14.429 -4.770 224 HZ2 LYS 28 2HZ LYS 28 -6.545 -15.644 -5.853 225 HZ3 LYS 28 3HZ LYS 28 -7.714 -14.568 -5.285 226 H ASN 29 H ASN 29 -10.023 -12.044 -4.233 227 HA ASN 29 HA ASN 29 -10.424 -14.741 -3.369 228 HB2 ASN 29 2HB ASN 29 -10.008 -12.201 -1.720 229 HB3 ASN 29 3HB ASN 29 -10.024 -13.829 -1.045 230 HD21 ASN 29 1HD2 ASN 29 -7.888 -11.964 -0.858 231 HD22 ASN 29 2HD2 ASN 29 -6.519 -12.652 -1.652 232 H MET 30 H MET 30 -12.424 -11.845 -3.319 233 HA MET 30 HA MET 30 -14.474 -12.729 -1.577 234 HB2 MET 30 2HB MET 30 -14.504 -10.708 -3.870 235 HB3 MET 30 3HB MET 30 -15.936 -11.051 -2.911 236 HG2 MET 30 2HG MET 30 -14.755 -10.280 -0.882 237 HG3 MET 30 3HG MET 30 -13.339 -9.899 -1.867 238 HE1 MET 30 1HE MET 30 -14.959 -6.379 -0.888 239 HE2 MET 30 2HE MET 30 -13.530 -7.396 -0.718 240 HE3 MET 30 3HE MET 30 -15.029 -7.841 0.096 241 H ILE 31 H ILE 31 -14.051 -12.933 -5.095 242 HA ILE 31 HA ILE 31 -16.472 -14.258 -5.737 243 HB ILE 31 HB ILE 31 -13.798 -14.226 -7.242 244 HG12 ILE 31 2HG1 ILE 31 -16.287 -12.507 -7.683 245 HG13 ILE 31 3HG1 ILE 31 -14.835 -11.969 -6.850 246 HG21 ILE 31 1HG2 ILE 31 -16.539 -15.023 -8.295 247 HG22 ILE 31 2HG2 ILE 31 -15.171 -16.107 -8.038 248 HG23 ILE 31 3HG2 ILE 31 -15.078 -14.849 -9.272 249 HD11 ILE 31 1HD1 ILE 31 -15.020 -12.753 -9.758 250 HD12 ILE 31 2HD1 ILE 31 -13.552 -12.242 -8.920 251 HD13 ILE 31 3HD1 ILE 31 -14.898 -11.119 -9.104 252 H GLU 32 H GLU 32 -13.182 -15.472 -5.049 253 HA GLU 32 HA GLU 32 -13.683 -18.237 -5.488 254 HB2 GLU 32 2HB GLU 32 -11.538 -16.852 -3.821 255 HB3 GLU 32 3HB GLU 32 -11.541 -18.577 -4.184 256 HG2 GLU 32 2HG GLU 32 -11.322 -18.113 -6.578 257 HG3 GLU 32 3HG GLU 32 -11.416 -16.377 -6.276 258 H ASP 33 H ASP 33 -13.881 -16.208 -2.587 259 HA ASP 33 HA ASP 33 -14.257 -18.260 -0.651 260 HB2 ASP 33 2HB ASP 33 -13.517 -16.001 -0.019 261 HB3 ASP 33 3HB ASP 33 -15.015 -15.300 -0.614 262 H ILE 34 H ILE 34 -16.522 -16.180 -2.439 263 HA ILE 34 HA ILE 34 -18.949 -17.291 -1.448 264 HB ILE 34 HB ILE 34 -18.330 -15.762 -4.029 265 HG12 ILE 34 2HG1 ILE 34 -17.984 -14.453 -1.950 266 HG13 ILE 34 3HG1 ILE 34 -19.316 -13.807 -2.897 267 HG21 ILE 34 1HG2 ILE 34 -21.082 -16.460 -2.946 268 HG22 ILE 34 2HG2 ILE 34 -20.358 -17.042 -4.448 269 HG23 ILE 34 3HG2 ILE 34 -20.761 -15.335 -4.268 270 HD11 ILE 34 1HD1 ILE 34 -19.559 -15.497 -0.410 271 HD12 ILE 34 2HD1 ILE 34 -20.909 -14.848 -1.348 272 HD13 ILE 34 3HD1 ILE 34 -19.791 -13.755 -0.533 273 H GLY 35 H GLY 35 -16.671 -18.246 -3.924 274 HA2 GLY 35 2HA GLY 35 -16.546 -20.163 -5.229 275 HA3 GLY 35 3HA GLY 35 -18.125 -20.671 -4.642 276 H GLU 36 H GLU 36 -17.834 -17.451 -5.747 277 HA GLU 36 HA GLU 36 -18.604 -16.200 -7.396 278 HB2 GLU 36 2HB GLU 36 -17.291 -17.626 -8.943 279 HB3 GLU 36 3HB GLU 36 -18.673 -18.704 -9.128 280 HG2 GLU 36 2HG GLU 36 -19.981 -16.756 -10.055 281 HG3 GLU 36 3HG GLU 36 -18.505 -15.791 -9.985 282 H SER 37 H SER 37 -20.594 -15.415 -8.044 283 HA SER 37 HA SER 37 -22.975 -17.092 -7.974 284 HB2 SER 37 2HB SER 37 -22.694 -16.479 -5.584 285 HB3 SER 37 3HB SER 37 -22.606 -14.771 -6.009 286 HG SER 37 HG SER 37 -24.691 -15.255 -5.351 287 H ASP 38 H ASP 38 -24.842 -15.947 -8.769 288 HA ASP 38 HA ASP 38 -24.310 -13.955 -10.785 289 HB2 ASP 38 2HB ASP 38 -26.715 -14.108 -11.277 290 HB3 ASP 38 3HB ASP 38 -26.040 -15.720 -11.106 291 H SER 39 H SER 39 -24.981 -13.868 -7.437 292 HA SER 39 HA SER 39 -26.351 -11.423 -7.125 293 HB2 SER 39 2HB SER 39 -24.296 -12.693 -5.251 294 HB3 SER 39 3HB SER 39 -25.532 -11.508 -4.806 295 HG SER 39 HG SER 39 -27.014 -13.220 -5.751 296 HA PRO 40 HA PRO 40 -22.970 -8.562 -8.442 297 HB2 PRO 40 2HB PRO 40 -24.801 -6.580 -7.065 298 HB3 PRO 40 3HB PRO 40 -24.069 -6.508 -8.686 299 HG2 PRO 40 2HG PRO 40 -26.646 -7.075 -8.434 300 HG3 PRO 40 3HG PRO 40 -25.654 -7.957 -9.621 301 HD2 PRO 40 2HD PRO 40 -26.584 -8.866 -6.894 302 HD3 PRO 40 3HD PRO 40 -26.535 -9.767 -8.428 303 H ILE 41 H ILE 41 -21.155 -8.607 -7.255 304 HA ILE 41 HA ILE 41 -20.963 -8.789 -4.447 305 HB ILE 41 HB ILE 41 -18.805 -7.931 -6.440 306 HG12 ILE 41 2HG1 ILE 41 -19.719 -10.149 -7.017 307 HG13 ILE 41 3HG1 ILE 41 -18.077 -10.316 -6.415 308 HG21 ILE 41 1HG2 ILE 41 -17.164 -8.665 -4.738 309 HG22 ILE 41 2HG2 ILE 41 -18.478 -8.979 -3.601 310 HG23 ILE 41 3HG2 ILE 41 -18.159 -7.331 -4.150 311 HD11 ILE 41 1HD1 ILE 41 -20.623 -10.941 -4.905 312 HD12 ILE 41 2HD1 ILE 41 -18.992 -11.076 -4.237 313 HD13 ILE 41 3HD1 ILE 41 -19.481 -12.096 -5.588 314 HA PRO 42 HA PRO 42 -21.497 -4.289 -3.868 315 HB2 PRO 42 2HB PRO 42 -22.651 -4.349 -1.422 316 HB3 PRO 42 3HB PRO 42 -23.521 -4.922 -2.860 317 HG2 PRO 42 2HG PRO 42 -22.287 -6.504 -0.665 318 HG3 PRO 42 3HG PRO 42 -23.713 -6.871 -1.657 319 HD2 PRO 42 2HD PRO 42 -21.052 -7.861 -2.048 320 HD3 PRO 42 3HD PRO 42 -22.444 -8.084 -3.127 321 H LEU 43 H LEU 43 -19.663 -3.181 -3.544 322 HA LEU 43 HA LEU 43 -17.837 -3.772 -1.320 323 HB2 LEU 43 2HB LEU 43 -17.404 -1.949 -3.734 324 HB3 LEU 43 3HB LEU 43 -16.230 -2.285 -2.477 325 HG LEU 43 HG LEU 43 -16.301 -4.755 -3.225 326 HD11 LEU 43 1HD1 LEU 43 -17.025 -5.243 -5.509 327 HD12 LEU 43 2HD1 LEU 43 -17.675 -3.609 -5.667 328 HD13 LEU 43 3HD1 LEU 43 -18.378 -4.732 -4.501 329 HD21 LEU 43 1HD2 LEU 43 -14.723 -4.410 -5.063 330 HD22 LEU 43 2HD2 LEU 43 -14.421 -3.280 -3.743 331 HD23 LEU 43 3HD2 LEU 43 -15.238 -2.725 -5.205 332 HA PRO 44 HA PRO 44 -20.073 -0.128 0.399 333 HB2 PRO 44 2HB PRO 44 -20.136 -0.865 2.976 334 HB3 PRO 44 3HB PRO 44 -21.052 -1.798 1.770 335 HG2 PRO 44 2HG PRO 44 -18.419 -2.446 3.047 336 HG3 PRO 44 3HG PRO 44 -19.791 -3.520 2.695 337 HD2 PRO 44 2HD PRO 44 -17.518 -3.234 1.069 338 HD3 PRO 44 3HD PRO 44 -19.071 -3.920 0.549 339 H ASN 45 H ASN 45 -17.337 0.165 -0.323 340 HA ASN 45 HA ASN 45 -16.314 1.932 1.795 341 HB2 ASN 45 2HB ASN 45 -15.138 -0.240 2.090 342 HB3 ASN 45 3HB ASN 45 -14.647 -0.222 0.400 343 HD21 ASN 45 1HD2 ASN 45 -14.120 1.180 3.565 344 HD22 ASN 45 2HD2 ASN 45 -12.617 1.951 3.188 345 H VAL 46 H VAL 46 -15.771 0.692 -1.524 346 HA VAL 46 HA VAL 46 -14.522 3.203 -2.345 347 HB VAL 46 HB VAL 46 -13.469 1.046 -2.956 348 HG11 VAL 46 1HG1 VAL 46 -15.880 0.527 -4.710 349 HG12 VAL 46 2HG1 VAL 46 -15.461 -0.343 -3.234 350 HG13 VAL 46 3HG1 VAL 46 -14.408 -0.449 -4.646 351 HG21 VAL 46 1HG2 VAL 46 -12.998 2.989 -4.340 352 HG22 VAL 46 2HG2 VAL 46 -14.397 2.647 -5.359 353 HG23 VAL 46 3HG2 VAL 46 -13.027 1.534 -5.338 354 H THR 47 H THR 47 -15.492 4.737 -3.581 355 HA THR 47 HA THR 47 -18.354 4.674 -4.043 356 HB THR 47 HB THR 47 -17.991 7.032 -4.853 357 HG1 THR 47 HG1 THR 47 -15.284 6.728 -4.045 358 HG21 THR 47 1HG2 THR 47 -18.389 6.637 -2.437 359 HG22 THR 47 2HG2 THR 47 -17.292 7.994 -2.691 360 HG23 THR 47 3HG2 THR 47 -16.651 6.428 -2.182 361 H SER 48 H SER 48 -19.042 5.808 -6.295 362 HA SER 48 HA SER 48 -18.727 3.764 -8.218 363 HB2 SER 48 2HB SER 48 -20.050 5.301 -9.727 364 HB3 SER 48 3HB SER 48 -20.786 5.017 -8.154 365 HG SER 48 HG SER 48 -20.882 7.199 -8.610 366 H THR 49 H THR 49 -17.444 7.088 -8.164 367 HA THR 49 HA THR 49 -16.275 7.024 -10.744 368 HB THR 49 HB THR 49 -15.014 9.072 -9.954 369 HG1 THR 49 HG1 THR 49 -14.699 9.161 -7.872 370 HG21 THR 49 1HG2 THR 49 -17.971 9.084 -9.235 371 HG22 THR 49 2HG2 THR 49 -17.308 9.360 -10.849 372 HG23 THR 49 3HG2 THR 49 -16.984 10.509 -9.548 373 H ILE 50 H ILE 50 -15.040 6.282 -7.514 374 HA ILE 50 HA ILE 50 -12.291 6.045 -8.304 375 HB ILE 50 HB ILE 50 -13.667 5.146 -5.729 376 HG12 ILE 50 2HG1 ILE 50 -13.863 7.578 -6.071 377 HG13 ILE 50 3HG1 ILE 50 -12.760 7.243 -4.744 378 HG21 ILE 50 1HG2 ILE 50 -10.692 5.465 -6.286 379 HG22 ILE 50 2HG2 ILE 50 -11.546 3.946 -6.009 380 HG23 ILE 50 3HG2 ILE 50 -11.409 5.128 -4.707 381 HD11 ILE 50 1HD1 ILE 50 -11.974 8.046 -7.549 382 HD12 ILE 50 2HD1 ILE 50 -10.853 7.696 -6.227 383 HD13 ILE 50 3HD1 ILE 50 -11.959 9.064 -6.111 384 H LEU 51 H LEU 51 -14.955 3.726 -7.665 385 HA LEU 51 HA LEU 51 -13.405 1.355 -7.971 386 HB2 LEU 51 2HB LEU 51 -15.640 1.353 -6.837 387 HB3 LEU 51 3HB LEU 51 -16.410 1.705 -8.377 388 HG LEU 51 HG LEU 51 -15.665 -0.489 -9.275 389 HD11 LEU 51 1HD1 LEU 51 -14.502 -1.023 -6.527 390 HD12 LEU 51 2HD1 LEU 51 -13.595 -0.792 -8.025 391 HD13 LEU 51 3HD1 LEU 51 -14.647 -2.192 -7.843 392 HD21 LEU 51 1HD2 LEU 51 -17.865 -0.361 -8.210 393 HD22 LEU 51 2HD2 LEU 51 -17.154 -0.769 -6.645 394 HD23 LEU 51 3HD2 LEU 51 -17.132 -1.946 -7.962 395 H GLU 52 H GLU 52 -15.479 3.234 -10.203 396 HA GLU 52 HA GLU 52 -15.263 1.747 -12.557 397 HB2 GLU 52 2HB GLU 52 -16.691 3.822 -12.283 398 HB3 GLU 52 3HB GLU 52 -15.242 4.800 -12.349 399 HG2 GLU 52 2HG GLU 52 -14.810 3.798 -14.661 400 HG3 GLU 52 3HG GLU 52 -16.434 3.121 -14.581 401 H LYS 53 H LYS 53 -13.165 4.205 -11.189 402 HA LYS 53 HA LYS 53 -11.445 4.557 -13.399 403 HB2 LYS 53 2HB LYS 53 -11.917 6.003 -11.150 404 HB3 LYS 53 3HB LYS 53 -10.461 5.181 -10.610 405 HG2 LYS 53 2HG LYS 53 -9.313 6.033 -12.676 406 HG3 LYS 53 3HG LYS 53 -10.780 6.949 -13.043 407 HD2 LYS 53 2HD LYS 53 -10.532 8.211 -10.934 408 HD3 LYS 53 3HD LYS 53 -9.088 7.271 -10.529 409 HE2 LYS 53 2HE LYS 53 -8.421 9.424 -11.432 410 HE3 LYS 53 3HE LYS 53 -7.985 8.161 -12.584 411 HZ1 LYS 53 1HZ LYS 53 -8.986 10.021 -13.716 412 HZ2 LYS 53 2HZ LYS 53 -10.362 9.936 -12.742 413 HZ3 LYS 53 3HZ LYS 53 -10.014 8.690 -13.825 414 H VAL 54 H VAL 54 -11.134 2.724 -10.369 415 HA VAL 54 HA VAL 54 -8.534 1.705 -10.752 416 HB VAL 54 HB VAL 54 -10.868 0.699 -9.055 417 HG11 VAL 54 1HG1 VAL 54 -8.007 -0.332 -9.027 418 HG12 VAL 54 2HG1 VAL 54 -9.443 -1.241 -9.508 419 HG13 VAL 54 3HG1 VAL 54 -9.245 -0.728 -7.832 420 HG21 VAL 54 1HG2 VAL 54 -9.582 1.654 -7.167 421 HG22 VAL 54 2HG2 VAL 54 -9.936 2.882 -8.383 422 HG23 VAL 54 3HG2 VAL 54 -8.321 2.182 -8.288 423 H LEU 55 H LEU 55 -11.749 0.313 -11.485 424 HA LEU 55 HA LEU 55 -10.829 -2.208 -12.413 425 HB2 LEU 55 2HB LEU 55 -13.438 -0.757 -13.027 426 HB3 LEU 55 3HB LEU 55 -13.122 -2.438 -13.416 427 HG LEU 55 HG LEU 55 -13.372 -1.237 -10.636 428 HD11 LEU 55 1HD1 LEU 55 -15.349 -2.675 -10.424 429 HD12 LEU 55 2HD1 LEU 55 -15.141 -3.222 -12.089 430 HD13 LEU 55 3HD1 LEU 55 -15.509 -1.530 -11.754 431 HD21 LEU 55 1HD2 LEU 55 -12.700 -4.109 -11.348 432 HD22 LEU 55 2HD2 LEU 55 -13.070 -3.500 -9.732 433 HD23 LEU 55 3HD2 LEU 55 -11.628 -2.939 -10.571 434 H ASP 56 H ASP 56 -11.574 0.842 -14.083 435 HA ASP 56 HA ASP 56 -11.300 -0.169 -16.763 436 HB2 ASP 56 2HB ASP 56 -12.689 1.844 -16.155 437 HB3 ASP 56 3HB ASP 56 -11.210 2.736 -15.813 438 H TYR 57 H TYR 57 -9.184 1.474 -14.471 439 HA TYR 57 HA TYR 57 -6.883 1.791 -16.065 440 HB2 TYR 57 2HB TYR 57 -7.000 2.879 -13.906 441 HB3 TYR 57 3HB TYR 57 -7.223 1.351 -13.070 442 HD1 TYR 57 HD1 TYR 57 -4.733 3.464 -14.874 443 HD2 TYR 57 HD2 TYR 57 -5.295 0.017 -12.406 444 HE1 TYR 57 HE1 TYR 57 -2.305 3.318 -14.509 445 HE2 TYR 57 HE2 TYR 57 -2.867 -0.126 -12.043 446 HH TYR 57 HH TYR 57 -0.715 2.358 -12.894 447 H CYS 58 H CYS 58 -7.993 -0.878 -14.032 448 HA CYS 58 HA CYS 58 -5.810 -2.606 -14.438 449 HB2 CYS 58 2HB CYS 58 -8.700 -3.168 -13.670 450 HB3 CYS 58 3HB CYS 58 -7.428 -4.387 -13.648 451 HG CYS 58 HG CYS 58 -7.032 -1.531 -11.829 452 H ARG 59 H ARG 59 -8.834 -2.078 -16.250 453 HA ARG 59 HA ARG 59 -8.602 -4.299 -18.017 454 HB2 ARG 59 2HB ARG 59 -10.175 -1.700 -18.315 455 HB3 ARG 59 3HB ARG 59 -10.287 -3.045 -19.443 456 HG2 ARG 59 2HG ARG 59 -11.066 -4.498 -17.524 457 HG3 ARG 59 3HG ARG 59 -11.109 -3.049 -16.524 458 HD2 ARG 59 2HD ARG 59 -13.346 -3.458 -17.292 459 HD3 ARG 59 3HD ARG 59 -12.740 -2.053 -18.174 460 HE ARG 59 HE ARG 59 -12.420 -4.624 -19.510 461 HH11 ARG 59 1HH1 ARG 59 -14.489 -1.786 -19.160 462 HH12 ARG 59 2HH1 ARG 59 -15.299 -2.053 -20.673 463 HH21 ARG 59 1HH2 ARG 59 -13.484 -4.934 -21.486 464 HH22 ARG 59 2HH2 ARG 59 -14.725 -3.836 -21.983 465 H HIS 60 H HIS 60 -7.752 -0.863 -18.343 466 HA HIS 60 HA HIS 60 -6.730 -0.908 -20.961 467 HB2 HIS 60 2HB HIS 60 -7.277 1.212 -19.877 468 HB3 HIS 60 3HB HIS 60 -6.081 0.935 -18.613 469 HD1 HIS 60 HD1 HIS 60 -3.809 1.922 -19.020 470 HD2 HIS 60 HD2 HIS 60 -6.009 1.593 -22.535 471 HE1 HIS 60 HE1 HIS 60 -2.394 2.954 -20.808 472 HE2 HIS 60 HE2 HIS 60 -3.769 2.819 -22.901 473 H HIS 61 H HIS 61 -5.155 -1.421 -17.828 474 HA HIS 61 HA HIS 61 -2.483 -1.591 -18.861 475 HB2 HIS 61 2HB HIS 61 -3.345 -0.973 -16.420 476 HB3 HIS 61 3HB HIS 61 -3.277 -2.709 -16.150 477 HD1 HIS 61 HD1 HIS 61 -0.642 -3.479 -17.421 478 HD2 HIS 61 HD2 HIS 61 -1.127 -0.021 -15.164 479 HE1 HIS 61 HE1 HIS 61 1.665 -2.822 -16.691 480 HE2 HIS 61 HE2 HIS 61 1.362 -0.642 -15.486 481 H HIS 62 H HIS 62 -5.102 -3.845 -18.325 482 HA HIS 62 HA HIS 62 -3.544 -6.251 -18.646 483 HB2 HIS 62 2HB HIS 62 -5.729 -6.203 -17.430 484 HB3 HIS 62 3HB HIS 62 -6.554 -5.832 -18.939 485 HD1 HIS 62 HD1 HIS 62 -4.823 -8.619 -17.107 486 HD2 HIS 62 HD2 HIS 62 -7.001 -8.061 -20.605 487 HE1 HIS 62 HE1 HIS 62 -5.395 -10.922 -17.927 488 HE2 HIS 62 HE2 HIS 62 -6.735 -10.552 -20.017 489 H GLN 63 H GLN 63 -5.275 -4.027 -20.745 490 HA GLN 63 HA GLN 63 -4.986 -5.646 -23.145 491 HB2 GLN 63 2HB GLN 63 -5.963 -2.774 -22.776 492 HB3 GLN 63 3HB GLN 63 -5.974 -3.648 -24.304 493 HG2 GLN 63 2HG GLN 63 -7.571 -4.357 -21.825 494 HG3 GLN 63 3HG GLN 63 -8.200 -3.659 -23.315 495 HE21 GLN 63 1HE2 GLN 63 -8.938 -6.161 -21.964 496 HE22 GLN 63 2HE2 GLN 63 -8.692 -7.415 -23.127 497 H HIS 64 H HIS 64 -2.997 -3.481 -21.410 498 HA HIS 64 HA HIS 64 -1.007 -3.595 -23.599 499 HB2 HIS 64 2HB HIS 64 -1.556 -1.218 -21.761 500 HB3 HIS 64 3HB HIS 64 -0.066 -1.384 -22.684 501 HD1 HIS 64 HD1 HIS 64 -0.125 -0.731 -25.125 502 HD2 HIS 64 HD2 HIS 64 -3.907 -0.786 -23.401 503 HE1 HIS 64 HE1 HIS 64 -1.664 0.277 -26.835 504 HE2 HIS 64 HE2 HIS 64 -3.955 0.156 -25.808 505 HA PRO 65 HA PRO 65 0.701 -5.607 -19.755 506 HB2 PRO 65 2HB PRO 65 1.331 -7.982 -21.365 507 HB3 PRO 65 3HB PRO 65 0.181 -7.839 -20.022 508 HG2 PRO 65 2HG PRO 65 -0.587 -8.284 -22.613 509 HG3 PRO 65 3HG PRO 65 -1.618 -7.481 -21.408 510 HD2 PRO 65 2HD PRO 65 0.088 -6.231 -23.566 511 HD3 PRO 65 3HD PRO 65 -1.571 -5.830 -23.057 512 H GLY 66 H GLY 66 2.482 -4.272 -19.700 513 HA2 GLY 66 2HA GLY 66 4.955 -5.217 -20.817 514 HA3 GLY 66 3HA GLY 66 4.387 -3.748 -21.611 515 H GLY 67 H GLY 67 4.439 -1.799 -20.519 516 HA2 GLY 67 2HA GLY 67 5.102 -0.228 -18.994 517 HA3 GLY 67 3HA GLY 67 5.120 -1.476 -17.759 518 H SER 68 H SER 68 6.980 -0.554 -20.688 519 HA SER 68 HA SER 68 9.512 -0.966 -19.218 520 HB2 SER 68 2HB SER 68 8.816 -2.257 -21.892 521 HB3 SER 68 3HB SER 68 10.415 -2.294 -21.141 522 HG SER 68 HG SER 68 8.744 -3.129 -19.298 523 H GLY 69 H GLY 69 10.033 1.195 -19.225 524 HA2 GLY 69 2HA GLY 69 11.284 2.960 -19.987 525 HA3 GLY 69 3HA GLY 69 11.483 2.116 -21.509 526 H LEU 70 H LEU 70 9.774 2.317 -23.098 527 HA LEU 70 HA LEU 70 8.910 5.050 -23.387 528 HB2 LEU 70 2HB LEU 70 8.353 2.646 -25.173 529 HB3 LEU 70 3HB LEU 70 8.136 4.332 -25.620 530 HG LEU 70 HG LEU 70 10.802 2.963 -25.060 531 HD11 LEU 70 1HD1 LEU 70 9.837 2.249 -27.183 532 HD12 LEU 70 2HD1 LEU 70 11.247 3.265 -27.458 533 HD13 LEU 70 3HD1 LEU 70 9.627 3.928 -27.687 534 HD21 LEU 70 1HD2 LEU 70 10.900 5.298 -24.345 535 HD22 LEU 70 2HD2 LEU 70 10.283 5.832 -25.909 536 HD23 LEU 70 3HD2 LEU 70 11.864 5.058 -25.802 537 H ASP 71 H ASP 71 7.285 1.884 -23.113 538 HA ASP 71 HA ASP 71 4.648 3.141 -22.731 539 HB2 ASP 71 2HB ASP 71 3.713 0.942 -23.117 540 HB3 ASP 71 3HB ASP 71 4.935 1.218 -24.349 541 H ASP 72 H ASP 72 6.994 2.998 -20.731 542 HA ASP 72 HA ASP 72 6.299 1.358 -18.531 543 HB2 ASP 72 2HB ASP 72 8.554 2.416 -18.897 544 HB3 ASP 72 3HB ASP 72 7.859 3.980 -18.485 545 H ILE 73 H ILE 73 5.718 4.809 -19.140 546 HA ILE 73 HA ILE 73 3.330 4.711 -17.380 547 HB ILE 73 HB ILE 73 4.904 7.211 -18.183 548 HG12 ILE 73 2HG1 ILE 73 4.872 5.814 -15.462 549 HG13 ILE 73 3HG1 ILE 73 6.197 5.719 -16.614 550 HG21 ILE 73 1HG2 ILE 73 3.505 8.379 -16.502 551 HG22 ILE 73 2HG2 ILE 73 2.629 6.880 -16.186 552 HG23 ILE 73 3HG2 ILE 73 2.509 7.654 -17.767 553 HD11 ILE 73 1HD1 ILE 73 5.248 8.225 -15.221 554 HD12 ILE 73 2HD1 ILE 73 6.576 8.122 -16.384 555 HD13 ILE 73 3HD1 ILE 73 6.689 7.281 -14.840 556 HA PRO 74 HA PRO 74 1.603 4.894 -21.734 557 HB2 PRO 74 2HB PRO 74 -0.715 3.839 -20.097 558 HB3 PRO 74 3HB PRO 74 -0.116 3.292 -21.681 559 HG2 PRO 74 2HG PRO 74 0.389 1.838 -19.541 560 HG3 PRO 74 3HG PRO 74 1.685 2.100 -20.737 561 HD2 PRO 74 2HD PRO 74 1.257 3.470 -18.081 562 HD3 PRO 74 3HD PRO 74 2.757 2.830 -18.796 563 HA PRO 75 HA PRO 75 -0.338 8.936 -21.537 564 HB2 PRO 75 2HB PRO 75 -2.493 7.637 -23.239 565 HB3 PRO 75 3HB PRO 75 -1.656 9.189 -23.480 566 HG2 PRO 75 2HG PRO 75 -0.929 7.092 -24.918 567 HG3 PRO 75 3HG PRO 75 0.313 8.172 -24.239 568 HD2 PRO 75 2HD PRO 75 -0.504 5.431 -23.331 569 HD3 PRO 75 3HD PRO 75 1.103 6.197 -23.323 570 H TYR 76 H TYR 76 -2.834 6.330 -21.404 571 HA TYR 76 HA TYR 76 -4.731 7.780 -19.916 572 HB2 TYR 76 2HB TYR 76 -5.477 5.828 -21.135 573 HB3 TYR 76 3HB TYR 76 -4.387 4.774 -20.244 574 HD1 TYR 76 HD1 TYR 76 -7.506 6.806 -19.963 575 HD2 TYR 76 HD2 TYR 76 -5.034 3.865 -18.079 576 HE1 TYR 76 HE1 TYR 76 -9.247 6.414 -18.271 577 HE2 TYR 76 HE2 TYR 76 -6.774 3.488 -16.398 578 HH TYR 76 HH TYR 76 -9.896 4.436 -16.696 579 H ASP 77 H ASP 77 -2.138 5.602 -18.835 580 HA ASP 77 HA ASP 77 -2.917 5.435 -16.109 581 HB2 ASP 77 2HB ASP 77 -0.219 4.985 -17.460 582 HB3 ASP 77 3HB ASP 77 -0.527 4.631 -15.763 583 H ARG 78 H ARG 78 -1.019 7.759 -17.909 584 HA ARG 78 HA ARG 78 -0.108 9.287 -15.641 585 HB2 ARG 78 2HB ARG 78 0.880 9.147 -18.065 586 HB3 ARG 78 3HB ARG 78 -0.344 10.325 -18.493 587 HG2 ARG 78 2HG ARG 78 1.711 10.800 -16.314 588 HG3 ARG 78 3HG ARG 78 2.002 11.210 -18.000 589 HD2 ARG 78 2HD ARG 78 0.072 12.767 -17.938 590 HD3 ARG 78 3HD ARG 78 -0.194 12.363 -16.238 591 HE ARG 78 HE ARG 78 2.454 13.224 -16.569 592 HH11 ARG 78 1HH1 ARG 78 -0.800 14.587 -16.665 593 HH12 ARG 78 2HH1 ARG 78 -0.268 16.172 -16.198 594 HH21 ARG 78 1HH2 ARG 78 3.125 15.301 -16.010 595 HH22 ARG 78 2HH2 ARG 78 1.962 16.574 -15.829 596 H ASP 79 H ASP 79 -2.852 9.426 -17.903 597 HA ASP 79 HA ASP 79 -4.067 11.820 -16.899 598 HB2 ASP 79 2HB ASP 79 -5.201 9.534 -18.564 599 HB3 ASP 79 3HB ASP 79 -6.151 10.951 -18.128 600 H PHE 80 H PHE 80 -4.059 8.536 -15.862 601 HA PHE 80 HA PHE 80 -6.397 8.429 -14.259 602 HB2 PHE 80 2HB PHE 80 -5.151 6.404 -14.982 603 HB3 PHE 80 3HB PHE 80 -3.749 6.893 -14.047 604 HD1 PHE 80 HD1 PHE 80 -7.193 5.553 -13.854 605 HD2 PHE 80 HD2 PHE 80 -3.666 6.511 -11.635 606 HE1 PHE 80 HE1 PHE 80 -8.054 4.302 -11.922 607 HE2 PHE 80 HE2 PHE 80 -4.543 5.265 -9.710 608 HZ PHE 80 HZ PHE 80 -6.739 4.161 -9.850 609 H CYS 81 H CYS 81 -3.157 9.627 -13.749 610 HA CYS 81 HA CYS 81 -3.372 10.039 -10.899 611 HB2 CYS 81 2HB CYS 81 -1.284 10.968 -12.908 612 HB3 CYS 81 3HB CYS 81 -1.111 11.018 -11.155 613 HG CYS 81 HG CYS 81 -1.535 8.088 -12.884 614 H LYS 82 H LYS 82 -4.583 11.745 -13.568 615 HA LYS 82 HA LYS 82 -4.286 14.458 -12.581 616 HB2 LYS 82 2HB LYS 82 -5.944 13.274 -14.848 617 HB3 LYS 82 3HB LYS 82 -5.891 14.995 -14.492 618 HG2 LYS 82 2HG LYS 82 -3.495 13.307 -15.272 619 HG3 LYS 82 3HG LYS 82 -4.419 14.325 -16.377 620 HD2 LYS 82 2HD LYS 82 -2.880 15.308 -13.946 621 HD3 LYS 82 3HD LYS 82 -2.338 15.426 -15.620 622 HE2 LYS 82 2HE LYS 82 -4.231 16.901 -16.153 623 HE3 LYS 82 3HE LYS 82 -4.834 16.749 -14.498 624 HZ1 LYS 82 1HZ LYS 82 -2.239 17.963 -15.298 625 HZ2 LYS 82 2HZ LYS 82 -2.783 17.783 -13.711 626 HZ3 LYS 82 3HZ LYS 82 -3.611 18.799 -14.770 627 H VAL 83 H VAL 83 -5.160 13.894 -10.439 628 HA VAL 83 HA VAL 83 -8.053 14.350 -10.256 629 HB VAL 83 HB VAL 83 -8.150 12.627 -8.332 630 HG11 VAL 83 1HG1 VAL 83 -8.646 10.743 -9.819 631 HG12 VAL 83 2HG1 VAL 83 -7.823 11.556 -11.152 632 HG13 VAL 83 3HG1 VAL 83 -9.290 12.254 -10.462 633 HG21 VAL 83 1HG2 VAL 83 -5.722 12.273 -8.068 634 HG22 VAL 83 2HG2 VAL 83 -5.634 11.556 -9.678 635 HG23 VAL 83 3HG2 VAL 83 -6.552 10.750 -8.399 636 H ASP 84 H ASP 84 -8.726 15.083 -8.174 637 HA ASP 84 HA ASP 84 -6.911 16.996 -6.994 638 HB2 ASP 84 2HB ASP 84 -9.315 17.471 -7.382 639 HB3 ASP 84 3HB ASP 84 -9.758 16.185 -6.269 640 H GLN 85 H GLN 85 -6.537 17.072 -4.572 641 HA GLN 85 HA GLN 85 -5.111 14.849 -3.786 642 HB2 GLN 85 2HB GLN 85 -6.115 17.175 -2.110 643 HB3 GLN 85 3HB GLN 85 -5.093 15.916 -1.432 644 HG2 GLN 85 2HG GLN 85 -4.324 17.681 -3.774 645 HG3 GLN 85 3HG GLN 85 -3.833 17.945 -2.101 646 HE21 GLN 85 1HE2 GLN 85 -2.356 16.488 -1.145 647 HE22 GLN 85 2HE2 GLN 85 -1.360 15.445 -2.089 648 HA PRO 86 HA PRO 86 -8.691 13.381 -0.639 649 HB2 PRO 86 2HB PRO 86 -11.048 14.415 -2.253 650 HB3 PRO 86 3HB PRO 86 -10.904 14.166 -0.496 651 HG2 PRO 86 2HG PRO 86 -10.736 16.620 -1.461 652 HG3 PRO 86 3HG PRO 86 -9.618 16.095 -0.177 653 HD2 PRO 86 2HD PRO 86 -9.093 16.395 -3.129 654 HD3 PRO 86 3HD PRO 86 -8.053 16.817 -1.749 655 H THR 87 H THR 87 -9.564 13.716 -4.102 656 HA THR 87 HA THR 87 -10.621 11.137 -4.516 657 HB THR 87 HB THR 87 -9.346 12.969 -6.589 658 HG1 THR 87 HG1 THR 87 -11.430 13.451 -5.043 659 HG21 THR 87 1HG2 THR 87 -10.896 11.925 -8.182 660 HG22 THR 87 2HG2 THR 87 -11.536 10.878 -6.918 661 HG23 THR 87 3HG2 THR 87 -9.864 10.692 -7.454 662 H LEU 88 H LEU 88 -7.346 12.374 -4.649 663 HA LEU 88 HA LEU 88 -6.133 10.242 -6.123 664 HB2 LEU 88 2HB LEU 88 -5.392 12.729 -5.807 665 HB3 LEU 88 3HB LEU 88 -4.675 12.198 -4.302 666 HG LEU 88 HG LEU 88 -3.915 11.009 -7.006 667 HD11 LEU 88 1HD1 LEU 88 -1.945 12.469 -6.990 668 HD12 LEU 88 2HD1 LEU 88 -2.546 13.288 -5.545 669 HD13 LEU 88 3HD1 LEU 88 -3.441 13.398 -7.065 670 HD21 LEU 88 1HD2 LEU 88 -1.867 10.277 -5.855 671 HD22 LEU 88 2HD2 LEU 88 -3.311 9.588 -5.119 672 HD23 LEU 88 3HD2 LEU 88 -2.483 10.933 -4.334 673 H PHE 89 H PHE 89 -6.348 11.126 -2.674 674 HA PHE 89 HA PHE 89 -4.935 8.809 -1.730 675 HB2 PHE 89 2HB PHE 89 -6.600 10.892 -0.255 676 HB3 PHE 89 3HB PHE 89 -5.778 9.560 0.555 677 HD1 PHE 89 HD1 PHE 89 -3.253 9.415 0.471 678 HD2 PHE 89 HD2 PHE 89 -5.348 12.843 -0.963 679 HE1 PHE 89 HE1 PHE 89 -1.174 10.723 0.515 680 HE2 PHE 89 HE2 PHE 89 -3.274 14.145 -0.926 681 HZ PHE 89 HZ PHE 89 -1.172 13.079 -0.192 682 H GLU 90 H GLU 90 -8.321 9.521 -2.426 683 HA GLU 90 HA GLU 90 -9.509 7.224 -1.306 684 HB2 GLU 90 2HB GLU 90 -10.247 8.749 -3.844 685 HB3 GLU 90 3HB GLU 90 -11.216 7.434 -3.194 686 HG2 GLU 90 2HG GLU 90 -10.631 10.051 -1.803 687 HG3 GLU 90 3HG GLU 90 -12.136 9.622 -2.604 688 H LEU 91 H LEU 91 -7.716 7.669 -4.336 689 HA LEU 91 HA LEU 91 -8.075 5.054 -5.395 690 HB2 LEU 91 2HB LEU 91 -5.835 7.067 -5.845 691 HB3 LEU 91 3HB LEU 91 -6.045 5.605 -6.792 692 HG LEU 91 HG LEU 91 -8.029 7.922 -6.695 693 HD11 LEU 91 1HD1 LEU 91 -7.292 8.433 -8.985 694 HD12 LEU 91 2HD1 LEU 91 -6.080 7.151 -8.898 695 HD13 LEU 91 3HD1 LEU 91 -5.954 8.560 -7.842 696 HD21 LEU 91 1HD2 LEU 91 -8.039 5.427 -8.429 697 HD22 LEU 91 2HD2 LEU 91 -9.179 6.772 -8.530 698 HD23 LEU 91 3HD2 LEU 91 -9.135 5.767 -7.087 699 H ILE 92 H ILE 92 -5.699 6.424 -3.134 700 HA ILE 92 HA ILE 92 -3.995 4.129 -2.921 701 HB ILE 92 HB ILE 92 -4.428 6.417 -0.926 702 HG12 ILE 92 2HG1 ILE 92 -2.331 6.058 -3.119 703 HG13 ILE 92 3HG1 ILE 92 -3.630 7.241 -3.105 704 HG21 ILE 92 1HG2 ILE 92 -3.415 4.465 0.196 705 HG22 ILE 92 2HG2 ILE 92 -2.252 5.785 0.065 706 HG23 ILE 92 3HG2 ILE 92 -2.144 4.406 -1.030 707 HD11 ILE 92 1HD1 ILE 92 -2.577 8.339 -1.172 708 HD12 ILE 92 2HD1 ILE 92 -1.537 8.293 -2.592 709 HD13 ILE 92 3HD1 ILE 92 -1.248 7.180 -1.256 710 H LEU 93 H LEU 93 -6.787 5.312 -1.067 711 HA LEU 93 HA LEU 93 -6.876 3.292 0.918 712 HB2 LEU 93 2HB LEU 93 -9.003 5.183 -0.160 713 HB3 LEU 93 3HB LEU 93 -9.316 4.085 1.173 714 HG LEU 93 HG LEU 93 -7.223 6.304 1.220 715 HD11 LEU 93 1HD1 LEU 93 -8.749 7.517 2.726 716 HD12 LEU 93 2HD1 LEU 93 -9.977 6.265 2.505 717 HD13 LEU 93 3HD1 LEU 93 -9.476 7.260 1.137 718 HD21 LEU 93 1HD2 LEU 93 -7.098 5.851 3.641 719 HD22 LEU 93 2HD2 LEU 93 -6.621 4.448 2.691 720 HD23 LEU 93 3HD2 LEU 93 -8.213 4.493 3.451 721 H ALA 94 H ALA 94 -8.255 3.571 -2.329 722 HA ALA 94 HA ALA 94 -9.828 1.154 -2.221 723 HB1 ALA 94 1HB ALA 94 -10.179 1.525 -4.629 724 HB2 ALA 94 2HB ALA 94 -8.961 2.808 -4.624 725 HB3 ALA 94 3HB ALA 94 -10.458 3.003 -3.709 726 H ALA 95 H ALA 95 -6.562 2.024 -3.285 727 HA ALA 95 HA ALA 95 -5.926 -0.447 -4.583 728 HB1 ALA 95 1HB ALA 95 -3.596 0.317 -4.482 729 HB2 ALA 95 2HB ALA 95 -4.042 1.592 -3.341 730 HB3 ALA 95 3HB ALA 95 -4.658 1.629 -4.994 731 H ASN 96 H ASN 96 -5.751 0.700 -1.264 732 HA ASN 96 HA ASN 96 -4.329 -1.593 -0.207 733 HB2 ASN 96 2HB ASN 96 -4.147 0.668 0.838 734 HB3 ASN 96 3HB ASN 96 -5.859 0.627 1.246 735 HD21 ASN 96 1HD2 ASN 96 -5.175 0.973 3.451 736 HD22 ASN 96 2HD2 ASN 96 -4.610 -0.341 4.413 737 H TYR 97 H TYR 97 -7.713 -0.484 -0.305 738 HA TYR 97 HA TYR 97 -8.883 -2.543 1.266 739 HB2 TYR 97 2HB TYR 97 -10.096 -0.458 0.921 740 HB3 TYR 97 3HB TYR 97 -10.087 -0.673 -0.825 741 HD1 TYR 97 HD1 TYR 97 -12.114 -1.422 -1.801 742 HD2 TYR 97 HD2 TYR 97 -11.295 -2.501 2.257 743 HE1 TYR 97 HE1 TYR 97 -14.307 -2.532 -1.659 744 HE2 TYR 97 HE2 TYR 97 -13.487 -3.610 2.398 745 HH TYR 97 HH TYR 97 -15.664 -3.581 1.312 746 H LEU 98 H LEU 98 -8.328 -2.196 -2.213 747 HA LEU 98 HA LEU 98 -9.515 -4.807 -2.828 748 HB2 LEU 98 2HB LEU 98 -8.281 -2.723 -4.680 749 HB3 LEU 98 3HB LEU 98 -9.115 -4.179 -5.197 750 HG LEU 98 HG LEU 98 -10.348 -1.782 -3.792 751 HD11 LEU 98 1HD1 LEU 98 -10.806 -2.859 -6.593 752 HD12 LEU 98 2HD1 LEU 98 -9.935 -1.385 -6.164 753 HD13 LEU 98 3HD1 LEU 98 -11.664 -1.504 -5.849 754 HD21 LEU 98 1HD2 LEU 98 -11.385 -3.790 -2.920 755 HD22 LEU 98 2HD2 LEU 98 -11.681 -4.391 -4.552 756 HD23 LEU 98 3HD2 LEU 98 -12.508 -2.940 -3.978 757 H ASP 99 H ASP 99 -6.567 -3.602 -1.873 758 HA ASP 99 HA ASP 99 -4.550 -4.473 -1.477 759 HB2 ASP 99 2HB ASP 99 -6.128 -6.428 -0.788 760 HB3 ASP 99 3HB ASP 99 -5.617 -7.212 -2.272 761 H ILE 100 H ILE 100 -5.236 -3.528 -4.157 762 HA ILE 100 HA ILE 100 -3.676 -5.106 -6.039 763 HB ILE 100 HB ILE 100 -4.702 -2.275 -6.521 764 HG12 ILE 100 2HG1 ILE 100 -6.201 -4.889 -6.963 765 HG13 ILE 100 3HG1 ILE 100 -6.607 -3.659 -5.775 766 HG21 ILE 100 1HG2 ILE 100 -4.645 -2.956 -8.905 767 HG22 ILE 100 2HG2 ILE 100 -4.061 -4.555 -8.443 768 HG23 ILE 100 3HG2 ILE 100 -3.056 -3.133 -8.156 769 HD11 ILE 100 1HD1 ILE 100 -6.726 -3.334 -8.770 770 HD12 ILE 100 2HD1 ILE 100 -7.124 -2.095 -7.574 771 HD13 ILE 100 3HD1 ILE 100 -8.087 -3.567 -7.674 772 H LYS 101 H LYS 101 -1.680 -5.143 -5.066 773 HA LYS 101 HA LYS 101 -0.186 -3.039 -4.066 774 HB2 LYS 101 2HB LYS 101 0.268 -5.481 -3.742 775 HB3 LYS 101 3HB LYS 101 0.901 -5.554 -5.384 776 HG2 LYS 101 2HG LYS 101 2.665 -3.914 -4.752 777 HG3 LYS 101 3HG LYS 101 2.037 -3.901 -3.102 778 HD2 LYS 101 2HD LYS 101 2.538 -6.350 -2.932 779 HD3 LYS 101 3HD LYS 101 3.236 -6.291 -4.556 780 HE2 LYS 101 2HE LYS 101 5.000 -6.165 -2.872 781 HE3 LYS 101 3HE LYS 101 4.903 -4.642 -3.759 782 HZ1 LYS 101 1HZ LYS 101 5.147 -4.365 -1.342 783 HZ2 LYS 101 2HZ LYS 101 3.652 -5.108 -1.115 784 HZ3 LYS 101 3HZ LYS 101 3.738 -3.647 -1.939 785 HA PRO 102 HA PRO 102 1.909 -2.441 -8.516 786 HB2 PRO 102 2HB PRO 102 0.078 -2.749 -10.624 787 HB3 PRO 102 3HB PRO 102 1.315 -3.934 -10.169 788 HG2 PRO 102 2HG PRO 102 -1.592 -3.884 -9.436 789 HG3 PRO 102 3HG PRO 102 -0.580 -5.259 -9.933 790 HD2 PRO 102 2HD PRO 102 -1.194 -4.874 -7.362 791 HD3 PRO 102 3HD PRO 102 0.426 -5.449 -7.823 792 H LEU 103 H LEU 103 -1.618 -1.848 -8.141 793 HA LEU 103 HA LEU 103 -1.672 0.749 -9.311 794 HB2 LEU 103 2HB LEU 103 -3.720 -0.585 -9.041 795 HB3 LEU 103 3HB LEU 103 -3.537 -0.566 -7.294 796 HG LEU 103 HG LEU 103 -3.927 1.902 -7.290 797 HD11 LEU 103 1HD1 LEU 103 -4.736 3.046 -9.278 798 HD12 LEU 103 2HD1 LEU 103 -4.465 1.600 -10.251 799 HD13 LEU 103 3HD1 LEU 103 -3.100 2.442 -9.513 800 HD21 LEU 103 1HD2 LEU 103 -6.148 0.318 -8.621 801 HD22 LEU 103 2HD2 LEU 103 -6.335 1.845 -7.752 802 HD23 LEU 103 3HD2 LEU 103 -5.814 0.401 -6.888 803 H LEU 104 H LEU 104 -1.427 -0.418 -5.980 804 HA LEU 104 HA LEU 104 -1.389 1.950 -4.534 805 HB2 LEU 104 2HB LEU 104 -1.529 -0.298 -3.511 806 HB3 LEU 104 3HB LEU 104 0.112 -0.651 -4.023 807 HG LEU 104 HG LEU 104 0.909 1.214 -2.480 808 HD11 LEU 104 1HD1 LEU 104 -0.580 2.013 -0.713 809 HD12 LEU 104 2HD1 LEU 104 -1.943 1.167 -1.449 810 HD13 LEU 104 3HD1 LEU 104 -1.161 2.499 -2.304 811 HD21 LEU 104 1HD2 LEU 104 1.072 -1.153 -1.851 812 HD22 LEU 104 2HD2 LEU 104 -0.548 -1.097 -1.152 813 HD23 LEU 104 3HD2 LEU 104 0.754 -0.137 -0.444 814 H ASP 105 H ASP 105 1.243 0.177 -6.102 815 HA ASP 105 HA ASP 105 3.417 1.747 -5.216 816 HB2 ASP 105 2HB ASP 105 3.674 -0.558 -6.083 817 HB3 ASP 105 3HB ASP 105 3.188 -0.033 -7.691 818 H VAL 106 H VAL 106 1.597 1.797 -8.306 819 HA VAL 106 HA VAL 106 2.992 3.842 -9.620 820 HB VAL 106 HB VAL 106 0.043 3.069 -9.847 821 HG11 VAL 106 1HG1 VAL 106 0.314 5.337 -10.758 822 HG12 VAL 106 2HG1 VAL 106 0.016 4.185 -12.057 823 HG13 VAL 106 3HG1 VAL 106 1.650 4.796 -11.778 824 HG21 VAL 106 1HG2 VAL 106 0.741 1.790 -11.834 825 HG22 VAL 106 2HG2 VAL 106 1.602 1.244 -10.396 826 HG23 VAL 106 3HG2 VAL 106 2.420 2.274 -11.571 827 H THR 107 H THR 107 0.108 4.067 -7.527 828 HA THR 107 HA THR 107 -0.193 6.890 -7.724 829 HB THR 107 HB THR 107 -1.333 5.075 -5.549 830 HG1 THR 107 HG1 THR 107 -2.256 4.113 -7.209 831 HG21 THR 107 1HG2 THR 107 -1.732 7.497 -5.172 832 HG22 THR 107 2HG2 THR 107 -3.233 6.659 -5.575 833 HG23 THR 107 3HG2 THR 107 -2.412 7.635 -6.797 834 H CYS 108 H CYS 108 1.572 4.794 -5.488 835 HA CYS 108 HA CYS 108 2.210 6.787 -3.525 836 HB2 CYS 108 2HB CYS 108 3.426 4.061 -4.099 837 HB3 CYS 108 3HB CYS 108 3.960 5.092 -2.772 838 HG CYS 108 HG CYS 108 0.690 4.166 -3.022 839 H LYS 109 H LYS 109 3.685 5.727 -6.544 840 HA LYS 109 HA LYS 109 6.126 7.229 -6.241 841 HB2 LYS 109 2HB LYS 109 4.856 5.600 -8.426 842 HB3 LYS 109 3HB LYS 109 5.950 6.866 -8.966 843 HG2 LYS 109 2HG LYS 109 7.021 4.616 -8.734 844 HG3 LYS 109 3HG LYS 109 7.810 5.881 -7.786 845 HD2 LYS 109 2HD LYS 109 6.696 5.052 -5.742 846 HD3 LYS 109 3HD LYS 109 5.851 3.824 -6.686 847 HE2 LYS 109 2HE LYS 109 8.870 4.002 -6.403 848 HE3 LYS 109 3HE LYS 109 7.828 2.932 -5.465 849 HZ1 LYS 109 1HZ LYS 109 8.802 1.768 -7.331 850 HZ2 LYS 109 2HZ LYS 109 8.140 2.877 -8.421 851 HZ3 LYS 109 3HZ LYS 109 7.131 1.864 -7.525 852 H THR 110 H THR 110 2.950 7.804 -7.732 853 HA THR 110 HA THR 110 3.457 10.229 -9.027 854 HB THR 110 HB THR 110 0.854 9.240 -7.775 855 HG1 THR 110 HG1 THR 110 0.455 8.585 -9.969 856 HG21 THR 110 1HG2 THR 110 0.701 11.671 -8.232 857 HG22 THR 110 2HG2 THR 110 -0.296 10.755 -9.364 858 HG23 THR 110 3HG2 THR 110 1.261 11.404 -9.886 859 H VAL 111 H VAL 111 2.172 9.688 -5.691 860 HA VAL 111 HA VAL 111 2.048 12.424 -4.957 861 HB VAL 111 HB VAL 111 1.982 11.637 -2.566 862 HG11 VAL 111 1HG1 VAL 111 -0.098 11.761 -3.870 863 HG12 VAL 111 2HG1 VAL 111 -0.155 10.423 -2.719 864 HG13 VAL 111 3HG1 VAL 111 0.137 10.102 -4.432 865 HG21 VAL 111 1HG2 VAL 111 3.489 9.709 -2.719 866 HG22 VAL 111 2HG2 VAL 111 2.335 8.863 -3.751 867 HG23 VAL 111 3HG2 VAL 111 1.921 9.217 -2.072 868 H ALA 112 H ALA 112 4.644 10.029 -4.728 869 HA ALA 112 HA ALA 112 6.498 11.558 -3.225 870 HB1 ALA 112 1HB ALA 112 8.151 9.901 -3.964 871 HB2 ALA 112 2HB ALA 112 7.022 9.305 -5.187 872 HB3 ALA 112 3HB ALA 112 6.646 9.118 -3.474 873 H ASN 113 H ASN 113 5.673 11.518 -6.621 874 HA ASN 113 HA ASN 113 7.958 13.042 -7.536 875 HB2 ASN 113 2HB ASN 113 5.353 12.249 -8.911 876 HB3 ASN 113 3HB ASN 113 6.631 13.160 -9.711 877 HD21 ASN 113 1HD2 ASN 113 5.502 10.483 -10.288 878 HD22 ASN 113 2HD2 ASN 113 6.852 9.412 -10.301 879 H MET 114 H MET 114 4.641 13.751 -6.535 880 HA MET 114 HA MET 114 4.559 16.457 -7.503 881 HB2 MET 114 2HB MET 114 2.884 15.133 -5.329 882 HB3 MET 114 3HB MET 114 2.550 16.711 -6.034 883 HG2 MET 114 2HG MET 114 2.291 15.558 -8.263 884 HG3 MET 114 3HG MET 114 2.393 14.022 -7.403 885 HE1 MET 114 1HE MET 114 -0.803 14.449 -4.985 886 HE2 MET 114 2HE MET 114 0.795 15.092 -4.611 887 HE3 MET 114 3HE MET 114 0.632 13.473 -5.292 888 H ILE 115 H ILE 115 5.398 14.948 -4.426 889 HA ILE 115 HA ILE 115 5.952 17.495 -3.087 890 HB ILE 115 HB ILE 115 6.405 16.134 -1.094 891 HG12 ILE 115 2HG1 ILE 115 6.214 13.747 -2.985 892 HG13 ILE 115 3HG1 ILE 115 7.659 14.318 -2.171 893 HG21 ILE 115 1HG2 ILE 115 3.949 15.049 -2.532 894 HG22 ILE 115 2HG2 ILE 115 4.023 16.559 -1.622 895 HG23 ILE 115 3HG2 ILE 115 4.229 15.019 -0.787 896 HD11 ILE 115 1HD1 ILE 115 5.282 12.970 -0.962 897 HD12 ILE 115 2HD1 ILE 115 6.546 13.749 -0.017 898 HD13 ILE 115 3HD1 ILE 115 6.943 12.391 -1.067 899 H ARG 116 H ARG 116 7.655 15.755 -5.313 900 HA ARG 116 HA ARG 116 10.037 14.961 -4.064 901 HB2 ARG 116 2HB ARG 116 9.233 14.158 -6.306 902 HB3 ARG 116 3HB ARG 116 9.691 15.707 -6.999 903 HG2 ARG 116 2HG ARG 116 11.409 14.047 -7.479 904 HG3 ARG 116 3HG ARG 116 12.056 15.261 -6.374 905 HD2 ARG 116 2HD ARG 116 11.455 13.633 -4.470 906 HD3 ARG 116 3HD ARG 116 11.194 12.424 -5.731 907 HE ARG 116 HE ARG 116 13.625 13.153 -6.366 908 HH11 ARG 116 1HH1 ARG 116 12.355 12.607 -3.109 909 HH12 ARG 116 2HH1 ARG 116 13.900 12.141 -2.479 910 HH21 ARG 116 1HH2 ARG 116 15.623 12.588 -5.499 911 HH22 ARG 116 2HH2 ARG 116 15.757 12.132 -3.829 912 H GLY 117 H GLY 117 11.047 16.445 -2.836 913 HA2 GLY 117 2HA GLY 117 11.669 19.139 -3.645 914 HA3 GLY 117 3HA GLY 117 12.226 18.310 -2.200 915 H1 SER 2 1H SER 2 18.650 -15.078 18.218 916 H2 SER 2 2H SER 2 17.598 -14.483 17.035 917 H3 SER 2 3H SER 2 17.742 -13.684 18.512 918 HA SER 2 HA SER 2 19.970 -13.074 18.061 919 HB2 SER 2 2HB SER 2 19.613 -14.542 15.410 920 HB3 SER 2 3HB SER 2 21.061 -13.672 15.924 921 HG SER 2 HG SER 2 21.629 -15.334 17.099 922 H LEU 3 H LEU 3 20.382 -11.067 17.131 923 HA LEU 3 HA LEU 3 18.170 -9.620 15.971 924 HB2 LEU 3 2HB LEU 3 21.059 -8.741 16.370 925 HB3 LEU 3 3HB LEU 3 19.711 -7.686 15.978 926 HG LEU 3 HG LEU 3 20.019 -9.228 18.584 927 HD11 LEU 3 1HD1 LEU 3 21.689 -7.454 18.396 928 HD12 LEU 3 2HD1 LEU 3 20.482 -7.049 19.611 929 HD13 LEU 3 3HD1 LEU 3 20.431 -6.270 18.024 930 HD21 LEU 3 1HD2 LEU 3 18.133 -7.877 19.377 931 HD22 LEU 3 2HD2 LEU 3 17.674 -8.893 18.013 932 HD23 LEU 3 3HD2 LEU 3 17.953 -7.165 17.769 933 H VAL 4 H VAL 4 17.775 -9.385 13.824 934 HA VAL 4 HA VAL 4 19.736 -10.307 11.846 935 HB VAL 4 HB VAL 4 17.856 -9.882 10.160 936 HG11 VAL 4 1HG1 VAL 4 18.352 -12.131 11.029 937 HG12 VAL 4 2HG1 VAL 4 16.616 -11.939 10.774 938 HG13 VAL 4 3HG1 VAL 4 17.285 -11.858 12.408 939 HG21 VAL 4 1HG2 VAL 4 16.524 -8.259 11.457 940 HG22 VAL 4 2HG2 VAL 4 16.171 -9.492 12.668 941 HG23 VAL 4 3HG2 VAL 4 15.542 -9.663 11.027 942 H LYS 5 H LYS 5 20.963 -9.020 10.703 943 HA LYS 5 HA LYS 5 21.093 -6.187 11.282 944 HB2 LYS 5 2HB LYS 5 22.833 -8.009 9.568 945 HB3 LYS 5 3HB LYS 5 23.202 -6.322 9.912 946 HG2 LYS 5 2HG LYS 5 23.430 -6.827 12.296 947 HG3 LYS 5 3HG LYS 5 22.970 -8.507 12.007 948 HD2 LYS 5 2HD LYS 5 24.983 -8.868 10.663 949 HD3 LYS 5 3HD LYS 5 25.428 -7.162 10.808 950 HE2 LYS 5 2HE LYS 5 26.733 -8.584 12.346 951 HE3 LYS 5 3HE LYS 5 25.729 -7.431 13.229 952 HZ1 LYS 5 1HZ LYS 5 24.123 -9.195 13.608 953 HZ2 LYS 5 2HZ LYS 5 25.639 -9.614 14.220 954 HZ3 LYS 5 3HZ LYS 5 25.088 -10.293 12.775 955 H LEU 6 H LEU 6 19.752 -4.879 10.181 956 HA LEU 6 HA LEU 6 19.295 -5.280 7.280 957 HB2 LEU 6 2HB LEU 6 17.689 -3.900 9.453 958 HB3 LEU 6 3HB LEU 6 17.481 -3.427 7.776 959 HG LEU 6 HG LEU 6 16.810 -5.763 7.204 960 HD11 LEU 6 1HD1 LEU 6 16.219 -7.366 8.949 961 HD12 LEU 6 2HD1 LEU 6 16.884 -6.286 10.179 962 HD13 LEU 6 3HD1 LEU 6 17.946 -7.005 8.968 963 HD21 LEU 6 1HD2 LEU 6 14.584 -5.642 8.209 964 HD22 LEU 6 2HD2 LEU 6 15.130 -4.064 7.649 965 HD23 LEU 6 3HD2 LEU 6 15.165 -4.449 9.374 966 H GLU 7 H GLU 7 21.069 -4.325 6.376 967 HA GLU 7 HA GLU 7 21.984 -1.680 7.129 968 HB2 GLU 7 2HB GLU 7 23.574 -3.355 6.232 969 HB3 GLU 7 3HB GLU 7 22.684 -3.408 4.712 970 HG2 GLU 7 2HG GLU 7 23.202 -0.982 4.377 971 HG3 GLU 7 3HG GLU 7 24.183 -1.015 5.839 972 H SER 8 H SER 8 21.082 0.165 6.415 973 HA SER 8 HA SER 8 18.918 0.192 4.480 974 HB2 SER 8 2HB SER 8 18.771 2.611 5.173 975 HB3 SER 8 3HB SER 8 18.724 1.498 6.540 976 HG SER 8 HG SER 8 20.621 2.181 7.200 977 H SER 9 H SER 9 18.945 2.279 3.023 978 HA SER 9 HA SER 9 20.944 2.029 1.030 979 HB2 SER 9 2HB SER 9 18.902 4.256 1.423 980 HB3 SER 9 3HB SER 9 19.774 3.892 -0.071 981 HG SER 9 HG SER 9 18.494 1.713 0.958 982 H ASP 10 H ASP 10 20.744 3.933 3.896 983 HA ASP 10 HA ASP 10 22.920 5.764 3.176 984 HB2 ASP 10 2HB ASP 10 20.864 6.520 4.459 985 HB3 ASP 10 3HB ASP 10 21.374 5.492 5.789 986 H GLU 11 H GLU 11 22.969 2.663 3.774 987 HA GLU 11 HA GLU 11 24.529 1.144 4.333 988 HB2 GLU 11 2HB GLU 11 26.301 3.574 4.815 989 HB3 GLU 11 3HB GLU 11 26.886 1.912 4.788 990 HG2 GLU 11 2HG GLU 11 26.295 1.675 2.443 991 HG3 GLU 11 3HG GLU 11 25.514 3.254 2.435 992 H LYS 12 H LYS 12 22.854 2.637 6.469 993 HA LYS 12 HA LYS 12 24.387 2.158 8.924 994 HB2 LYS 12 2HB LYS 12 21.589 3.298 8.503 995 HB3 LYS 12 3HB LYS 12 22.435 3.217 10.047 996 HG2 LYS 12 2HG LYS 12 23.353 4.800 7.629 997 HG3 LYS 12 3HG LYS 12 22.527 5.472 9.036 998 HD2 LYS 12 2HD LYS 12 24.405 4.895 10.477 999 HD3 LYS 12 3HD LYS 12 25.212 4.049 9.153 1000 HE2 LYS 12 2HE LYS 12 26.176 6.305 9.595 1001 HE3 LYS 12 3HE LYS 12 25.552 6.143 7.955 1002 HZ1 LYS 12 1HZ LYS 12 24.058 7.414 10.192 1003 HZ2 LYS 12 2HZ LYS 12 23.608 7.382 8.564 1004 HZ3 LYS 12 3HZ LYS 12 24.968 8.267 9.047 1005 H VAL 13 H VAL 13 24.254 0.302 9.993 1006 HA VAL 13 HA VAL 13 22.346 -1.766 9.190 1007 HB VAL 13 HB VAL 13 24.753 -1.939 11.074 1008 HG11 VAL 13 1HG1 VAL 13 23.138 -4.162 9.774 1009 HG12 VAL 13 2HG1 VAL 13 23.136 -3.735 11.485 1010 HG13 VAL 13 3HG1 VAL 13 24.599 -4.381 10.742 1011 HG21 VAL 13 1HG2 VAL 13 25.984 -2.932 9.182 1012 HG22 VAL 13 2HG2 VAL 13 25.449 -1.294 8.796 1013 HG23 VAL 13 3HG2 VAL 13 24.589 -2.683 8.126 1014 H PHE 14 H PHE 14 20.511 -1.969 10.304 1015 HA PHE 14 HA PHE 14 20.329 -1.215 13.162 1016 HB2 PHE 14 2HB PHE 14 18.102 -1.446 11.076 1017 HB3 PHE 14 3HB PHE 14 17.898 -0.938 12.751 1018 HD1 PHE 14 HD1 PHE 14 18.513 0.205 9.406 1019 HD2 PHE 14 HD2 PHE 14 19.227 1.173 13.511 1020 HE1 PHE 14 HE1 PHE 14 18.996 2.532 8.781 1021 HE2 PHE 14 HE2 PHE 14 19.699 3.497 12.873 1022 HZ PHE 14 HZ PHE 14 19.592 4.178 10.514 1023 H GLU 15 H GLU 15 20.683 -3.000 14.285 1024 HA GLU 15 HA GLU 15 19.991 -5.657 13.339 1025 HB2 GLU 15 2HB GLU 15 21.263 -4.831 15.978 1026 HB3 GLU 15 3HB GLU 15 21.224 -6.453 15.291 1027 HG2 GLU 15 2HG GLU 15 22.656 -5.675 13.415 1028 HG3 GLU 15 3HG GLU 15 22.696 -4.067 14.133 1029 H ILE 16 H ILE 16 17.708 -5.263 13.313 1030 HA ILE 16 HA ILE 16 16.233 -4.827 15.779 1031 HB ILE 16 HB ILE 16 15.290 -3.945 13.690 1032 HG12 ILE 16 2HG1 ILE 16 13.603 -6.198 14.883 1033 HG13 ILE 16 3HG1 ILE 16 13.640 -4.519 15.396 1034 HG21 ILE 16 1HG2 ILE 16 15.119 -6.802 12.687 1035 HG22 ILE 16 2HG2 ILE 16 16.226 -5.560 12.103 1036 HG23 ILE 16 3HG2 ILE 16 14.488 -5.380 11.852 1037 HD11 ILE 16 1HD1 ILE 16 12.596 -3.864 13.282 1038 HD12 ILE 16 2HD1 ILE 16 11.614 -5.010 14.185 1039 HD13 ILE 16 3HD1 ILE 16 12.539 -5.556 12.788 1040 H GLU 17 H GLU 17 15.006 -6.340 16.871 1041 HA GLU 17 HA GLU 17 15.695 -9.036 17.072 1042 HB2 GLU 17 2HB GLU 17 13.056 -7.678 17.788 1043 HB3 GLU 17 3HB GLU 17 13.579 -9.249 18.391 1044 HG2 GLU 17 2HG GLU 17 15.434 -8.227 19.597 1045 HG3 GLU 17 3HG GLU 17 15.063 -6.655 18.899 1046 H LYS 18 H LYS 18 15.240 -10.764 15.846 1047 HA LYS 18 HA LYS 18 14.275 -10.552 13.252 1048 HB2 LYS 18 2HB LYS 18 15.822 -12.323 13.920 1049 HB3 LYS 18 3HB LYS 18 14.604 -13.038 14.973 1050 HG2 LYS 18 2HG LYS 18 13.205 -13.538 12.952 1051 HG3 LYS 18 3HG LYS 18 14.507 -12.912 11.931 1052 HD2 LYS 18 2HD LYS 18 16.016 -14.683 12.687 1053 HD3 LYS 18 3HD LYS 18 14.829 -15.238 13.872 1054 HE2 LYS 18 2HE LYS 18 13.296 -15.850 12.022 1055 HE3 LYS 18 3HE LYS 18 14.530 -15.348 10.857 1056 HZ1 LYS 18 1HZ LYS 18 15.987 -17.047 11.629 1057 HZ2 LYS 18 2HZ LYS 18 14.499 -17.765 11.313 1058 HZ3 LYS 18 3HZ LYS 18 14.966 -17.449 12.914 1059 H GLU 19 H GLU 19 12.619 -11.706 16.165 1060 HA GLU 19 HA GLU 19 10.262 -12.758 15.061 1061 HB2 GLU 19 2HB GLU 19 10.912 -13.163 17.384 1062 HB3 GLU 19 3HB GLU 19 10.746 -11.457 17.777 1063 HG2 GLU 19 2HG GLU 19 8.307 -11.611 17.398 1064 HG3 GLU 19 3HG GLU 19 8.475 -13.315 16.987 1065 H ILE 20 H ILE 20 11.155 -9.483 15.826 1066 HA ILE 20 HA ILE 20 8.534 -8.323 15.399 1067 HB ILE 20 HB ILE 20 11.255 -7.022 15.856 1068 HG12 ILE 20 2HG1 ILE 20 9.001 -7.683 17.815 1069 HG13 ILE 20 3HG1 ILE 20 10.582 -8.445 17.759 1070 HG21 ILE 20 1HG2 ILE 20 9.693 -5.486 14.751 1071 HG22 ILE 20 2HG2 ILE 20 10.007 -4.986 16.410 1072 HG23 ILE 20 3HG2 ILE 20 8.489 -5.790 16.008 1073 HD11 ILE 20 1HD1 ILE 20 10.462 -6.925 19.600 1074 HD12 ILE 20 2HD1 ILE 20 9.993 -5.597 18.546 1075 HD13 ILE 20 3HD1 ILE 20 11.606 -6.303 18.414 1076 H ALA 21 H ALA 21 11.590 -8.652 13.620 1077 HA ALA 21 HA ALA 21 10.930 -7.052 11.357 1078 HB1 ALA 21 1HB ALA 21 12.890 -9.363 11.573 1079 HB2 ALA 21 2HB ALA 21 13.244 -7.671 11.917 1080 HB3 ALA 21 3HB ALA 21 12.841 -8.165 10.272 1081 H CYS 22 H CYS 22 9.930 -10.194 12.344 1082 HA CYS 22 HA CYS 22 9.192 -11.308 9.842 1083 HB2 CYS 22 2HB CYS 22 8.281 -11.919 12.664 1084 HB3 CYS 22 3HB CYS 22 7.830 -12.885 11.259 1085 HG CYS 22 HG CYS 22 11.137 -12.393 11.626 1086 H MET 23 H MET 23 7.610 -8.947 11.905 1087 HA MET 23 HA MET 23 4.949 -9.219 10.906 1088 HB2 MET 23 2HB MET 23 6.258 -6.694 11.985 1089 HB3 MET 23 3HB MET 23 4.532 -6.957 11.788 1090 HG2 MET 23 2HG MET 23 4.931 -8.958 13.448 1091 HG3 MET 23 3HG MET 23 6.397 -8.071 13.862 1092 HE1 MET 23 1HE MET 23 4.825 -5.022 13.150 1093 HE2 MET 23 2HE MET 23 6.109 -5.239 14.347 1094 HE3 MET 23 3HE MET 23 4.560 -4.548 14.829 1095 H SER 24 H SER 24 7.779 -7.519 9.757 1096 HA SER 24 HA SER 24 6.507 -6.368 7.438 1097 HB2 SER 24 2HB SER 24 8.607 -5.391 8.311 1098 HB3 SER 24 3HB SER 24 9.452 -6.912 8.016 1099 HG SER 24 HG SER 24 8.117 -5.506 5.957 1100 H VAL 25 H VAL 25 5.753 -7.613 5.853 1101 HA VAL 25 HA VAL 25 6.129 -10.401 5.724 1102 HB VAL 25 HB VAL 25 5.014 -8.608 3.515 1103 HG11 VAL 25 1HG1 VAL 25 3.735 -10.615 2.826 1104 HG12 VAL 25 2HG1 VAL 25 4.548 -11.561 4.077 1105 HG13 VAL 25 3HG1 VAL 25 5.477 -10.891 2.735 1106 HG21 VAL 25 1HG2 VAL 25 2.776 -9.009 4.519 1107 HG22 VAL 25 2HG2 VAL 25 3.844 -8.149 5.631 1108 HG23 VAL 25 3HG2 VAL 25 3.539 -9.871 5.862 1109 H THR 26 H THR 26 7.421 -7.756 3.682 1110 HA THR 26 HA THR 26 8.812 -9.334 1.815 1111 HB THR 26 HB THR 26 9.410 -6.472 2.685 1112 HG1 THR 26 HG1 THR 26 8.179 -6.002 0.762 1113 HG21 THR 26 1HG2 THR 26 10.250 -7.902 0.131 1114 HG22 THR 26 2HG2 THR 26 11.334 -7.433 1.445 1115 HG23 THR 26 3HG2 THR 26 10.508 -6.194 0.496 1116 H ILE 27 H ILE 27 10.051 -7.718 4.790 1117 HA ILE 27 HA ILE 27 12.764 -8.482 4.524 1118 HB ILE 27 HB ILE 27 11.158 -7.778 7.026 1119 HG12 ILE 27 2HG1 ILE 27 13.110 -6.050 5.429 1120 HG13 ILE 27 3HG1 ILE 27 11.362 -5.995 5.243 1121 HG21 ILE 27 1HG2 ILE 27 14.186 -8.001 6.771 1122 HG22 ILE 27 2HG2 ILE 27 13.139 -9.063 7.716 1123 HG23 ILE 27 3HG2 ILE 27 13.321 -7.370 8.175 1124 HD11 ILE 27 1HD1 ILE 27 12.833 -5.337 7.793 1125 HD12 ILE 27 2HD1 ILE 27 11.101 -5.188 7.498 1126 HD13 ILE 27 3HD1 ILE 27 12.234 -4.170 6.616 1127 H LYS 28 H LYS 28 10.040 -9.977 6.280 1128 HA LYS 28 HA LYS 28 11.321 -12.204 7.401 1129 HB2 LYS 28 2HB LYS 28 9.019 -11.499 7.985 1130 HB3 LYS 28 3HB LYS 28 8.460 -11.940 6.377 1131 HG2 LYS 28 2HG LYS 28 9.085 -14.337 6.895 1132 HG3 LYS 28 3HG LYS 28 9.464 -13.820 8.542 1133 HD2 LYS 28 2HD LYS 28 7.209 -14.809 8.411 1134 HD3 LYS 28 3HD LYS 28 7.132 -13.111 8.885 1135 HE2 LYS 28 2HE LYS 28 5.374 -13.677 7.258 1136 HE3 LYS 28 3HE LYS 28 6.490 -12.489 6.584 1137 HZ1 LYS 28 1HZ LYS 28 5.979 -14.168 4.961 1138 HZ2 LYS 28 2HZ LYS 28 6.445 -15.405 6.009 1139 HZ3 LYS 28 3HZ LYS 28 7.602 -14.333 5.404 1140 H ASN 29 H ASN 29 9.786 -11.783 4.203 1141 HA ASN 29 HA ASN 29 10.147 -14.471 3.298 1142 HB2 ASN 29 2HB ASN 29 9.618 -11.925 1.697 1143 HB3 ASN 29 3HB ASN 29 9.600 -13.547 1.009 1144 HD21 ASN 29 1HD2 ASN 29 7.448 -11.692 0.956 1145 HD22 ASN 29 2HD2 ASN 29 6.129 -12.400 1.821 1146 H MET 30 H MET 30 12.131 -11.567 3.134 1147 HA MET 30 HA MET 30 14.066 -12.442 1.260 1148 HB2 MET 30 2HB MET 30 14.243 -10.434 3.557 1149 HB3 MET 30 3HB MET 30 15.603 -10.760 2.494 1150 HG2 MET 30 2HG MET 30 14.275 -9.984 0.562 1151 HG3 MET 30 3HG MET 30 12.926 -9.627 1.645 1152 HE1 MET 30 1HE MET 30 14.503 -6.099 0.539 1153 HE2 MET 30 2HE MET 30 13.065 -7.115 0.433 1154 HE3 MET 30 3HE MET 30 14.533 -7.571 -0.433 1155 H ILE 31 H ILE 31 13.876 -12.659 4.801 1156 HA ILE 31 HA ILE 31 16.335 -13.983 5.276 1157 HB ILE 31 HB ILE 31 13.766 -13.956 6.958 1158 HG12 ILE 31 2HG1 ILE 31 16.275 -12.229 7.235 1159 HG13 ILE 31 3HG1 ILE 31 14.773 -11.695 6.497 1160 HG21 ILE 31 1HG2 ILE 31 16.571 -14.748 7.833 1161 HG22 ILE 31 2HG2 ILE 31 15.192 -15.834 7.663 1162 HG23 ILE 31 3HG2 ILE 31 15.176 -14.577 8.901 1163 HD11 ILE 31 1HD1 ILE 31 15.149 -12.470 9.389 1164 HD12 ILE 31 2HD1 ILE 31 13.626 -11.968 8.648 1165 HD13 ILE 31 3HD1 ILE 31 14.977 -10.839 8.739 1166 H GLU 32 H GLU 32 13.008 -15.205 4.798 1167 HA GLU 32 HA GLU 32 13.545 -17.969 5.199 1168 HB2 GLU 32 2HB GLU 32 11.285 -16.593 3.681 1169 HB3 GLU 32 3HB GLU 32 11.319 -18.320 4.042 1170 HG2 GLU 32 2HG GLU 32 11.259 -17.866 6.443 1171 HG3 GLU 32 3HG GLU 32 11.339 -16.129 6.149 1172 H ASP 33 H ASP 33 13.571 -15.936 2.304 1173 HA ASP 33 HA ASP 33 13.817 -18.009 0.355 1174 HB2 ASP 33 2HB ASP 33 12.999 -15.761 -0.238 1175 HB3 ASP 33 3HB ASP 33 14.536 -15.045 0.223 1176 H ILE 34 H ILE 34 16.169 -15.892 1.974 1177 HA ILE 34 HA ILE 34 18.537 -16.989 0.834 1178 HB ILE 34 HB ILE 34 18.074 -15.458 3.442 1179 HG12 ILE 34 2HG1 ILE 34 17.584 -14.160 1.393 1180 HG13 ILE 34 3HG1 ILE 34 18.979 -13.503 2.234 1181 HG21 ILE 34 1HG2 ILE 34 20.759 -16.135 2.194 1182 HG22 ILE 34 2HG2 ILE 34 20.137 -16.716 3.740 1183 HG23 ILE 34 3HG2 ILE 34 20.509 -15.006 3.528 1184 HD11 ILE 34 1HD1 ILE 34 19.043 -15.217 -0.249 1185 HD12 ILE 34 2HD1 ILE 34 20.457 -14.566 0.588 1186 HD13 ILE 34 3HD1 ILE 34 19.292 -13.476 -0.157 1187 H GLY 35 H GLY 35 16.429 -17.972 3.442 1188 HA2 GLY 35 2HA GLY 35 16.401 -19.862 4.776 1189 HA3 GLY 35 3HA GLY 35 17.929 -20.382 4.073 1190 H GLU 36 H GLU 36 17.712 -17.165 5.202 1191 HA GLU 36 HA GLU 36 18.600 -15.899 6.783 1192 HB2 GLU 36 2HB GLU 36 17.389 -17.327 8.423 1193 HB3 GLU 36 3HB GLU 36 18.786 -18.393 8.531 1194 HG2 GLU 36 2HG GLU 36 20.135 -16.443 9.373 1195 HG3 GLU 36 3HG GLU 36 18.660 -15.473 9.367 1196 H SER 37 H SER 37 20.630 -15.118 7.334 1197 HA SER 37 HA SER 37 23.017 -16.760 7.051 1198 HB2 SER 37 2HB SER 37 22.517 -16.133 4.697 1199 HB3 SER 37 3HB SER 37 22.443 -14.429 5.145 1200 HG SER 37 HG SER 37 24.463 -14.776 4.352 1201 H ASP 38 H ASP 38 24.934 -15.576 7.707 1202 HA ASP 38 HA ASP 38 24.497 -13.584 9.756 1203 HB2 ASP 38 2HB ASP 38 26.946 -13.708 10.090 1204 HB3 ASP 38 3HB ASP 38 26.230 -15.314 10.055 1205 H SER 39 H SER 39 24.936 -13.498 6.394 1206 HA SER 39 HA SER 39 26.274 -11.047 5.989 1207 HB2 SER 39 2HB SER 39 24.104 -12.328 4.254 1208 HB3 SER 39 3HB SER 39 25.318 -11.158 3.723 1209 HG SER 39 HG SER 39 26.851 -12.883 4.583 1210 HA PRO 40 HA PRO 40 22.964 -8.203 7.534 1211 HB2 PRO 40 2HB PRO 40 24.700 -6.219 6.044 1212 HB3 PRO 40 3HB PRO 40 24.066 -6.142 7.706 1213 HG2 PRO 40 2HG PRO 40 26.624 -6.706 7.301 1214 HG3 PRO 40 3HG PRO 40 25.709 -7.579 8.554 1215 HD2 PRO 40 2HD PRO 40 26.476 -8.507 5.790 1216 HD3 PRO 40 3HD PRO 40 26.517 -9.399 7.326 1217 H ILE 41 H ILE 41 21.093 -8.273 6.470 1218 HA ILE 41 HA ILE 41 20.708 -8.454 3.689 1219 HB ILE 41 HB ILE 41 18.683 -7.607 5.822 1220 HG12 ILE 41 2HG1 ILE 41 19.649 -9.819 6.349 1221 HG13 ILE 41 3HG1 ILE 41 17.972 -9.997 5.854 1222 HG21 ILE 41 1HG2 ILE 41 16.941 -8.370 4.233 1223 HG22 ILE 41 2HG2 ILE 41 18.182 -8.674 3.015 1224 HG23 ILE 41 3HG2 ILE 41 17.881 -7.027 3.575 1225 HD11 ILE 41 1HD1 ILE 41 20.413 -10.615 4.180 1226 HD12 ILE 41 2HD1 ILE 41 18.740 -10.760 3.627 1227 HD13 ILE 41 3HD1 ILE 41 19.327 -11.775 4.944 1228 HA PRO 42 HA PRO 42 21.178 -3.952 3.101 1229 HB2 PRO 42 2HB PRO 42 22.194 -3.990 0.597 1230 HB3 PRO 42 3HB PRO 42 23.139 -4.583 1.977 1231 HG2 PRO 42 2HG PRO 42 21.781 -6.135 -0.165 1232 HG3 PRO 42 3HG PRO 42 23.256 -6.517 0.743 1233 HD2 PRO 42 2HD PRO 42 20.612 -7.501 1.272 1234 HD3 PRO 42 3HD PRO 42 22.067 -7.751 2.262 1235 H LEU 43 H LEU 43 19.287 -2.891 2.923 1236 HA LEU 43 HA LEU 43 17.357 -3.461 0.785 1237 HB2 LEU 43 2HB LEU 43 17.064 -1.645 3.224 1238 HB3 LEU 43 3HB LEU 43 15.815 -1.989 2.044 1239 HG LEU 43 HG LEU 43 15.947 -4.460 2.786 1240 HD11 LEU 43 1HD1 LEU 43 16.818 -4.942 5.018 1241 HD12 LEU 43 2HD1 LEU 43 17.465 -3.304 5.139 1242 HD13 LEU 43 3HD1 LEU 43 18.101 -4.421 3.928 1243 HD21 LEU 43 1HD2 LEU 43 14.487 -4.121 4.722 1244 HD22 LEU 43 2HD2 LEU 43 14.095 -2.994 3.424 1245 HD23 LEU 43 3HD2 LEU 43 15.002 -2.433 4.831 1246 HA PRO 44 HA PRO 44 19.444 0.218 -1.072 1247 HB2 PRO 44 2HB PRO 44 19.333 -0.520 -3.652 1248 HB3 PRO 44 3HB PRO 44 20.338 -1.444 -2.514 1249 HG2 PRO 44 2HG PRO 44 17.639 -2.125 -3.615 1250 HG3 PRO 44 3HG PRO 44 19.040 -3.180 -3.338 1251 HD2 PRO 44 2HD PRO 44 16.862 -2.895 -1.578 1252 HD3 PRO 44 3HD PRO 44 18.441 -3.587 -1.159 1253 H ASN 45 H ASN 45 16.780 0.513 -0.151 1254 HA ASN 45 HA ASN 45 15.572 2.239 -2.203 1255 HB2 ASN 45 2HB ASN 45 14.436 0.033 -2.413 1256 HB3 ASN 45 3HB ASN 45 14.045 0.056 -0.698 1257 HD21 ASN 45 1HD2 ASN 45 13.311 1.411 -3.833 1258 HD22 ASN 45 2HD2 ASN 45 11.819 2.158 -3.384 1259 H VAL 46 H VAL 46 15.291 0.999 1.133 1260 HA VAL 46 HA VAL 46 14.062 3.488 2.044 1261 HB VAL 46 HB VAL 46 13.073 1.323 2.704 1262 HG11 VAL 46 1HG1 VAL 46 15.593 0.806 4.298 1263 HG12 VAL 46 2HG1 VAL 46 15.080 -0.059 2.848 1264 HG13 VAL 46 3HG1 VAL 46 14.123 -0.172 4.328 1265 HG21 VAL 46 1HG2 VAL 46 12.670 3.256 4.117 1266 HG22 VAL 46 2HG2 VAL 46 14.131 2.924 5.051 1267 HG23 VAL 46 3HG2 VAL 46 12.771 1.799 5.109 1268 H THR 47 H THR 47 15.094 5.029 3.223 1269 HA THR 47 HA THR 47 17.986 4.974 3.479 1270 HB THR 47 HB THR 47 17.687 7.328 4.318 1271 HG1 THR 47 HG1 THR 47 14.936 7.135 3.689 1272 HG21 THR 47 1HG2 THR 47 17.916 6.937 1.883 1273 HG22 THR 47 2HG2 THR 47 16.831 8.290 2.206 1274 HG23 THR 47 3HG2 THR 47 16.167 6.720 1.746 1275 H SER 48 H SER 48 18.817 6.106 5.679 1276 HA SER 48 HA SER 48 18.657 4.072 7.627 1277 HB2 SER 48 2HB SER 48 20.039 5.659 9.039 1278 HB3 SER 48 3HB SER 48 20.679 5.376 7.421 1279 HG SER 48 HG SER 48 20.750 7.558 7.748 1280 H THR 49 H THR 49 17.336 7.387 7.649 1281 HA THR 49 HA THR 49 16.327 7.321 10.294 1282 HB THR 49 HB THR 49 15.003 9.356 9.576 1283 HG1 THR 49 HG1 THR 49 14.570 9.455 7.516 1284 HG21 THR 49 1HG2 THR 49 17.911 9.384 8.683 1285 HG22 THR 49 2HG2 THR 49 17.344 9.650 10.333 1286 HG23 THR 49 3HG2 THR 49 16.933 10.805 9.063 1287 H ILE 50 H ILE 50 14.888 6.569 7.144 1288 HA ILE 50 HA ILE 50 12.199 6.312 8.116 1289 HB ILE 50 HB ILE 50 13.422 5.422 5.465 1290 HG12 ILE 50 2HG1 ILE 50 13.625 7.853 5.793 1291 HG13 ILE 50 3HG1 ILE 50 12.443 7.513 4.536 1292 HG21 ILE 50 1HG2 ILE 50 10.485 5.720 6.202 1293 HG22 ILE 50 2HG2 ILE 50 11.333 4.209 5.869 1294 HG23 ILE 50 3HG2 ILE 50 11.108 5.393 4.582 1295 HD11 ILE 50 1HD1 ILE 50 11.831 8.314 7.386 1296 HD12 ILE 50 2HD1 ILE 50 10.630 7.958 6.139 1297 HD13 ILE 50 3HD1 ILE 50 11.719 9.331 5.951 1298 H LEU 51 H LEU 51 14.837 4.018 7.305 1299 HA LEU 51 HA LEU 51 13.327 1.634 7.709 1300 HB2 LEU 51 2HB LEU 51 15.480 1.642 6.431 1301 HB3 LEU 51 3HB LEU 51 16.350 1.997 7.916 1302 HG LEU 51 HG LEU 51 15.680 -0.203 8.862 1303 HD11 LEU 51 1HD1 LEU 51 14.344 -0.751 6.196 1304 HD12 LEU 51 2HD1 LEU 51 13.534 -0.525 7.748 1305 HD13 LEU 51 3HD1 LEU 51 14.585 -1.916 7.502 1306 HD21 LEU 51 1HD2 LEU 51 17.804 -0.058 7.654 1307 HD22 LEU 51 2HD2 LEU 51 16.994 -0.470 6.140 1308 HD23 LEU 51 3HD2 LEU 51 17.069 -1.648 7.454 1309 H GLU 52 H GLU 52 15.534 3.516 9.807 1310 HA GLU 52 HA GLU 52 15.475 2.023 12.168 1311 HB2 GLU 52 2HB GLU 52 16.875 4.100 11.806 1312 HB3 GLU 52 3HB GLU 52 15.426 5.076 11.948 1313 HG2 GLU 52 2HG GLU 52 15.130 4.103 14.285 1314 HG3 GLU 52 3HG GLU 52 16.735 3.401 14.117 1315 H LYS 53 H LYS 53 13.280 4.470 10.914 1316 HA LYS 53 HA LYS 53 11.706 4.815 13.233 1317 HB2 LYS 53 2HB LYS 53 12.013 6.267 10.956 1318 HB3 LYS 53 3HB LYS 53 10.516 5.448 10.536 1319 HG2 LYS 53 2HG LYS 53 9.544 6.296 12.696 1320 HG3 LYS 53 3HG LYS 53 11.033 7.220 12.933 1321 HD2 LYS 53 2HD LYS 53 10.607 8.480 10.860 1322 HD3 LYS 53 3HD LYS 53 9.155 7.514 10.553 1323 HE2 LYS 53 2HE LYS 53 8.528 9.668 11.496 1324 HE3 LYS 53 3HE LYS 53 8.165 8.394 12.662 1325 HZ1 LYS 53 1HZ LYS 53 9.215 10.262 13.739 1326 HZ2 LYS 53 2HZ LYS 53 10.540 10.176 12.698 1327 HZ3 LYS 53 3HZ LYS 53 10.245 8.928 13.799 1328 H VAL 54 H VAL 54 11.208 2.972 10.243 1329 HA VAL 54 HA VAL 54 8.642 1.943 10.801 1330 HB VAL 54 HB VAL 54 10.869 0.950 8.957 1331 HG11 VAL 54 1HG1 VAL 54 8.019 -0.096 9.115 1332 HG12 VAL 54 2HG1 VAL 54 9.488 -0.996 9.501 1333 HG13 VAL 54 3HG1 VAL 54 9.178 -0.484 7.842 1334 HG21 VAL 54 1HG2 VAL 54 9.461 1.894 7.154 1335 HG22 VAL 54 2HG2 VAL 54 9.888 3.128 8.343 1336 HG23 VAL 54 3HG2 VAL 54 8.273 2.420 8.354 1337 H LEU 55 H LEU 55 11.912 0.573 11.325 1338 HA LEU 55 HA LEU 55 11.070 -1.946 12.328 1339 HB2 LEU 55 2HB LEU 55 13.707 -0.481 12.761 1340 HB3 LEU 55 3HB LEU 55 13.426 -2.164 13.167 1341 HG LEU 55 HG LEU 55 13.483 -0.959 10.376 1342 HD11 LEU 55 1HD1 LEU 55 15.451 -2.385 10.032 1343 HD12 LEU 55 2HD1 LEU 55 15.357 -2.935 11.709 1344 HD13 LEU 55 3HD1 LEU 55 15.693 -1.238 11.350 1345 HD21 LEU 55 1HD2 LEU 55 12.880 -3.837 11.131 1346 HD22 LEU 55 2HD2 LEU 55 13.140 -3.225 9.495 1347 HD23 LEU 55 3HD2 LEU 55 11.751 -2.674 10.424 1348 H ASP 56 H ASP 56 11.910 1.118 13.918 1349 HA ASP 56 HA ASP 56 11.833 0.134 16.620 1350 HB2 ASP 56 2HB ASP 56 13.163 2.158 15.878 1351 HB3 ASP 56 3HB ASP 56 11.654 3.037 15.662 1352 H TYR 57 H TYR 57 9.542 1.716 14.459 1353 HA TYR 57 HA TYR 57 7.356 2.032 16.217 1354 HB2 TYR 57 2HB TYR 57 7.322 3.113 14.053 1355 HB3 TYR 57 3HB TYR 57 7.497 1.583 13.209 1356 HD1 TYR 57 HD1 TYR 57 5.123 3.683 15.174 1357 HD2 TYR 57 HD2 TYR 57 5.542 0.238 12.676 1358 HE1 TYR 57 HE1 TYR 57 2.676 3.525 14.967 1359 HE2 TYR 57 HE2 TYR 57 3.097 0.082 12.471 1360 HH TYR 57 HH TYR 57 0.990 2.558 13.463 1361 H CYS 58 H CYS 58 8.340 -0.633 14.115 1362 HA CYS 58 HA CYS 58 6.203 -2.375 14.669 1363 HB2 CYS 58 2HB CYS 58 9.040 -2.916 13.709 1364 HB3 CYS 58 3HB CYS 58 7.780 -4.147 13.777 1365 HG CYS 58 HG CYS 58 7.240 -1.295 11.989 1366 H ARG 59 H ARG 59 9.343 -1.838 16.274 1367 HA ARG 59 HA ARG 59 9.233 -4.046 18.061 1368 HB2 ARG 59 2HB ARG 59 10.805 -1.436 18.265 1369 HB3 ARG 59 3HB ARG 59 11.000 -2.788 19.376 1370 HG2 ARG 59 2HG ARG 59 11.661 -4.228 17.405 1371 HG3 ARG 59 3HG ARG 59 11.619 -2.780 16.403 1372 HD2 ARG 59 2HD ARG 59 13.909 -3.184 17.019 1373 HD3 ARG 59 3HD ARG 59 13.355 -1.764 17.913 1374 HE ARG 59 HE ARG 59 13.143 -4.312 19.310 1375 HH11 ARG 59 1HH1 ARG 59 15.147 -1.443 18.782 1376 HH12 ARG 59 2HH1 ARG 59 16.044 -1.677 20.245 1377 HH21 ARG 59 1HH2 ARG 59 14.327 -4.587 21.198 1378 HH22 ARG 59 2HH2 ARG 59 15.580 -3.462 21.616 1379 H HIS 60 H HIS 60 8.369 -0.619 18.426 1380 HA HIS 60 HA HIS 60 7.524 -0.664 21.108 1381 HB2 HIS 60 2HB HIS 60 7.965 1.459 19.987 1382 HB3 HIS 60 3HB HIS 60 6.694 1.160 18.803 1383 HD1 HIS 60 HD1 HIS 60 4.475 2.163 19.340 1384 HD2 HIS 60 HD2 HIS 60 6.851 1.764 22.722 1385 HE1 HIS 60 HE1 HIS 60 3.139 3.125 21.224 1386 HE2 HIS 60 HE2 HIS 60 4.675 3.050 23.205 1387 H HIS 61 H HIS 61 5.741 -1.203 18.091 1388 HA HIS 61 HA HIS 61 3.143 -1.383 19.304 1389 HB2 HIS 61 2HB HIS 61 3.849 -0.762 16.808 1390 HB3 HIS 61 3HB HIS 61 3.766 -2.498 16.546 1391 HD1 HIS 61 HD1 HIS 61 1.215 -3.271 17.982 1392 HD2 HIS 61 HD2 HIS 61 1.555 0.178 15.681 1393 HE1 HIS 61 HE1 HIS 61 -1.134 -2.606 17.412 1394 HE2 HIS 61 HE2 HIS 61 -0.904 -0.415 16.203 1395 H HIS 62 H HIS 62 5.740 -3.625 18.575 1396 HA HIS 62 HA HIS 62 4.227 -6.040 19.008 1397 HB2 HIS 62 2HB HIS 62 6.326 -5.978 17.650 1398 HB3 HIS 62 3HB HIS 62 7.244 -5.606 19.104 1399 HD1 HIS 62 HD1 HIS 62 5.395 -8.400 17.388 1400 HD2 HIS 62 HD2 HIS 62 7.808 -7.822 20.729 1401 HE1 HIS 62 HE1 HIS 62 6.020 -10.699 18.180 1402 HE2 HIS 62 HE2 HIS 62 7.483 -10.318 20.189 1403 H GLN 63 H GLN 63 6.100 -3.817 20.988 1404 HA GLN 63 HA GLN 63 5.990 -5.426 23.396 1405 HB2 GLN 63 2HB GLN 63 6.897 -2.547 22.958 1406 HB3 GLN 63 3HB GLN 63 7.018 -3.408 24.490 1407 HG2 GLN 63 2HG GLN 63 8.460 -4.112 21.915 1408 HG3 GLN 63 3HG GLN 63 9.175 -3.397 23.358 1409 HE21 GLN 63 1HE2 GLN 63 9.854 -5.895 21.968 1410 HE22 GLN 63 2HE2 GLN 63 9.687 -7.157 23.139 1411 H HIS 64 H HIS 64 3.851 -3.264 21.819 1412 HA HIS 64 HA HIS 64 2.016 -3.410 24.138 1413 HB2 HIS 64 2HB HIS 64 2.404 -1.032 22.256 1414 HB3 HIS 64 3HB HIS 64 0.985 -1.210 23.284 1415 HD1 HIS 64 HD1 HIS 64 1.207 -0.519 25.708 1416 HD2 HIS 64 HD2 HIS 64 4.866 -0.580 23.735 1417 HE1 HIS 64 HE1 HIS 64 2.858 0.466 27.313 1418 HE2 HIS 64 HE2 HIS 64 5.080 0.205 26.187 1419 HA PRO 65 HA PRO 65 0.029 -5.453 20.437 1420 HB2 PRO 65 2HB PRO 65 -0.481 -7.809 22.118 1421 HB3 PRO 65 3HB PRO 65 0.557 -7.683 20.683 1422 HG2 PRO 65 2HG PRO 65 1.536 -8.107 23.202 1423 HG3 PRO 65 3HG PRO 65 2.462 -7.301 21.915 1424 HD2 PRO 65 2HD PRO 65 0.923 -6.050 24.196 1425 HD3 PRO 65 3HD PRO 65 2.538 -5.647 23.563 1426 H GLY 66 H GLY 66 -1.748 -4.117 20.493 1427 HA2 GLY 66 2HA GLY 66 -4.162 -5.068 21.722 1428 HA3 GLY 66 3HA GLY 66 -3.555 -3.604 22.499 1429 H GLY 67 H GLY 67 -3.618 -1.638 21.403 1430 HA2 GLY 67 2HA GLY 67 -4.425 -0.058 19.946 1431 HA3 GLY 67 3HA GLY 67 -4.503 -1.297 18.700 1432 H SER 68 H SER 68 -6.174 -0.416 21.756 1433 HA SER 68 HA SER 68 -8.802 -0.879 20.473 1434 HB2 SER 68 2HB SER 68 -7.917 -2.085 23.133 1435 HB3 SER 68 3HB SER 68 -9.544 -2.194 22.454 1436 HG SER 68 HG SER 68 -7.961 -3.016 20.562 1437 H GLY 69 H GLY 69 -9.306 1.302 20.484 1438 HA2 GLY 69 2HA GLY 69 -10.536 3.056 21.308 1439 HA3 GLY 69 3HA GLY 69 -10.635 2.218 22.842 1440 H LEU 70 H LEU 70 -8.815 2.428 24.309 1441 HA LEU 70 HA LEU 70 -7.973 5.173 24.555 1442 HB2 LEU 70 2HB LEU 70 -7.280 2.764 26.297 1443 HB3 LEU 70 3HB LEU 70 -7.033 4.449 26.729 1444 HG LEU 70 HG LEU 70 -9.730 3.079 26.364 1445 HD11 LEU 70 1HD1 LEU 70 -8.613 2.394 28.426 1446 HD12 LEU 70 2HD1 LEU 70 -10.012 3.401 28.781 1447 HD13 LEU 70 3HD1 LEU 70 -8.386 4.081 28.896 1448 HD21 LEU 70 1HD2 LEU 70 -9.877 5.407 25.633 1449 HD22 LEU 70 2HD2 LEU 70 -9.155 5.957 27.146 1450 HD23 LEU 70 3HD2 LEU 70 -10.741 5.181 27.152 1451 H ASP 71 H ASP 71 -6.345 2.029 24.153 1452 HA ASP 71 HA ASP 71 -3.744 3.307 23.620 1453 HB2 ASP 71 2HB ASP 71 -2.775 1.114 23.973 1454 HB3 ASP 71 3HB ASP 71 -3.922 1.403 25.272 1455 H ASP 72 H ASP 72 -6.195 3.141 21.776 1456 HA ASP 72 HA ASP 72 -5.650 1.487 19.547 1457 HB2 ASP 72 2HB ASP 72 -7.872 2.496 20.044 1458 HB3 ASP 72 3HB ASP 72 -7.236 4.090 19.664 1459 H ILE 73 H ILE 73 -5.056 4.945 20.095 1460 HA ILE 73 HA ILE 73 -2.772 4.868 18.198 1461 HB ILE 73 HB ILE 73 -4.307 7.354 19.113 1462 HG12 ILE 73 2HG1 ILE 73 -4.457 5.969 16.388 1463 HG13 ILE 73 3HG1 ILE 73 -5.700 5.876 17.628 1464 HG21 ILE 73 1HG2 ILE 73 -3.025 8.542 17.350 1465 HG22 ILE 73 2HG2 ILE 73 -2.162 7.051 16.972 1466 HG23 ILE 73 3HG2 ILE 73 -1.949 7.817 18.547 1467 HD11 ILE 73 1HD1 ILE 73 -4.842 8.385 16.181 1468 HD12 ILE 73 2HD1 ILE 73 -6.092 8.278 17.426 1469 HD13 ILE 73 3HD1 ILE 73 -6.306 7.444 15.889 1470 HA PRO 74 HA PRO 74 -0.767 5.067 22.438 1471 HB2 PRO 74 2HB PRO 74 1.452 4.021 20.668 1472 HB3 PRO 74 3HB PRO 74 0.952 3.475 22.286 1473 HG2 PRO 74 2HG PRO 74 0.333 2.011 20.173 1474 HG3 PRO 74 3HG PRO 74 -0.887 2.259 21.450 1475 HD2 PRO 74 2HD PRO 74 -0.647 3.635 18.773 1476 HD3 PRO 74 3HD PRO 74 -2.091 2.985 19.585 1477 HA PRO 75 HA PRO 75 1.111 9.132 22.107 1478 HB2 PRO 75 2HB PRO 75 3.380 7.856 23.670 1479 HB3 PRO 75 3HB PRO 75 2.556 9.409 23.953 1480 HG2 PRO 75 2HG PRO 75 1.929 7.314 25.451 1481 HG3 PRO 75 3HG PRO 75 0.644 8.392 24.856 1482 HD2 PRO 75 2HD PRO 75 1.386 5.643 23.914 1483 HD3 PRO 75 3HD PRO 75 -0.212 6.423 23.990 1484 H TYR 76 H TYR 76 3.618 6.552 21.822 1485 HA TYR 76 HA TYR 76 5.415 8.002 20.216 1486 HB2 TYR 76 2HB TYR 76 6.239 6.043 21.385 1487 HB3 TYR 76 3HB TYR 76 5.096 4.988 20.566 1488 HD1 TYR 76 HD1 TYR 76 8.194 7.020 20.088 1489 HD2 TYR 76 HD2 TYR 76 5.598 4.089 18.372 1490 HE1 TYR 76 HE1 TYR 76 9.817 6.631 18.279 1491 HE2 TYR 76 HE2 TYR 76 7.215 3.712 16.576 1492 HH TYR 76 HH TYR 76 10.364 4.693 16.662 1493 H ASP 77 H ASP 77 2.765 5.818 19.302 1494 HA ASP 77 HA ASP 77 3.370 5.645 16.532 1495 HB2 ASP 77 2HB ASP 77 0.771 5.169 18.059 1496 HB3 ASP 77 3HB ASP 77 0.970 4.819 16.344 1497 H ARG 78 H ARG 78 1.578 7.965 18.446 1498 HA ARG 78 HA ARG 78 0.502 9.475 16.241 1499 HB2 ARG 78 2HB ARG 78 -0.310 9.350 18.727 1500 HB3 ARG 78 3HB ARG 78 0.938 10.531 19.063 1501 HG2 ARG 78 2HG ARG 78 -1.252 11.001 17.022 1502 HG3 ARG 78 3HG ARG 78 -1.450 11.397 18.725 1503 HD2 ARG 78 2HD ARG 78 0.465 12.968 18.562 1504 HD3 ARG 78 3HD ARG 78 0.622 12.587 16.843 1505 HE ARG 78 HE ARG 78 -2.009 13.405 17.345 1506 HH11 ARG 78 1HH1 ARG 78 1.224 14.828 17.234 1507 HH12 ARG 78 2HH1 ARG 78 0.634 16.409 16.827 1508 HH21 ARG 78 1HH2 ARG 78 -2.748 15.469 16.860 1509 HH22 ARG 78 2HH2 ARG 78 -1.624 16.766 16.613 1510 H ASP 79 H ASP 79 3.396 9.641 18.300 1511 HA ASP 79 HA ASP 79 4.521 12.040 17.199 1512 HB2 ASP 79 2HB ASP 79 5.776 9.778 18.807 1513 HB3 ASP 79 3HB ASP 79 6.690 11.191 18.289 1514 H PHE 80 H PHE 80 4.487 8.743 16.201 1515 HA PHE 80 HA PHE 80 6.704 8.650 14.441 1516 HB2 PHE 80 2HB PHE 80 5.526 6.618 15.249 1517 HB3 PHE 80 3HB PHE 80 4.058 7.097 14.408 1518 HD1 PHE 80 HD1 PHE 80 7.495 5.790 13.987 1519 HD2 PHE 80 HD2 PHE 80 3.817 6.715 12.012 1520 HE1 PHE 80 HE1 PHE 80 8.235 4.549 12.000 1521 HE2 PHE 80 HE2 PHE 80 4.572 5.478 10.031 1522 HZ PHE 80 HZ PHE 80 6.784 4.393 10.024 1523 H CYS 81 H CYS 81 3.422 9.806 14.141 1524 HA CYS 81 HA CYS 81 3.453 10.223 11.288 1525 HB2 CYS 81 2HB CYS 81 1.494 11.141 13.428 1526 HB3 CYS 81 3HB CYS 81 1.207 11.191 11.690 1527 HG CYS 81 HG CYS 81 1.759 8.268 13.397 1528 H LYS 82 H LYS 82 4.800 11.951 13.893 1529 HA LYS 82 HA LYS 82 4.448 14.653 12.899 1530 HB2 LYS 82 2HB LYS 82 6.245 13.494 15.069 1531 HB3 LYS 82 3HB LYS 82 6.158 15.213 14.705 1532 HG2 LYS 82 2HG LYS 82 3.824 13.515 15.635 1533 HG3 LYS 82 3HG LYS 82 4.811 14.535 16.683 1534 HD2 LYS 82 2HD LYS 82 3.118 15.518 14.356 1535 HD3 LYS 82 3HD LYS 82 2.678 15.620 16.061 1536 HE2 LYS 82 2HE LYS 82 4.590 17.106 16.491 1537 HE3 LYS 82 3HE LYS 82 5.092 16.977 14.802 1538 HZ1 LYS 82 1HZ LYS 82 2.536 18.147 15.770 1539 HZ2 LYS 82 2HZ LYS 82 3.000 18.014 14.150 1540 HZ3 LYS 82 3HZ LYS 82 3.871 19.014 15.199 1541 H VAL 83 H VAL 83 5.197 14.114 10.722 1542 HA VAL 83 HA VAL 83 8.068 14.592 10.358 1543 HB VAL 83 HB VAL 83 8.046 12.864 8.425 1544 HG11 VAL 83 1HG1 VAL 83 8.660 10.985 9.871 1545 HG12 VAL 83 2HG1 VAL 83 7.922 11.789 11.259 1546 HG13 VAL 83 3HG1 VAL 83 9.334 12.501 10.473 1547 HG21 VAL 83 1HG2 VAL 83 5.608 12.486 8.333 1548 HG22 VAL 83 2HG2 VAL 83 5.642 11.775 9.948 1549 HG23 VAL 83 3HG2 VAL 83 6.472 10.973 8.610 1550 H ASP 84 H ASP 84 8.578 15.332 8.223 1551 HA ASP 84 HA ASP 84 6.665 17.223 7.169 1552 HB2 ASP 84 2HB ASP 84 9.112 17.690 7.419 1553 HB3 ASP 84 3HB ASP 84 9.461 16.464 6.211 1554 H GLN 85 H GLN 85 6.134 17.299 4.767 1555 HA GLN 85 HA GLN 85 4.691 15.055 4.069 1556 HB2 GLN 85 2HB GLN 85 5.558 17.396 2.338 1557 HB3 GLN 85 3HB GLN 85 4.530 16.116 1.709 1558 HG2 GLN 85 2HG GLN 85 3.845 17.864 4.091 1559 HG3 GLN 85 3HG GLN 85 3.272 18.128 2.445 1560 HE21 GLN 85 1HE2 GLN 85 1.745 16.694 1.578 1561 HE22 GLN 85 2HE2 GLN 85 0.804 15.640 2.568 1562 HA PRO 86 HA PRO 86 8.126 13.631 0.754 1563 HB2 PRO 86 2HB PRO 86 10.547 14.696 2.228 1564 HB3 PRO 86 3HB PRO 86 10.314 14.429 0.483 1565 HG2 PRO 86 2HG PRO 86 10.159 16.890 1.429 1566 HG3 PRO 86 3HG PRO 86 8.980 16.335 0.216 1567 HD2 PRO 86 2HD PRO 86 8.612 16.662 3.191 1568 HD3 PRO 86 3HD PRO 86 7.495 17.059 1.862 1569 H THR 87 H THR 87 9.224 13.971 4.136 1570 HA THR 87 HA THR 87 10.285 11.390 4.487 1571 HB THR 87 HB THR 87 9.128 13.222 6.626 1572 HG1 THR 87 HG1 THR 87 11.140 13.668 4.950 1573 HG21 THR 87 1HG2 THR 87 10.795 12.211 8.121 1574 HG22 THR 87 2HG2 THR 87 11.348 11.147 6.826 1575 HG23 THR 87 3HG2 THR 87 9.718 10.966 7.483 1576 H LEU 88 H LEU 88 7.008 12.606 4.787 1577 HA LEU 88 HA LEU 88 5.902 10.484 6.363 1578 HB2 LEU 88 2HB LEU 88 5.119 12.961 6.078 1579 HB3 LEU 88 3HB LEU 88 4.314 12.415 4.623 1580 HG LEU 88 HG LEU 88 3.733 11.227 7.373 1581 HD11 LEU 88 1HD1 LEU 88 1.759 12.672 7.488 1582 HD12 LEU 88 2HD1 LEU 88 2.258 13.497 6.008 1583 HD13 LEU 88 3HD1 LEU 88 3.250 13.613 7.465 1584 HD21 LEU 88 1HD2 LEU 88 1.618 10.483 6.357 1585 HD22 LEU 88 2HD2 LEU 88 3.014 9.802 5.529 1586 HD23 LEU 88 3HD2 LEU 88 2.129 11.145 4.800 1587 H PHE 89 H PHE 89 5.881 11.334 2.905 1588 HA PHE 89 HA PHE 89 4.423 8.990 2.102 1589 HB2 PHE 89 2HB PHE 89 5.918 11.076 0.480 1590 HB3 PHE 89 3HB PHE 89 5.036 9.731 -0.242 1591 HD1 PHE 89 HD1 PHE 89 2.541 9.601 0.006 1592 HD2 PHE 89 HD2 PHE 89 4.709 13.008 1.345 1593 HE1 PHE 89 HE1 PHE 89 0.465 10.907 0.105 1594 HE2 PHE 89 HE2 PHE 89 2.653 14.309 1.449 1595 HZ PHE 89 HZ PHE 89 0.505 13.256 0.833 1596 H GLU 90 H GLU 90 7.845 9.756 2.507 1597 HA GLU 90 HA GLU 90 8.973 7.465 1.311 1598 HB2 GLU 90 2HB GLU 90 9.866 8.988 3.799 1599 HB3 GLU 90 3HB GLU 90 10.801 7.688 3.072 1600 HG2 GLU 90 2HG GLU 90 10.089 10.308 1.743 1601 HG3 GLU 90 3HG GLU 90 11.651 9.889 2.431 1602 H LEU 91 H LEU 91 7.379 7.902 4.452 1603 HA LEU 91 HA LEU 91 7.819 5.292 5.495 1604 HB2 LEU 91 2HB LEU 91 5.601 7.291 6.095 1605 HB3 LEU 91 3HB LEU 91 5.887 5.831 7.025 1606 HG LEU 91 HG LEU 91 7.843 8.161 6.794 1607 HD11 LEU 91 1HD1 LEU 91 7.255 8.667 9.127 1608 HD12 LEU 91 2HD1 LEU 91 6.048 7.377 9.118 1609 HD13 LEU 91 3HD1 LEU 91 5.844 8.786 8.074 1610 HD21 LEU 91 1HD2 LEU 91 7.981 5.669 8.526 1611 HD22 LEU 91 2HD2 LEU 91 9.118 7.021 8.554 1612 HD23 LEU 91 3HD2 LEU 91 8.988 6.015 7.116 1613 H ILE 92 H ILE 92 5.296 6.642 3.387 1614 HA ILE 92 HA ILE 92 3.588 4.340 3.301 1615 HB ILE 92 HB ILE 92 3.877 6.630 1.282 1616 HG12 ILE 92 2HG1 ILE 92 1.933 6.257 3.609 1617 HG13 ILE 92 3HG1 ILE 92 3.217 7.452 3.504 1618 HG21 ILE 92 1HG2 ILE 92 2.805 4.676 0.223 1619 HG22 ILE 92 2HG2 ILE 92 1.646 5.987 0.432 1620 HG23 ILE 92 3HG2 ILE 92 1.617 4.604 1.527 1621 HD11 ILE 92 1HD1 ILE 92 2.023 8.534 1.645 1622 HD12 ILE 92 2HD1 ILE 92 1.084 8.483 3.133 1623 HD13 ILE 92 3HD1 ILE 92 0.714 7.363 1.822 1624 H LEU 93 H LEU 93 6.248 5.533 1.282 1625 HA LEU 93 HA LEU 93 6.232 3.529 -0.720 1626 HB2 LEU 93 2HB LEU 93 8.409 5.417 0.261 1627 HB3 LEU 93 3HB LEU 93 8.657 4.324 -1.088 1628 HG LEU 93 HG LEU 93 6.572 6.547 -1.031 1629 HD11 LEU 93 1HD1 LEU 93 8.032 7.738 -2.608 1630 HD12 LEU 93 2HD1 LEU 93 9.252 6.470 -2.465 1631 HD13 LEU 93 3HD1 LEU 93 8.847 7.470 -1.068 1632 HD21 LEU 93 1HD2 LEU 93 6.313 6.082 -3.431 1633 HD22 LEU 93 2HD2 LEU 93 5.897 4.676 -2.458 1634 HD23 LEU 93 3HD2 LEU 93 7.445 4.730 -3.306 1635 H ALA 94 H ALA 94 7.817 3.808 2.427 1636 HA ALA 94 HA ALA 94 9.386 1.401 2.215 1637 HB1 ALA 94 1HB ALA 94 9.890 1.777 4.596 1638 HB2 ALA 94 2HB ALA 94 8.669 3.053 4.670 1639 HB3 ALA 94 3HB ALA 94 10.103 3.253 3.659 1640 H ALA 95 H ALA 95 6.196 2.259 3.492 1641 HA ALA 95 HA ALA 95 5.656 -0.212 4.831 1642 HB1 ALA 95 1HB ALA 95 3.321 0.534 4.874 1643 HB2 ALA 95 2HB ALA 95 3.684 1.811 3.705 1644 HB3 ALA 95 3HB ALA 95 4.402 1.857 5.318 1645 H ASN 96 H ASN 96 5.261 0.928 1.529 1646 HA ASN 96 HA ASN 96 3.811 -1.391 0.573 1647 HB2 ASN 96 2HB ASN 96 3.503 0.833 -0.492 1648 HB3 ASN 96 3HB ASN 96 5.196 0.859 -0.971 1649 HD21 ASN 96 1HD2 ASN 96 4.466 1.131 -3.158 1650 HD22 ASN 96 2HD2 ASN 96 3.882 -0.204 -4.081 1651 H TYR 97 H TYR 97 7.175 -0.225 0.462 1652 HA TYR 97 HA TYR 97 8.253 -2.295 -1.175 1653 HB2 TYR 97 2HB TYR 97 9.468 -0.198 -0.948 1654 HB3 TYR 97 3HB TYR 97 9.586 -0.383 0.796 1655 HD1 TYR 97 HD1 TYR 97 11.666 -1.145 1.647 1656 HD2 TYR 97 HD2 TYR 97 10.595 -2.227 -2.352 1657 HE1 TYR 97 HE1 TYR 97 13.846 -2.250 1.366 1658 HE2 TYR 97 HE2 TYR 97 12.775 -3.330 -2.629 1659 HH TYR 97 HH TYR 97 15.006 -3.300 -1.686 1660 H LEU 98 H LEU 98 7.877 -1.949 2.318 1661 HA LEU 98 HA LEU 98 9.138 -4.547 2.848 1662 HB2 LEU 98 2HB LEU 98 8.024 -2.475 4.785 1663 HB3 LEU 98 3HB LEU 98 8.902 -3.930 5.234 1664 HG LEU 98 HG LEU 98 10.022 -1.526 3.749 1665 HD11 LEU 98 1HD1 LEU 98 10.679 -2.597 6.512 1666 HD12 LEU 98 2HD1 LEU 98 9.771 -1.129 6.141 1667 HD13 LEU 98 3HD1 LEU 98 11.475 -1.238 5.708 1668 HD21 LEU 98 1HD2 LEU 98 11.001 -3.530 2.807 1669 HD22 LEU 98 2HD2 LEU 98 11.418 -4.130 4.413 1670 HD23 LEU 98 3HD2 LEU 98 12.194 -2.677 3.781 1671 H ASP 99 H ASP 99 6.144 -3.397 2.035 1672 HA ASP 99 HA ASP 99 4.099 -4.270 1.802 1673 HB2 ASP 99 2HB ASP 99 5.593 -6.210 0.978 1674 HB3 ASP 99 3HB ASP 99 5.277 -6.988 2.522 1675 H ILE 100 H ILE 100 4.970 -3.315 4.441 1676 HA ILE 100 HA ILE 100 3.538 -4.891 6.424 1677 HB ILE 100 HB ILE 100 4.578 -2.051 6.832 1678 HG12 ILE 100 2HG1 ILE 100 6.115 -4.658 7.179 1679 HG13 ILE 100 3HG1 ILE 100 6.438 -3.425 5.969 1680 HG21 ILE 100 1HG2 ILE 100 4.685 -2.727 9.217 1681 HG22 ILE 100 2HG2 ILE 100 4.075 -4.329 8.798 1682 HG23 ILE 100 3HG2 ILE 100 3.049 -2.909 8.576 1683 HD11 ILE 100 1HD1 ILE 100 6.750 -3.102 8.950 1684 HD12 ILE 100 2HD1 ILE 100 7.063 -1.861 7.734 1685 HD13 ILE 100 3HD1 ILE 100 8.037 -3.328 7.766 1686 H LYS 101 H LYS 101 1.478 -4.941 5.566 1687 HA LYS 101 HA LYS 101 -0.097 -2.841 4.676 1688 HB2 LYS 101 2HB LYS 101 -0.556 -5.286 4.373 1689 HB3 LYS 101 3HB LYS 101 -1.092 -5.366 6.046 1690 HG2 LYS 101 2HG LYS 101 -2.913 -3.744 5.516 1691 HG3 LYS 101 3HG LYS 101 -2.377 -3.721 3.833 1692 HD2 LYS 101 2HD LYS 101 -2.836 -6.194 3.713 1693 HD3 LYS 101 3HD LYS 101 -3.483 -6.116 5.355 1694 HE2 LYS 101 2HE LYS 101 -5.320 -6.060 3.761 1695 HE3 LYS 101 3HE LYS 101 -5.202 -4.495 4.564 1696 HZ1 LYS 101 1HZ LYS 101 -5.559 -4.225 2.199 1697 HZ2 LYS 101 2HZ LYS 101 -4.168 -5.127 1.844 1698 HZ3 LYS 101 3HZ LYS 101 -4.029 -3.638 2.622 1699 HA PRO 102 HA PRO 102 -1.898 -2.257 9.256 1700 HB2 PRO 102 2HB PRO 102 0.062 -2.562 11.242 1701 HB3 PRO 102 3HB PRO 102 -1.192 -3.756 10.860 1702 HG2 PRO 102 2HG PRO 102 1.662 -3.674 9.934 1703 HG3 PRO 102 3HG PRO 102 0.703 -5.059 10.504 1704 HD2 PRO 102 2HD PRO 102 1.128 -4.683 7.897 1705 HD3 PRO 102 3HD PRO 102 -0.456 -5.262 8.472 1706 H LEU 103 H LEU 103 1.596 -1.643 8.655 1707 HA LEU 103 HA LEU 103 1.709 0.952 9.818 1708 HB2 LEU 103 2HB LEU 103 3.744 -0.368 9.414 1709 HB3 LEU 103 3HB LEU 103 3.446 -0.350 7.683 1710 HG LEU 103 HG LEU 103 3.824 2.120 7.654 1711 HD11 LEU 103 1HD1 LEU 103 4.755 3.267 9.587 1712 HD12 LEU 103 2HD1 LEU 103 4.554 1.819 10.574 1713 HD13 LEU 103 3HD1 LEU 103 3.139 2.655 9.926 1714 HD21 LEU 103 1HD2 LEU 103 6.134 0.547 8.838 1715 HD22 LEU 103 2HD2 LEU 103 6.257 2.074 7.959 1716 HD23 LEU 103 3HD2 LEU 103 5.688 0.628 7.131 1717 H LEU 104 H LEU 104 1.265 -0.213 6.502 1718 HA LEU 104 HA LEU 104 1.100 2.146 5.057 1719 HB2 LEU 104 2HB LEU 104 1.154 -0.113 4.038 1720 HB3 LEU 104 3HB LEU 104 -0.444 -0.451 4.662 1721 HG LEU 104 HG LEU 104 -1.333 1.407 3.168 1722 HD11 LEU 104 1HD1 LEU 104 0.046 2.201 1.307 1723 HD12 LEU 104 2HD1 LEU 104 1.450 1.356 1.961 1724 HD13 LEU 104 3HD1 LEU 104 0.723 2.692 2.859 1725 HD21 LEU 104 1HD2 LEU 104 -1.534 -0.965 2.554 1726 HD22 LEU 104 2HD2 LEU 104 0.038 -0.903 1.751 1727 HD23 LEU 104 3HD2 LEU 104 -1.311 0.050 1.129 1728 H ASP 105 H ASP 105 -1.410 0.360 6.796 1729 HA ASP 105 HA ASP 105 -3.644 1.921 6.054 1730 HB2 ASP 105 2HB ASP 105 -3.832 -0.395 6.931 1731 HB3 ASP 105 3HB ASP 105 -3.253 0.134 8.505 1732 H VAL 106 H VAL 106 -1.596 1.986 9.003 1733 HA VAL 106 HA VAL 106 -2.937 4.005 10.422 1734 HB VAL 106 HB VAL 106 0.030 3.265 10.460 1735 HG11 VAL 106 1HG1 VAL 106 -0.209 5.534 11.382 1736 HG12 VAL 106 2HG1 VAL 106 0.187 4.390 12.662 1737 HG13 VAL 106 3HG1 VAL 106 -1.469 4.978 12.488 1738 HG21 VAL 106 1HG2 VAL 106 -0.522 1.990 12.495 1739 HG22 VAL 106 2HG2 VAL 106 -1.472 1.428 11.120 1740 HG23 VAL 106 3HG2 VAL 106 -2.220 2.455 12.341 1741 H THR 107 H THR 107 -0.192 4.260 8.155 1742 HA THR 107 HA THR 107 0.087 7.082 8.325 1743 HB THR 107 HB THR 107 1.102 5.279 6.082 1744 HG1 THR 107 HG1 THR 107 2.141 4.322 7.674 1745 HG21 THR 107 1HG2 THR 107 1.464 7.705 5.689 1746 HG22 THR 107 2HG2 THR 107 2.990 6.874 5.992 1747 HG23 THR 107 3HG2 THR 107 2.246 7.840 7.267 1748 H CYS 108 H CYS 108 -1.813 4.976 6.213 1749 HA CYS 108 HA CYS 108 -2.589 6.964 4.292 1750 HB2 CYS 108 2HB CYS 108 -3.753 4.234 4.945 1751 HB3 CYS 108 3HB CYS 108 -4.382 5.265 3.659 1752 HG CYS 108 HG CYS 108 -1.098 4.349 3.689 1753 H LYS 109 H LYS 109 -3.845 5.904 7.400 1754 HA LYS 109 HA LYS 109 -6.310 7.394 7.262 1755 HB2 LYS 109 2HB LYS 109 -4.884 5.774 9.355 1756 HB3 LYS 109 3HB LYS 109 -5.956 7.028 9.964 1757 HG2 LYS 109 2HG LYS 109 -7.009 4.764 9.792 1758 HG3 LYS 109 3HG LYS 109 -7.873 6.022 8.905 1759 HD2 LYS 109 2HD LYS 109 -6.896 5.210 6.787 1760 HD3 LYS 109 3HD LYS 109 -5.965 3.996 7.666 1761 HE2 LYS 109 2HE LYS 109 -8.994 4.130 7.571 1762 HE3 LYS 109 3HE LYS 109 -7.994 3.056 6.595 1763 HZ1 LYS 109 1HZ LYS 109 -8.869 1.928 8.534 1764 HZ2 LYS 109 2HZ LYS 109 -8.143 3.051 9.555 1765 HZ3 LYS 109 3HZ LYS 109 -7.188 2.025 8.621 1766 H THR 110 H THR 110 -3.045 7.977 8.551 1767 HA THR 110 HA THR 110 -3.471 10.401 9.867 1768 HB THR 110 HB THR 110 -0.957 9.442 8.424 1769 HG1 THR 110 HG1 THR 110 -0.408 8.800 10.618 1770 HG21 THR 110 1HG2 THR 110 -0.793 11.863 8.905 1771 HG22 THR 110 2HG2 THR 110 0.282 10.945 9.960 1772 HG23 THR 110 3HG2 THR 110 -1.243 11.571 10.588 1773 H VAL 111 H VAL 111 -2.415 9.868 6.447 1774 HA VAL 111 HA VAL 111 -2.370 12.604 5.707 1775 HB VAL 111 HB VAL 111 -2.442 11.830 3.320 1776 HG11 VAL 111 1HG1 VAL 111 -0.284 11.946 4.483 1777 HG12 VAL 111 2HG1 VAL 111 -0.299 10.609 3.332 1778 HG13 VAL 111 3HG1 VAL 111 -0.482 10.289 5.059 1779 HG21 VAL 111 1HG2 VAL 111 -3.937 9.898 3.546 1780 HG22 VAL 111 2HG2 VAL 111 -2.721 9.044 4.495 1781 HG23 VAL 111 3HG2 VAL 111 -2.412 9.415 2.796 1782 H ALA 112 H ALA 112 -4.962 10.188 5.664 1783 HA ALA 112 HA ALA 112 -6.912 11.699 4.257 1784 HB1 ALA 112 1HB ALA 112 -8.516 10.043 5.111 1785 HB2 ALA 112 2HB ALA 112 -7.304 9.451 6.254 1786 HB3 ALA 112 3HB ALA 112 -7.048 9.259 4.518 1787 H ASN 113 H ASN 113 -5.898 11.617 7.596 1788 HA ASN 113 HA ASN 113 -8.090 13.169 8.667 1789 HB2 ASN 113 2HB ASN 113 -5.399 12.382 9.880 1790 HB3 ASN 113 3HB ASN 113 -6.633 13.289 10.752 1791 HD21 ASN 113 1HD2 ASN 113 -5.476 10.621 11.285 1792 HD22 ASN 113 2HD2 ASN 113 -6.811 9.526 11.347 1793 H MET 114 H MET 114 -4.822 13.904 7.468 1794 HA MET 114 HA MET 114 -4.730 16.620 8.412 1795 HB2 MET 114 2HB MET 114 -3.166 15.314 6.135 1796 HB3 MET 114 3HB MET 114 -2.818 16.899 6.813 1797 HG2 MET 114 2HG MET 114 -2.379 15.763 9.020 1798 HG3 MET 114 3HG MET 114 -2.525 14.219 8.182 1799 HE1 MET 114 1HE MET 114 0.479 14.630 5.540 1800 HE2 MET 114 2HE MET 114 -1.142 15.266 5.271 1801 HE3 MET 114 3HE MET 114 -0.927 13.655 5.962 1802 H ILE 115 H ILE 115 -5.756 15.075 5.407 1803 HA ILE 115 HA ILE 115 -6.432 17.605 4.089 1804 HB ILE 115 HB ILE 115 -6.970 16.271 2.113 1805 HG12 ILE 115 2HG1 ILE 115 -6.622 13.811 3.894 1806 HG13 ILE 115 3HG1 ILE 115 -8.138 14.397 3.233 1807 HG21 ILE 115 1HG2 ILE 115 -4.428 15.204 3.396 1808 HG22 ILE 115 2HG2 ILE 115 -4.577 16.715 2.498 1809 HG23 ILE 115 3HG2 ILE 115 -4.804 15.175 1.670 1810 HD11 ILE 115 1HD1 ILE 115 -5.850 13.177 1.705 1811 HD12 ILE 115 2HD1 ILE 115 -7.269 13.910 0.956 1812 HD13 ILE 115 3HD1 ILE 115 -7.452 12.498 1.995 1813 H ARG 116 H ARG 116 -7.951 15.886 6.424 1814 HA ARG 116 HA ARG 116 -10.422 15.078 5.372 1815 HB2 ARG 116 2HB ARG 116 -9.442 14.289 7.549 1816 HB3 ARG 116 3HB ARG 116 -9.853 15.842 8.264 1817 HG2 ARG 116 2HG ARG 116 -11.529 14.186 8.878 1818 HG3 ARG 116 3HG ARG 116 -12.259 15.391 7.813 1819 HD2 ARG 116 2HD ARG 116 -11.788 13.751 5.886 1820 HD3 ARG 116 3HD ARG 116 -11.440 12.551 7.133 1821 HE ARG 116 HE ARG 116 -13.820 13.266 7.928 1822 HH11 ARG 116 1HH1 ARG 116 -12.790 12.752 4.580 1823 HH12 ARG 116 2HH1 ARG 116 -14.386 12.301 4.055 1824 HH21 ARG 116 1HH2 ARG 116 -15.886 12.725 7.205 1825 HH22 ARG 116 2HH2 ARG 116 -16.131 12.286 5.539 1826 H GLY 117 H GLY 117 -11.473 16.612 4.202 1827 HA2 GLY 117 2HA GLY 117 -12.049 19.281 5.114 1828 HA3 GLY 117 3HA GLY 117 -12.685 18.488 3.681 Start of MODEL 10 1 H1 SER 2 1H SER 2 -15.505 -15.291 -14.978 2 H2 SER 2 2H SER 2 -15.907 -14.595 -16.463 3 H3 SER 2 3H SER 2 -16.393 -16.176 -16.106 4 HA SER 2 HA SER 2 -18.220 -14.663 -15.919 5 HB2 SER 2 2HB SER 2 -17.294 -15.720 -13.215 6 HB3 SER 2 3HB SER 2 -18.962 -15.368 -13.684 7 HG SER 2 HG SER 2 -19.017 -17.329 -14.424 8 H LEU 3 H LEU 3 -18.935 -12.643 -15.440 9 HA LEU 3 HA LEU 3 -17.084 -10.639 -14.547 10 HB2 LEU 3 2HB LEU 3 -20.080 -10.434 -15.037 11 HB3 LEU 3 3HB LEU 3 -18.980 -9.072 -14.867 12 HG LEU 3 HG LEU 3 -18.834 -11.113 -17.119 13 HD11 LEU 3 1HD1 LEU 3 -19.802 -9.391 -18.560 14 HD12 LEU 3 2HD1 LEU 3 -20.024 -8.326 -17.169 15 HD13 LEU 3 3HD1 LEU 3 -20.911 -9.851 -17.271 16 HD21 LEU 3 1HD2 LEU 3 -16.671 -10.081 -16.672 17 HD22 LEU 3 2HD2 LEU 3 -17.385 -8.469 -16.772 18 HD23 LEU 3 3HD2 LEU 3 -17.325 -9.502 -18.202 19 H VAL 4 H VAL 4 -16.598 -10.358 -12.438 20 HA VAL 4 HA VAL 4 -18.517 -10.837 -10.301 21 HB VAL 4 HB VAL 4 -16.713 -10.075 -8.749 22 HG11 VAL 4 1HG1 VAL 4 -16.863 -12.453 -9.372 23 HG12 VAL 4 2HG1 VAL 4 -15.183 -11.988 -9.109 24 HG13 VAL 4 3HG1 VAL 4 -15.797 -12.180 -10.753 25 HG21 VAL 4 1HG2 VAL 4 -15.577 -8.420 -10.180 26 HG22 VAL 4 2HG2 VAL 4 -15.014 -9.704 -11.252 27 HG23 VAL 4 3HG2 VAL 4 -14.426 -9.621 -9.590 28 H LYS 5 H LYS 5 -19.801 -9.357 -9.446 29 HA LYS 5 HA LYS 5 -19.972 -6.743 -10.741 30 HB2 LYS 5 2HB LYS 5 -21.928 -8.161 -8.886 31 HB3 LYS 5 3HB LYS 5 -22.243 -6.685 -9.787 32 HG2 LYS 5 2HG LYS 5 -21.887 -7.987 -11.919 33 HG3 LYS 5 3HG LYS 5 -21.783 -9.453 -10.938 34 HD2 LYS 5 2HD LYS 5 -24.094 -9.012 -10.085 35 HD3 LYS 5 3HD LYS 5 -24.187 -7.590 -11.131 36 HE2 LYS 5 2HE LYS 5 -23.828 -9.096 -13.106 37 HE3 LYS 5 3HE LYS 5 -23.900 -10.479 -12.009 38 HZ1 LYS 5 1HZ LYS 5 -26.078 -8.498 -12.372 39 HZ2 LYS 5 2HZ LYS 5 -26.148 -9.909 -11.444 40 HZ3 LYS 5 3HZ LYS 5 -26.013 -10.006 -13.124 41 H LEU 6 H LEU 6 -18.304 -5.661 -9.730 42 HA LEU 6 HA LEU 6 -18.168 -5.367 -6.838 43 HB2 LEU 6 2HB LEU 6 -16.598 -3.991 -9.055 44 HB3 LEU 6 3HB LEU 6 -16.236 -3.891 -7.337 45 HG LEU 6 HG LEU 6 -16.084 -6.409 -9.037 46 HD11 LEU 6 1HD1 LEU 6 -13.669 -6.253 -8.715 47 HD12 LEU 6 2HD1 LEU 6 -13.867 -4.735 -7.833 48 HD13 LEU 6 3HD1 LEU 6 -14.298 -4.830 -9.542 49 HD21 LEU 6 1HD2 LEU 6 -16.748 -6.991 -6.757 50 HD22 LEU 6 2HD2 LEU 6 -15.407 -6.053 -6.095 51 HD23 LEU 6 3HD2 LEU 6 -15.086 -7.498 -7.059 52 H GLU 7 H GLU 7 -20.038 -4.354 -6.224 53 HA GLU 7 HA GLU 7 -20.945 -1.872 -7.414 54 HB2 GLU 7 2HB GLU 7 -22.537 -3.499 -6.400 55 HB3 GLU 7 3HB GLU 7 -21.783 -3.265 -4.824 56 HG2 GLU 7 2HG GLU 7 -22.436 -0.838 -4.931 57 HG3 GLU 7 3HG GLU 7 -23.304 -1.172 -6.429 58 H SER 8 H SER 8 -20.410 0.145 -6.735 59 HA SER 8 HA SER 8 -18.318 0.562 -4.750 60 HB2 SER 8 2HB SER 8 -18.473 2.938 -5.621 61 HB3 SER 8 3HB SER 8 -18.172 1.738 -6.875 62 HG SER 8 HG SER 8 -20.123 2.033 -7.676 63 H SER 9 H SER 9 -18.635 2.615 -3.344 64 HA SER 9 HA SER 9 -20.821 2.353 -1.545 65 HB2 SER 9 2HB SER 9 -19.820 4.424 -0.492 66 HB3 SER 9 3HB SER 9 -18.646 3.142 -0.762 67 HG SER 9 HG SER 9 -17.740 5.032 -1.483 68 H ASP 10 H ASP 10 -20.297 4.218 -4.420 69 HA ASP 10 HA ASP 10 -22.614 5.964 -4.146 70 HB2 ASP 10 2HB ASP 10 -20.514 6.670 -5.303 71 HB3 ASP 10 3HB ASP 10 -20.753 5.404 -6.497 72 H GLU 11 H GLU 11 -22.358 2.761 -4.612 73 HA GLU 11 HA GLU 11 -23.768 1.096 -5.086 74 HB2 GLU 11 2HB GLU 11 -25.820 3.300 -5.545 75 HB3 GLU 11 3HB GLU 11 -26.197 1.584 -5.422 76 HG2 GLU 11 2HG GLU 11 -25.277 1.588 -3.090 77 HG3 GLU 11 3HG GLU 11 -25.022 3.326 -3.236 78 H LYS 12 H LYS 12 -22.229 2.563 -7.292 79 HA LYS 12 HA LYS 12 -23.664 1.695 -9.694 80 HB2 LYS 12 2HB LYS 12 -20.871 2.885 -9.361 81 HB3 LYS 12 3HB LYS 12 -21.609 2.496 -10.910 82 HG2 LYS 12 2HG LYS 12 -22.642 4.540 -8.925 83 HG3 LYS 12 3HG LYS 12 -21.763 4.894 -10.414 84 HD2 LYS 12 2HD LYS 12 -23.593 3.988 -11.761 85 HD3 LYS 12 3HD LYS 12 -24.452 3.476 -10.305 86 HE2 LYS 12 2HE LYS 12 -23.856 6.346 -11.101 87 HE3 LYS 12 3HE LYS 12 -25.418 5.539 -11.209 88 HZ1 LYS 12 1HZ LYS 12 -25.251 6.921 -9.234 89 HZ2 LYS 12 2HZ LYS 12 -23.919 6.041 -8.698 90 HZ3 LYS 12 3HZ LYS 12 -25.430 5.295 -8.814 91 H VAL 13 H VAL 13 -23.511 -0.281 -10.471 92 HA VAL 13 HA VAL 13 -21.724 -2.251 -9.253 93 HB VAL 13 HB VAL 13 -24.061 -2.644 -11.193 94 HG11 VAL 13 1HG1 VAL 13 -22.500 -4.540 -11.234 95 HG12 VAL 13 2HG1 VAL 13 -24.024 -5.002 -10.479 96 HG13 VAL 13 3HG1 VAL 13 -22.605 -4.690 -9.476 97 HG21 VAL 13 1HG2 VAL 13 -24.817 -1.616 -9.083 98 HG22 VAL 13 2HG2 VAL 13 -24.046 -2.907 -8.158 99 HG23 VAL 13 3HG2 VAL 13 -25.404 -3.276 -9.225 100 H PHE 14 H PHE 14 -19.755 -2.251 -10.205 101 HA PHE 14 HA PHE 14 -19.410 -2.035 -13.112 102 HB2 PHE 14 2HB PHE 14 -17.365 -2.178 -10.846 103 HB3 PHE 14 3HB PHE 14 -16.970 -1.956 -12.547 104 HD1 PHE 14 HD1 PHE 14 -17.500 0.196 -13.691 105 HD2 PHE 14 HD2 PHE 14 -18.243 -0.312 -9.507 106 HE1 PHE 14 HE1 PHE 14 -17.728 2.629 -13.425 107 HE2 PHE 14 HE2 PHE 14 -18.466 2.123 -9.258 108 HZ PHE 14 HZ PHE 14 -18.216 3.593 -11.216 109 H GLU 15 H GLU 15 -19.944 -3.912 -14.052 110 HA GLU 15 HA GLU 15 -19.336 -6.522 -12.925 111 HB2 GLU 15 2HB GLU 15 -20.525 -5.851 -15.643 112 HB3 GLU 15 3HB GLU 15 -20.574 -7.408 -14.822 113 HG2 GLU 15 2HG GLU 15 -22.010 -6.438 -13.052 114 HG3 GLU 15 3HG GLU 15 -21.945 -4.874 -13.864 115 H ILE 16 H ILE 16 -17.041 -6.222 -12.873 116 HA ILE 16 HA ILE 16 -15.541 -6.172 -15.408 117 HB ILE 16 HB ILE 16 -14.806 -4.660 -13.556 118 HG12 ILE 16 2HG1 ILE 16 -12.774 -6.850 -14.189 119 HG13 ILE 16 3HG1 ILE 16 -13.128 -5.457 -15.201 120 HG21 ILE 16 1HG2 ILE 16 -13.792 -5.537 -11.488 121 HG22 ILE 16 2HG2 ILE 16 -14.185 -7.183 -11.984 122 HG23 ILE 16 3HG2 ILE 16 -15.480 -6.040 -11.630 123 HD11 ILE 16 1HD1 ILE 16 -11.066 -5.136 -14.030 124 HD12 ILE 16 2HD1 ILE 16 -11.848 -5.405 -12.474 125 HD13 ILE 16 3HD1 ILE 16 -12.258 -3.985 -13.436 126 H GLU 17 H GLU 17 -14.048 -7.811 -15.927 127 HA GLU 17 HA GLU 17 -14.981 -10.448 -15.521 128 HB2 GLU 17 2HB GLU 17 -13.361 -9.162 -17.394 129 HB3 GLU 17 3HB GLU 17 -12.190 -10.169 -16.562 130 HG2 GLU 17 2HG GLU 17 -14.726 -11.124 -17.907 131 HG3 GLU 17 3HG GLU 17 -13.104 -11.257 -18.556 132 H LYS 18 H LYS 18 -14.231 -12.111 -14.232 133 HA LYS 18 HA LYS 18 -13.150 -11.486 -11.724 134 HB2 LYS 18 2HB LYS 18 -14.577 -13.471 -12.108 135 HB3 LYS 18 3HB LYS 18 -13.303 -14.218 -13.066 136 HG2 LYS 18 2HG LYS 18 -11.832 -14.124 -10.985 137 HG3 LYS 18 3HG LYS 18 -13.271 -13.647 -10.080 138 HD2 LYS 18 2HD LYS 18 -14.362 -15.774 -10.589 139 HD3 LYS 18 3HD LYS 18 -13.056 -16.220 -11.695 140 HE2 LYS 18 2HE LYS 18 -11.471 -16.196 -9.758 141 HE3 LYS 18 3HE LYS 18 -12.838 -15.891 -8.685 142 HZ1 LYS 18 1HZ LYS 18 -12.273 -18.215 -8.719 143 HZ2 LYS 18 2HZ LYS 18 -12.464 -18.291 -10.396 144 HZ3 LYS 18 3HZ LYS 18 -13.799 -17.996 -9.405 145 H GLU 19 H GLU 19 -11.605 -12.780 -14.654 146 HA GLU 19 HA GLU 19 -9.095 -13.527 -13.718 147 HB2 GLU 19 2HB GLU 19 -9.830 -13.994 -16.001 148 HB3 GLU 19 3HB GLU 19 -9.866 -12.279 -16.387 149 HG2 GLU 19 2HG GLU 19 -7.449 -12.135 -16.238 150 HG3 GLU 19 3HG GLU 19 -7.333 -13.804 -15.680 151 H ILE 20 H ILE 20 -10.312 -10.326 -14.470 152 HA ILE 20 HA ILE 20 -7.785 -8.934 -14.209 153 HB ILE 20 HB ILE 20 -10.565 -7.670 -14.157 154 HG12 ILE 20 2HG1 ILE 20 -8.948 -8.487 -16.613 155 HG13 ILE 20 3HG1 ILE 20 -10.501 -9.147 -16.125 156 HG21 ILE 20 1HG2 ILE 20 -9.419 -5.709 -15.098 157 HG22 ILE 20 2HG2 ILE 20 -7.888 -6.583 -15.107 158 HG23 ILE 20 3HG2 ILE 20 -8.671 -6.195 -13.575 159 HD11 ILE 20 1HD1 ILE 20 -11.555 -6.981 -16.552 160 HD12 ILE 20 2HD1 ILE 20 -10.734 -7.620 -17.977 161 HD13 ILE 20 3HD1 ILE 20 -9.991 -6.323 -17.046 162 H ALA 21 H ALA 21 -10.660 -9.540 -12.247 163 HA ALA 21 HA ALA 21 -9.960 -7.875 -10.012 164 HB1 ALA 21 1HB ALA 21 -12.291 -8.404 -10.583 165 HB2 ALA 21 2HB ALA 21 -11.912 -8.897 -8.933 166 HB3 ALA 21 3HB ALA 21 -12.004 -10.105 -10.219 167 H CYS 22 H CYS 22 -8.858 -10.954 -11.003 168 HA CYS 22 HA CYS 22 -8.197 -12.078 -8.465 169 HB2 CYS 22 2HB CYS 22 -6.995 -12.565 -11.216 170 HB3 CYS 22 3HB CYS 22 -6.630 -13.529 -9.786 171 HG CYS 22 HG CYS 22 -9.902 -13.343 -10.311 172 H MET 23 H MET 23 -6.613 -9.762 -10.619 173 HA MET 23 HA MET 23 -4.038 -9.679 -9.406 174 HB2 MET 23 2HB MET 23 -5.464 -7.367 -10.791 175 HB3 MET 23 3HB MET 23 -3.734 -7.512 -10.520 176 HG2 MET 23 2HG MET 23 -3.812 -9.576 -12.020 177 HG3 MET 23 3HG MET 23 -5.450 -9.080 -12.446 178 HE1 MET 23 1HE MET 23 -4.788 -5.733 -12.232 179 HE2 MET 23 2HE MET 23 -5.900 -6.442 -13.406 180 HE3 MET 23 3HE MET 23 -4.574 -5.417 -13.954 181 H SER 24 H SER 24 -7.071 -8.110 -8.686 182 HA SER 24 HA SER 24 -6.154 -6.620 -6.399 183 HB2 SER 24 2HB SER 24 -8.222 -5.994 -7.665 184 HB3 SER 24 3HB SER 24 -8.974 -7.512 -7.164 185 HG SER 24 HG SER 24 -7.977 -5.567 -5.363 186 H VAL 25 H VAL 25 -5.298 -7.766 -4.747 187 HA VAL 25 HA VAL 25 -5.657 -10.564 -4.435 188 HB VAL 25 HB VAL 25 -4.311 -8.582 -2.555 189 HG11 VAL 25 1HG1 VAL 25 -4.073 -11.616 -2.599 190 HG12 VAL 25 2HG1 VAL 25 -4.834 -10.650 -1.336 191 HG13 VAL 25 3HG1 VAL 25 -3.097 -10.527 -1.611 192 HG21 VAL 25 1HG2 VAL 25 -2.200 -9.304 -3.632 193 HG22 VAL 25 2HG2 VAL 25 -3.304 -8.573 -4.797 194 HG23 VAL 25 3HG2 VAL 25 -3.114 -10.327 -4.744 195 H THR 26 H THR 26 -7.018 -7.768 -2.687 196 HA THR 26 HA THR 26 -8.180 -9.211 -0.534 197 HB THR 26 HB THR 26 -9.041 -6.531 -1.713 198 HG1 THR 26 HG1 THR 26 -6.994 -6.348 -0.920 199 HG21 THR 26 1HG2 THR 26 -10.106 -6.088 0.478 200 HG22 THR 26 2HG2 THR 26 -9.719 -7.725 1.008 201 HG23 THR 26 3HG2 THR 26 -10.863 -7.476 -0.312 202 H ILE 27 H ILE 27 -9.468 -8.270 -3.724 203 HA ILE 27 HA ILE 27 -12.125 -9.238 -3.342 204 HB ILE 27 HB ILE 27 -10.570 -8.722 -5.919 205 HG12 ILE 27 2HG1 ILE 27 -12.673 -7.019 -4.497 206 HG13 ILE 27 3HG1 ILE 27 -10.939 -6.727 -4.448 207 HG21 ILE 27 1HG2 ILE 27 -12.754 -8.723 -7.103 208 HG22 ILE 27 2HG2 ILE 27 -13.565 -9.213 -5.615 209 HG23 ILE 27 3HG2 ILE 27 -12.413 -10.301 -6.390 210 HD11 ILE 27 1HD1 ILE 27 -12.691 -6.591 -6.887 211 HD12 ILE 27 2HD1 ILE 27 -10.948 -6.332 -6.860 212 HD13 ILE 27 3HD1 ILE 27 -12.016 -5.234 -5.989 213 H LYS 28 H LYS 28 -9.226 -10.624 -4.900 214 HA LYS 28 HA LYS 28 -10.169 -13.128 -5.680 215 HB2 LYS 28 2HB LYS 28 -7.938 -12.240 -6.298 216 HB3 LYS 28 3HB LYS 28 -7.410 -12.373 -4.626 217 HG2 LYS 28 2HG LYS 28 -7.766 -14.889 -4.807 218 HG3 LYS 28 3HG LYS 28 -8.059 -14.646 -6.531 219 HD2 LYS 28 2HD LYS 28 -5.739 -15.349 -6.145 220 HD3 LYS 28 3HD LYS 28 -5.782 -13.708 -6.799 221 HE2 LYS 28 2HE LYS 28 -4.124 -13.931 -4.986 222 HE3 LYS 28 3HE LYS 28 -5.392 -12.789 -4.546 223 HZ1 LYS 28 1HZ LYS 28 -6.434 -14.576 -3.241 224 HZ2 LYS 28 2HZ LYS 28 -4.869 -14.237 -2.703 225 HZ3 LYS 28 3HZ LYS 28 -5.162 -15.609 -3.642 226 H ASN 29 H ASN 29 -8.835 -12.056 -2.577 227 HA ASN 29 HA ASN 29 -8.938 -14.561 -1.221 228 HB2 ASN 29 2HB ASN 29 -8.624 -11.688 -0.247 229 HB3 ASN 29 3HB ASN 29 -8.751 -13.029 0.892 230 HD21 ASN 29 1HD2 ASN 29 -6.654 -12.649 1.675 231 HD22 ASN 29 2HD2 ASN 29 -5.242 -13.046 0.762 232 H MET 30 H MET 30 -11.252 -11.905 -1.602 233 HA MET 30 HA MET 30 -13.166 -12.795 0.323 234 HB2 MET 30 2HB MET 30 -13.400 -10.934 -2.081 235 HB3 MET 30 3HB MET 30 -14.803 -11.358 -1.110 236 HG2 MET 30 2HG MET 30 -13.728 -10.386 0.882 237 HG3 MET 30 3HG MET 30 -12.323 -9.953 -0.097 238 HE1 MET 30 1HE MET 30 -12.664 -7.401 0.860 239 HE2 MET 30 2HE MET 30 -14.110 -7.923 1.730 240 HE3 MET 30 3HE MET 30 -14.177 -6.513 0.671 241 H ILE 31 H ILE 31 -12.659 -13.466 -3.110 242 HA ILE 31 HA ILE 31 -14.999 -14.988 -3.593 243 HB ILE 31 HB ILE 31 -12.278 -15.141 -4.990 244 HG12 ILE 31 2HG1 ILE 31 -14.826 -13.665 -5.825 245 HG13 ILE 31 3HG1 ILE 31 -13.430 -12.896 -5.086 246 HG21 ILE 31 1HG2 ILE 31 -14.964 -16.252 -5.903 247 HG22 ILE 31 2HG2 ILE 31 -13.561 -17.203 -5.412 248 HG23 ILE 31 3HG2 ILE 31 -13.491 -16.222 -6.875 249 HD11 ILE 31 1HD1 ILE 31 -13.491 -14.258 -7.771 250 HD12 ILE 31 2HD1 ILE 31 -12.074 -13.511 -7.026 251 HD13 ILE 31 3HD1 ILE 31 -13.466 -12.521 -7.464 252 H GLU 32 H GLU 32 -11.701 -15.877 -2.596 253 HA GLU 32 HA GLU 32 -12.128 -18.690 -2.333 254 HB2 GLU 32 2HB GLU 32 -10.008 -16.926 -1.023 255 HB3 GLU 32 3HB GLU 32 -9.948 -18.685 -1.141 256 HG2 GLU 32 2HG GLU 32 -9.802 -18.562 -3.577 257 HG3 GLU 32 3HG GLU 32 -9.978 -16.811 -3.529 258 H ASP 33 H ASP 33 -12.577 -15.978 -0.167 259 HA ASP 33 HA ASP 33 -12.741 -17.328 2.336 260 HB2 ASP 33 2HB ASP 33 -12.265 -14.909 2.151 261 HB3 ASP 33 3HB ASP 33 -13.845 -14.618 1.432 262 H ILE 34 H ILE 34 -15.166 -16.209 0.022 263 HA ILE 34 HA ILE 34 -17.454 -17.367 1.379 264 HB ILE 34 HB ILE 34 -17.139 -16.091 -1.390 265 HG12 ILE 34 2HG1 ILE 34 -18.283 -14.943 1.203 266 HG13 ILE 34 3HG1 ILE 34 -16.726 -14.530 0.499 267 HG21 ILE 34 1HG2 ILE 34 -19.091 -17.604 -1.405 268 HG22 ILE 34 2HG2 ILE 34 -19.599 -15.918 -1.499 269 HG23 ILE 34 3HG2 ILE 34 -19.742 -16.800 0.025 270 HD11 ILE 34 1HD1 ILE 34 -18.327 -12.791 0.078 271 HD12 ILE 34 2HD1 ILE 34 -19.432 -13.928 -0.688 272 HD13 ILE 34 3HD1 ILE 34 -17.881 -13.557 -1.444 273 H GLY 35 H GLY 35 -15.034 -18.447 -0.807 274 HA2 GLY 35 2HA GLY 35 -14.722 -20.690 -1.526 275 HA3 GLY 35 3HA GLY 35 -16.462 -20.961 -1.448 276 H GLU 36 H GLU 36 -17.455 -18.818 -2.745 277 HA GLU 36 HA GLU 36 -16.192 -18.195 -5.237 278 HB2 GLU 36 2HB GLU 36 -17.050 -20.419 -5.824 279 HB3 GLU 36 3HB GLU 36 -18.636 -20.031 -5.173 280 HG2 GLU 36 2HG GLU 36 -18.944 -18.342 -6.960 281 HG3 GLU 36 3HG GLU 36 -17.365 -18.759 -7.618 282 H SER 37 H SER 37 -16.589 -16.028 -5.019 283 HA SER 37 HA SER 37 -19.035 -14.941 -3.963 284 HB2 SER 37 2HB SER 37 -16.745 -13.568 -5.426 285 HB3 SER 37 3HB SER 37 -18.062 -12.733 -4.603 286 HG SER 37 HG SER 37 -16.797 -12.868 -2.937 287 H ASP 38 H ASP 38 -20.487 -16.079 -5.344 288 HA ASP 38 HA ASP 38 -20.761 -15.480 -8.152 289 HB2 ASP 38 2HB ASP 38 -21.551 -17.637 -7.286 290 HB3 ASP 38 3HB ASP 38 -22.644 -16.839 -6.166 291 H SER 39 H SER 39 -22.061 -14.321 -5.115 292 HA SER 39 HA SER 39 -24.096 -12.627 -6.237 293 HB2 SER 39 2HB SER 39 -24.329 -11.888 -3.815 294 HB3 SER 39 3HB SER 39 -24.492 -13.624 -4.059 295 HG SER 39 HG SER 39 -22.503 -12.186 -2.758 296 HA PRO 40 HA PRO 40 -21.702 -8.846 -6.959 297 HB2 PRO 40 2HB PRO 40 -24.043 -7.410 -5.679 298 HB3 PRO 40 3HB PRO 40 -23.278 -7.143 -7.264 299 HG2 PRO 40 2HG PRO 40 -25.632 -8.352 -7.116 300 HG3 PRO 40 3HG PRO 40 -24.402 -8.927 -8.269 301 HD2 PRO 40 2HD PRO 40 -25.188 -10.096 -5.603 302 HD3 PRO 40 3HD PRO 40 -24.815 -10.922 -7.133 303 H ILE 41 H ILE 41 -20.104 -7.943 -5.776 304 HA ILE 41 HA ILE 41 -20.167 -8.105 -2.850 305 HB ILE 41 HB ILE 41 -17.851 -7.424 -4.734 306 HG12 ILE 41 2HG1 ILE 41 -18.598 -9.768 -5.018 307 HG13 ILE 41 3HG1 ILE 41 -17.022 -9.724 -4.241 308 HG21 ILE 41 1HG2 ILE 41 -16.381 -7.765 -2.767 309 HG22 ILE 41 2HG2 ILE 41 -17.797 -7.995 -1.741 310 HG23 ILE 41 3HG2 ILE 41 -17.507 -6.432 -2.504 311 HD11 ILE 41 1HD1 ILE 41 -18.419 -11.426 -3.241 312 HD12 ILE 41 2HD1 ILE 41 -19.675 -10.245 -2.886 313 HD13 ILE 41 3HD1 ILE 41 -18.118 -10.153 -2.059 314 HA PRO 42 HA PRO 42 -21.020 -3.594 -3.001 315 HB2 PRO 42 2HB PRO 42 -21.800 -3.814 -0.165 316 HB3 PRO 42 3HB PRO 42 -22.824 -3.451 -1.567 317 HG2 PRO 42 2HG PRO 42 -23.028 -5.775 -0.160 318 HG3 PRO 42 3HG PRO 42 -23.422 -5.652 -1.891 319 HD2 PRO 42 2HD PRO 42 -20.881 -6.670 -0.604 320 HD3 PRO 42 3HD PRO 42 -21.819 -7.358 -1.953 321 H LEU 43 H LEU 43 -19.494 -2.114 -2.630 322 HA LEU 43 HA LEU 43 -17.403 -2.557 -0.576 323 HB2 LEU 43 2HB LEU 43 -17.134 -1.087 -3.242 324 HB3 LEU 43 3HB LEU 43 -15.848 -1.353 -2.075 325 HG LEU 43 HG LEU 43 -17.248 -3.554 -3.650 326 HD11 LEU 43 1HD1 LEU 43 -14.487 -2.373 -4.083 327 HD12 LEU 43 2HD1 LEU 43 -15.894 -2.168 -5.130 328 HD13 LEU 43 3HD1 LEU 43 -15.170 -3.762 -4.939 329 HD21 LEU 43 1HD2 LEU 43 -14.852 -3.737 -1.796 330 HD22 LEU 43 2HD2 LEU 43 -15.474 -5.044 -2.809 331 HD23 LEU 43 3HD2 LEU 43 -16.464 -4.396 -1.506 332 HA PRO 44 HA PRO 44 -19.707 1.280 0.640 333 HB2 PRO 44 2HB PRO 44 -19.717 0.919 3.309 334 HB3 PRO 44 3HB PRO 44 -20.688 -0.139 2.263 335 HG2 PRO 44 2HG PRO 44 -18.011 -0.687 3.504 336 HG3 PRO 44 3HG PRO 44 -19.442 -1.737 3.423 337 HD2 PRO 44 2HD PRO 44 -17.314 -1.910 1.658 338 HD3 PRO 44 3HD PRO 44 -18.967 -2.444 1.275 339 H ASN 45 H ASN 45 -16.896 1.312 -0.085 340 HA ASN 45 HA ASN 45 -15.755 3.281 1.795 341 HB2 ASN 45 2HB ASN 45 -14.671 1.096 2.261 342 HB3 ASN 45 3HB ASN 45 -14.301 0.884 0.554 343 HD21 ASN 45 1HD2 ASN 45 -13.475 2.650 3.471 344 HD22 ASN 45 2HD2 ASN 45 -11.948 3.238 2.916 345 H VAL 46 H VAL 46 -14.996 1.662 -1.302 346 HA VAL 46 HA VAL 46 -13.863 4.078 -2.411 347 HB VAL 46 HB VAL 46 -12.758 1.928 -2.825 348 HG11 VAL 46 1HG1 VAL 46 -15.219 1.061 -4.374 349 HG12 VAL 46 2HG1 VAL 46 -14.683 0.414 -2.824 350 HG13 VAL 46 3HG1 VAL 46 -13.694 0.173 -4.264 351 HG21 VAL 46 1HG2 VAL 46 -13.852 3.119 -5.398 352 HG22 VAL 46 2HG2 VAL 46 -12.413 2.105 -5.263 353 HG23 VAL 46 3HG2 VAL 46 -12.446 3.692 -4.493 354 H THR 47 H THR 47 -14.904 5.529 -3.660 355 HA THR 47 HA THR 47 -17.716 5.337 -4.244 356 HB THR 47 HB THR 47 -17.314 7.583 -5.413 357 HG1 THR 47 HG1 THR 47 -15.283 8.389 -5.473 358 HG21 THR 47 1HG2 THR 47 -16.846 8.831 -3.324 359 HG22 THR 47 2HG2 THR 47 -16.315 7.340 -2.548 360 HG23 THR 47 3HG2 THR 47 -17.999 7.523 -3.042 361 H SER 48 H SER 48 -18.491 5.981 -6.511 362 HA SER 48 HA SER 48 -17.923 3.896 -8.320 363 HB2 SER 48 2HB SER 48 -19.405 5.184 -9.888 364 HB3 SER 48 3HB SER 48 -20.101 4.983 -8.278 365 HG SER 48 HG SER 48 -20.286 7.139 -9.089 366 H THR 49 H THR 49 -17.042 7.312 -8.334 367 HA THR 49 HA THR 49 -15.813 7.546 -10.820 368 HB THR 49 HB THR 49 -14.586 9.509 -9.722 369 HG1 THR 49 HG1 THR 49 -15.083 9.914 -7.546 370 HG21 THR 49 1HG2 THR 49 -16.828 9.852 -10.727 371 HG22 THR 49 2HG2 THR 49 -16.639 10.831 -9.270 372 HG23 THR 49 3HG2 THR 49 -17.590 9.345 -9.217 373 H ILE 50 H ILE 50 -14.348 6.792 -7.641 374 HA ILE 50 HA ILE 50 -11.671 6.605 -8.659 375 HB ILE 50 HB ILE 50 -12.813 5.748 -5.961 376 HG12 ILE 50 2HG1 ILE 50 -13.106 8.146 -6.346 377 HG13 ILE 50 3HG1 ILE 50 -11.844 7.909 -5.145 378 HG21 ILE 50 1HG2 ILE 50 -9.900 6.108 -6.762 379 HG22 ILE 50 2HG2 ILE 50 -10.692 4.580 -6.375 380 HG23 ILE 50 3HG2 ILE 50 -10.484 5.804 -5.123 381 HD11 ILE 50 1HD1 ILE 50 -11.245 9.689 -6.660 382 HD12 ILE 50 2HD1 ILE 50 -11.438 8.633 -8.057 383 HD13 ILE 50 3HD1 ILE 50 -10.140 8.334 -6.896 384 H LEU 51 H LEU 51 -14.161 4.229 -7.693 385 HA LEU 51 HA LEU 51 -12.627 1.883 -8.026 386 HB2 LEU 51 2HB LEU 51 -14.827 1.991 -6.809 387 HB3 LEU 51 3HB LEU 51 -15.649 2.172 -8.353 388 HG LEU 51 HG LEU 51 -14.911 -0.101 -9.033 389 HD11 LEU 51 1HD1 LEU 51 -13.798 -1.620 -7.454 390 HD12 LEU 51 2HD1 LEU 51 -13.615 -0.304 -6.295 391 HD13 LEU 51 3HD1 LEU 51 -12.779 -0.239 -7.849 392 HD21 LEU 51 1HD2 LEU 51 -16.296 -1.418 -7.499 393 HD22 LEU 51 2HD2 LEU 51 -17.064 0.126 -7.864 394 HD23 LEU 51 3HD2 LEU 51 -16.261 -0.111 -6.310 395 H GLU 52 H GLU 52 -14.527 3.825 -10.285 396 HA GLU 52 HA GLU 52 -14.482 2.151 -12.557 397 HB2 GLU 52 2HB GLU 52 -15.907 4.186 -12.385 398 HB3 GLU 52 3HB GLU 52 -14.471 5.206 -12.429 399 HG2 GLU 52 2HG GLU 52 -13.975 4.451 -14.718 400 HG3 GLU 52 3HG GLU 52 -15.365 3.369 -14.678 401 H LYS 53 H LYS 53 -12.265 4.684 -11.431 402 HA LYS 53 HA LYS 53 -10.443 4.633 -13.597 403 HB2 LYS 53 2HB LYS 53 -10.021 5.521 -10.710 404 HB3 LYS 53 3HB LYS 53 -8.896 5.827 -12.030 405 HG2 LYS 53 2HG LYS 53 -10.702 7.141 -13.194 406 HG3 LYS 53 3HG LYS 53 -11.704 6.925 -11.754 407 HD2 LYS 53 2HD LYS 53 -10.606 9.114 -11.690 408 HD3 LYS 53 3HD LYS 53 -9.996 8.091 -10.387 409 HE2 LYS 53 2HE LYS 53 -8.195 9.355 -11.517 410 HE3 LYS 53 3HE LYS 53 -7.963 7.615 -11.672 411 HZ1 LYS 53 1HZ LYS 53 -7.554 8.793 -13.760 412 HZ2 LYS 53 2HZ LYS 53 -9.134 9.389 -13.750 413 HZ3 LYS 53 3HZ LYS 53 -8.863 7.732 -13.907 414 H VAL 54 H VAL 54 -10.430 3.029 -10.443 415 HA VAL 54 HA VAL 54 -7.849 1.887 -10.570 416 HB VAL 54 HB VAL 54 -10.308 1.152 -8.902 417 HG11 VAL 54 1HG1 VAL 54 -8.810 -0.160 -7.435 418 HG12 VAL 54 2HG1 VAL 54 -7.476 0.098 -8.562 419 HG13 VAL 54 3HG1 VAL 54 -8.881 -0.845 -9.061 420 HG21 VAL 54 1HG2 VAL 54 -9.355 3.387 -8.437 421 HG22 VAL 54 2HG2 VAL 54 -7.772 2.665 -8.150 422 HG23 VAL 54 3HG2 VAL 54 -9.117 2.302 -7.065 423 H LEU 55 H LEU 55 -11.086 0.605 -11.357 424 HA LEU 55 HA LEU 55 -10.163 -1.995 -12.135 425 HB2 LEU 55 2HB LEU 55 -12.831 -0.623 -12.652 426 HB3 LEU 55 3HB LEU 55 -12.495 -2.308 -13.007 427 HG LEU 55 HG LEU 55 -12.628 -1.022 -10.253 428 HD11 LEU 55 1HD1 LEU 55 -14.513 -2.550 -9.878 429 HD12 LEU 55 2HD1 LEU 55 -14.364 -3.157 -11.530 430 HD13 LEU 55 3HD1 LEU 55 -14.810 -1.473 -11.242 431 HD21 LEU 55 1HD2 LEU 55 -10.799 -2.652 -10.230 432 HD22 LEU 55 2HD2 LEU 55 -11.865 -3.893 -10.895 433 HD23 LEU 55 3HD2 LEU 55 -12.169 -3.235 -9.285 434 H ASP 56 H ASP 56 -10.704 1.038 -13.854 435 HA ASP 56 HA ASP 56 -10.574 -0.029 -16.523 436 HB2 ASP 56 2HB ASP 56 -11.650 2.146 -16.083 437 HB3 ASP 56 3HB ASP 56 -10.127 2.824 -15.513 438 H TYR 57 H TYR 57 -8.221 1.347 -14.255 439 HA TYR 57 HA TYR 57 -5.947 1.167 -15.978 440 HB2 TYR 57 2HB TYR 57 -5.997 2.607 -13.922 441 HB3 TYR 57 3HB TYR 57 -5.997 1.156 -12.920 442 HD1 TYR 57 HD1 TYR 57 -3.924 -0.043 -12.491 443 HD2 TYR 57 HD2 TYR 57 -3.977 3.137 -15.351 444 HE1 TYR 57 HE1 TYR 57 -1.480 -0.142 -12.630 445 HE2 TYR 57 HE2 TYR 57 -1.521 3.052 -15.484 446 HH TYR 57 HH TYR 57 0.386 2.284 -14.068 447 H CYS 58 H CYS 58 -7.545 -1.047 -13.748 448 HA CYS 58 HA CYS 58 -5.652 -3.162 -13.925 449 HB2 CYS 58 2HB CYS 58 -8.603 -3.144 -13.193 450 HB3 CYS 58 3HB CYS 58 -7.586 -4.581 -13.096 451 HG CYS 58 HG CYS 58 -6.630 -1.768 -11.442 452 H ARG 59 H ARG 59 -8.487 -2.241 -15.928 453 HA ARG 59 HA ARG 59 -8.406 -4.486 -17.710 454 HB2 ARG 59 2HB ARG 59 -9.446 -1.669 -18.266 455 HB3 ARG 59 3HB ARG 59 -9.715 -3.069 -19.298 456 HG2 ARG 59 2HG ARG 59 -10.969 -4.144 -17.391 457 HG3 ARG 59 3HG ARG 59 -10.808 -2.625 -16.510 458 HD2 ARG 59 2HD ARG 59 -12.311 -3.112 -19.097 459 HD3 ARG 59 3HD ARG 59 -12.981 -2.629 -17.538 460 HE ARG 59 HE ARG 59 -11.248 -0.594 -18.226 461 HH11 ARG 59 1HH1 ARG 59 -14.113 -2.029 -19.720 462 HH12 ARG 59 2HH1 ARG 59 -14.559 -0.562 -20.528 463 HH21 ARG 59 1HH2 ARG 59 -11.844 1.295 -19.353 464 HH22 ARG 59 2HH2 ARG 59 -13.282 1.314 -20.322 465 H HIS 60 H HIS 60 -6.818 -1.345 -17.637 466 HA HIS 60 HA HIS 60 -5.478 -1.337 -20.090 467 HB2 HIS 60 2HB HIS 60 -5.467 0.667 -18.684 468 HB3 HIS 60 3HB HIS 60 -4.633 -0.181 -17.385 469 HD1 HIS 60 HD1 HIS 60 -2.068 -0.807 -17.892 470 HD2 HIS 60 HD2 HIS 60 -3.821 1.851 -20.547 471 HE1 HIS 60 HE1 HIS 60 -0.177 0.205 -19.165 472 HE2 HIS 60 HE2 HIS 60 -1.249 1.999 -20.536 473 H HIS 61 H HIS 61 -4.468 -2.611 -16.914 474 HA HIS 61 HA HIS 61 -1.960 -3.652 -17.835 475 HB2 HIS 61 2HB HIS 61 -2.406 -2.946 -15.467 476 HB3 HIS 61 3HB HIS 61 -3.490 -4.323 -15.274 477 HD1 HIS 61 HD1 HIS 61 -2.409 -6.606 -14.823 478 HD2 HIS 61 HD2 HIS 61 0.362 -3.648 -15.732 479 HE1 HIS 61 HE1 HIS 61 -0.160 -7.619 -14.363 480 HE2 HIS 61 HE2 HIS 61 1.495 -5.844 -15.001 481 H HIS 62 H HIS 62 -5.204 -4.889 -17.744 482 HA HIS 62 HA HIS 62 -4.615 -7.695 -17.829 483 HB2 HIS 62 2HB HIS 62 -6.792 -6.898 -17.038 484 HB3 HIS 62 3HB HIS 62 -7.117 -6.110 -18.577 485 HD1 HIS 62 HD1 HIS 62 -8.908 -7.415 -19.739 486 HD2 HIS 62 HD2 HIS 62 -6.233 -9.872 -17.775 487 HE1 HIS 62 HE1 HIS 62 -9.727 -9.764 -20.114 488 HE2 HIS 62 HE2 HIS 62 -7.984 -11.216 -19.084 489 H GLN 63 H GLN 63 -5.435 -5.246 -20.242 490 HA GLN 63 HA GLN 63 -5.363 -7.200 -22.440 491 HB2 GLN 63 2HB GLN 63 -6.381 -4.326 -22.309 492 HB3 GLN 63 3HB GLN 63 -6.547 -5.397 -23.699 493 HG2 GLN 63 2HG GLN 63 -8.028 -6.879 -22.471 494 HG3 GLN 63 3HG GLN 63 -7.733 -6.019 -20.963 495 HE21 GLN 63 1HE2 GLN 63 -7.968 -3.349 -22.124 496 HE22 GLN 63 2HE2 GLN 63 -9.644 -3.119 -22.476 497 H HIS 64 H HIS 64 -3.593 -4.557 -21.101 498 HA HIS 64 HA HIS 64 -1.450 -4.972 -23.085 499 HB2 HIS 64 2HB HIS 64 -2.288 -2.286 -21.875 500 HB3 HIS 64 3HB HIS 64 -0.769 -2.538 -22.728 501 HD1 HIS 64 HD1 HIS 64 -0.814 -2.193 -25.201 502 HD2 HIS 64 HD2 HIS 64 -4.644 -2.603 -23.635 503 HE1 HIS 64 HE1 HIS 64 -2.376 -1.672 -27.087 504 HE2 HIS 64 HE2 HIS 64 -4.665 -1.733 -26.067 505 HA PRO 65 HA PRO 65 -0.265 -6.235 -18.736 506 HB2 PRO 65 2HB PRO 65 1.728 -8.012 -19.658 507 HB3 PRO 65 3HB PRO 65 0.047 -8.453 -19.305 508 HG2 PRO 65 2HG PRO 65 1.306 -7.809 -21.945 509 HG3 PRO 65 3HG PRO 65 0.108 -9.060 -21.544 510 HD2 PRO 65 2HD PRO 65 -0.634 -6.797 -22.772 511 HD3 PRO 65 3HD PRO 65 -1.672 -7.539 -21.532 512 H GLY 66 H GLY 66 2.415 -6.162 -21.158 513 HA2 GLY 66 2HA GLY 66 4.220 -4.742 -21.382 514 HA3 GLY 66 3HA GLY 66 3.630 -3.764 -20.049 515 H GLY 67 H GLY 67 3.466 -5.930 -18.115 516 HA2 GLY 67 2HA GLY 67 4.785 -7.067 -16.597 517 HA3 GLY 67 3HA GLY 67 6.174 -6.897 -17.666 518 H SER 68 H SER 68 7.012 -4.619 -17.900 519 HA SER 68 HA SER 68 6.479 -2.747 -15.723 520 HB2 SER 68 2HB SER 68 9.254 -3.933 -16.198 521 HB3 SER 68 3HB SER 68 8.922 -2.551 -15.153 522 HG SER 68 HG SER 68 7.299 -4.378 -14.303 523 H GLY 69 H GLY 69 5.755 -1.270 -17.218 524 HA2 GLY 69 2HA GLY 69 7.316 -0.407 -19.519 525 HA3 GLY 69 3HA GLY 69 5.827 0.312 -18.913 526 H LEU 70 H LEU 70 9.087 -0.239 -17.643 527 HA LEU 70 HA LEU 70 9.059 1.965 -15.861 528 HB2 LEU 70 2HB LEU 70 11.613 1.292 -15.647 529 HB3 LEU 70 3HB LEU 70 10.350 0.267 -15.003 530 HG LEU 70 HG LEU 70 10.532 -1.213 -17.025 531 HD11 LEU 70 1HD1 LEU 70 12.486 -1.075 -18.508 532 HD12 LEU 70 2HD1 LEU 70 12.939 0.463 -17.771 533 HD13 LEU 70 3HD1 LEU 70 11.428 0.327 -18.672 534 HD21 LEU 70 1HD2 LEU 70 13.110 -0.889 -15.457 535 HD22 LEU 70 2HD2 LEU 70 12.622 -2.325 -16.362 536 HD23 LEU 70 3HD2 LEU 70 11.690 -1.814 -14.958 537 H ASP 71 H ASP 71 10.218 1.617 -19.128 538 HA ASP 71 HA ASP 71 10.757 4.514 -19.208 539 HB2 ASP 71 2HB ASP 71 12.466 2.317 -20.461 540 HB3 ASP 71 3HB ASP 71 12.540 3.991 -20.999 541 H ASP 72 H ASP 72 8.392 4.088 -19.705 542 HA ASP 72 HA ASP 72 8.102 4.550 -22.540 543 HB2 ASP 72 2HB ASP 72 7.826 2.056 -22.377 544 HB3 ASP 72 3HB ASP 72 6.485 2.299 -21.256 545 H ILE 73 H ILE 73 5.857 3.625 -19.926 546 HA ILE 73 HA ILE 73 3.945 4.494 -19.150 547 HB ILE 73 HB ILE 73 5.511 7.116 -19.103 548 HG12 ILE 73 2HG1 ILE 73 5.703 6.505 -16.562 549 HG13 ILE 73 3HG1 ILE 73 5.260 4.877 -17.045 550 HG21 ILE 73 1HG2 ILE 73 3.890 7.873 -17.374 551 HG22 ILE 73 2HG2 ILE 73 2.964 6.389 -17.601 552 HG23 ILE 73 3HG2 ILE 73 3.095 7.554 -18.918 553 HD11 ILE 73 1HD1 ILE 73 7.696 6.387 -17.989 554 HD12 ILE 73 2HD1 ILE 73 7.278 4.726 -18.414 555 HD13 ILE 73 3HD1 ILE 73 7.667 5.139 -16.744 556 HA PRO 74 HA PRO 74 2.187 5.781 -23.265 557 HB2 PRO 74 2HB PRO 74 -0.177 4.388 -22.012 558 HB3 PRO 74 3HB PRO 74 0.511 4.194 -23.639 559 HG2 PRO 74 2HG PRO 74 0.880 2.315 -21.797 560 HG3 PRO 74 3HG PRO 74 2.205 2.760 -22.901 561 HD2 PRO 74 2HD PRO 74 1.793 3.564 -20.023 562 HD3 PRO 74 3HD PRO 74 3.288 3.076 -20.857 563 HA PRO 75 HA PRO 75 0.179 9.649 -22.341 564 HB2 PRO 75 2HB PRO 75 -2.144 8.616 -24.007 565 HB3 PRO 75 3HB PRO 75 -1.326 10.197 -24.069 566 HG2 PRO 75 2HG PRO 75 -0.736 8.358 -25.883 567 HG3 PRO 75 3HG PRO 75 0.557 9.349 -25.165 568 HD2 PRO 75 2HD PRO 75 -0.135 6.481 -24.639 569 HD3 PRO 75 3HD PRO 75 1.449 7.282 -24.630 570 H TYR 76 H TYR 76 -2.260 7.000 -22.302 571 HA TYR 76 HA TYR 76 -4.120 8.120 -20.563 572 HB2 TYR 76 2HB TYR 76 -4.805 6.158 -21.735 573 HB3 TYR 76 3HB TYR 76 -3.429 5.224 -21.164 574 HD1 TYR 76 HD1 TYR 76 -3.648 3.847 -19.212 575 HD2 TYR 76 HD2 TYR 76 -6.629 6.816 -19.992 576 HE1 TYR 76 HE1 TYR 76 -4.993 2.974 -17.354 577 HE2 TYR 76 HE2 TYR 76 -7.975 5.935 -18.130 578 HH TYR 76 HH TYR 76 -8.217 3.797 -16.869 579 H ASP 77 H ASP 77 -1.190 6.298 -19.808 580 HA ASP 77 HA ASP 77 -1.727 5.898 -17.034 581 HB2 ASP 77 2HB ASP 77 0.890 5.766 -18.596 582 HB3 ASP 77 3HB ASP 77 0.695 5.221 -16.930 583 H ARG 78 H ARG 78 0.091 8.365 -18.842 584 HA ARG 78 HA ARG 78 0.995 9.917 -16.645 585 HB2 ARG 78 2HB ARG 78 0.304 10.681 -19.513 586 HB3 ARG 78 3HB ARG 78 0.871 11.874 -18.348 587 HG2 ARG 78 2HG ARG 78 2.953 10.582 -18.053 588 HG3 ARG 78 3HG ARG 78 2.404 9.424 -19.267 589 HD2 ARG 78 2HD ARG 78 2.476 11.101 -21.006 590 HD3 ARG 78 3HD ARG 78 2.741 12.393 -19.830 591 HE ARG 78 HE ARG 78 4.826 10.537 -19.593 592 HH11 ARG 78 1HH1 ARG 78 3.698 12.915 -21.939 593 HH12 ARG 78 2HH1 ARG 78 5.286 13.203 -22.581 594 HH21 ARG 78 1HH2 ARG 78 6.893 10.941 -20.417 595 HH22 ARG 78 2HH2 ARG 78 7.105 12.081 -21.719 596 H ASP 79 H ASP 79 -1.960 10.194 -18.640 597 HA ASP 79 HA ASP 79 -3.137 12.366 -17.295 598 HB2 ASP 79 2HB ASP 79 -4.350 10.178 -19.039 599 HB3 ASP 79 3HB ASP 79 -5.314 11.509 -18.410 600 H PHE 80 H PHE 80 -3.210 8.936 -16.659 601 HA PHE 80 HA PHE 80 -5.415 8.789 -14.874 602 HB2 PHE 80 2HB PHE 80 -4.464 6.761 -15.974 603 HB3 PHE 80 3HB PHE 80 -2.954 6.961 -15.091 604 HD1 PHE 80 HD1 PHE 80 -6.581 6.250 -14.699 605 HD2 PHE 80 HD2 PHE 80 -2.728 6.070 -12.854 606 HE1 PHE 80 HE1 PHE 80 -7.517 4.942 -12.852 607 HE2 PHE 80 HE2 PHE 80 -3.682 4.756 -11.005 608 HZ PHE 80 HZ PHE 80 -6.081 4.198 -11.005 609 H CYS 81 H CYS 81 -1.945 9.257 -14.450 610 HA CYS 81 HA CYS 81 -1.984 9.458 -11.585 611 HB2 CYS 81 2HB CYS 81 0.132 10.253 -13.630 612 HB3 CYS 81 3HB CYS 81 0.389 10.107 -11.888 613 HG CYS 81 HG CYS 81 -0.758 7.412 -13.609 614 H LYS 82 H LYS 82 -2.403 11.689 -14.262 615 HA LYS 82 HA LYS 82 -2.015 14.108 -12.697 616 HB2 LYS 82 2HB LYS 82 -3.021 13.671 -15.539 617 HB3 LYS 82 3HB LYS 82 -2.835 15.259 -14.801 618 HG2 LYS 82 2HG LYS 82 -0.396 14.812 -14.520 619 HG3 LYS 82 3HG LYS 82 -0.616 13.266 -15.345 620 HD2 LYS 82 2HD LYS 82 0.235 14.942 -16.919 621 HD3 LYS 82 3HD LYS 82 -1.400 14.466 -17.376 622 HE2 LYS 82 2HE LYS 82 -2.304 16.510 -16.376 623 HE3 LYS 82 3HE LYS 82 -0.698 16.973 -15.807 624 HZ1 LYS 82 1HZ LYS 82 -1.537 16.719 -18.640 625 HZ2 LYS 82 2HZ LYS 82 0.016 17.112 -18.113 626 HZ3 LYS 82 3HZ LYS 82 -1.270 18.159 -17.798 627 H VAL 83 H VAL 83 -3.567 13.348 -11.078 628 HA VAL 83 HA VAL 83 -6.314 14.310 -11.651 629 HB VAL 83 HB VAL 83 -7.170 12.747 -9.897 630 HG11 VAL 83 1HG1 VAL 83 -7.064 10.661 -11.220 631 HG12 VAL 83 2HG1 VAL 83 -5.759 11.339 -12.192 632 HG13 VAL 83 3HG1 VAL 83 -7.367 12.068 -12.236 633 HG21 VAL 83 1HG2 VAL 83 -4.379 11.523 -9.921 634 HG22 VAL 83 2HG2 VAL 83 -5.782 10.856 -9.082 635 HG23 VAL 83 3HG2 VAL 83 -5.114 12.409 -8.581 636 H ASP 84 H ASP 84 -7.376 14.934 -9.475 637 HA ASP 84 HA ASP 84 -5.907 17.191 -8.561 638 HB2 ASP 84 2HB ASP 84 -8.428 17.036 -8.936 639 HB3 ASP 84 3HB ASP 84 -8.531 16.102 -7.448 640 H GLN 85 H GLN 85 -5.628 17.734 -6.199 641 HA GLN 85 HA GLN 85 -3.739 16.050 -5.082 642 HB2 GLN 85 2HB GLN 85 -3.747 18.472 -4.665 643 HB3 GLN 85 3HB GLN 85 -5.238 18.341 -3.741 644 HG2 GLN 85 2HG GLN 85 -3.314 18.616 -2.250 645 HG3 GLN 85 3HG GLN 85 -4.069 17.045 -2.009 646 HE21 GLN 85 1HE2 GLN 85 -2.204 16.196 -1.078 647 HE22 GLN 85 2HE2 GLN 85 -0.808 15.797 -2.001 648 HA PRO 86 HA PRO 86 -6.914 14.431 -1.695 649 HB2 PRO 86 2HB PRO 86 -9.612 14.565 -2.326 650 HB3 PRO 86 3HB PRO 86 -8.772 15.790 -1.354 651 HG2 PRO 86 2HG PRO 86 -9.409 15.853 -4.293 652 HG3 PRO 86 3HG PRO 86 -9.614 17.134 -3.075 653 HD2 PRO 86 2HD PRO 86 -7.512 17.144 -4.743 654 HD3 PRO 86 3HD PRO 86 -7.329 17.655 -3.046 655 H THR 87 H THR 87 -7.789 14.288 -5.142 656 HA THR 87 HA THR 87 -8.970 11.742 -5.235 657 HB THR 87 HB THR 87 -7.460 13.091 -7.514 658 HG1 THR 87 HG1 THR 87 -10.206 13.484 -6.913 659 HG21 THR 87 1HG2 THR 87 -9.116 11.972 -8.962 660 HG22 THR 87 2HG2 THR 87 -9.871 11.229 -7.552 661 HG23 THR 87 3HG2 THR 87 -8.224 10.782 -8.009 662 H LEU 88 H LEU 88 -5.612 12.764 -5.477 663 HA LEU 88 HA LEU 88 -4.325 10.402 -6.238 664 HB2 LEU 88 2HB LEU 88 -3.461 12.684 -4.422 665 HB3 LEU 88 3HB LEU 88 -2.364 11.393 -4.884 666 HG LEU 88 HG LEU 88 -3.754 13.157 -6.941 667 HD11 LEU 88 1HD1 LEU 88 -0.983 13.562 -5.769 668 HD12 LEU 88 2HD1 LEU 88 -2.385 14.608 -5.527 669 HD13 LEU 88 3HD1 LEU 88 -1.678 14.448 -7.132 670 HD21 LEU 88 1HD2 LEU 88 -1.330 11.336 -7.160 671 HD22 LEU 88 2HD2 LEU 88 -1.998 12.331 -8.454 672 HD23 LEU 88 3HD2 LEU 88 -2.946 11.003 -7.793 673 H PHE 89 H PHE 89 -5.174 11.580 -2.977 674 HA PHE 89 HA PHE 89 -4.241 9.284 -1.555 675 HB2 PHE 89 2HB PHE 89 -6.233 11.421 -0.693 676 HB3 PHE 89 3HB PHE 89 -5.496 10.234 0.380 677 HD1 PHE 89 HD1 PHE 89 -5.171 13.515 -0.995 678 HD2 PHE 89 HD2 PHE 89 -2.885 10.219 0.489 679 HE1 PHE 89 HE1 PHE 89 -3.267 15.013 -0.593 680 HE2 PHE 89 HE2 PHE 89 -0.994 11.726 0.889 681 HZ PHE 89 HZ PHE 89 -1.177 14.124 0.348 682 H GLU 90 H GLU 90 -7.325 10.134 -3.038 683 HA GLU 90 HA GLU 90 -8.956 8.112 -1.918 684 HB2 GLU 90 2HB GLU 90 -9.132 9.368 -4.690 685 HB3 GLU 90 3HB GLU 90 -10.412 8.451 -3.911 686 HG2 GLU 90 2HG GLU 90 -9.290 11.065 -2.888 687 HG3 GLU 90 3HG GLU 90 -10.756 10.911 -3.844 688 H LEU 91 H LEU 91 -6.838 8.158 -4.767 689 HA LEU 91 HA LEU 91 -7.327 5.500 -5.673 690 HB2 LEU 91 2HB LEU 91 -4.940 7.337 -6.122 691 HB3 LEU 91 3HB LEU 91 -5.184 5.820 -6.970 692 HG LEU 91 HG LEU 91 -7.014 8.251 -7.184 693 HD11 LEU 91 1HD1 LEU 91 -5.005 7.190 -9.204 694 HD12 LEU 91 2HD1 LEU 91 -4.825 8.656 -8.239 695 HD13 LEU 91 3HD1 LEU 91 -6.107 8.551 -9.441 696 HD21 LEU 91 1HD2 LEU 91 -7.094 5.639 -8.729 697 HD22 LEU 91 2HD2 LEU 91 -8.117 7.049 -9.019 698 HD23 LEU 91 3HD2 LEU 91 -8.254 6.160 -7.504 699 H ILE 92 H ILE 92 -5.011 6.909 -3.375 700 HA ILE 92 HA ILE 92 -3.433 4.590 -2.886 701 HB ILE 92 HB ILE 92 -3.940 7.040 -1.114 702 HG12 ILE 92 2HG1 ILE 92 -1.550 6.334 -2.888 703 HG13 ILE 92 3HG1 ILE 92 -2.789 7.516 -3.277 704 HG21 ILE 92 1HG2 ILE 92 -3.234 5.171 0.328 705 HG22 ILE 92 2HG2 ILE 92 -1.948 6.370 0.207 706 HG23 ILE 92 3HG2 ILE 92 -1.841 4.870 -0.713 707 HD11 ILE 92 1HD1 ILE 92 -0.801 7.706 -1.017 708 HD12 ILE 92 2HD1 ILE 92 -2.077 8.877 -1.361 709 HD13 ILE 92 3HD1 ILE 92 -0.784 8.614 -2.531 710 H LEU 93 H LEU 93 -6.357 5.904 -1.323 711 HA LEU 93 HA LEU 93 -6.547 4.024 0.806 712 HB2 LEU 93 2HB LEU 93 -8.625 5.870 -0.445 713 HB3 LEU 93 3HB LEU 93 -8.963 4.875 0.960 714 HG LEU 93 HG LEU 93 -6.894 7.115 0.852 715 HD11 LEU 93 1HD1 LEU 93 -8.400 8.356 2.344 716 HD12 LEU 93 2HD1 LEU 93 -9.589 7.055 2.256 717 HD13 LEU 93 3HD1 LEU 93 -9.190 7.985 0.809 718 HD21 LEU 93 1HD2 LEU 93 -7.745 5.406 3.217 719 HD22 LEU 93 2HD2 LEU 93 -6.657 6.795 3.281 720 HD23 LEU 93 3HD2 LEU 93 -6.183 5.351 2.395 721 H ALA 94 H ALA 94 -7.973 4.178 -2.440 722 HA ALA 94 HA ALA 94 -9.642 1.863 -2.228 723 HB1 ALA 94 1HB ALA 94 -8.572 3.263 -4.708 724 HB2 ALA 94 2HB ALA 94 -10.068 3.656 -3.860 725 HB3 ALA 94 3HB ALA 94 -9.901 2.097 -4.665 726 H ALA 95 H ALA 95 -6.352 2.429 -3.411 727 HA ALA 95 HA ALA 95 -5.902 -0.193 -4.475 728 HB1 ALA 95 1HB ALA 95 -4.643 1.772 -5.244 729 HB2 ALA 95 2HB ALA 95 -3.568 0.494 -4.678 730 HB3 ALA 95 3HB ALA 95 -3.874 1.910 -3.662 731 H ASN 96 H ASN 96 -5.454 1.282 -1.296 732 HA ASN 96 HA ASN 96 -4.059 -0.995 -0.149 733 HB2 ASN 96 2HB ASN 96 -3.778 1.323 0.755 734 HB3 ASN 96 3HB ASN 96 -5.476 1.352 1.223 735 HD21 ASN 96 1HD2 ASN 96 -4.749 1.782 3.390 736 HD22 ASN 96 2HD2 ASN 96 -4.171 0.515 4.400 737 H TYR 97 H TYR 97 -7.393 0.163 -0.347 738 HA TYR 97 HA TYR 97 -8.630 -1.641 1.454 739 HB2 TYR 97 2HB TYR 97 -9.733 0.417 0.785 740 HB3 TYR 97 3HB TYR 97 -9.702 -0.041 -0.912 741 HD1 TYR 97 HD1 TYR 97 -11.812 -0.610 -1.772 742 HD2 TYR 97 HD2 TYR 97 -10.977 -1.540 2.319 743 HE1 TYR 97 HE1 TYR 97 -14.084 -1.512 -1.513 744 HE2 TYR 97 HE2 TYR 97 -13.241 -2.444 2.567 745 HH TYR 97 HH TYR 97 -15.207 -3.275 0.186 746 H LEU 98 H LEU 98 -8.106 -1.806 -2.061 747 HA LEU 98 HA LEU 98 -9.308 -4.478 -2.255 748 HB2 LEU 98 2HB LEU 98 -8.298 -2.559 -4.388 749 HB3 LEU 98 3HB LEU 98 -9.043 -4.113 -4.723 750 HG LEU 98 HG LEU 98 -10.422 -1.727 -3.422 751 HD11 LEU 98 1HD1 LEU 98 -10.785 -2.916 -6.194 752 HD12 LEU 98 2HD1 LEU 98 -10.031 -1.368 -5.808 753 HD13 LEU 98 3HD1 LEU 98 -11.747 -1.609 -5.498 754 HD21 LEU 98 1HD2 LEU 98 -12.504 -3.060 -3.573 755 HD22 LEU 98 2HD2 LEU 98 -11.320 -3.807 -2.503 756 HD23 LEU 98 3HD2 LEU 98 -11.568 -4.453 -4.127 757 H ASP 99 H ASP 99 -6.283 -3.192 -1.636 758 HA ASP 99 HA ASP 99 -4.120 -3.686 -1.947 759 HB2 ASP 99 2HB ASP 99 -4.765 -5.502 -0.380 760 HB3 ASP 99 3HB ASP 99 -5.098 -6.562 -1.746 761 H ILE 100 H ILE 100 -4.536 -2.789 -4.103 762 HA ILE 100 HA ILE 100 -3.492 -4.616 -6.195 763 HB ILE 100 HB ILE 100 -4.935 -1.956 -6.711 764 HG12 ILE 100 2HG1 ILE 100 -6.076 -4.781 -6.898 765 HG13 ILE 100 3HG1 ILE 100 -6.521 -3.579 -5.697 766 HG21 ILE 100 1HG2 ILE 100 -4.178 -4.228 -8.604 767 HG22 ILE 100 2HG2 ILE 100 -3.358 -2.670 -8.491 768 HG23 ILE 100 3HG2 ILE 100 -5.025 -2.747 -9.060 769 HD11 ILE 100 1HD1 ILE 100 -8.207 -3.765 -7.399 770 HD12 ILE 100 2HD1 ILE 100 -7.031 -3.394 -8.660 771 HD13 ILE 100 3HD1 ILE 100 -7.456 -2.172 -7.460 772 H LYS 101 H LYS 101 -1.378 -4.367 -5.542 773 HA LYS 101 HA LYS 101 -0.040 -1.946 -4.990 774 HB2 LYS 101 2HB LYS 101 1.077 -4.621 -5.927 775 HB3 LYS 101 3HB LYS 101 2.040 -3.292 -5.282 776 HG2 LYS 101 2HG LYS 101 0.922 -3.438 -3.129 777 HG3 LYS 101 3HG LYS 101 -0.184 -4.669 -3.746 778 HD2 LYS 101 2HD LYS 101 1.744 -6.208 -4.094 779 HD3 LYS 101 3HD LYS 101 2.831 -4.983 -3.427 780 HE2 LYS 101 2HE LYS 101 1.592 -5.089 -1.269 781 HE3 LYS 101 3HE LYS 101 0.548 -6.348 -1.947 782 HZ1 LYS 101 1HZ LYS 101 2.276 -7.331 -0.638 783 HZ2 LYS 101 2HZ LYS 101 3.482 -6.532 -1.509 784 HZ3 LYS 101 3HZ LYS 101 2.553 -7.730 -2.255 785 HA PRO 102 HA PRO 102 1.082 -1.958 -9.939 786 HB2 PRO 102 2HB PRO 102 -1.763 -2.809 -10.588 787 HB3 PRO 102 3HB PRO 102 -0.292 -2.973 -11.576 788 HG2 PRO 102 2HG PRO 102 -1.221 -5.086 -10.291 789 HG3 PRO 102 3HG PRO 102 0.531 -4.763 -10.303 790 HD2 PRO 102 2HD PRO 102 -1.458 -4.345 -8.088 791 HD3 PRO 102 3HD PRO 102 0.242 -4.861 -7.997 792 H LEU 103 H LEU 103 -2.036 -1.268 -8.353 793 HA LEU 103 HA LEU 103 -2.428 1.294 -9.662 794 HB2 LEU 103 2HB LEU 103 -4.206 -0.399 -8.634 795 HB3 LEU 103 3HB LEU 103 -3.859 0.409 -7.123 796 HG LEU 103 HG LEU 103 -5.926 1.253 -8.189 797 HD11 LEU 103 1HD1 LEU 103 -4.747 2.839 -6.759 798 HD12 LEU 103 2HD1 LEU 103 -5.537 3.675 -8.095 799 HD13 LEU 103 3HD1 LEU 103 -3.790 3.408 -8.131 800 HD21 LEU 103 1HD2 LEU 103 -4.167 2.185 -10.476 801 HD22 LEU 103 2HD2 LEU 103 -5.900 2.472 -10.297 802 HD23 LEU 103 3HD2 LEU 103 -5.302 0.832 -10.528 803 H LEU 104 H LEU 104 -1.494 0.129 -6.431 804 HA LEU 104 HA LEU 104 -1.496 2.551 -5.039 805 HB2 LEU 104 2HB LEU 104 -1.590 0.331 -3.956 806 HB3 LEU 104 3HB LEU 104 0.054 -0.006 -4.466 807 HG LEU 104 HG LEU 104 0.854 1.874 -2.981 808 HD11 LEU 104 1HD1 LEU 104 -1.174 3.238 -2.904 809 HD12 LEU 104 2HD1 LEU 104 -0.653 2.805 -1.278 810 HD13 LEU 104 3HD1 LEU 104 -2.023 1.970 -2.013 811 HD21 LEU 104 1HD2 LEU 104 0.596 0.653 -0.862 812 HD22 LEU 104 2HD2 LEU 104 0.928 -0.453 -2.193 813 HD23 LEU 104 3HD2 LEU 104 -0.714 -0.309 -1.558 814 H ASP 105 H ASP 105 1.197 0.737 -6.466 815 HA ASP 105 HA ASP 105 3.289 2.369 -5.520 816 HB2 ASP 105 2HB ASP 105 3.528 -0.027 -6.250 817 HB3 ASP 105 3HB ASP 105 3.347 0.484 -7.930 818 H VAL 106 H VAL 106 1.515 2.325 -8.586 819 HA VAL 106 HA VAL 106 3.014 4.260 -10.000 820 HB VAL 106 HB VAL 106 0.138 3.293 -10.259 821 HG11 VAL 106 1HG1 VAL 106 -0.005 4.392 -12.469 822 HG12 VAL 106 2HG1 VAL 106 1.539 5.198 -12.175 823 HG13 VAL 106 3HG1 VAL 106 0.139 5.572 -11.166 824 HG21 VAL 106 1HG2 VAL 106 1.880 1.652 -10.801 825 HG22 VAL 106 2HG2 VAL 106 2.606 2.773 -11.956 826 HG23 VAL 106 3HG2 VAL 106 0.995 2.117 -12.255 827 H THR 107 H THR 107 0.087 4.575 -7.963 828 HA THR 107 HA THR 107 -0.130 7.410 -8.148 829 HB THR 107 HB THR 107 -1.204 5.610 -5.928 830 HG1 THR 107 HG1 THR 107 -2.226 4.771 -7.613 831 HG21 THR 107 1HG2 THR 107 -2.197 8.298 -6.963 832 HG22 THR 107 2HG2 THR 107 -1.389 8.037 -5.417 833 HG23 THR 107 3HG2 THR 107 -2.975 7.325 -5.712 834 H CYS 108 H CYS 108 1.691 5.260 -6.055 835 HA CYS 108 HA CYS 108 2.473 7.157 -4.067 836 HB2 CYS 108 2HB CYS 108 3.627 4.451 -4.845 837 HB3 CYS 108 3HB CYS 108 4.242 5.410 -3.500 838 HG CYS 108 HG CYS 108 0.930 4.726 -3.507 839 H LYS 109 H LYS 109 3.825 6.121 -7.185 840 HA LYS 109 HA LYS 109 6.278 7.591 -7.000 841 HB2 LYS 109 2HB LYS 109 4.862 6.045 -9.130 842 HB3 LYS 109 3HB LYS 109 5.814 7.388 -9.748 843 HG2 LYS 109 2HG LYS 109 7.123 5.354 -9.799 844 HG3 LYS 109 3HG LYS 109 7.825 6.477 -8.634 845 HD2 LYS 109 2HD LYS 109 6.731 5.201 -6.791 846 HD3 LYS 109 3HD LYS 109 6.084 4.069 -7.982 847 HE2 LYS 109 2HE LYS 109 8.428 3.495 -8.647 848 HE3 LYS 109 3HE LYS 109 9.014 4.560 -7.363 849 HZ1 LYS 109 1HZ LYS 109 7.887 3.171 -5.747 850 HZ2 LYS 109 2HZ LYS 109 8.954 2.244 -6.668 851 HZ3 LYS 109 3HZ LYS 109 7.293 2.171 -6.972 852 H THR 110 H THR 110 3.046 8.306 -8.242 853 HA THR 110 HA THR 110 3.559 10.762 -9.502 854 HB THR 110 HB THR 110 0.980 9.918 -8.105 855 HG1 THR 110 HG1 THR 110 0.927 8.449 -9.609 856 HG21 THR 110 1HG2 THR 110 0.971 12.312 -8.769 857 HG22 THR 110 2HG2 THR 110 -0.138 11.373 -9.769 858 HG23 THR 110 3HG2 THR 110 1.430 11.858 -10.412 859 H VAL 111 H VAL 111 2.356 10.103 -6.193 860 HA VAL 111 HA VAL 111 2.288 12.820 -5.361 861 HB VAL 111 HB VAL 111 1.916 11.965 -3.065 862 HG11 VAL 111 1HG1 VAL 111 -0.205 10.772 -3.470 863 HG12 VAL 111 2HG1 VAL 111 0.270 10.466 -5.143 864 HG13 VAL 111 3HG1 VAL 111 -0.007 12.121 -4.593 865 HG21 VAL 111 1HG2 VAL 111 3.425 10.030 -3.048 866 HG22 VAL 111 2HG2 VAL 111 2.412 9.194 -4.227 867 HG23 VAL 111 3HG2 VAL 111 1.790 9.528 -2.608 868 H ALA 112 H ALA 112 4.758 10.306 -5.198 869 HA ALA 112 HA ALA 112 6.627 11.632 -3.522 870 HB1 ALA 112 1HB ALA 112 6.765 9.230 -3.984 871 HB2 ALA 112 2HB ALA 112 8.272 10.036 -4.420 872 HB3 ALA 112 3HB ALA 112 7.129 9.555 -5.680 873 H ASN 113 H ASN 113 6.083 11.628 -7.037 874 HA ASN 113 HA ASN 113 8.397 13.127 -7.770 875 HB2 ASN 113 2HB ASN 113 5.821 12.468 -9.254 876 HB3 ASN 113 3HB ASN 113 7.044 13.514 -9.973 877 HD21 ASN 113 1HD2 ASN 113 6.084 10.856 -10.813 878 HD22 ASN 113 2HD2 ASN 113 7.483 9.850 -10.897 879 H MET 114 H MET 114 5.238 14.083 -6.632 880 HA MET 114 HA MET 114 5.333 16.830 -7.444 881 HB2 MET 114 2HB MET 114 3.814 15.604 -5.100 882 HB3 MET 114 3HB MET 114 3.537 17.203 -5.777 883 HG2 MET 114 2HG MET 114 2.917 16.067 -7.951 884 HG3 MET 114 3HG MET 114 2.969 14.535 -7.074 885 HE1 MET 114 1HE MET 114 0.173 15.382 -4.270 886 HE2 MET 114 2HE MET 114 1.852 15.902 -4.142 887 HE3 MET 114 3HE MET 114 1.474 14.267 -4.680 888 H ILE 115 H ILE 115 6.148 15.153 -4.403 889 HA ILE 115 HA ILE 115 7.139 17.584 -3.121 890 HB ILE 115 HB ILE 115 7.520 16.173 -1.136 891 HG12 ILE 115 2HG1 ILE 115 6.622 13.782 -2.827 892 HG13 ILE 115 3HG1 ILE 115 8.291 14.109 -2.384 893 HG21 ILE 115 1HG2 ILE 115 5.246 17.049 -1.518 894 HG22 ILE 115 2HG2 ILE 115 5.186 15.489 -0.697 895 HG23 ILE 115 3HG2 ILE 115 4.822 15.591 -2.421 896 HD11 ILE 115 1HD1 ILE 115 6.067 13.533 -0.438 897 HD12 ILE 115 2HD1 ILE 115 7.771 13.777 -0.052 898 HD13 ILE 115 3HD1 ILE 115 7.276 12.380 -1.004 899 H ARG 116 H ARG 116 8.448 15.474 -5.283 900 HA ARG 116 HA ARG 116 10.987 14.760 -4.315 901 HB2 ARG 116 2HB ARG 116 9.819 13.690 -6.213 902 HB3 ARG 116 3HB ARG 116 9.990 15.156 -7.158 903 HG2 ARG 116 2HG ARG 116 12.426 14.837 -7.255 904 HG3 ARG 116 3HG ARG 116 12.291 13.398 -6.236 905 HD2 ARG 116 2HD ARG 116 10.905 12.296 -7.952 906 HD3 ARG 116 3HD ARG 116 10.993 13.740 -8.965 907 HE ARG 116 HE ARG 116 13.611 12.907 -8.454 908 HH11 ARG 116 1HH1 ARG 116 10.767 11.722 -10.164 909 HH12 ARG 116 2HH1 ARG 116 11.689 10.830 -11.334 910 HH21 ARG 116 1HH2 ARG 116 14.816 11.743 -10.003 911 HH22 ARG 116 2HH2 ARG 116 13.994 10.841 -11.242 912 H GLY 117 H GLY 117 12.043 16.498 -3.412 913 HA2 GLY 117 2HA GLY 117 13.010 18.660 -5.218 914 HA3 GLY 117 3HA GLY 117 12.945 18.737 -3.461 915 H1 SER 2 1H SER 2 15.947 -15.084 14.873 916 H2 SER 2 2H SER 2 16.352 -14.378 16.352 917 H3 SER 2 3H SER 2 16.877 -15.943 15.989 918 HA SER 2 HA SER 2 18.667 -14.382 15.763 919 HB2 SER 2 2HB SER 2 17.703 -15.473 13.082 920 HB3 SER 2 3HB SER 2 19.375 -15.081 13.508 921 HG SER 2 HG SER 2 19.444 -17.083 14.144 922 H LEU 3 H LEU 3 19.375 -12.365 15.171 923 HA LEU 3 HA LEU 3 17.418 -10.396 14.383 924 HB2 LEU 3 2HB LEU 3 20.422 -10.109 14.793 925 HB3 LEU 3 3HB LEU 3 19.279 -8.780 14.661 926 HG LEU 3 HG LEU 3 19.264 -10.830 16.914 927 HD11 LEU 3 1HD1 LEU 3 20.219 -9.068 18.329 928 HD12 LEU 3 2HD1 LEU 3 20.372 -8.005 16.928 929 HD13 LEU 3 3HD1 LEU 3 21.306 -9.502 17.010 930 HD21 LEU 3 1HD2 LEU 3 17.052 -9.864 16.541 931 HD22 LEU 3 2HD2 LEU 3 17.721 -8.231 16.616 932 HD23 LEU 3 3HD2 LEU 3 17.739 -9.262 18.048 933 H VAL 4 H VAL 4 16.870 -10.135 12.268 934 HA VAL 4 HA VAL 4 18.754 -10.561 10.092 935 HB VAL 4 HB VAL 4 16.908 -9.830 8.578 936 HG11 VAL 4 1HG1 VAL 4 17.109 -12.203 9.197 937 HG12 VAL 4 2HG1 VAL 4 15.417 -11.765 8.968 938 HG13 VAL 4 3HG1 VAL 4 16.067 -11.948 10.599 939 HG21 VAL 4 1HG2 VAL 4 15.774 -8.198 10.034 940 HG22 VAL 4 2HG2 VAL 4 15.257 -9.493 11.116 941 HG23 VAL 4 3HG2 VAL 4 14.631 -9.418 9.467 942 H LYS 5 H LYS 5 19.985 -9.060 9.208 943 HA LYS 5 HA LYS 5 20.150 -6.446 10.510 944 HB2 LYS 5 2HB LYS 5 22.087 -7.844 8.620 945 HB3 LYS 5 3HB LYS 5 22.408 -6.372 9.524 946 HG2 LYS 5 2HG LYS 5 22.100 -7.688 11.655 947 HG3 LYS 5 3HG LYS 5 21.977 -9.149 10.669 948 HD2 LYS 5 2HD LYS 5 24.266 -8.708 9.772 949 HD3 LYS 5 3HD LYS 5 24.376 -7.284 10.813 950 HE2 LYS 5 2HE LYS 5 24.075 -8.783 12.802 951 HE3 LYS 5 3HE LYS 5 24.134 -10.172 11.714 952 HZ1 LYS 5 1HZ LYS 5 26.300 -8.167 12.006 953 HZ2 LYS 5 2HZ LYS 5 26.359 -9.577 11.077 954 HZ3 LYS 5 3HZ LYS 5 26.280 -9.679 12.765 955 H LEU 6 H LEU 6 18.439 -5.407 9.522 956 HA LEU 6 HA LEU 6 18.238 -5.116 6.638 957 HB2 LEU 6 2HB LEU 6 16.685 -3.773 8.887 958 HB3 LEU 6 3HB LEU 6 16.284 -3.680 7.178 959 HG LEU 6 HG LEU 6 16.219 -6.202 8.881 960 HD11 LEU 6 1HD1 LEU 6 13.794 -6.093 8.608 961 HD12 LEU 6 2HD1 LEU 6 13.943 -4.570 7.725 962 HD13 LEU 6 3HD1 LEU 6 14.411 -4.659 9.425 963 HD21 LEU 6 1HD2 LEU 6 16.848 -6.768 6.587 964 HD22 LEU 6 2HD2 LEU 6 15.477 -5.856 5.953 965 HD23 LEU 6 3HD2 LEU 6 15.204 -7.308 6.920 966 H GLU 7 H GLU 7 20.066 -4.063 5.981 967 HA GLU 7 HA GLU 7 20.964 -1.566 7.146 968 HB2 GLU 7 2HB GLU 7 22.557 -3.168 6.102 969 HB3 GLU 7 3HB GLU 7 21.754 -2.960 4.544 970 HG2 GLU 7 2HG GLU 7 22.365 -0.514 4.628 971 HG3 GLU 7 3HG GLU 7 23.301 -0.840 6.087 972 H SER 8 H SER 8 20.388 0.443 6.465 973 HA SER 8 HA SER 8 18.227 0.811 4.538 974 HB2 SER 8 2HB SER 8 18.346 3.188 5.410 975 HB3 SER 8 3HB SER 8 18.103 1.980 6.670 976 HG SER 8 HG SER 8 20.053 2.336 7.433 977 H SER 9 H SER 9 18.462 2.863 3.125 978 HA SER 9 HA SER 9 20.618 2.648 1.284 979 HB2 SER 9 2HB SER 9 19.555 4.698 0.256 980 HB3 SER 9 3HB SER 9 18.419 3.388 0.543 981 HG SER 9 HG SER 9 17.503 5.290 1.265 982 H ASP 10 H ASP 10 20.120 4.504 4.172 983 HA ASP 10 HA ASP 10 22.392 6.301 3.832 984 HB2 ASP 10 2HB ASP 10 20.298 6.942 5.052 985 HB3 ASP 10 3HB ASP 10 20.632 5.703 6.249 986 H GLU 11 H GLU 11 22.212 3.094 4.305 987 HA GLU 11 HA GLU 11 23.674 1.458 4.733 988 HB2 GLU 11 2HB GLU 11 25.684 3.699 5.187 989 HB3 GLU 11 3HB GLU 11 26.096 1.992 5.060 990 HG2 GLU 11 2HG GLU 11 25.187 1.975 2.732 991 HG3 GLU 11 3HG GLU 11 24.865 3.703 2.880 992 H LYS 12 H LYS 12 22.132 2.877 6.964 993 HA LYS 12 HA LYS 12 23.642 2.058 9.334 994 HB2 LYS 12 2HB LYS 12 20.832 3.204 9.054 995 HB3 LYS 12 3HB LYS 12 21.609 2.835 10.588 996 HG2 LYS 12 2HG LYS 12 22.586 4.869 8.567 997 HG3 LYS 12 3HG LYS 12 21.722 5.234 10.061 998 HD2 LYS 12 2HD LYS 12 23.580 4.340 11.394 999 HD3 LYS 12 3HD LYS 12 24.437 3.862 9.926 1000 HE2 LYS 12 2HE LYS 12 23.782 6.709 10.763 1001 HE3 LYS 12 3HE LYS 12 25.366 5.937 10.836 1002 HZ1 LYS 12 1HZ LYS 12 25.154 7.334 8.887 1003 HZ2 LYS 12 2HZ LYS 12 23.814 6.454 8.361 1004 HZ3 LYS 12 3HZ LYS 12 25.329 5.712 8.433 1005 H VAL 13 H VAL 13 23.554 0.082 10.122 1006 HA VAL 13 HA VAL 13 21.769 -1.928 8.970 1007 HB VAL 13 HB VAL 13 24.145 -2.251 10.877 1008 HG11 VAL 13 1HG1 VAL 13 22.647 -4.195 10.934 1009 HG12 VAL 13 2HG1 VAL 13 24.172 -4.609 10.151 1010 HG13 VAL 13 3HG1 VAL 13 22.728 -4.335 9.174 1011 HG21 VAL 13 1HG2 VAL 13 24.844 -1.192 8.765 1012 HG22 VAL 13 2HG2 VAL 13 24.095 -2.497 7.843 1013 HG23 VAL 13 3HG2 VAL 13 25.480 -2.833 8.884 1014 H PHE 14 H PHE 14 19.825 -1.986 9.967 1015 HA PHE 14 HA PHE 14 19.555 -1.752 12.888 1016 HB2 PHE 14 2HB PHE 14 17.451 -1.920 10.669 1017 HB3 PHE 14 3HB PHE 14 17.097 -1.708 12.381 1018 HD1 PHE 14 HD1 PHE 14 17.648 0.441 13.527 1019 HD2 PHE 14 HD2 PHE 14 18.247 -0.040 9.317 1020 HE1 PHE 14 HE1 PHE 14 17.834 2.879 13.265 1021 HE2 PHE 14 HE2 PHE 14 18.428 2.397 9.068 1022 HZ PHE 14 HZ PHE 14 18.228 3.856 11.041 1023 H GLU 15 H GLU 15 20.111 -3.624 13.823 1024 HA GLU 15 HA GLU 15 19.570 -6.238 12.664 1025 HB2 GLU 15 2HB GLU 15 20.788 -5.546 15.375 1026 HB3 GLU 15 3HB GLU 15 20.846 -7.110 14.565 1027 HG2 GLU 15 2HG GLU 15 22.246 -6.133 12.771 1028 HG3 GLU 15 3HG GLU 15 22.171 -4.564 13.573 1029 H ILE 16 H ILE 16 17.249 -5.973 12.669 1030 HA ILE 16 HA ILE 16 15.825 -5.971 15.258 1031 HB ILE 16 HB ILE 16 15.007 -4.475 13.435 1032 HG12 ILE 16 2HG1 ILE 16 13.035 -6.707 14.116 1033 HG13 ILE 16 3HG1 ILE 16 13.381 -5.304 15.116 1034 HG21 ILE 16 1HG2 ILE 16 13.969 -5.367 11.390 1035 HG22 ILE 16 2HG2 ILE 16 14.407 -7.006 11.875 1036 HG23 ILE 16 3HG2 ILE 16 15.671 -5.836 11.494 1037 HD11 ILE 16 1HD1 ILE 16 11.292 -5.025 13.979 1038 HD12 ILE 16 2HD1 ILE 16 12.054 -5.284 12.411 1039 HD13 ILE 16 3HD1 ILE 16 12.453 -3.853 13.365 1040 H GLU 17 H GLU 17 14.361 -7.642 15.799 1041 HA GLU 17 HA GLU 17 15.332 -10.260 15.383 1042 HB2 GLU 17 2HB GLU 17 13.732 -8.998 17.290 1043 HB3 GLU 17 3HB GLU 17 12.561 -10.024 16.483 1044 HG2 GLU 17 2HG GLU 17 15.136 -10.940 17.791 1045 HG3 GLU 17 3HG GLU 17 13.521 -11.095 18.459 1046 H LYS 18 H LYS 18 14.598 -11.934 14.108 1047 HA LYS 18 HA LYS 18 13.465 -11.344 11.616 1048 HB2 LYS 18 2HB LYS 18 14.934 -13.303 11.986 1049 HB3 LYS 18 3HB LYS 18 13.687 -14.070 12.967 1050 HG2 LYS 18 2HG LYS 18 12.179 -14.014 10.916 1051 HG3 LYS 18 3HG LYS 18 13.585 -13.493 9.981 1052 HD2 LYS 18 2HD LYS 18 14.746 -15.591 10.464 1053 HD3 LYS 18 3HD LYS 18 13.466 -16.080 11.581 1054 HE2 LYS 18 2HE LYS 18 11.857 -16.084 9.666 1055 HE3 LYS 18 3HE LYS 18 13.202 -15.735 8.579 1056 HZ1 LYS 18 1HZ LYS 18 12.697 -18.077 8.609 1057 HZ2 LYS 18 2HZ LYS 18 12.930 -18.152 10.281 1058 HZ3 LYS 18 3HZ LYS 18 14.233 -17.816 9.258 1059 H GLU 19 H GLU 19 12.002 -12.640 14.575 1060 HA GLU 19 HA GLU 19 9.490 -13.458 13.691 1061 HB2 GLU 19 2HB GLU 19 10.311 -13.914 15.946 1062 HB3 GLU 19 3HB GLU 19 10.306 -12.201 16.340 1063 HG2 GLU 19 2HG GLU 19 7.886 -12.134 16.250 1064 HG3 GLU 19 3HG GLU 19 7.817 -13.813 15.707 1065 H ILE 20 H ILE 20 10.663 -10.233 14.401 1066 HA ILE 20 HA ILE 20 8.092 -8.900 14.223 1067 HB ILE 20 HB ILE 20 10.841 -7.574 14.116 1068 HG12 ILE 20 2HG1 ILE 20 9.277 -8.422 16.599 1069 HG13 ILE 20 3HG1 ILE 20 10.836 -9.051 16.088 1070 HG21 ILE 20 1HG2 ILE 20 9.668 -5.634 15.072 1071 HG22 ILE 20 2HG2 ILE 20 8.157 -6.547 15.113 1072 HG23 ILE 20 3HG2 ILE 20 8.900 -6.143 13.565 1073 HD11 ILE 20 1HD1 ILE 20 11.844 -6.856 16.490 1074 HD12 ILE 20 2HD1 ILE 20 11.071 -7.521 17.929 1075 HD13 ILE 20 3HD1 ILE 20 10.273 -6.242 17.018 1076 H ALA 21 H ALA 21 10.927 -9.447 12.195 1077 HA ALA 21 HA ALA 21 10.140 -7.794 9.981 1078 HB1 ALA 21 1HB ALA 21 12.492 -8.273 10.504 1079 HB2 ALA 21 2HB ALA 21 12.093 -8.776 8.860 1080 HB3 ALA 21 3HB ALA 21 12.235 -9.981 10.147 1081 H CYS 22 H CYS 22 9.130 -10.895 11.000 1082 HA CYS 22 HA CYS 22 8.419 -12.038 8.485 1083 HB2 CYS 22 2HB CYS 22 7.288 -12.538 11.265 1084 HB3 CYS 22 3HB CYS 22 6.924 -13.518 9.845 1085 HG CYS 22 HG CYS 22 10.198 -13.257 10.275 1086 H MET 23 H MET 23 6.856 -9.733 10.668 1087 HA MET 23 HA MET 23 4.249 -9.702 9.524 1088 HB2 MET 23 2HB MET 23 5.672 -7.352 10.857 1089 HB3 MET 23 3HB MET 23 3.939 -7.536 10.634 1090 HG2 MET 23 2HG MET 23 4.100 -9.587 12.141 1091 HG3 MET 23 3HG MET 23 5.734 -9.052 12.524 1092 HE1 MET 23 1HE MET 23 4.992 -5.730 12.315 1093 HE2 MET 23 2HE MET 23 6.144 -6.415 13.466 1094 HE3 MET 23 3HE MET 23 4.811 -5.415 14.042 1095 H SER 24 H SER 24 7.248 -8.091 8.721 1096 HA SER 24 HA SER 24 6.238 -6.617 6.456 1097 HB2 SER 24 2HB SER 24 8.322 -5.940 7.665 1098 HB3 SER 24 3HB SER 24 9.097 -7.440 7.152 1099 HG SER 24 HG SER 24 8.018 -5.512 5.379 1100 H VAL 25 H VAL 25 5.376 -7.770 4.811 1101 HA VAL 25 HA VAL 25 5.781 -10.567 4.495 1102 HB VAL 25 HB VAL 25 4.368 -8.618 2.627 1103 HG11 VAL 25 1HG1 VAL 25 4.172 -11.656 2.732 1104 HG12 VAL 25 2HG1 VAL 25 4.882 -10.697 1.433 1105 HG13 VAL 25 3HG1 VAL 25 3.151 -10.601 1.752 1106 HG21 VAL 25 1HG2 VAL 25 2.283 -9.340 3.754 1107 HG22 VAL 25 2HG2 VAL 25 3.400 -8.575 4.885 1108 HG23 VAL 25 3HG2 VAL 25 3.227 -10.332 4.870 1109 H THR 26 H THR 26 7.048 -7.739 2.718 1110 HA THR 26 HA THR 26 8.200 -9.154 0.539 1111 HB THR 26 HB THR 26 9.035 -6.457 1.706 1112 HG1 THR 26 HG1 THR 26 6.943 -6.389 0.935 1113 HG21 THR 26 1HG2 THR 26 10.069 -6.000 -0.500 1114 HG22 THR 26 2HG2 THR 26 9.699 -7.643 -1.028 1115 HG23 THR 26 3HG2 THR 26 10.855 -7.376 0.278 1116 H ILE 27 H ILE 27 9.537 -8.186 3.700 1117 HA ILE 27 HA ILE 27 12.200 -9.112 3.267 1118 HB ILE 27 HB ILE 27 10.685 -8.626 5.872 1119 HG12 ILE 27 2HG1 ILE 27 12.723 -6.882 4.408 1120 HG13 ILE 27 3HG1 ILE 27 10.982 -6.623 4.396 1121 HG21 ILE 27 1HG2 ILE 27 12.893 -8.581 7.011 1122 HG22 ILE 27 2HG2 ILE 27 13.683 -9.053 5.506 1123 HG23 ILE 27 3HG2 ILE 27 12.572 -10.166 6.304 1124 HD11 ILE 27 1HD1 ILE 27 12.783 -6.455 6.799 1125 HD12 ILE 27 2HD1 ILE 27 11.034 -6.231 6.807 1126 HD13 ILE 27 3HD1 ILE 27 12.062 -5.110 5.916 1127 H LYS 28 H LYS 28 9.353 -10.552 4.870 1128 HA LYS 28 HA LYS 28 10.372 -13.033 5.638 1129 HB2 LYS 28 2HB LYS 28 8.137 -12.185 6.309 1130 HB3 LYS 28 3HB LYS 28 7.574 -12.332 4.649 1131 HG2 LYS 28 2HG LYS 28 7.981 -14.840 4.826 1132 HG3 LYS 28 3HG LYS 28 8.313 -14.588 6.542 1133 HD2 LYS 28 2HD LYS 28 5.998 -15.338 6.210 1134 HD3 LYS 28 3HD LYS 28 6.025 -13.698 6.864 1135 HE2 LYS 28 2HE LYS 28 4.329 -13.952 5.088 1136 HE3 LYS 28 3HE LYS 28 5.565 -12.782 4.623 1137 HZ1 LYS 28 1HZ LYS 28 6.629 -14.554 3.307 1138 HZ2 LYS 28 2HZ LYS 28 5.055 -14.232 2.787 1139 HZ3 LYS 28 3HZ LYS 28 5.372 -15.608 3.714 1140 H ASN 29 H ASN 29 8.937 -12.002 2.563 1141 HA ASN 29 HA ASN 29 9.073 -14.504 1.206 1142 HB2 ASN 29 2HB ASN 29 8.684 -11.640 0.231 1143 HB3 ASN 29 3HB ASN 29 8.813 -12.983 -0.905 1144 HD21 ASN 29 1HD2 ASN 29 6.687 -12.586 -1.635 1145 HD22 ASN 29 2HD2 ASN 29 5.305 -13.032 -0.702 1146 H MET 30 H MET 30 11.338 -11.794 1.543 1147 HA MET 30 HA MET 30 13.236 -12.651 -0.417 1148 HB2 MET 30 2HB MET 30 13.485 -10.793 1.989 1149 HB3 MET 30 3HB MET 30 14.875 -11.192 0.988 1150 HG2 MET 30 2HG MET 30 13.737 -10.236 -0.980 1151 HG3 MET 30 3HG MET 30 12.355 -9.816 0.037 1152 HE1 MET 30 1HE MET 30 12.648 -7.263 -0.914 1153 HE2 MET 30 2HE MET 30 14.073 -7.763 -1.827 1154 HE3 MET 30 3HE MET 30 14.156 -6.359 -0.763 1155 H ILE 31 H ILE 31 12.813 -13.333 3.027 1156 HA ILE 31 HA ILE 31 15.188 -14.816 3.459 1157 HB ILE 31 HB ILE 31 12.505 -15.004 4.919 1158 HG12 ILE 31 2HG1 ILE 31 15.042 -13.476 5.690 1159 HG13 ILE 31 3HG1 ILE 31 13.615 -12.738 4.982 1160 HG21 ILE 31 1HG2 ILE 31 15.226 -16.066 5.776 1161 HG22 ILE 31 2HG2 ILE 31 13.829 -17.041 5.319 1162 HG23 ILE 31 3HG2 ILE 31 13.773 -16.055 6.779 1163 HD11 ILE 31 1HD1 ILE 31 13.761 -14.086 7.672 1164 HD12 ILE 31 2HD1 ILE 31 12.315 -13.371 6.955 1165 HD13 ILE 31 3HD1 ILE 31 13.696 -12.352 7.358 1166 H GLU 32 H GLU 32 11.889 -15.762 2.524 1167 HA GLU 32 HA GLU 32 12.368 -18.568 2.274 1168 HB2 GLU 32 2HB GLU 32 10.197 -16.838 1.005 1169 HB3 GLU 32 3HB GLU 32 10.167 -18.596 1.115 1170 HG2 GLU 32 2HG GLU 32 10.036 -18.494 3.553 1171 HG3 GLU 32 3HG GLU 32 10.199 -16.738 3.510 1172 H ASP 33 H ASP 33 12.733 -15.845 0.101 1173 HA ASP 33 HA ASP 33 12.837 -17.213 -2.403 1174 HB2 ASP 33 2HB ASP 33 12.325 -14.792 -2.188 1175 HB3 ASP 33 3HB ASP 33 13.942 -14.479 -1.568 1176 H ILE 34 H ILE 34 15.308 -16.022 -0.179 1177 HA ILE 34 HA ILE 34 17.578 -17.132 -1.581 1178 HB ILE 34 HB ILE 34 17.292 -15.887 1.208 1179 HG12 ILE 34 2HG1 ILE 34 18.362 -14.699 -1.402 1180 HG13 ILE 34 3HG1 ILE 34 16.813 -14.316 -0.664 1181 HG21 ILE 34 1HG2 ILE 34 19.267 -17.367 1.175 1182 HG22 ILE 34 2HG2 ILE 34 19.745 -15.673 1.266 1183 HG23 ILE 34 3HG2 ILE 34 19.874 -16.542 -0.264 1184 HD11 ILE 34 1HD1 ILE 34 18.395 -12.552 -0.267 1185 HD12 ILE 34 2HD1 ILE 34 19.535 -13.677 0.468 1186 HD13 ILE 34 3HD1 ILE 34 17.994 -13.335 1.260 1187 H GLY 35 H GLY 35 15.262 -18.237 0.736 1188 HA2 GLY 35 2HA GLY 35 14.991 -20.513 1.408 1189 HA3 GLY 35 3HA GLY 35 16.731 -20.762 1.265 1190 H GLU 36 H GLU 36 17.679 -18.562 2.552 1191 HA GLU 36 HA GLU 36 16.484 -17.977 5.078 1192 HB2 GLU 36 2HB GLU 36 17.417 -20.171 5.659 1193 HB3 GLU 36 3HB GLU 36 18.975 -19.748 4.959 1194 HG2 GLU 36 2HG GLU 36 19.231 -17.983 6.718 1195 HG3 GLU 36 3HG GLU 36 17.726 -18.539 7.445 1196 H SER 37 H SER 37 16.834 -15.804 4.828 1197 HA SER 37 HA SER 37 19.241 -14.676 3.722 1198 HB2 SER 37 2HB SER 37 16.971 -13.349 5.250 1199 HB3 SER 37 3HB SER 37 18.245 -12.493 4.384 1200 HG SER 37 HG SER 37 16.938 -12.652 2.753 1201 H ASP 38 H ASP 38 20.750 -15.776 5.084 1202 HA ASP 38 HA ASP 38 21.056 -15.155 7.892 1203 HB2 ASP 38 2HB ASP 38 21.873 -17.301 7.006 1204 HB3 ASP 38 3HB ASP 38 22.930 -16.479 5.867 1205 H SER 39 H SER 39 22.320 -14.013 4.828 1206 HA SER 39 HA SER 39 24.318 -12.248 5.907 1207 HB2 SER 39 2HB SER 39 24.499 -11.493 3.496 1208 HB3 SER 39 3HB SER 39 24.684 -13.231 3.715 1209 HG SER 39 HG SER 39 22.679 -11.798 2.446 1210 HA PRO 40 HA PRO 40 21.845 -8.527 6.692 1211 HB2 PRO 40 2HB PRO 40 24.110 -7.040 5.336 1212 HB3 PRO 40 3HB PRO 40 23.373 -6.773 6.933 1213 HG2 PRO 40 2HG PRO 40 25.761 -7.924 6.744 1214 HG3 PRO 40 3HG PRO 40 24.576 -8.508 7.940 1215 HD2 PRO 40 2HD PRO 40 25.335 -9.711 5.281 1216 HD3 PRO 40 3HD PRO 40 24.998 -10.517 6.830 1217 H ILE 41 H ILE 41 20.201 -7.639 5.549 1218 HA ILE 41 HA ILE 41 20.198 -7.812 2.620 1219 HB ILE 41 HB ILE 41 17.901 -7.181 4.541 1220 HG12 ILE 41 2HG1 ILE 41 18.710 -9.509 4.814 1221 HG13 ILE 41 3HG1 ILE 41 17.119 -9.501 4.066 1222 HG21 ILE 41 1HG2 ILE 41 16.409 -7.559 2.598 1223 HG22 ILE 41 2HG2 ILE 41 17.812 -7.761 1.549 1224 HG23 ILE 41 3HG2 ILE 41 17.501 -6.202 2.314 1225 HD11 ILE 41 1HD1 ILE 41 18.536 -11.172 3.039 1226 HD12 ILE 41 2HD1 ILE 41 19.757 -9.963 2.661 1227 HD13 ILE 41 3HD1 ILE 41 18.183 -9.905 1.864 1228 HA PRO 42 HA PRO 42 20.972 -3.292 2.749 1229 HB2 PRO 42 2HB PRO 42 21.711 -3.527 -0.101 1230 HB3 PRO 42 3HB PRO 42 22.745 -3.115 1.279 1231 HG2 PRO 42 2HG PRO 42 22.998 -5.451 -0.094 1232 HG3 PRO 42 3HG PRO 42 23.403 -5.296 1.632 1233 HD2 PRO 42 2HD PRO 42 20.882 -6.392 0.378 1234 HD3 PRO 42 3HD PRO 42 21.844 -7.041 1.726 1235 H LEU 43 H LEU 43 19.402 -1.853 2.407 1236 HA LEU 43 HA LEU 43 17.282 -2.333 0.388 1237 HB2 LEU 43 2HB LEU 43 17.048 -0.865 3.058 1238 HB3 LEU 43 3HB LEU 43 15.740 -1.159 1.925 1239 HG LEU 43 HG LEU 43 17.221 -3.322 3.482 1240 HD11 LEU 43 1HD1 LEU 43 14.444 -2.200 3.962 1241 HD12 LEU 43 2HD1 LEU 43 15.864 -1.963 4.981 1242 HD13 LEU 43 3HD1 LEU 43 15.169 -3.572 4.808 1243 HD21 LEU 43 1HD2 LEU 43 14.791 -3.577 1.680 1244 HD22 LEU 43 2HD2 LEU 43 15.468 -4.861 2.687 1245 HD23 LEU 43 3HD2 LEU 43 16.412 -4.197 1.356 1246 HA PRO 44 HA PRO 44 19.491 1.559 -0.872 1247 HB2 PRO 44 2HB PRO 44 19.440 1.199 -3.543 1248 HB3 PRO 44 3HB PRO 44 20.460 0.167 -2.520 1249 HG2 PRO 44 2HG PRO 44 17.772 -0.446 -3.702 1250 HG3 PRO 44 3HG PRO 44 19.226 -1.467 -3.640 1251 HD2 PRO 44 2HD PRO 44 17.129 -1.666 -1.840 1252 HD3 PRO 44 3HD PRO 44 18.794 -2.178 -1.490 1253 H ASN 45 H ASN 45 16.671 1.519 -0.099 1254 HA ASN 45 HA ASN 45 15.468 3.475 -1.956 1255 HB2 ASN 45 2HB ASN 45 14.417 1.276 -2.410 1256 HB3 ASN 45 3HB ASN 45 14.088 1.046 -0.698 1257 HD21 ASN 45 1HD2 ASN 45 13.141 2.784 -3.592 1258 HD22 ASN 45 2HD2 ASN 45 11.618 3.337 -2.995 1259 H VAL 46 H VAL 46 14.811 1.846 1.161 1260 HA VAL 46 HA VAL 46 13.640 4.238 2.292 1261 HB VAL 46 HB VAL 46 12.587 2.068 2.739 1262 HG11 VAL 46 1HG1 VAL 46 15.103 1.253 4.229 1263 HG12 VAL 46 2HG1 VAL 46 14.549 0.595 2.690 1264 HG13 VAL 46 3HG1 VAL 46 13.597 0.331 4.154 1265 HG21 VAL 46 1HG2 VAL 46 13.724 3.285 5.283 1266 HG22 VAL 46 2HG2 VAL 46 12.303 2.242 5.186 1267 HG23 VAL 46 3HG2 VAL 46 12.285 3.829 4.416 1268 H THR 47 H THR 47 14.684 5.714 3.517 1269 HA THR 47 HA THR 47 17.513 5.578 4.031 1270 HB THR 47 HB THR 47 17.113 7.812 5.190 1271 HG1 THR 47 HG1 THR 47 15.072 8.564 5.369 1272 HG21 THR 47 1HG2 THR 47 16.492 9.048 3.130 1273 HG22 THR 47 2HG2 THR 47 15.955 7.542 2.383 1274 HG23 THR 47 3HG2 THR 47 17.660 7.769 2.783 1275 H SER 48 H SER 48 18.325 6.236 6.288 1276 HA SER 48 HA SER 48 17.839 4.140 8.102 1277 HB2 SER 48 2HB SER 48 19.318 5.460 9.649 1278 HB3 SER 48 3HB SER 48 19.991 5.266 8.029 1279 HG SER 48 HG SER 48 20.148 7.428 8.858 1280 H THR 49 H THR 49 16.890 7.539 8.146 1281 HA THR 49 HA THR 49 15.718 7.738 10.664 1282 HB THR 49 HB THR 49 14.447 9.698 9.600 1283 HG1 THR 49 HG1 THR 49 14.815 10.101 7.433 1284 HG21 THR 49 1HG2 THR 49 16.702 10.059 10.571 1285 HG22 THR 49 2HG2 THR 49 16.478 11.046 9.124 1286 HG23 THR 49 3HG2 THR 49 17.444 9.571 9.044 1287 H ILE 50 H ILE 50 14.201 6.963 7.518 1288 HA ILE 50 HA ILE 50 11.545 6.734 8.586 1289 HB ILE 50 HB ILE 50 12.653 5.894 5.869 1290 HG12 ILE 50 2HG1 ILE 50 12.893 8.306 6.250 1291 HG13 ILE 50 3HG1 ILE 50 11.622 8.032 5.066 1292 HG21 ILE 50 1HG2 ILE 50 9.750 6.184 6.731 1293 HG22 ILE 50 2HG2 ILE 50 10.572 4.676 6.327 1294 HG23 ILE 50 3HG2 ILE 50 10.304 5.892 5.079 1295 HD11 ILE 50 1HD1 ILE 50 10.986 9.790 6.591 1296 HD12 ILE 50 2HD1 ILE 50 11.232 8.739 7.983 1297 HD13 ILE 50 3HD1 ILE 50 9.929 8.401 6.839 1298 H LEU 51 H LEU 51 14.060 4.402 7.575 1299 HA LEU 51 HA LEU 51 12.578 2.029 7.947 1300 HB2 LEU 51 2HB LEU 51 14.749 2.176 6.683 1301 HB3 LEU 51 3HB LEU 51 15.601 2.374 8.206 1302 HG LEU 51 HG LEU 51 14.921 0.086 8.902 1303 HD11 LEU 51 1HD1 LEU 51 13.807 -1.454 7.346 1304 HD12 LEU 51 2HD1 LEU 51 13.574 -0.142 6.189 1305 HD13 LEU 51 3HD1 LEU 51 12.768 -0.092 7.760 1306 HD21 LEU 51 1HD2 LEU 51 16.302 -1.203 7.339 1307 HD22 LEU 51 2HD2 LEU 51 17.045 0.355 7.688 1308 HD23 LEU 51 3HD2 LEU 51 16.214 0.103 6.150 1309 H GLU 52 H GLU 52 14.465 4.021 10.165 1310 HA GLU 52 HA GLU 52 14.531 2.340 12.436 1311 HB2 GLU 52 2HB GLU 52 15.899 4.400 12.235 1312 HB3 GLU 52 3HB GLU 52 14.444 5.391 12.288 1313 HG2 GLU 52 2HG GLU 52 13.998 4.618 14.600 1314 HG3 GLU 52 3HG GLU 52 15.453 3.623 14.550 1315 H LYS 53 H LYS 53 12.228 4.808 11.352 1316 HA LYS 53 HA LYS 53 10.466 4.721 13.571 1317 HB2 LYS 53 2HB LYS 53 9.961 5.622 10.700 1318 HB3 LYS 53 3HB LYS 53 8.860 5.897 12.044 1319 HG2 LYS 53 2HG LYS 53 10.667 7.237 13.177 1320 HG3 LYS 53 3HG LYS 53 11.639 7.051 11.716 1321 HD2 LYS 53 2HD LYS 53 10.504 9.223 11.689 1322 HD3 LYS 53 3HD LYS 53 9.875 8.195 10.397 1323 HE2 LYS 53 2HE LYS 53 8.081 9.420 11.582 1324 HE3 LYS 53 3HE LYS 53 7.890 7.675 11.747 1325 HZ1 LYS 53 1HZ LYS 53 7.528 8.840 13.847 1326 HZ2 LYS 53 2HZ LYS 53 9.088 9.481 13.786 1327 HZ3 LYS 53 3HZ LYS 53 8.868 7.812 13.956 1328 H VAL 54 H VAL 54 10.411 3.129 10.407 1329 HA VAL 54 HA VAL 54 7.860 1.935 10.588 1330 HB VAL 54 HB VAL 54 10.296 1.250 8.866 1331 HG11 VAL 54 1HG1 VAL 54 8.792 -0.089 7.431 1332 HG12 VAL 54 2HG1 VAL 54 7.479 0.141 8.588 1333 HG13 VAL 54 3HG1 VAL 54 8.913 -0.774 9.053 1334 HG21 VAL 54 1HG2 VAL 54 9.288 3.466 8.422 1335 HG22 VAL 54 2HG2 VAL 54 7.715 2.712 8.171 1336 HG23 VAL 54 3HG2 VAL 54 9.040 2.377 7.056 1337 H LEU 55 H LEU 55 11.136 0.713 11.308 1338 HA LEU 55 HA LEU 55 10.283 -1.910 12.091 1339 HB2 LEU 55 2HB LEU 55 12.931 -0.479 12.557 1340 HB3 LEU 55 3HB LEU 55 12.642 -2.171 12.922 1341 HG LEU 55 HG LEU 55 12.690 -0.884 10.167 1342 HD11 LEU 55 1HD1 LEU 55 14.597 -2.373 9.746 1343 HD12 LEU 55 2HD1 LEU 55 14.499 -2.983 11.401 1344 HD13 LEU 55 3HD1 LEU 55 14.902 -1.290 11.103 1345 HD21 LEU 55 1HD2 LEU 55 10.896 -2.548 10.177 1346 HD22 LEU 55 2HD2 LEU 55 11.997 -3.769 10.820 1347 HD23 LEU 55 3HD2 LEU 55 12.256 -3.104 9.206 1348 H ASP 56 H ASP 56 10.798 1.126 13.800 1349 HA ASP 56 HA ASP 56 10.745 0.082 16.477 1350 HB2 ASP 56 2HB ASP 56 11.747 2.273 15.979 1351 HB3 ASP 56 3HB ASP 56 10.200 2.903 15.432 1352 H TYR 57 H TYR 57 8.307 1.412 14.265 1353 HA TYR 57 HA TYR 57 6.077 1.177 16.030 1354 HB2 TYR 57 2HB TYR 57 6.062 2.611 13.968 1355 HB3 TYR 57 3HB TYR 57 6.065 1.155 12.973 1356 HD1 TYR 57 HD1 TYR 57 4.004 -0.080 12.590 1357 HD2 TYR 57 HD2 TYR 57 4.063 3.108 15.444 1358 HE1 TYR 57 HE1 TYR 57 1.565 -0.218 12.788 1359 HE2 TYR 57 HE2 TYR 57 1.618 2.980 15.633 1360 HH TYR 57 HH TYR 57 -0.305 2.172 14.258 1361 H CYS 58 H CYS 58 7.672 -1.009 13.779 1362 HA CYS 58 HA CYS 58 5.827 -3.163 13.987 1363 HB2 CYS 58 2HB CYS 58 8.763 -3.082 13.207 1364 HB3 CYS 58 3HB CYS 58 7.775 -4.540 13.122 1365 HG CYS 58 HG CYS 58 6.732 -1.743 11.491 1366 H ARG 59 H ARG 59 8.681 -2.188 15.933 1367 HA ARG 59 HA ARG 59 8.687 -4.430 17.720 1368 HB2 ARG 59 2HB ARG 59 9.679 -1.591 18.256 1369 HB3 ARG 59 3HB ARG 59 10.008 -2.989 19.273 1370 HG2 ARG 59 2HG ARG 59 11.239 -4.024 17.336 1371 HG3 ARG 59 3HG ARG 59 11.013 -2.513 16.458 1372 HD2 ARG 59 2HD ARG 59 12.599 -2.961 19.000 1373 HD3 ARG 59 3HD ARG 59 13.211 -2.455 17.425 1374 HE ARG 59 HE ARG 59 11.461 -0.460 18.158 1375 HH11 ARG 59 1HH1 ARG 59 14.359 -1.857 19.621 1376 HH12 ARG 59 2HH1 ARG 59 14.781 -0.384 20.437 1377 HH21 ARG 59 1HH2 ARG 59 12.034 1.436 19.279 1378 HH22 ARG 59 2HH2 ARG 59 13.474 1.466 20.245 1379 H HIS 60 H HIS 60 7.032 -1.324 17.672 1380 HA HIS 60 HA HIS 60 5.763 -1.333 20.169 1381 HB2 HIS 60 2HB HIS 60 5.682 0.681 18.774 1382 HB3 HIS 60 3HB HIS 60 4.841 -0.181 17.488 1383 HD1 HIS 60 HD1 HIS 60 2.308 -0.876 18.049 1384 HD2 HIS 60 HD2 HIS 60 4.030 1.863 20.640 1385 HE1 HIS 60 HE1 HIS 60 0.413 0.085 19.360 1386 HE2 HIS 60 HE2 HIS 60 1.457 1.935 20.683 1387 H HIS 61 H HIS 61 4.703 -2.612 17.021 1388 HA HIS 61 HA HIS 61 2.238 -3.699 17.979 1389 HB2 HIS 61 2HB HIS 61 2.653 -3.003 15.600 1390 HB3 HIS 61 3HB HIS 61 3.746 -4.374 15.410 1391 HD1 HIS 61 HD1 HIS 61 2.680 -6.644 14.935 1392 HD2 HIS 61 HD2 HIS 61 -0.107 -3.736 15.956 1393 HE1 HIS 61 HE1 HIS 61 0.439 -7.681 14.512 1394 HE2 HIS 61 HE2 HIS 61 -1.224 -5.953 15.251 1395 H HIS 62 H HIS 62 5.516 -4.892 17.795 1396 HA HIS 62 HA HIS 62 4.979 -7.698 17.930 1397 HB2 HIS 62 2HB HIS 62 7.129 -6.871 17.095 1398 HB3 HIS 62 3HB HIS 62 7.472 -6.080 18.630 1399 HD1 HIS 62 HD1 HIS 62 9.326 -7.374 19.722 1400 HD2 HIS 62 HD2 HIS 62 6.597 -9.865 17.871 1401 HE1 HIS 62 HE1 HIS 62 10.184 -9.710 20.065 1402 HE2 HIS 62 HE2 HIS 62 8.413 -11.185 19.114 1403 H GLN 63 H GLN 63 5.817 -5.231 20.322 1404 HA GLN 63 HA GLN 63 5.827 -7.194 22.512 1405 HB2 GLN 63 2HB GLN 63 6.774 -4.293 22.363 1406 HB3 GLN 63 3HB GLN 63 6.973 -5.352 23.758 1407 HG2 GLN 63 2HG GLN 63 8.473 -6.816 22.524 1408 HG3 GLN 63 3HG GLN 63 8.150 -5.967 21.015 1409 HE21 GLN 63 1HE2 GLN 63 8.355 -3.297 22.098 1410 HE22 GLN 63 2HE2 GLN 63 10.020 -3.026 22.463 1411 H HIS 64 H HIS 64 3.950 -4.609 21.215 1412 HA HIS 64 HA HIS 64 1.863 -5.060 23.256 1413 HB2 HIS 64 2HB HIS 64 2.653 -2.367 22.028 1414 HB3 HIS 64 3HB HIS 64 1.149 -2.629 22.903 1415 HD1 HIS 64 HD1 HIS 64 1.234 -2.277 25.371 1416 HD2 HIS 64 HD2 HIS 64 5.039 -2.651 23.744 1417 HE1 HIS 64 HE1 HIS 64 2.819 -1.715 27.222 1418 HE2 HIS 64 HE2 HIS 64 5.093 -1.744 26.165 1419 HA PRO 65 HA PRO 65 0.629 -6.344 18.910 1420 HB2 PRO 65 2HB PRO 65 -1.339 -8.137 19.881 1421 HB3 PRO 65 3HB PRO 65 0.334 -8.564 19.472 1422 HG2 PRO 65 2HG PRO 65 -0.843 -7.938 22.156 1423 HG3 PRO 65 3HG PRO 65 0.355 -9.175 21.711 1424 HD2 PRO 65 2HD PRO 65 1.120 -6.917 22.923 1425 HD3 PRO 65 3HD PRO 65 2.117 -7.630 21.633 1426 H GLY 66 H GLY 66 -1.999 -6.265 21.389 1427 HA2 GLY 66 2HA GLY 66 -3.833 -4.892 21.613 1428 HA3 GLY 66 3HA GLY 66 -3.269 -3.910 20.269 1429 H GLY 67 H GLY 67 -3.109 -6.081 18.346 1430 HA2 GLY 67 2HA GLY 67 -4.412 -7.269 16.860 1431 HA3 GLY 67 3HA GLY 67 -5.777 -7.155 17.964 1432 H SER 68 H SER 68 -6.706 -4.919 18.226 1433 HA SER 68 HA SER 68 -6.272 -3.005 16.057 1434 HB2 SER 68 2HB SER 68 -9.009 -4.242 16.623 1435 HB3 SER 68 3HB SER 68 -8.738 -2.838 15.589 1436 HG SER 68 HG SER 68 -7.111 -4.603 14.650 1437 H GLY 69 H GLY 69 -5.556 -1.472 17.474 1438 HA2 GLY 69 2HA GLY 69 -7.024 -0.659 19.862 1439 HA3 GLY 69 3HA GLY 69 -5.574 0.089 19.198 1440 H LEU 70 H LEU 70 -8.853 -0.542 18.040 1441 HA LEU 70 HA LEU 70 -8.931 1.655 16.257 1442 HB2 LEU 70 2HB LEU 70 -11.472 0.923 16.119 1443 HB3 LEU 70 3HB LEU 70 -10.205 -0.077 15.448 1444 HG LEU 70 HG LEU 70 -10.308 -1.557 17.470 1445 HD11 LEU 70 1HD1 LEU 70 -12.226 -1.460 19.006 1446 HD12 LEU 70 2HD1 LEU 70 -12.726 0.071 18.284 1447 HD13 LEU 70 3HD1 LEU 70 -11.192 -0.038 19.146 1448 HD21 LEU 70 1HD2 LEU 70 -12.940 -1.277 15.987 1449 HD22 LEU 70 2HD2 LEU 70 -12.396 -2.707 16.872 1450 HD23 LEU 70 3HD2 LEU 70 -11.522 -2.175 15.438 1451 H ASP 71 H ASP 71 -9.989 1.298 19.555 1452 HA ASP 71 HA ASP 71 -10.629 4.176 19.634 1453 HB2 ASP 71 2HB ASP 71 -12.255 1.931 20.918 1454 HB3 ASP 71 3HB ASP 71 -12.369 3.602 21.460 1455 H ASP 72 H ASP 72 -8.234 3.814 20.097 1456 HA ASP 72 HA ASP 72 -7.898 4.265 22.934 1457 HB2 ASP 72 2HB ASP 72 -7.564 1.789 22.764 1458 HB3 ASP 72 3HB ASP 72 -6.291 2.047 21.576 1459 H ILE 73 H ILE 73 -5.711 3.411 20.248 1460 HA ILE 73 HA ILE 73 -3.823 4.309 19.436 1461 HB ILE 73 HB ILE 73 -5.432 6.906 19.411 1462 HG12 ILE 73 2HG1 ILE 73 -5.657 6.288 16.879 1463 HG13 ILE 73 3HG1 ILE 73 -5.164 4.670 17.351 1464 HG21 ILE 73 1HG2 ILE 73 -3.855 7.684 17.654 1465 HG22 ILE 73 2HG2 ILE 73 -2.899 6.218 17.864 1466 HG23 ILE 73 3HG2 ILE 73 -3.025 7.382 19.182 1467 HD11 ILE 73 1HD1 ILE 73 -7.617 6.121 18.345 1468 HD12 ILE 73 2HD1 ILE 73 -7.150 4.469 18.759 1469 HD13 ILE 73 3HD1 ILE 73 -7.582 4.874 17.097 1470 HA PRO 74 HA PRO 74 -1.973 5.605 23.515 1471 HB2 PRO 74 2HB PRO 74 0.385 4.276 22.173 1472 HB3 PRO 74 3HB PRO 74 -0.250 4.054 23.819 1473 HG2 PRO 74 2HG PRO 74 -0.640 2.183 21.978 1474 HG3 PRO 74 3HG PRO 74 -1.938 2.598 23.123 1475 HD2 PRO 74 2HD PRO 74 -1.627 3.428 20.240 1476 HD3 PRO 74 3HD PRO 74 -3.087 2.903 21.114 1477 HA PRO 75 HA PRO 75 -0.062 9.516 22.561 1478 HB2 PRO 75 2HB PRO 75 2.328 8.539 24.160 1479 HB3 PRO 75 3HB PRO 75 1.469 10.096 24.252 1480 HG2 PRO 75 2HG PRO 75 0.984 8.243 26.077 1481 HG3 PRO 75 3HG PRO 75 -0.359 9.191 25.396 1482 HD2 PRO 75 2HD PRO 75 0.414 6.345 24.836 1483 HD3 PRO 75 3HD PRO 75 -1.198 7.091 24.890 1484 H TYR 76 H TYR 76 2.428 6.916 22.459 1485 HA TYR 76 HA TYR 76 4.214 8.071 20.666 1486 HB2 TYR 76 2HB TYR 76 4.968 6.118 21.813 1487 HB3 TYR 76 3HB TYR 76 3.600 5.153 21.274 1488 HD1 TYR 76 HD1 TYR 76 3.796 3.807 19.307 1489 HD2 TYR 76 HD2 TYR 76 6.742 6.825 20.029 1490 HE1 TYR 76 HE1 TYR 76 5.101 2.971 17.409 1491 HE2 TYR 76 HE2 TYR 76 8.054 5.981 18.122 1492 HH TYR 76 HH TYR 76 8.287 3.823 16.834 1493 H ASP 77 H ASP 77 1.301 6.184 19.965 1494 HA ASP 77 HA ASP 77 1.788 5.815 17.177 1495 HB2 ASP 77 2HB ASP 77 -0.802 5.636 18.783 1496 HB3 ASP 77 3HB ASP 77 -0.624 5.107 17.106 1497 H ARG 78 H ARG 78 -0.030 8.245 19.036 1498 HA ARG 78 HA ARG 78 -1.009 9.782 16.860 1499 HB2 ARG 78 2HB ARG 78 -0.281 10.567 19.713 1500 HB3 ARG 78 3HB ARG 78 -0.903 11.741 18.555 1501 HG2 ARG 78 2HG ARG 78 -2.952 10.395 18.298 1502 HG3 ARG 78 3HG ARG 78 -2.352 9.250 19.500 1503 HD2 ARG 78 2HD ARG 78 -2.426 10.928 21.240 1504 HD3 ARG 78 3HD ARG 78 -2.764 12.207 20.069 1505 HE ARG 78 HE ARG 78 -4.794 10.284 19.889 1506 HH11 ARG 78 1HH1 ARG 78 -3.680 12.695 22.209 1507 HH12 ARG 78 2HH1 ARG 78 -5.257 12.931 22.897 1508 HH21 ARG 78 1HH2 ARG 78 -6.854 10.629 20.767 1509 HH22 ARG 78 2HH2 ARG 78 -7.061 11.755 22.077 1510 H ASP 79 H ASP 79 1.976 10.121 18.797 1511 HA ASP 79 HA ASP 79 3.074 12.312 17.414 1512 HB2 ASP 79 2HB ASP 79 4.371 10.172 19.152 1513 HB3 ASP 79 3HB ASP 79 5.286 11.532 18.503 1514 H PHE 80 H PHE 80 3.213 8.884 16.779 1515 HA PHE 80 HA PHE 80 5.386 8.797 14.947 1516 HB2 PHE 80 2HB PHE 80 4.511 6.752 16.074 1517 HB3 PHE 80 3HB PHE 80 2.977 6.912 15.224 1518 HD1 PHE 80 HD1 PHE 80 6.610 6.282 14.759 1519 HD2 PHE 80 HD2 PHE 80 2.721 6.018 12.999 1520 HE1 PHE 80 HE1 PHE 80 7.531 4.988 12.895 1521 HE2 PHE 80 HE2 PHE 80 3.659 4.721 11.132 1522 HZ PHE 80 HZ PHE 80 6.068 4.210 11.080 1523 H CYS 81 H CYS 81 1.894 9.176 14.601 1524 HA CYS 81 HA CYS 81 1.862 9.380 11.736 1525 HB2 CYS 81 2HB CYS 81 -0.224 10.133 13.826 1526 HB3 CYS 81 3HB CYS 81 -0.517 9.978 12.091 1527 HG CYS 81 HG CYS 81 0.734 7.310 13.775 1528 H LYS 82 H LYS 82 2.289 11.627 14.402 1529 HA LYS 82 HA LYS 82 1.813 14.036 12.844 1530 HB2 LYS 82 2HB LYS 82 2.896 13.626 15.662 1531 HB3 LYS 82 3HB LYS 82 2.654 15.207 14.928 1532 HG2 LYS 82 2HG LYS 82 0.220 14.708 14.713 1533 HG3 LYS 82 3HG LYS 82 0.494 13.163 15.525 1534 HD2 LYS 82 2HD LYS 82 -0.357 14.817 17.129 1535 HD3 LYS 82 3HD LYS 82 1.300 14.374 17.545 1536 HE2 LYS 82 2HE LYS 82 2.135 16.441 16.524 1537 HE3 LYS 82 3HE LYS 82 0.505 16.873 16.009 1538 HZ1 LYS 82 1HZ LYS 82 1.437 16.628 18.813 1539 HZ2 LYS 82 2HZ LYS 82 -0.139 16.992 18.337 1540 HZ3 LYS 82 3HZ LYS 82 1.116 18.066 17.985 1541 H VAL 83 H VAL 83 3.348 13.338 11.181 1542 HA VAL 83 HA VAL 83 6.084 14.352 11.713 1543 HB VAL 83 HB VAL 83 6.942 12.808 9.935 1544 HG11 VAL 83 1HG1 VAL 83 6.913 10.715 11.256 1545 HG12 VAL 83 2HG1 VAL 83 5.608 11.358 12.253 1546 HG13 VAL 83 3HG1 VAL 83 7.197 12.128 12.272 1547 HG21 VAL 83 1HG2 VAL 83 4.183 11.519 10.013 1548 HG22 VAL 83 2HG2 VAL 83 5.583 10.888 9.143 1549 HG23 VAL 83 3HG2 VAL 83 4.868 12.425 8.663 1550 H ASP 84 H ASP 84 7.098 14.978 9.498 1551 HA ASP 84 HA ASP 84 5.559 17.200 8.601 1552 HB2 ASP 84 2HB ASP 84 8.091 17.116 8.925 1553 HB3 ASP 84 3HB ASP 84 8.185 16.174 7.441 1554 H GLN 85 H GLN 85 5.202 17.718 6.275 1555 HA GLN 85 HA GLN 85 3.347 15.988 5.187 1556 HB2 GLN 85 2HB GLN 85 3.305 18.412 4.783 1557 HB3 GLN 85 3HB GLN 85 4.769 18.307 3.816 1558 HG2 GLN 85 2HG GLN 85 2.800 18.548 2.383 1559 HG3 GLN 85 3HG GLN 85 3.569 16.988 2.119 1560 HE21 GLN 85 1HE2 GLN 85 1.686 16.102 1.260 1561 HE22 GLN 85 2HE2 GLN 85 0.324 15.694 2.233 1562 HA PRO 86 HA PRO 86 6.496 14.455 1.744 1563 HB2 PRO 86 2HB PRO 86 9.202 14.644 2.325 1564 HB3 PRO 86 3HB PRO 86 8.319 15.855 1.373 1565 HG2 PRO 86 2HG PRO 86 9.000 15.916 4.302 1566 HG3 PRO 86 3HG PRO 86 9.168 17.204 3.086 1567 HD2 PRO 86 2HD PRO 86 7.086 17.179 4.777 1568 HD3 PRO 86 3HD PRO 86 6.870 17.680 3.081 1569 H THR 87 H THR 87 7.434 14.320 5.176 1570 HA THR 87 HA THR 87 8.670 11.794 5.223 1571 HB THR 87 HB THR 87 7.216 13.130 7.547 1572 HG1 THR 87 HG1 THR 87 9.950 13.541 6.942 1573 HG21 THR 87 1HG2 THR 87 8.921 12.029 8.948 1574 HG22 THR 87 2HG2 THR 87 9.645 11.289 7.523 1575 HG23 THR 87 3HG2 THR 87 8.017 10.826 8.027 1576 H LEU 88 H LEU 88 5.301 12.760 5.566 1577 HA LEU 88 HA LEU 88 4.069 10.372 6.338 1578 HB2 LEU 88 2HB LEU 88 3.131 12.643 4.546 1579 HB3 LEU 88 3HB LEU 88 2.064 11.334 5.023 1580 HG LEU 88 HG LEU 88 3.461 13.119 7.057 1581 HD11 LEU 88 1HD1 LEU 88 0.658 13.470 5.944 1582 HD12 LEU 88 2HD1 LEU 88 2.033 14.544 5.673 1583 HD13 LEU 88 3HD1 LEU 88 1.364 14.367 7.292 1584 HD21 LEU 88 1HD2 LEU 88 1.079 11.247 7.321 1585 HD22 LEU 88 2HD2 LEU 88 1.753 12.258 8.604 1586 HD23 LEU 88 3HD2 LEU 88 2.714 10.950 7.922 1587 H PHE 89 H PHE 89 4.832 11.572 3.064 1588 HA PHE 89 HA PHE 89 3.908 9.263 1.656 1589 HB2 PHE 89 2HB PHE 89 5.839 11.439 0.756 1590 HB3 PHE 89 3HB PHE 89 5.103 10.240 -0.305 1591 HD1 PHE 89 HD1 PHE 89 4.746 13.518 1.057 1592 HD2 PHE 89 HD2 PHE 89 2.482 10.163 -0.318 1593 HE1 PHE 89 HE1 PHE 89 2.799 14.973 0.705 1594 HE2 PHE 89 HE2 PHE 89 0.546 11.628 -0.670 1595 HZ PHE 89 HZ PHE 89 0.699 14.033 -0.159 1596 H GLU 90 H GLU 90 7.007 10.159 3.063 1597 HA GLU 90 HA GLU 90 8.644 8.160 1.910 1598 HB2 GLU 90 2HB GLU 90 8.844 9.456 4.660 1599 HB3 GLU 90 3HB GLU 90 10.128 8.537 3.884 1600 HG2 GLU 90 2HG GLU 90 8.955 11.097 2.787 1601 HG3 GLU 90 3HG GLU 90 10.417 11.009 3.760 1602 H LEU 91 H LEU 91 6.590 8.178 4.806 1603 HA LEU 91 HA LEU 91 7.157 5.533 5.706 1604 HB2 LEU 91 2HB LEU 91 4.744 7.321 6.209 1605 HB3 LEU 91 3HB LEU 91 5.036 5.810 7.051 1606 HG LEU 91 HG LEU 91 6.821 8.279 7.226 1607 HD11 LEU 91 1HD1 LEU 91 4.880 7.172 9.287 1608 HD12 LEU 91 2HD1 LEU 91 4.647 8.635 8.327 1609 HD13 LEU 91 3HD1 LEU 91 5.957 8.558 9.501 1610 HD21 LEU 91 1HD2 LEU 91 6.987 5.667 8.767 1611 HD22 LEU 91 2HD2 LEU 91 7.989 7.096 9.035 1612 HD23 LEU 91 3HD2 LEU 91 8.111 6.211 7.517 1613 H ILE 92 H ILE 92 4.760 6.893 3.460 1614 HA ILE 92 HA ILE 92 3.219 4.542 3.008 1615 HB ILE 92 HB ILE 92 3.641 7.000 1.225 1616 HG12 ILE 92 2HG1 ILE 92 1.305 6.252 3.052 1617 HG13 ILE 92 3HG1 ILE 92 2.530 7.459 3.409 1618 HG21 ILE 92 1HG2 ILE 92 2.940 5.119 -0.203 1619 HG22 ILE 92 2HG2 ILE 92 1.633 6.291 -0.053 1620 HG23 ILE 92 3HG2 ILE 92 1.576 4.790 0.870 1621 HD11 ILE 92 1HD1 ILE 92 0.488 7.604 1.195 1622 HD12 ILE 92 2HD1 ILE 92 1.746 8.802 1.510 1623 HD13 ILE 92 3HD1 ILE 92 0.484 8.514 2.706 1624 H LEU 93 H LEU 93 6.082 5.914 1.383 1625 HA LEU 93 HA LEU 93 6.271 4.043 -0.752 1626 HB2 LEU 93 2HB LEU 93 8.340 5.917 0.475 1627 HB3 LEU 93 3HB LEU 93 8.668 4.934 -0.942 1628 HG LEU 93 HG LEU 93 6.562 7.133 -0.790 1629 HD11 LEU 93 1HD1 LEU 93 8.029 8.423 -2.277 1630 HD12 LEU 93 2HD1 LEU 93 9.245 7.147 -2.214 1631 HD13 LEU 93 3HD1 LEU 93 8.838 8.052 -0.755 1632 HD21 LEU 93 1HD2 LEU 93 7.427 5.462 -3.176 1633 HD22 LEU 93 2HD2 LEU 93 6.309 6.828 -3.218 1634 HD23 LEU 93 3HD2 LEU 93 5.874 5.367 -2.338 1635 H ALA 94 H ALA 94 7.767 4.224 2.459 1636 HA ALA 94 HA ALA 94 9.470 1.942 2.212 1637 HB1 ALA 94 1HB ALA 94 8.425 3.320 4.716 1638 HB2 ALA 94 2HB ALA 94 9.896 3.743 3.837 1639 HB3 ALA 94 3HB ALA 94 9.777 2.180 4.644 1640 H ALA 95 H ALA 95 6.193 2.440 3.465 1641 HA ALA 95 HA ALA 95 5.820 -0.192 4.535 1642 HB1 ALA 95 1HB ALA 95 4.538 1.750 5.335 1643 HB2 ALA 95 2HB ALA 95 3.478 0.450 4.792 1644 HB3 ALA 95 3HB ALA 95 3.733 1.871 3.771 1645 H ASN 96 H ASN 96 5.278 1.264 1.364 1646 HA ASN 96 HA ASN 96 3.881 -1.023 0.250 1647 HB2 ASN 96 2HB ASN 96 3.565 1.292 -0.642 1648 HB3 ASN 96 3HB ASN 96 5.253 1.336 -1.141 1649 HD21 ASN 96 1HD2 ASN 96 4.539 1.744 -3.291 1650 HD22 ASN 96 2HD2 ASN 96 3.944 0.480 -4.297 1651 H TYR 97 H TYR 97 7.193 0.181 0.367 1652 HA TYR 97 HA TYR 97 8.437 -1.605 -1.451 1653 HB2 TYR 97 2HB TYR 97 9.520 0.485 -0.878 1654 HB3 TYR 97 3HB TYR 97 9.511 0.099 0.836 1655 HD1 TYR 97 HD1 TYR 97 11.611 -0.416 1.721 1656 HD2 TYR 97 HD2 TYR 97 10.840 -1.479 -2.351 1657 HE1 TYR 97 HE1 TYR 97 13.881 -1.316 1.530 1658 HE2 TYR 97 HE2 TYR 97 13.125 -2.379 -2.537 1659 HH TYR 97 HH TYR 97 15.137 -2.605 -1.488 1660 H LEU 98 H LEU 98 7.981 -1.754 2.076 1661 HA LEU 98 HA LEU 98 9.270 -4.393 2.245 1662 HB2 LEU 98 2HB LEU 98 8.268 -2.497 4.408 1663 HB3 LEU 98 3HB LEU 98 9.050 -4.038 4.718 1664 HG LEU 98 HG LEU 98 10.357 -1.625 3.392 1665 HD11 LEU 98 1HD1 LEU 98 10.796 -2.811 6.156 1666 HD12 LEU 98 2HD1 LEU 98 10.005 -1.277 5.787 1667 HD13 LEU 98 3HD1 LEU 98 11.719 -1.482 5.442 1668 HD21 LEU 98 1HD2 LEU 98 12.465 -2.924 3.497 1669 HD22 LEU 98 2HD2 LEU 98 11.269 -3.692 2.455 1670 HD23 LEU 98 3HD2 LEU 98 11.564 -4.332 4.072 1671 H ASP 99 H ASP 99 6.207 -3.170 1.720 1672 HA ASP 99 HA ASP 99 4.067 -3.722 2.044 1673 HB2 ASP 99 2HB ASP 99 4.734 -5.518 0.477 1674 HB3 ASP 99 3HB ASP 99 5.112 -6.573 1.834 1675 H ILE 100 H ILE 100 4.484 -2.812 4.194 1676 HA ILE 100 HA ILE 100 3.539 -4.657 6.317 1677 HB ILE 100 HB ILE 100 4.939 -1.971 6.801 1678 HG12 ILE 100 2HG1 ILE 100 6.144 -4.769 6.962 1679 HG13 ILE 100 3HG1 ILE 100 6.536 -3.556 5.753 1680 HG21 ILE 100 1HG2 ILE 100 4.269 -4.254 8.715 1681 HG22 ILE 100 2HG2 ILE 100 3.416 -2.712 8.616 1682 HG23 ILE 100 3HG2 ILE 100 5.096 -2.755 9.150 1683 HD11 ILE 100 1HD1 ILE 100 8.263 -3.710 7.418 1684 HD12 ILE 100 2HD1 ILE 100 7.109 -3.363 8.703 1685 HD13 ILE 100 3HD1 ILE 100 7.483 -2.133 7.495 1686 H LYS 101 H LYS 101 1.425 -4.455 5.697 1687 HA LYS 101 HA LYS 101 0.008 -2.080 5.172 1688 HB2 LYS 101 2HB LYS 101 -1.015 -4.775 6.151 1689 HB3 LYS 101 3HB LYS 101 -2.026 -3.486 5.499 1690 HG2 LYS 101 2HG LYS 101 -0.911 -3.628 3.334 1691 HG3 LYS 101 3HG LYS 101 0.216 -4.836 3.958 1692 HD2 LYS 101 2HD LYS 101 -1.671 -6.408 4.320 1693 HD3 LYS 101 3HD LYS 101 -2.798 -5.199 3.695 1694 HE2 LYS 101 2HE LYS 101 -1.601 -5.258 1.503 1695 HE3 LYS 101 3HE LYS 101 -0.551 -6.532 2.135 1696 HZ1 LYS 101 1HZ LYS 101 -2.322 -7.485 0.848 1697 HZ2 LYS 101 2HZ LYS 101 -3.499 -6.692 1.768 1698 HZ3 LYS 101 3HZ LYS 101 -2.557 -7.907 2.468 1699 HA PRO 102 HA PRO 102 -1.004 -2.094 10.153 1700 HB2 PRO 102 2HB PRO 102 1.868 -2.881 10.739 1701 HB3 PRO 102 3HB PRO 102 0.425 -3.072 11.762 1702 HG2 PRO 102 2HG PRO 102 1.368 -5.169 10.460 1703 HG3 PRO 102 3HG PRO 102 -0.390 -4.885 10.513 1704 HD2 PRO 102 2HD PRO 102 1.535 -4.436 8.251 1705 HD3 PRO 102 3HD PRO 102 -0.155 -4.984 8.201 1706 H LEU 103 H LEU 103 2.061 -1.337 8.496 1707 HA LEU 103 HA LEU 103 2.427 1.233 9.797 1708 HB2 LEU 103 2HB LEU 103 4.217 -0.423 8.733 1709 HB3 LEU 103 3HB LEU 103 3.823 0.374 7.229 1710 HG LEU 103 HG LEU 103 5.894 1.262 8.249 1711 HD11 LEU 103 1HD1 LEU 103 4.652 2.822 6.844 1712 HD12 LEU 103 2HD1 LEU 103 5.453 3.675 8.162 1713 HD13 LEU 103 3HD1 LEU 103 3.715 3.373 8.235 1714 HD21 LEU 103 1HD2 LEU 103 4.167 2.161 10.575 1715 HD22 LEU 103 2HD2 LEU 103 5.889 2.483 10.357 1716 HD23 LEU 103 3HD2 LEU 103 5.329 0.832 10.601 1717 H LEU 104 H LEU 104 1.457 0.045 6.584 1718 HA LEU 104 HA LEU 104 1.372 2.461 5.191 1719 HB2 LEU 104 2HB LEU 104 1.464 0.237 4.111 1720 HB3 LEU 104 3HB LEU 104 -0.158 -0.115 4.657 1721 HG LEU 104 HG LEU 104 -1.012 1.750 3.187 1722 HD11 LEU 104 1HD1 LEU 104 0.993 3.146 3.072 1723 HD12 LEU 104 2HD1 LEU 104 0.449 2.705 1.456 1724 HD13 LEU 104 3HD1 LEU 104 1.847 1.892 2.166 1725 HD21 LEU 104 1HD2 LEU 104 -0.778 0.530 1.064 1726 HD22 LEU 104 2HD2 LEU 104 -1.062 -0.581 2.402 1727 HD23 LEU 104 3HD2 LEU 104 0.562 -0.408 1.733 1728 H ASP 105 H ASP 105 -1.255 0.603 6.690 1729 HA ASP 105 HA ASP 105 -3.396 2.201 5.771 1730 HB2 ASP 105 2HB ASP 105 -3.579 -0.209 6.490 1731 HB3 ASP 105 3HB ASP 105 -3.376 0.298 8.170 1732 H VAL 106 H VAL 106 -1.550 2.182 8.793 1733 HA VAL 106 HA VAL 106 -3.066 4.080 10.249 1734 HB VAL 106 HB VAL 106 -0.163 3.171 10.451 1735 HG11 VAL 106 1HG1 VAL 106 0.001 4.282 12.654 1736 HG12 VAL 106 2HG1 VAL 106 -1.566 5.050 12.389 1737 HG13 VAL 106 3HG1 VAL 106 -0.198 5.454 11.351 1738 HG21 VAL 106 1HG2 VAL 106 -1.867 1.498 11.031 1739 HG22 VAL 106 2HG2 VAL 106 -2.588 2.608 12.200 1740 HG23 VAL 106 3HG2 VAL 106 -0.958 1.983 12.465 1741 H THR 107 H THR 107 -0.188 4.458 8.152 1742 HA THR 107 HA THR 107 -0.027 7.295 8.333 1743 HB THR 107 HB THR 107 1.041 5.517 6.093 1744 HG1 THR 107 HG1 THR 107 2.112 4.703 7.756 1745 HG21 THR 107 1HG2 THR 107 2.001 8.226 7.107 1746 HG22 THR 107 2HG2 THR 107 1.165 7.950 5.578 1747 HG23 THR 107 3HG2 THR 107 2.772 7.268 5.840 1748 H CYS 108 H CYS 108 -1.847 5.108 6.276 1749 HA CYS 108 HA CYS 108 -2.711 6.992 4.306 1750 HB2 CYS 108 2HB CYS 108 -3.802 4.264 5.107 1751 HB3 CYS 108 3HB CYS 108 -4.464 5.215 3.776 1752 HG CYS 108 HG CYS 108 -1.139 4.585 3.713 1753 H LYS 109 H LYS 109 -3.965 5.934 7.456 1754 HA LYS 109 HA LYS 109 -6.449 7.360 7.315 1755 HB2 LYS 109 2HB LYS 109 -4.984 5.823 9.416 1756 HB3 LYS 109 3HB LYS 109 -5.945 7.151 10.053 1757 HG2 LYS 109 2HG LYS 109 -7.245 5.119 10.112 1758 HG3 LYS 109 3HG LYS 109 -7.953 6.223 8.928 1759 HD2 LYS 109 2HD LYS 109 -6.860 4.936 7.105 1760 HD3 LYS 109 3HD LYS 109 -6.178 3.831 8.303 1761 HE2 LYS 109 2HE LYS 109 -8.489 3.210 9.003 1762 HE3 LYS 109 3HE LYS 109 -9.130 4.269 7.738 1763 HZ1 LYS 109 1HZ LYS 109 -8.023 2.904 6.087 1764 HZ2 LYS 109 2HZ LYS 109 -9.049 1.956 7.033 1765 HZ3 LYS 109 3HZ LYS 109 -7.378 1.914 7.295 1766 H THR 110 H THR 110 -3.204 8.133 8.484 1767 HA THR 110 HA THR 110 -3.750 10.575 9.766 1768 HB THR 110 HB THR 110 -1.179 9.785 8.322 1769 HG1 THR 110 HG1 THR 110 -1.076 8.316 9.824 1770 HG21 THR 110 1HG2 THR 110 -1.210 12.182 8.987 1771 HG22 THR 110 2HG2 THR 110 -0.060 11.266 9.963 1772 HG23 THR 110 3HG2 THR 110 -1.624 11.716 10.640 1773 H VAL 111 H VAL 111 -2.588 9.948 6.434 1774 HA VAL 111 HA VAL 111 -2.608 12.661 5.598 1775 HB VAL 111 HB VAL 111 -2.265 11.819 3.295 1776 HG11 VAL 111 1HG1 VAL 111 -0.115 10.660 3.650 1777 HG12 VAL 111 2HG1 VAL 111 -0.550 10.343 5.332 1778 HG13 VAL 111 3HG1 VAL 111 -0.311 12.002 4.779 1779 HG21 VAL 111 1HG2 VAL 111 -3.737 9.857 3.296 1780 HG22 VAL 111 2HG2 VAL 111 -2.686 9.036 4.450 1781 HG23 VAL 111 3HG2 VAL 111 -2.102 9.388 2.821 1782 H ALA 112 H ALA 112 -5.033 10.099 5.504 1783 HA ALA 112 HA ALA 112 -6.962 11.383 3.858 1784 HB1 ALA 112 1HB ALA 112 -7.045 8.979 4.322 1785 HB2 ALA 112 2HB ALA 112 -8.557 9.757 4.796 1786 HB3 ALA 112 3HB ALA 112 -7.373 9.296 6.026 1787 H ASN 113 H ASN 113 -6.361 11.372 7.368 1788 HA ASN 113 HA ASN 113 -8.673 12.837 8.149 1789 HB2 ASN 113 2HB ASN 113 -6.049 12.236 9.579 1790 HB3 ASN 113 3HB ASN 113 -7.274 13.263 10.321 1791 HD21 ASN 113 1HD2 ASN 113 -6.243 10.621 11.138 1792 HD22 ASN 113 2HD2 ASN 113 -7.627 9.594 11.267 1793 H MET 114 H MET 114 -5.556 13.862 6.933 1794 HA MET 114 HA MET 114 -5.699 16.608 7.747 1795 HB2 MET 114 2HB MET 114 -4.209 15.416 5.367 1796 HB3 MET 114 3HB MET 114 -3.959 17.025 6.032 1797 HG2 MET 114 2HG MET 114 -3.255 15.909 8.191 1798 HG3 MET 114 3HG MET 114 -3.276 14.380 7.310 1799 HE1 MET 114 1HE MET 114 -0.575 15.268 4.455 1800 HE2 MET 114 2HE MET 114 -2.271 15.733 4.351 1801 HE3 MET 114 3HE MET 114 -1.831 14.124 4.920 1802 H ILE 115 H ILE 115 -6.541 14.900 4.732 1803 HA ILE 115 HA ILE 115 -7.614 17.314 3.477 1804 HB ILE 115 HB ILE 115 -7.987 15.920 1.484 1805 HG12 ILE 115 2HG1 ILE 115 -6.987 13.528 3.114 1806 HG13 ILE 115 3HG1 ILE 115 -8.675 13.813 2.708 1807 HG21 ILE 115 1HG2 ILE 115 -5.736 16.846 1.837 1808 HG22 ILE 115 2HG2 ILE 115 -5.643 15.297 1.003 1809 HG23 ILE 115 3HG2 ILE 115 -5.258 15.396 2.722 1810 HD11 ILE 115 1HD1 ILE 115 -6.464 13.343 0.713 1811 HD12 ILE 115 2HD1 ILE 115 -8.177 13.561 0.351 1812 HD13 ILE 115 3HD1 ILE 115 -7.643 12.152 1.264 1813 H ARG 116 H ARG 116 -8.816 15.165 5.658 1814 HA ARG 116 HA ARG 116 -11.370 14.422 4.759 1815 HB2 ARG 116 2HB ARG 116 -10.143 13.393 6.641 1816 HB3 ARG 116 3HB ARG 116 -10.331 14.861 7.584 1817 HG2 ARG 116 2HG ARG 116 -12.757 14.482 7.723 1818 HG3 ARG 116 3HG ARG 116 -12.607 13.052 6.691 1819 HD2 ARG 116 2HD ARG 116 -11.177 11.961 8.367 1820 HD3 ARG 116 3HD ARG 116 -11.248 13.397 9.392 1821 HE ARG 116 HE ARG 116 -13.873 12.523 8.954 1822 HH11 ARG 116 1HH1 ARG 116 -10.953 11.381 10.562 1823 HH12 ARG 116 2HH1 ARG 116 -11.819 10.475 11.754 1824 HH21 ARG 116 1HH2 ARG 116 -14.999 11.334 10.551 1825 HH22 ARG 116 2HH2 ARG 116 -14.128 10.442 11.753 1826 H GLY 117 H GLY 117 -12.500 16.078 3.881 1827 HA2 GLY 117 2HA GLY 117 -13.356 18.359 5.568 1828 HA3 GLY 117 3HA GLY 117 -13.447 18.280 3.817 Start of MODEL 11 1 H1 SER 2 1H SER 2 -14.238 -15.440 -15.277 2 H2 SER 2 2H SER 2 -13.889 -14.614 -16.715 3 H3 SER 2 3H SER 2 -14.579 -16.156 -16.768 4 HA SER 2 HA SER 2 -16.176 -14.408 -17.249 5 HB2 SER 2 2HB SER 2 -16.723 -15.873 -14.634 6 HB3 SER 2 3HB SER 2 -17.926 -15.296 -15.785 7 HG SER 2 HG SER 2 -17.073 -17.640 -15.795 8 H LEU 3 H LEU 3 -17.711 -12.855 -16.154 9 HA LEU 3 HA LEU 3 -16.207 -10.793 -14.790 10 HB2 LEU 3 2HB LEU 3 -19.167 -10.895 -15.494 11 HB3 LEU 3 3HB LEU 3 -18.299 -9.471 -14.945 12 HG LEU 3 HG LEU 3 -17.786 -10.914 -17.571 13 HD11 LEU 3 1HD1 LEU 3 -18.883 -8.985 -18.634 14 HD12 LEU 3 2HD1 LEU 3 -19.268 -8.315 -17.047 15 HD13 LEU 3 3HD1 LEU 3 -19.985 -9.845 -17.560 16 HD21 LEU 3 1HD2 LEU 3 -16.658 -8.285 -16.547 17 HD22 LEU 3 2HD2 LEU 3 -16.400 -8.967 -18.156 18 HD23 LEU 3 3HD2 LEU 3 -15.765 -9.796 -16.738 19 H VAL 4 H VAL 4 -16.128 -10.486 -12.633 20 HA VAL 4 HA VAL 4 -18.306 -11.440 -10.870 21 HB VAL 4 HB VAL 4 -16.801 -10.844 -8.963 22 HG11 VAL 4 1HG1 VAL 4 -15.205 -12.720 -9.223 23 HG12 VAL 4 2HG1 VAL 4 -15.550 -12.774 -10.953 24 HG13 VAL 4 3HG1 VAL 4 -16.821 -13.149 -9.788 25 HG21 VAL 4 1HG2 VAL 4 -15.457 -9.071 -10.001 26 HG22 VAL 4 2HG2 VAL 4 -14.716 -10.236 -11.099 27 HG23 VAL 4 3HG2 VAL 4 -14.397 -10.333 -9.365 28 H LYS 5 H LYS 5 -19.429 -9.947 -9.612 29 HA LYS 5 HA LYS 5 -19.550 -7.239 -10.743 30 HB2 LYS 5 2HB LYS 5 -21.505 -8.695 -8.915 31 HB3 LYS 5 3HB LYS 5 -21.775 -7.135 -9.683 32 HG2 LYS 5 2HG LYS 5 -21.607 -8.288 -11.920 33 HG3 LYS 5 3HG LYS 5 -21.549 -9.831 -11.060 34 HD2 LYS 5 2HD LYS 5 -23.778 -9.343 -10.065 35 HD3 LYS 5 3HD LYS 5 -23.821 -7.808 -10.937 36 HE2 LYS 5 2HE LYS 5 -23.692 -9.097 -13.089 37 HE3 LYS 5 3HE LYS 5 -23.824 -10.587 -12.154 38 HZ1 LYS 5 1HZ LYS 5 -25.829 -8.406 -12.255 39 HZ2 LYS 5 2HZ LYS 5 -25.966 -9.803 -11.315 40 HZ3 LYS 5 3HZ LYS 5 -25.964 -9.913 -13.003 41 H LEU 6 H LEU 6 -18.654 -5.600 -9.653 42 HA LEU 6 HA LEU 6 -18.196 -5.792 -6.730 43 HB2 LEU 6 2HB LEU 6 -16.551 -4.193 -8.743 44 HB3 LEU 6 3HB LEU 6 -16.233 -4.343 -7.023 45 HG LEU 6 HG LEU 6 -15.972 -6.557 -9.097 46 HD11 LEU 6 1HD1 LEU 6 -14.166 -4.917 -9.230 47 HD12 LEU 6 2HD1 LEU 6 -13.567 -6.453 -8.616 48 HD13 LEU 6 3HD1 LEU 6 -13.834 -5.107 -7.506 49 HD21 LEU 6 1HD2 LEU 6 -16.743 -7.513 -6.981 50 HD22 LEU 6 2HD2 LEU 6 -15.435 -6.707 -6.114 51 HD23 LEU 6 3HD2 LEU 6 -15.069 -7.967 -7.296 52 H GLU 7 H GLU 7 -20.213 -4.820 -6.200 53 HA GLU 7 HA GLU 7 -20.997 -2.253 -7.257 54 HB2 GLU 7 2HB GLU 7 -21.961 -3.705 -4.750 55 HB3 GLU 7 3HB GLU 7 -22.647 -2.196 -5.347 56 HG2 GLU 7 2HG GLU 7 -24.134 -3.841 -6.080 57 HG3 GLU 7 3HG GLU 7 -23.174 -3.461 -7.501 58 H SER 8 H SER 8 -19.937 -0.408 -6.774 59 HA SER 8 HA SER 8 -18.280 0.048 -4.508 60 HB2 SER 8 2HB SER 8 -18.476 2.473 -5.252 61 HB3 SER 8 3HB SER 8 -17.991 1.360 -6.532 62 HG SER 8 HG SER 8 -19.927 1.530 -7.461 63 H SER 9 H SER 9 -18.830 2.084 -3.046 64 HA SER 9 HA SER 9 -21.066 1.604 -1.398 65 HB2 SER 9 2HB SER 9 -20.483 3.773 -0.334 66 HB3 SER 9 3HB SER 9 -19.050 2.794 -0.609 67 HG SER 9 HG SER 9 -18.673 4.913 -1.256 68 H ASP 10 H ASP 10 -20.612 3.567 -4.238 69 HA ASP 10 HA ASP 10 -23.149 4.978 -4.078 70 HB2 ASP 10 2HB ASP 10 -21.083 6.019 -5.001 71 HB3 ASP 10 3HB ASP 10 -21.061 4.827 -6.291 72 H GLU 11 H GLU 11 -22.539 1.857 -4.637 73 HA GLU 11 HA GLU 11 -23.823 0.116 -5.256 74 HB2 GLU 11 2HB GLU 11 -25.885 2.198 -6.078 75 HB3 GLU 11 3HB GLU 11 -26.187 0.469 -5.969 76 HG2 GLU 11 2HG GLU 11 -25.749 0.543 -3.535 77 HG3 GLU 11 3HG GLU 11 -25.447 2.276 -3.649 78 H LYS 12 H LYS 12 -22.286 2.004 -7.376 79 HA LYS 12 HA LYS 12 -23.338 1.125 -9.891 80 HB2 LYS 12 2HB LYS 12 -20.632 2.284 -9.120 81 HB3 LYS 12 3HB LYS 12 -21.062 1.900 -10.778 82 HG2 LYS 12 2HG LYS 12 -22.821 3.789 -9.216 83 HG3 LYS 12 3HG LYS 12 -21.280 4.361 -9.839 84 HD2 LYS 12 2HD LYS 12 -22.886 4.971 -11.468 85 HD3 LYS 12 3HD LYS 12 -22.038 3.584 -12.142 86 HE2 LYS 12 2HE LYS 12 -23.932 2.132 -11.484 87 HE3 LYS 12 3HE LYS 12 -24.777 3.539 -10.836 88 HZ1 LYS 12 1HZ LYS 12 -24.770 4.507 -13.057 89 HZ2 LYS 12 2HZ LYS 12 -25.544 3.006 -13.055 90 HZ3 LYS 12 3HZ LYS 12 -23.975 3.147 -13.672 91 H VAL 13 H VAL 13 -23.124 -0.804 -10.796 92 HA VAL 13 HA VAL 13 -21.667 -2.927 -9.429 93 HB VAL 13 HB VAL 13 -23.538 -3.117 -11.842 94 HG11 VAL 13 1HG1 VAL 13 -23.834 -5.471 -11.206 95 HG12 VAL 13 2HG1 VAL 13 -22.703 -5.268 -9.867 96 HG13 VAL 13 3HG1 VAL 13 -22.137 -5.111 -11.530 97 HG21 VAL 13 1HG2 VAL 13 -25.369 -3.640 -10.294 98 HG22 VAL 13 2HG2 VAL 13 -24.710 -2.040 -9.952 99 HG23 VAL 13 3HG2 VAL 13 -24.297 -3.405 -8.912 100 H PHE 14 H PHE 14 -19.521 -2.675 -9.980 101 HA PHE 14 HA PHE 14 -18.615 -2.361 -12.722 102 HB2 PHE 14 2HB PHE 14 -17.083 -2.780 -10.120 103 HB3 PHE 14 3HB PHE 14 -16.316 -2.546 -11.687 104 HD1 PHE 14 HD1 PHE 14 -18.042 -0.884 -8.904 105 HD2 PHE 14 HD2 PHE 14 -16.466 -0.348 -12.843 106 HE1 PHE 14 HE1 PHE 14 -18.141 1.556 -8.617 107 HE2 PHE 14 HE2 PHE 14 -16.565 2.089 -12.541 108 HZ PHE 14 HZ PHE 14 -17.403 3.044 -10.431 109 H GLU 15 H GLU 15 -19.489 -4.179 -13.680 110 HA GLU 15 HA GLU 15 -18.799 -6.875 -12.912 111 HB2 GLU 15 2HB GLU 15 -19.987 -5.842 -15.524 112 HB3 GLU 15 3HB GLU 15 -19.991 -7.514 -14.964 113 HG2 GLU 15 2HG GLU 15 -21.440 -6.876 -13.067 114 HG3 GLU 15 3HG GLU 15 -21.419 -5.202 -13.618 115 H ILE 16 H ILE 16 -16.585 -6.979 -12.872 116 HA ILE 16 HA ILE 16 -15.065 -6.480 -15.374 117 HB ILE 16 HB ILE 16 -14.667 -4.788 -13.522 118 HG12 ILE 16 2HG1 ILE 16 -12.189 -6.449 -14.152 119 HG13 ILE 16 3HG1 ILE 16 -12.942 -5.344 -15.290 120 HG21 ILE 16 1HG2 ILE 16 -13.383 -5.429 -11.515 121 HG22 ILE 16 2HG2 ILE 16 -13.438 -7.122 -12.006 122 HG23 ILE 16 3HG2 ILE 16 -14.928 -6.282 -11.576 123 HD11 ILE 16 1HD1 ILE 16 -11.682 -4.599 -12.659 124 HD12 ILE 16 2HD1 ILE 16 -12.480 -3.478 -13.766 125 HD13 ILE 16 3HD1 ILE 16 -11.023 -4.331 -14.273 126 H GLU 17 H GLU 17 -13.188 -7.920 -15.650 127 HA GLU 17 HA GLU 17 -13.831 -10.640 -15.316 128 HB2 GLU 17 2HB GLU 17 -11.076 -9.456 -15.868 129 HB3 GLU 17 3HB GLU 17 -11.565 -11.118 -16.181 130 HG2 GLU 17 2HG GLU 17 -13.170 -10.330 -17.883 131 HG3 GLU 17 3HG GLU 17 -12.703 -8.664 -17.553 132 H LYS 18 H LYS 18 -13.203 -12.212 -13.886 133 HA LYS 18 HA LYS 18 -12.712 -11.532 -11.211 134 HB2 LYS 18 2HB LYS 18 -13.823 -13.657 -11.939 135 HB3 LYS 18 3HB LYS 18 -12.272 -14.256 -12.517 136 HG2 LYS 18 2HG LYS 18 -11.379 -14.228 -10.217 137 HG3 LYS 18 3HG LYS 18 -12.896 -13.545 -9.624 138 HD2 LYS 18 2HD LYS 18 -12.848 -15.929 -9.131 139 HD3 LYS 18 3HD LYS 18 -14.085 -15.616 -10.350 140 HE2 LYS 18 2HE LYS 18 -12.875 -17.631 -10.927 141 HE3 LYS 18 3HE LYS 18 -12.486 -16.385 -12.109 142 HZ1 LYS 18 1HZ LYS 18 -10.513 -17.543 -11.483 143 HZ2 LYS 18 2HZ LYS 18 -10.805 -17.278 -9.841 144 HZ3 LYS 18 3HZ LYS 18 -10.426 -15.981 -10.848 145 H GLU 19 H GLU 19 -10.534 -12.380 -13.813 146 HA GLU 19 HA GLU 19 -8.147 -12.881 -12.422 147 HB2 GLU 19 2HB GLU 19 -8.425 -11.531 -15.139 148 HB3 GLU 19 3HB GLU 19 -6.999 -12.367 -14.526 149 HG2 GLU 19 2HG GLU 19 -8.305 -14.492 -14.494 150 HG3 GLU 19 3HG GLU 19 -9.664 -13.634 -15.221 151 H ILE 20 H ILE 20 -9.583 -9.842 -13.504 152 HA ILE 20 HA ILE 20 -7.360 -8.155 -12.756 153 HB ILE 20 HB ILE 20 -10.234 -7.277 -13.332 154 HG12 ILE 20 2HG1 ILE 20 -7.976 -7.666 -15.356 155 HG13 ILE 20 3HG1 ILE 20 -9.366 -8.727 -15.189 156 HG21 ILE 20 1HG2 ILE 20 -8.791 -5.534 -12.338 157 HG22 ILE 20 2HG2 ILE 20 -9.177 -5.139 -14.012 158 HG23 ILE 20 3HG2 ILE 20 -7.588 -5.788 -13.607 159 HD11 ILE 20 1HD1 ILE 20 -10.843 -6.936 -15.875 160 HD12 ILE 20 2HD1 ILE 20 -9.581 -7.215 -17.075 161 HD13 ILE 20 3HD1 ILE 20 -9.474 -5.830 -15.993 162 H ALA 21 H ALA 21 -10.455 -9.125 -11.354 163 HA ALA 21 HA ALA 21 -10.379 -7.513 -9.013 164 HB1 ALA 21 1HB ALA 21 -12.436 -8.573 -9.835 165 HB2 ALA 21 2HB ALA 21 -12.117 -9.032 -8.164 166 HB3 ALA 21 3HB ALA 21 -11.777 -10.169 -9.473 167 H CYS 22 H CYS 22 -8.895 -10.584 -9.847 168 HA CYS 22 HA CYS 22 -8.006 -11.255 -7.193 169 HB2 CYS 22 2HB CYS 22 -7.177 -12.313 -9.919 170 HB3 CYS 22 3HB CYS 22 -6.632 -12.987 -8.382 171 HG CYS 22 HG CYS 22 -9.964 -12.727 -8.691 172 H MET 23 H MET 23 -6.767 -9.263 -9.806 173 HA MET 23 HA MET 23 -4.089 -8.921 -8.932 174 HB2 MET 23 2HB MET 23 -5.915 -6.954 -10.378 175 HB3 MET 23 3HB MET 23 -4.191 -6.711 -10.153 176 HG2 MET 23 2HG MET 23 -3.691 -8.646 -11.543 177 HG3 MET 23 3HG MET 23 -5.407 -9.025 -11.682 178 HE1 MET 23 1HE MET 23 -3.477 -5.268 -13.615 179 HE2 MET 23 2HE MET 23 -2.559 -6.444 -12.674 180 HE3 MET 23 3HE MET 23 -3.733 -5.398 -11.873 181 H SER 24 H SER 24 -7.128 -7.536 -7.785 182 HA SER 24 HA SER 24 -5.935 -6.061 -5.610 183 HB2 SER 24 2HB SER 24 -8.741 -7.243 -5.882 184 HB3 SER 24 3HB SER 24 -8.227 -6.096 -4.644 185 HG SER 24 HG SER 24 -8.315 -4.537 -6.035 186 H VAL 25 H VAL 25 -4.791 -7.117 -4.061 187 HA VAL 25 HA VAL 25 -4.840 -9.906 -3.565 188 HB VAL 25 HB VAL 25 -3.742 -7.667 -1.795 189 HG11 VAL 25 1HG1 VAL 25 -3.153 -10.653 -1.657 190 HG12 VAL 25 2HG1 VAL 25 -4.052 -9.715 -0.465 191 HG13 VAL 25 3HG1 VAL 25 -2.335 -9.401 -0.715 192 HG21 VAL 25 1HG2 VAL 25 -2.699 -7.696 -4.031 193 HG22 VAL 25 2HG2 VAL 25 -2.307 -9.407 -3.848 194 HG23 VAL 25 3HG2 VAL 25 -1.543 -8.210 -2.799 195 H THR 26 H THR 26 -6.667 -7.222 -2.213 196 HA THR 26 HA THR 26 -7.628 -8.520 0.144 197 HB THR 26 HB THR 26 -8.709 -6.126 -1.402 198 HG1 THR 26 HG1 THR 26 -7.704 -5.037 0.438 199 HG21 THR 26 1HG2 THR 26 -9.949 -5.531 0.649 200 HG22 THR 26 2HG2 THR 26 -9.466 -7.055 1.394 201 HG23 THR 26 3HG2 THR 26 -10.526 -7.059 -0.018 202 H ILE 27 H ILE 27 -9.038 -8.052 -3.123 203 HA ILE 27 HA ILE 27 -11.490 -9.447 -2.527 204 HB ILE 27 HB ILE 27 -10.296 -8.432 -5.141 205 HG12 ILE 27 2HG1 ILE 27 -12.310 -6.944 -5.166 206 HG13 ILE 27 3HG1 ILE 27 -12.836 -7.628 -3.636 207 HG21 ILE 27 1HG2 ILE 27 -12.918 -9.958 -4.887 208 HG22 ILE 27 2HG2 ILE 27 -11.473 -10.498 -5.743 209 HG23 ILE 27 3HG2 ILE 27 -12.372 -9.101 -6.330 210 HD11 ILE 27 1HD1 ILE 27 -10.879 -6.657 -2.547 211 HD12 ILE 27 2HD1 ILE 27 -11.852 -5.437 -3.371 212 HD13 ILE 27 3HD1 ILE 27 -10.347 -5.998 -4.096 213 H LYS 28 H LYS 28 -8.378 -10.291 -4.002 214 HA LYS 28 HA LYS 28 -8.832 -12.930 -4.807 215 HB2 LYS 28 2HB LYS 28 -6.728 -11.861 -5.352 216 HB3 LYS 28 3HB LYS 28 -6.355 -11.568 -3.655 217 HG2 LYS 28 2HG LYS 28 -6.070 -13.985 -3.293 218 HG3 LYS 28 3HG LYS 28 -6.463 -14.290 -4.986 219 HD2 LYS 28 2HD LYS 28 -4.444 -13.203 -5.737 220 HD3 LYS 28 3HD LYS 28 -4.111 -12.571 -4.119 221 HE2 LYS 28 2HE LYS 28 -2.705 -14.553 -4.770 222 HE3 LYS 28 3HE LYS 28 -3.613 -14.775 -3.275 223 HZ1 LYS 28 1HZ LYS 28 -4.529 -15.781 -5.913 224 HZ2 LYS 28 2HZ LYS 28 -5.184 -16.138 -4.395 225 HZ3 LYS 28 3HZ LYS 28 -3.648 -16.709 -4.810 226 H ASN 29 H ASN 29 -7.729 -11.699 -1.650 227 HA ASN 29 HA ASN 29 -7.689 -14.116 -0.214 228 HB2 ASN 29 2HB ASN 29 -7.907 -11.218 0.689 229 HB3 ASN 29 3HB ASN 29 -7.927 -12.537 1.855 230 HD21 ASN 29 1HD2 ASN 29 -6.019 -11.754 2.807 231 HD22 ASN 29 2HD2 ASN 29 -4.475 -11.945 2.055 232 H MET 30 H MET 30 -10.287 -11.734 -0.724 233 HA MET 30 HA MET 30 -12.181 -12.754 1.094 234 HB2 MET 30 2HB MET 30 -12.525 -11.163 -1.479 235 HB3 MET 30 3HB MET 30 -13.911 -11.669 -0.524 236 HG2 MET 30 2HG MET 30 -13.055 -10.386 1.399 237 HG3 MET 30 3HG MET 30 -11.675 -9.870 0.424 238 HE1 MET 30 1HE MET 30 -12.375 -7.299 1.073 239 HE2 MET 30 2HE MET 30 -13.784 -7.889 1.955 240 HE3 MET 30 3HE MET 30 -13.972 -6.632 0.733 241 H ILE 31 H ILE 31 -11.832 -13.362 -2.411 242 HA ILE 31 HA ILE 31 -13.997 -15.118 -2.731 243 HB ILE 31 HB ILE 31 -11.421 -14.894 -4.372 244 HG12 ILE 31 2HG1 ILE 31 -14.208 -13.738 -4.888 245 HG13 ILE 31 3HG1 ILE 31 -12.818 -12.822 -4.322 246 HG21 ILE 31 1HG2 ILE 31 -12.605 -16.079 -6.203 247 HG22 ILE 31 2HG2 ILE 31 -13.985 -16.350 -5.139 248 HG23 ILE 31 3HG2 ILE 31 -12.433 -17.106 -4.779 249 HD11 ILE 31 1HD1 ILE 31 -11.666 -13.297 -6.442 250 HD12 ILE 31 2HD1 ILE 31 -13.186 -12.433 -6.667 251 HD13 ILE 31 3HD1 ILE 31 -13.098 -14.159 -7.010 252 H GLU 32 H GLU 32 -10.539 -15.812 -2.103 253 HA GLU 32 HA GLU 32 -10.825 -18.661 -2.216 254 HB2 GLU 32 2HB GLU 32 -8.571 -16.983 -1.031 255 HB3 GLU 32 3HB GLU 32 -8.496 -18.714 -1.355 256 HG2 GLU 32 2HG GLU 32 -8.772 -18.297 -3.767 257 HG3 GLU 32 3HG GLU 32 -8.876 -16.564 -3.463 258 H ASP 33 H ASP 33 -10.894 -16.308 0.439 259 HA ASP 33 HA ASP 33 -10.769 -18.146 2.624 260 HB2 ASP 33 2HB ASP 33 -10.255 -15.746 2.903 261 HB3 ASP 33 3HB ASP 33 -11.914 -15.317 2.505 262 H ILE 34 H ILE 34 -13.440 -16.711 0.805 263 HA ILE 34 HA ILE 34 -15.553 -17.926 2.325 264 HB ILE 34 HB ILE 34 -15.636 -16.818 -0.533 265 HG12 ILE 34 2HG1 ILE 34 -14.946 -15.053 1.015 266 HG13 ILE 34 3HG1 ILE 34 -16.594 -14.746 0.504 267 HG21 ILE 34 1HG2 ILE 34 -17.550 -18.284 -0.103 268 HG22 ILE 34 2HG2 ILE 34 -18.077 -16.606 -0.194 269 HG23 ILE 34 3HG2 ILE 34 -17.934 -17.400 1.375 270 HD11 ILE 34 1HD1 ILE 34 -15.716 -15.870 3.159 271 HD12 ILE 34 2HD1 ILE 34 -17.391 -15.612 2.664 272 HD13 ILE 34 3HD1 ILE 34 -16.299 -14.241 2.835 273 H GLY 35 H GLY 35 -13.709 -18.753 -0.575 274 HA2 GLY 35 2HA GLY 35 -13.204 -21.000 -1.212 275 HA3 GLY 35 3HA GLY 35 -14.738 -21.531 -0.536 276 H GLU 36 H GLU 36 -14.616 -18.661 -2.451 277 HA GLU 36 HA GLU 36 -15.294 -17.962 -4.452 278 HB2 GLU 36 2HB GLU 36 -13.860 -19.728 -5.441 279 HB3 GLU 36 3HB GLU 36 -15.188 -20.876 -5.329 280 HG2 GLU 36 2HG GLU 36 -16.506 -19.453 -6.904 281 HG3 GLU 36 3HG GLU 36 -15.111 -18.387 -7.074 282 H SER 37 H SER 37 -17.299 -17.268 -4.987 283 HA SER 37 HA SER 37 -19.650 -18.976 -4.599 284 HB2 SER 37 2HB SER 37 -19.192 -16.363 -3.096 285 HB3 SER 37 3HB SER 37 -20.742 -17.200 -3.174 286 HG SER 37 HG SER 37 -18.927 -18.984 -2.437 287 H ASP 38 H ASP 38 -21.555 -18.129 -5.440 288 HA ASP 38 HA ASP 38 -21.337 -16.572 -7.855 289 HB2 ASP 38 2HB ASP 38 -23.775 -17.703 -6.395 290 HB3 ASP 38 3HB ASP 38 -23.801 -16.989 -8.005 291 H SER 39 H SER 39 -21.832 -15.836 -4.582 292 HA SER 39 HA SER 39 -23.382 -13.515 -4.655 293 HB2 SER 39 2HB SER 39 -21.108 -14.241 -2.758 294 HB3 SER 39 3HB SER 39 -22.373 -13.047 -2.449 295 HG SER 39 HG SER 39 -23.746 -14.605 -2.018 296 HA PRO 40 HA PRO 40 -20.369 -10.617 -6.542 297 HB2 PRO 40 2HB PRO 40 -21.802 -8.310 -6.053 298 HB3 PRO 40 3HB PRO 40 -22.174 -9.415 -7.390 299 HG2 PRO 40 2HG PRO 40 -23.501 -9.189 -4.715 300 HG3 PRO 40 3HG PRO 40 -24.232 -9.406 -6.322 301 HD2 PRO 40 2HD PRO 40 -23.904 -11.477 -4.593 302 HD3 PRO 40 3HD PRO 40 -23.819 -11.687 -6.355 303 H ILE 41 H ILE 41 -18.994 -8.859 -5.731 304 HA ILE 41 HA ILE 41 -18.666 -8.911 -2.784 305 HB ILE 41 HB ILE 41 -16.565 -8.336 -4.922 306 HG12 ILE 41 2HG1 ILE 41 -17.179 -10.733 -4.913 307 HG13 ILE 41 3HG1 ILE 41 -15.545 -10.514 -4.305 308 HG21 ILE 41 1HG2 ILE 41 -14.909 -8.393 -3.083 309 HG22 ILE 41 2HG2 ILE 41 -16.218 -8.575 -1.915 310 HG23 ILE 41 3HG2 ILE 41 -16.085 -7.095 -2.865 311 HD11 ILE 41 1HD1 ILE 41 -18.013 -11.059 -2.650 312 HD12 ILE 41 2HD1 ILE 41 -16.393 -10.796 -2.001 313 HD13 ILE 41 3HD1 ILE 41 -16.717 -12.194 -3.022 314 HA PRO 42 HA PRO 42 -19.793 -4.504 -3.532 315 HB2 PRO 42 2HB PRO 42 -21.191 -4.094 -1.236 316 HB3 PRO 42 3HB PRO 42 -21.906 -4.940 -2.622 317 HG2 PRO 42 2HG PRO 42 -20.770 -6.086 -0.103 318 HG3 PRO 42 3HG PRO 42 -22.233 -6.559 -0.995 319 HD2 PRO 42 2HD PRO 42 -19.802 -7.879 -1.192 320 HD3 PRO 42 3HD PRO 42 -21.056 -7.910 -2.450 321 H LEU 43 H LEU 43 -18.393 -2.960 -3.057 322 HA LEU 43 HA LEU 43 -16.599 -3.101 -0.721 323 HB2 LEU 43 2HB LEU 43 -16.258 -1.667 -3.394 324 HB3 LEU 43 3HB LEU 43 -15.047 -1.776 -2.127 325 HG LEU 43 HG LEU 43 -16.133 -4.183 -3.646 326 HD11 LEU 43 1HD1 LEU 43 -14.941 -2.771 -5.215 327 HD12 LEU 43 2HD1 LEU 43 -13.988 -4.213 -4.874 328 HD13 LEU 43 3HD1 LEU 43 -13.551 -2.673 -4.133 329 HD21 LEU 43 1HD2 LEU 43 -13.782 -3.952 -1.737 330 HD22 LEU 43 2HD2 LEU 43 -14.196 -5.387 -2.679 331 HD23 LEU 43 3HD2 LEU 43 -15.305 -4.799 -1.444 332 HA PRO 44 HA PRO 44 -19.561 0.397 0.067 333 HB2 PRO 44 2HB PRO 44 -19.888 0.088 2.732 334 HB3 PRO 44 3HB PRO 44 -20.599 -1.065 1.582 335 HG2 PRO 44 2HG PRO 44 -18.075 -1.337 3.184 336 HG3 PRO 44 3HG PRO 44 -19.378 -2.522 2.933 337 HD2 PRO 44 2HD PRO 44 -17.034 -2.533 1.489 338 HD3 PRO 44 3HD PRO 44 -18.571 -3.168 0.863 339 H ASN 45 H ASN 45 -16.331 0.011 0.982 340 HA ASN 45 HA ASN 45 -16.015 2.417 2.573 341 HB2 ASN 45 2HB ASN 45 -14.555 0.498 3.004 342 HB3 ASN 45 3HB ASN 45 -13.996 0.489 1.337 343 HD21 ASN 45 1HD2 ASN 45 -13.746 2.085 4.434 344 HD22 ASN 45 2HD2 ASN 45 -12.332 3.004 4.074 345 H VAL 46 H VAL 46 -15.459 1.406 -0.771 346 HA VAL 46 HA VAL 46 -14.294 4.028 -1.475 347 HB VAL 46 HB VAL 46 -12.894 2.067 -1.990 348 HG11 VAL 46 1HG1 VAL 46 -15.124 1.123 -3.817 349 HG12 VAL 46 2HG1 VAL 46 -14.624 0.366 -2.305 350 HG13 VAL 46 3HG1 VAL 46 -13.519 0.393 -3.680 351 HG21 VAL 46 1HG2 VAL 46 -12.400 2.555 -4.366 352 HG22 VAL 46 2HG2 VAL 46 -12.672 4.031 -3.442 353 HG23 VAL 46 3HG2 VAL 46 -13.935 3.418 -4.512 354 H THR 47 H THR 47 -15.280 5.373 -2.936 355 HA THR 47 HA THR 47 -18.047 4.909 -3.666 356 HB THR 47 HB THR 47 -17.887 7.229 -4.666 357 HG1 THR 47 HG1 THR 47 -15.982 8.206 -4.802 358 HG21 THR 47 1HG2 THR 47 -18.565 6.985 -2.301 359 HG22 THR 47 2HG2 THR 47 -17.590 8.438 -2.521 360 HG23 THR 47 3HG2 THR 47 -16.873 6.996 -1.801 361 H SER 48 H SER 48 -18.671 5.656 -5.983 362 HA SER 48 HA SER 48 -17.776 3.670 -7.783 363 HB2 SER 48 2HB SER 48 -19.276 4.891 -9.421 364 HB3 SER 48 3HB SER 48 -20.046 4.466 -7.891 365 HG SER 48 HG SER 48 -20.504 6.623 -8.483 366 H THR 49 H THR 49 -17.277 7.171 -7.700 367 HA THR 49 HA THR 49 -15.948 7.517 -10.144 368 HB THR 49 HB THR 49 -15.166 9.699 -9.068 369 HG1 THR 49 HG1 THR 49 -15.622 10.035 -6.951 370 HG21 THR 49 1HG2 THR 49 -17.352 9.621 -10.233 371 HG22 THR 49 2HG2 THR 49 -17.448 10.655 -8.806 372 HG23 THR 49 3HG2 THR 49 -18.126 9.028 -8.760 373 H ILE 50 H ILE 50 -14.720 6.715 -6.936 374 HA ILE 50 HA ILE 50 -11.921 7.051 -7.631 375 HB ILE 50 HB ILE 50 -13.211 5.823 -5.146 376 HG12 ILE 50 2HG1 ILE 50 -13.900 8.142 -5.341 377 HG13 ILE 50 3HG1 ILE 50 -12.686 8.048 -4.074 378 HG21 ILE 50 1HG2 ILE 50 -10.892 5.068 -5.382 379 HG22 ILE 50 2HG2 ILE 50 -11.042 6.188 -4.030 380 HG23 ILE 50 3HG2 ILE 50 -10.343 6.738 -5.553 381 HD11 ILE 50 1HD1 ILE 50 -12.281 9.077 -6.885 382 HD12 ILE 50 2HD1 ILE 50 -11.004 8.919 -5.676 383 HD13 ILE 50 3HD1 ILE 50 -12.347 10.025 -5.400 384 H LEU 51 H LEU 51 -14.141 4.349 -6.935 385 HA LEU 51 HA LEU 51 -12.321 2.212 -7.233 386 HB2 LEU 51 2HB LEU 51 -14.531 2.034 -6.081 387 HB3 LEU 51 3HB LEU 51 -15.346 2.186 -7.627 388 HG LEU 51 HG LEU 51 -14.406 0.014 -8.362 389 HD11 LEU 51 1HD1 LEU 51 -12.275 0.043 -7.164 390 HD12 LEU 51 2HD1 LEU 51 -13.161 -1.439 -6.821 391 HD13 LEU 51 3HD1 LEU 51 -13.112 -0.147 -5.620 392 HD21 LEU 51 1HD2 LEU 51 -16.575 0.012 -7.193 393 HD22 LEU 51 2HD2 LEU 51 -15.755 -0.199 -5.645 394 HD23 LEU 51 3HD2 LEU 51 -15.673 -1.468 -6.868 395 H GLU 52 H GLU 52 -14.187 4.048 -9.547 396 HA GLU 52 HA GLU 52 -14.145 2.319 -11.760 397 HB2 GLU 52 2HB GLU 52 -15.604 4.317 -11.594 398 HB3 GLU 52 3HB GLU 52 -14.198 5.371 -11.749 399 HG2 GLU 52 2HG GLU 52 -13.787 4.552 -14.007 400 HG3 GLU 52 3HG GLU 52 -15.089 3.374 -13.855 401 H LYS 53 H LYS 53 -11.953 4.988 -10.844 402 HA LYS 53 HA LYS 53 -10.222 4.824 -13.089 403 HB2 LYS 53 2HB LYS 53 -9.343 5.787 -10.340 404 HB3 LYS 53 3HB LYS 53 -8.741 6.294 -11.914 405 HG2 LYS 53 2HG LYS 53 -10.959 7.385 -12.337 406 HG3 LYS 53 3HG LYS 53 -11.422 6.956 -10.687 407 HD2 LYS 53 2HD LYS 53 -9.213 8.209 -10.001 408 HD3 LYS 53 3HD LYS 53 -9.317 8.923 -11.611 409 HE2 LYS 53 2HE LYS 53 -11.350 9.121 -9.383 410 HE3 LYS 53 3HE LYS 53 -10.334 10.413 -10.012 411 HZ1 LYS 53 1HZ LYS 53 -12.580 9.061 -11.376 412 HZ2 LYS 53 2HZ LYS 53 -11.504 10.089 -12.167 413 HZ3 LYS 53 3HZ LYS 53 -12.473 10.685 -10.920 414 H VAL 54 H VAL 54 -10.139 3.402 -9.869 415 HA VAL 54 HA VAL 54 -7.561 2.286 -9.884 416 HB VAL 54 HB VAL 54 -10.071 1.470 -8.338 417 HG11 VAL 54 1HG1 VAL 54 -8.567 0.300 -6.758 418 HG12 VAL 54 2HG1 VAL 54 -7.200 0.619 -7.827 419 HG13 VAL 54 3HG1 VAL 54 -8.517 -0.421 -8.367 420 HG21 VAL 54 1HG2 VAL 54 -9.083 2.744 -6.470 421 HG22 VAL 54 2HG2 VAL 54 -9.294 3.778 -7.884 422 HG23 VAL 54 3HG2 VAL 54 -7.691 3.166 -7.472 423 H LEU 55 H LEU 55 -10.728 0.823 -10.647 424 HA LEU 55 HA LEU 55 -9.668 -1.721 -11.443 425 HB2 LEU 55 2HB LEU 55 -12.412 -0.473 -11.828 426 HB3 LEU 55 3HB LEU 55 -12.019 -2.115 -12.308 427 HG LEU 55 HG LEU 55 -12.018 -1.036 -9.461 428 HD11 LEU 55 1HD1 LEU 55 -14.266 -1.383 -10.374 429 HD12 LEU 55 2HD1 LEU 55 -13.913 -2.547 -9.102 430 HD13 LEU 55 3HD1 LEU 55 -13.859 -3.051 -10.795 431 HD21 LEU 55 1HD2 LEU 55 -10.222 -2.689 -9.694 432 HD22 LEU 55 2HD2 LEU 55 -11.343 -3.846 -10.414 433 HD23 LEU 55 3HD2 LEU 55 -11.543 -3.350 -8.732 434 H ASP 56 H ASP 56 -10.335 1.268 -13.121 435 HA ASP 56 HA ASP 56 -10.438 0.298 -15.799 436 HB2 ASP 56 2HB ASP 56 -11.353 2.486 -15.225 437 HB3 ASP 56 3HB ASP 56 -9.788 3.058 -14.672 438 H TYR 57 H TYR 57 -7.836 1.873 -13.923 439 HA TYR 57 HA TYR 57 -5.771 1.643 -15.806 440 HB2 TYR 57 2HB TYR 57 -5.486 3.110 -13.881 441 HB3 TYR 57 3HB TYR 57 -5.642 1.762 -12.757 442 HD1 TYR 57 HD1 TYR 57 -3.719 0.284 -12.298 443 HD2 TYR 57 HD2 TYR 57 -3.384 3.383 -15.226 444 HE1 TYR 57 HE1 TYR 57 -1.298 -0.086 -12.397 445 HE2 TYR 57 HE2 TYR 57 -0.961 3.009 -15.312 446 HH TYR 57 HH TYR 57 0.822 2.039 -14.069 447 H CYS 58 H CYS 58 -6.722 -0.519 -13.125 448 HA CYS 58 HA CYS 58 -4.688 -2.456 -13.478 449 HB2 CYS 58 2HB CYS 58 -7.411 -2.696 -12.136 450 HB3 CYS 58 3HB CYS 58 -6.107 -3.878 -11.980 451 HG CYS 58 HG CYS 58 -6.677 -1.366 -10.101 452 H ARG 59 H ARG 59 -7.896 -2.105 -14.896 453 HA ARG 59 HA ARG 59 -8.134 -4.629 -16.158 454 HB2 ARG 59 2HB ARG 59 -10.088 -3.195 -15.947 455 HB3 ARG 59 3HB ARG 59 -9.325 -1.921 -16.896 456 HG2 ARG 59 2HG ARG 59 -9.425 -3.322 -18.908 457 HG3 ARG 59 3HG ARG 59 -10.111 -4.655 -17.972 458 HD2 ARG 59 2HD ARG 59 -11.829 -3.415 -19.263 459 HD3 ARG 59 3HD ARG 59 -12.129 -3.358 -17.524 460 HE ARG 59 HE ARG 59 -10.649 -1.071 -18.325 461 HH11 ARG 59 1HH1 ARG 59 -13.911 -2.399 -18.550 462 HH12 ARG 59 2HH1 ARG 59 -14.667 -0.838 -18.678 463 HH21 ARG 59 1HH2 ARG 59 -11.662 0.970 -18.489 464 HH22 ARG 59 2HH2 ARG 59 -13.389 1.068 -18.639 465 H HIS 60 H HIS 60 -6.990 -1.500 -17.379 466 HA HIS 60 HA HIS 60 -6.116 -2.359 -19.927 467 HB2 HIS 60 2HB HIS 60 -6.525 -0.011 -19.475 468 HB3 HIS 60 3HB HIS 60 -5.316 0.014 -18.196 469 HD1 HIS 60 HD1 HIS 60 -2.928 0.444 -18.866 470 HD2 HIS 60 HD2 HIS 60 -5.418 -0.092 -22.146 471 HE1 HIS 60 HE1 HIS 60 -1.557 1.092 -20.853 472 HE2 HIS 60 HE2 HIS 60 -3.140 0.952 -22.798 473 H HIS 61 H HIS 61 -4.534 -2.287 -16.784 474 HA HIS 61 HA HIS 61 -1.892 -2.925 -17.743 475 HB2 HIS 61 2HB HIS 61 -2.512 -1.696 -15.533 476 HB3 HIS 61 3HB HIS 61 -2.877 -3.289 -14.881 477 HD1 HIS 61 HD1 HIS 61 -0.713 -5.041 -15.106 478 HD2 HIS 61 HD2 HIS 61 0.079 -0.961 -15.172 479 HE1 HIS 61 HE1 HIS 61 1.735 -4.826 -14.617 480 HE2 HIS 61 HE2 HIS 61 2.190 -2.351 -14.621 481 H HIS 62 H HIS 62 -4.752 -4.714 -16.926 482 HA HIS 62 HA HIS 62 -3.436 -7.301 -16.845 483 HB2 HIS 62 2HB HIS 62 -5.539 -6.917 -15.595 484 HB3 HIS 62 3HB HIS 62 -6.396 -6.589 -17.099 485 HD1 HIS 62 HD1 HIS 62 -4.566 -9.402 -15.360 486 HD2 HIS 62 HD2 HIS 62 -7.418 -8.850 -18.321 487 HE1 HIS 62 HE1 HIS 62 -5.325 -11.701 -16.002 488 HE2 HIS 62 HE2 HIS 62 -7.036 -11.350 -17.804 489 H GLN 63 H GLN 63 -4.981 -5.224 -19.242 490 HA GLN 63 HA GLN 63 -5.118 -7.148 -21.365 491 HB2 GLN 63 2HB GLN 63 -4.938 -4.110 -21.637 492 HB3 GLN 63 3HB GLN 63 -5.481 -5.236 -22.870 493 HG2 GLN 63 2HG GLN 63 -6.906 -4.412 -20.343 494 HG3 GLN 63 3HG GLN 63 -7.420 -4.162 -22.002 495 HE21 GLN 63 1HE2 GLN 63 -7.346 -6.350 -19.330 496 HE22 GLN 63 2HE2 GLN 63 -8.339 -7.583 -20.025 497 H HIS 64 H HIS 64 -2.715 -4.834 -20.234 498 HA HIS 64 HA HIS 64 -0.638 -6.135 -21.895 499 HB2 HIS 64 2HB HIS 64 -0.773 -3.166 -21.174 500 HB3 HIS 64 3HB HIS 64 0.551 -3.952 -22.029 501 HD1 HIS 64 HD1 HIS 64 0.187 -4.511 -24.514 502 HD2 HIS 64 HD2 HIS 64 -3.084 -2.670 -22.738 503 HE1 HIS 64 HE1 HIS 64 -1.336 -3.888 -26.401 504 HE2 HIS 64 HE2 HIS 64 -3.380 -2.948 -25.289 505 HA PRO 65 HA PRO 65 0.207 -6.680 -17.335 506 HB2 PRO 65 2HB PRO 65 1.269 -9.212 -17.526 507 HB3 PRO 65 3HB PRO 65 -0.474 -8.895 -17.443 508 HG2 PRO 65 2HG PRO 65 1.221 -9.420 -19.864 509 HG3 PRO 65 3HG PRO 65 -0.362 -10.109 -19.430 510 HD2 PRO 65 2HD PRO 65 -0.144 -8.078 -21.197 511 HD3 PRO 65 3HD PRO 65 -1.526 -8.197 -20.083 512 H GLY 66 H GLY 66 2.275 -6.929 -20.150 513 HA2 GLY 66 2HA GLY 66 4.481 -5.633 -18.864 514 HA3 GLY 66 3HA GLY 66 4.788 -7.359 -19.058 515 H GLY 67 H GLY 67 6.312 -7.374 -20.647 516 HA2 GLY 67 2HA GLY 67 7.002 -7.538 -22.848 517 HA3 GLY 67 3HA GLY 67 5.497 -6.800 -23.379 518 H SER 68 H SER 68 5.322 -4.408 -22.699 519 HA SER 68 HA SER 68 7.863 -2.929 -22.770 520 HB2 SER 68 2HB SER 68 5.520 -2.445 -24.678 521 HB3 SER 68 3HB SER 68 6.979 -1.455 -24.574 522 HG SER 68 HG SER 68 7.946 -3.787 -24.927 523 H GLY 69 H GLY 69 7.032 -0.408 -22.729 524 HA2 GLY 69 2HA GLY 69 5.572 1.180 -21.726 525 HA3 GLY 69 3HA GLY 69 4.900 -0.079 -20.702 526 H LEU 70 H LEU 70 7.700 -1.053 -20.122 527 HA LEU 70 HA LEU 70 8.118 0.348 -17.694 528 HB2 LEU 70 2HB LEU 70 9.957 -1.603 -19.140 529 HB3 LEU 70 3HB LEU 70 10.123 -1.112 -17.461 530 HG LEU 70 HG LEU 70 7.795 -2.710 -18.613 531 HD11 LEU 70 1HD1 LEU 70 8.663 -4.600 -17.301 532 HD12 LEU 70 2HD1 LEU 70 10.052 -3.629 -16.804 533 HD13 LEU 70 3HD1 LEU 70 9.829 -4.051 -18.504 534 HD21 LEU 70 1HD2 LEU 70 8.303 -1.891 -15.729 535 HD22 LEU 70 2HD2 LEU 70 7.041 -3.001 -16.272 536 HD23 LEU 70 3HD2 LEU 70 7.000 -1.313 -16.773 537 H ASP 71 H ASP 71 9.940 0.293 -20.765 538 HA ASP 71 HA ASP 71 11.591 2.588 -19.987 539 HB2 ASP 71 2HB ASP 71 12.662 0.739 -21.196 540 HB3 ASP 71 3HB ASP 71 11.521 0.892 -22.523 541 H ASP 72 H ASP 72 8.924 1.770 -22.107 542 HA ASP 72 HA ASP 72 8.917 4.022 -23.801 543 HB2 ASP 72 2HB ASP 72 6.597 2.189 -23.045 544 HB3 ASP 72 3HB ASP 72 6.633 3.265 -24.440 545 H ILE 73 H ILE 73 7.432 3.395 -20.687 546 HA ILE 73 HA ILE 73 6.081 4.467 -19.268 547 HB ILE 73 HB ILE 73 7.299 7.017 -20.430 548 HG12 ILE 73 2HG1 ILE 73 9.055 5.489 -19.586 549 HG13 ILE 73 3HG1 ILE 73 8.914 6.893 -18.538 550 HG21 ILE 73 1HG2 ILE 73 5.869 6.580 -17.773 551 HG22 ILE 73 2HG2 ILE 73 5.255 7.505 -19.145 552 HG23 ILE 73 3HG2 ILE 73 6.675 8.072 -18.267 553 HD11 ILE 73 1HD1 ILE 73 7.832 4.128 -17.966 554 HD12 ILE 73 2HD1 ILE 73 7.659 5.533 -16.910 555 HD13 ILE 73 3HD1 ILE 73 9.258 4.872 -17.246 556 HA PRO 74 HA PRO 74 2.741 4.902 -22.389 557 HB2 PRO 74 2HB PRO 74 1.004 3.978 -20.127 558 HB3 PRO 74 3HB PRO 74 1.199 3.293 -21.754 559 HG2 PRO 74 2HG PRO 74 2.208 2.045 -19.618 560 HG3 PRO 74 3HG PRO 74 3.092 2.061 -21.164 561 HD2 PRO 74 2HD PRO 74 3.545 3.773 -18.713 562 HD3 PRO 74 3HD PRO 74 4.733 2.920 -19.732 563 HA PRO 75 HA PRO 75 1.478 9.120 -21.043 564 HB2 PRO 75 2HB PRO 75 -0.481 8.527 -23.284 565 HB3 PRO 75 3HB PRO 75 0.461 10.003 -22.966 566 HG2 PRO 75 2HG PRO 75 1.257 8.352 -24.863 567 HG3 PRO 75 3HG PRO 75 2.460 9.077 -23.769 568 HD2 PRO 75 2HD PRO 75 1.349 6.283 -23.778 569 HD3 PRO 75 3HD PRO 75 3.001 6.843 -23.424 570 H TYR 76 H TYR 76 -0.581 6.318 -21.471 571 HA TYR 76 HA TYR 76 -2.988 6.999 -20.312 572 HB2 TYR 76 2HB TYR 76 -2.386 4.822 -21.433 573 HB3 TYR 76 3HB TYR 76 -1.491 4.352 -20.000 574 HD1 TYR 76 HD1 TYR 76 -2.773 3.891 -17.833 575 HD2 TYR 76 HD2 TYR 76 -4.783 4.546 -21.557 576 HE1 TYR 76 HE1 TYR 76 -4.809 2.856 -16.925 577 HE2 TYR 76 HE2 TYR 76 -6.802 3.512 -20.637 578 HH TYR 76 HH TYR 76 -7.294 2.902 -17.397 579 H ASP 77 H ASP 77 -0.075 5.761 -18.684 580 HA ASP 77 HA ASP 77 -1.044 5.659 -16.035 581 HB2 ASP 77 2HB ASP 77 1.780 5.913 -17.158 582 HB3 ASP 77 3HB ASP 77 1.451 5.666 -15.447 583 H ARG 78 H ARG 78 0.586 8.172 -17.864 584 HA ARG 78 HA ARG 78 0.965 10.027 -15.704 585 HB2 ARG 78 2HB ARG 78 0.931 10.609 -18.700 586 HB3 ARG 78 3HB ARG 78 1.677 11.595 -17.443 587 HG2 ARG 78 2HG ARG 78 3.232 9.725 -16.960 588 HG3 ARG 78 3HG ARG 78 2.549 8.821 -18.308 589 HD2 ARG 78 2HD ARG 78 4.027 11.470 -18.462 590 HD3 ARG 78 3HD ARG 78 4.616 9.900 -19.012 591 HE ARG 78 HE ARG 78 2.162 10.805 -20.269 592 HH11 ARG 78 1HH1 ARG 78 5.670 10.773 -20.517 593 HH12 ARG 78 2HH1 ARG 78 5.667 11.087 -22.222 594 HH21 ARG 78 1HH2 ARG 78 2.183 11.278 -22.494 595 HH22 ARG 78 2HH2 ARG 78 3.696 11.373 -23.344 596 H ASP 79 H ASP 79 -1.508 9.451 -18.110 597 HA ASP 79 HA ASP 79 -3.007 11.808 -17.459 598 HB2 ASP 79 2HB ASP 79 -3.576 9.495 -19.330 599 HB3 ASP 79 3HB ASP 79 -4.776 10.751 -19.018 600 H PHE 80 H PHE 80 -2.917 8.531 -16.349 601 HA PHE 80 HA PHE 80 -5.359 8.446 -14.902 602 HB2 PHE 80 2HB PHE 80 -4.107 6.382 -15.230 603 HB3 PHE 80 3HB PHE 80 -2.688 7.038 -14.424 604 HD1 PHE 80 HD1 PHE 80 -2.379 6.647 -12.099 605 HD2 PHE 80 HD2 PHE 80 -6.275 6.098 -13.793 606 HE1 PHE 80 HE1 PHE 80 -3.192 5.755 -9.958 607 HE2 PHE 80 HE2 PHE 80 -7.067 5.206 -11.642 608 HZ PHE 80 HZ PHE 80 -5.535 5.041 -9.725 609 H CYS 81 H CYS 81 -2.224 9.859 -14.275 610 HA CYS 81 HA CYS 81 -2.571 10.559 -11.537 611 HB2 CYS 81 2HB CYS 81 -0.698 11.736 -13.633 612 HB3 CYS 81 3HB CYS 81 -0.536 11.925 -11.887 613 HG CYS 81 HG CYS 81 -0.366 9.018 -11.621 614 H LYS 82 H LYS 82 -4.019 11.874 -14.351 615 HA LYS 82 HA LYS 82 -4.154 14.649 -13.464 616 HB2 LYS 82 2HB LYS 82 -5.710 13.318 -15.724 617 HB3 LYS 82 3HB LYS 82 -5.480 15.047 -15.484 618 HG2 LYS 82 2HG LYS 82 -3.342 13.033 -16.191 619 HG3 LYS 82 3HG LYS 82 -4.077 14.197 -17.293 620 HD2 LYS 82 2HD LYS 82 -3.078 16.054 -16.009 621 HD3 LYS 82 3HD LYS 82 -2.397 14.903 -14.854 622 HE2 LYS 82 2HE LYS 82 -0.734 15.704 -16.539 623 HE3 LYS 82 3HE LYS 82 -0.958 13.952 -16.566 624 HZ1 LYS 82 1HZ LYS 82 -0.888 15.053 -18.785 625 HZ2 LYS 82 2HZ LYS 82 -2.353 15.805 -18.411 626 HZ3 LYS 82 3HZ LYS 82 -2.272 14.120 -18.513 627 H VAL 83 H VAL 83 -5.056 13.963 -11.383 628 HA VAL 83 HA VAL 83 -8.016 13.915 -11.380 629 HB VAL 83 HB VAL 83 -7.940 12.511 -9.289 630 HG11 VAL 83 1HG1 VAL 83 -6.669 11.168 -11.705 631 HG12 VAL 83 2HG1 VAL 83 -8.397 11.413 -11.438 632 HG13 VAL 83 3HG1 VAL 83 -7.488 10.338 -10.378 633 HG21 VAL 83 1HG2 VAL 83 -5.647 13.012 -8.535 634 HG22 VAL 83 2HG2 VAL 83 -4.980 12.160 -9.928 635 HG23 VAL 83 3HG2 VAL 83 -5.869 11.266 -8.692 636 H ASP 84 H ASP 84 -8.800 14.713 -9.101 637 HA ASP 84 HA ASP 84 -7.574 17.240 -8.517 638 HB2 ASP 84 2HB ASP 84 -9.665 15.759 -6.856 639 HB3 ASP 84 3HB ASP 84 -9.253 17.466 -6.717 640 H GLN 85 H GLN 85 -6.702 17.892 -6.439 641 HA GLN 85 HA GLN 85 -4.577 16.359 -5.517 642 HB2 GLN 85 2HB GLN 85 -4.704 18.839 -5.414 643 HB3 GLN 85 3HB GLN 85 -5.915 18.747 -4.155 644 HG2 GLN 85 2HG GLN 85 -3.144 17.603 -3.748 645 HG3 GLN 85 3HG GLN 85 -3.472 19.317 -3.505 646 HE21 GLN 85 1HE2 GLN 85 -4.003 16.108 -2.269 647 HE22 GLN 85 2HE2 GLN 85 -4.634 16.586 -0.740 648 HA PRO 86 HA PRO 86 -7.164 14.968 -1.607 649 HB2 PRO 86 2HB PRO 86 -10.029 15.411 -2.361 650 HB3 PRO 86 3HB PRO 86 -9.188 15.775 -0.839 651 HG2 PRO 86 2HG PRO 86 -9.926 17.745 -2.473 652 HG3 PRO 86 3HG PRO 86 -8.377 17.820 -1.601 653 HD2 PRO 86 2HD PRO 86 -8.877 17.025 -4.480 654 HD3 PRO 86 3HD PRO 86 -7.658 18.142 -3.813 655 H THR 87 H THR 87 -8.903 14.668 -4.712 656 HA THR 87 HA THR 87 -9.900 12.067 -4.543 657 HB THR 87 HB THR 87 -8.939 13.585 -7.007 658 HG1 THR 87 HG1 THR 87 -11.547 13.624 -6.846 659 HG21 THR 87 1HG2 THR 87 -10.514 12.201 -8.299 660 HG22 THR 87 2HG2 THR 87 -10.903 11.270 -6.857 661 HG23 THR 87 3HG2 THR 87 -9.282 11.190 -7.548 662 H LEU 88 H LEU 88 -6.722 13.221 -5.365 663 HA LEU 88 HA LEU 88 -5.492 10.963 -6.468 664 HB2 LEU 88 2HB LEU 88 -4.753 13.499 -6.192 665 HB3 LEU 88 3HB LEU 88 -4.026 12.957 -4.694 666 HG LEU 88 HG LEU 88 -3.306 11.911 -7.467 667 HD11 LEU 88 1HD1 LEU 88 -2.635 14.254 -7.194 668 HD12 LEU 88 2HD1 LEU 88 -1.229 13.197 -7.239 669 HD13 LEU 88 3HD1 LEU 88 -1.783 13.857 -5.698 670 HD21 LEU 88 1HD2 LEU 88 -2.014 11.374 -4.781 671 HD22 LEU 88 2HD2 LEU 88 -1.362 10.875 -6.347 672 HD23 LEU 88 3HD2 LEU 88 -2.893 10.214 -5.782 673 H PHE 89 H PHE 89 -5.760 12.070 -3.090 674 HA PHE 89 HA PHE 89 -4.338 9.852 -1.951 675 HB2 PHE 89 2HB PHE 89 -6.080 11.996 -0.681 676 HB3 PHE 89 3HB PHE 89 -5.184 10.789 0.243 677 HD1 PHE 89 HD1 PHE 89 -2.614 10.585 -1.025 678 HD2 PHE 89 HD2 PHE 89 -4.992 14.081 -0.399 679 HE1 PHE 89 HE1 PHE 89 -0.597 11.972 -1.076 680 HE2 PHE 89 HE2 PHE 89 -2.959 15.458 -0.449 681 HZ PHE 89 HZ PHE 89 -0.761 14.409 -0.795 682 H GLU 90 H GLU 90 -7.733 10.554 -2.585 683 HA GLU 90 HA GLU 90 -8.922 8.419 -1.192 684 HB2 GLU 90 2HB GLU 90 -9.780 9.632 -3.849 685 HB3 GLU 90 3HB GLU 90 -10.790 8.630 -2.815 686 HG2 GLU 90 2HG GLU 90 -9.652 11.325 -2.061 687 HG3 GLU 90 3HG GLU 90 -11.297 11.038 -2.614 688 H LEU 91 H LEU 91 -7.345 8.561 -4.348 689 HA LEU 91 HA LEU 91 -7.878 5.898 -5.195 690 HB2 LEU 91 2HB LEU 91 -5.653 7.813 -5.987 691 HB3 LEU 91 3HB LEU 91 -5.953 6.280 -6.787 692 HG LEU 91 HG LEU 91 -7.884 8.637 -6.738 693 HD11 LEU 91 1HD1 LEU 91 -6.154 7.595 -9.013 694 HD12 LEU 91 2HD1 LEU 91 -5.899 9.097 -8.119 695 HD13 LEU 91 3HD1 LEU 91 -7.335 8.904 -9.120 696 HD21 LEU 91 1HD2 LEU 91 -8.093 5.999 -8.229 697 HD22 LEU 91 2HD2 LEU 91 -9.217 7.357 -8.345 698 HD23 LEU 91 3HD2 LEU 91 -9.059 6.476 -6.829 699 H ILE 92 H ILE 92 -5.271 7.335 -3.241 700 HA ILE 92 HA ILE 92 -3.621 4.998 -3.062 701 HB ILE 92 HB ILE 92 -3.790 7.397 -1.166 702 HG12 ILE 92 2HG1 ILE 92 -1.924 6.809 -3.512 703 HG13 ILE 92 3HG1 ILE 92 -3.122 8.092 -3.415 704 HG21 ILE 92 1HG2 ILE 92 -2.775 5.464 -0.006 705 HG22 ILE 92 2HG2 ILE 92 -1.570 6.714 -0.306 706 HG23 ILE 92 3HG2 ILE 92 -1.609 5.270 -1.320 707 HD11 ILE 92 1HD1 ILE 92 -0.942 9.015 -3.135 708 HD12 ILE 92 2HD1 ILE 92 -0.565 7.883 -1.841 709 HD13 ILE 92 3HD1 ILE 92 -1.794 9.125 -1.597 710 H LEU 93 H LEU 93 -6.231 6.330 -1.068 711 HA LEU 93 HA LEU 93 -6.180 4.460 1.060 712 HB2 LEU 93 2HB LEU 93 -8.442 6.190 -0.017 713 HB3 LEU 93 3HB LEU 93 -8.542 5.279 1.483 714 HG LEU 93 HG LEU 93 -6.534 7.511 0.966 715 HD11 LEU 93 1HD1 LEU 93 -8.820 8.404 1.018 716 HD12 LEU 93 2HD1 LEU 93 -7.904 8.916 2.430 717 HD13 LEU 93 3HD1 LEU 93 -9.103 7.629 2.581 718 HD21 LEU 93 1HD2 LEU 93 -7.203 6.050 3.544 719 HD22 LEU 93 2HD2 LEU 93 -6.093 7.416 3.383 720 HD23 LEU 93 3HD2 LEU 93 -5.716 5.881 2.605 721 H ALA 94 H ALA 94 -7.890 4.539 -2.037 722 HA ALA 94 HA ALA 94 -9.379 2.105 -1.688 723 HB1 ALA 94 1HB ALA 94 -9.897 2.342 -4.090 724 HB2 ALA 94 2HB ALA 94 -8.695 3.630 -4.232 725 HB3 ALA 94 3HB ALA 94 -10.130 3.865 -3.232 726 H ALA 95 H ALA 95 -6.244 2.963 -3.060 727 HA ALA 95 HA ALA 95 -5.660 0.470 -4.333 728 HB1 ALA 95 1HB ALA 95 -4.545 2.619 -4.895 729 HB2 ALA 95 2HB ALA 95 -3.404 1.317 -4.566 730 HB3 ALA 95 3HB ALA 95 -3.701 2.566 -3.349 731 H ASN 96 H ASN 96 -5.182 1.733 -1.085 732 HA ASN 96 HA ASN 96 -3.644 -0.516 -0.102 733 HB2 ASN 96 2HB ASN 96 -3.380 1.720 0.912 734 HB3 ASN 96 3HB ASN 96 -5.086 1.758 1.350 735 HD21 ASN 96 1HD2 ASN 96 -4.557 2.069 3.535 736 HD22 ASN 96 2HD2 ASN 96 -3.959 0.795 4.526 737 H TYR 97 H TYR 97 -7.023 0.569 -0.003 738 HA TYR 97 HA TYR 97 -8.088 -1.396 1.723 739 HB2 TYR 97 2HB TYR 97 -9.356 0.618 1.350 740 HB3 TYR 97 3HB TYR 97 -9.381 0.374 -0.390 741 HD1 TYR 97 HD1 TYR 97 -11.400 -0.420 -1.313 742 HD2 TYR 97 HD2 TYR 97 -10.527 -1.399 2.759 743 HE1 TYR 97 HE1 TYR 97 -13.565 -1.552 -1.127 744 HE2 TYR 97 HE2 TYR 97 -12.703 -2.532 2.939 745 HH TYR 97 HH TYR 97 -14.890 -2.541 1.853 746 H LEU 98 H LEU 98 -7.616 -1.383 -1.790 747 HA LEU 98 HA LEU 98 -8.781 -4.074 -2.081 748 HB2 LEU 98 2HB LEU 98 -7.597 -2.258 -4.221 749 HB3 LEU 98 3HB LEU 98 -8.517 -3.728 -4.487 750 HG LEU 98 HG LEU 98 -9.585 -1.098 -3.404 751 HD11 LEU 98 1HD1 LEU 98 -10.902 -1.019 -5.457 752 HD12 LEU 98 2HD1 LEU 98 -10.193 -2.543 -5.999 753 HD13 LEU 98 3HD1 LEU 98 -9.181 -1.109 -5.824 754 HD21 LEU 98 1HD2 LEU 98 -10.709 -2.947 -2.265 755 HD22 LEU 98 2HD2 LEU 98 -11.106 -3.680 -3.820 756 HD23 LEU 98 3HD2 LEU 98 -11.804 -2.123 -3.374 757 H ASP 99 H ASP 99 -5.810 -2.508 -1.663 758 HA ASP 99 HA ASP 99 -3.643 -2.904 -1.916 759 HB2 ASP 99 2HB ASP 99 -4.228 -4.499 -0.067 760 HB3 ASP 99 3HB ASP 99 -4.342 -5.786 -1.261 761 H ILE 100 H ILE 100 -4.057 -2.417 -4.222 762 HA ILE 100 HA ILE 100 -3.278 -4.655 -6.016 763 HB ILE 100 HB ILE 100 -4.187 -1.860 -6.861 764 HG12 ILE 100 2HG1 ILE 100 -5.846 -4.413 -6.635 765 HG13 ILE 100 3HG1 ILE 100 -6.040 -2.956 -5.671 766 HG21 ILE 100 1HG2 ILE 100 -4.481 -2.915 -9.081 767 HG22 ILE 100 2HG2 ILE 100 -3.909 -4.454 -8.440 768 HG23 ILE 100 3HG2 ILE 100 -2.818 -3.069 -8.519 769 HD11 ILE 100 1HD1 ILE 100 -7.757 -3.083 -7.325 770 HD12 ILE 100 2HD1 ILE 100 -6.574 -3.240 -8.621 771 HD13 ILE 100 3HD1 ILE 100 -6.693 -1.732 -7.709 772 H LYS 101 H LYS 101 -1.142 -4.772 -6.381 773 HA LYS 101 HA LYS 101 0.650 -2.961 -5.191 774 HB2 LYS 101 2HB LYS 101 1.466 -5.078 -7.218 775 HB3 LYS 101 3HB LYS 101 2.432 -4.417 -5.912 776 HG2 LYS 101 2HG LYS 101 0.158 -6.397 -5.752 777 HG3 LYS 101 3HG LYS 101 1.817 -6.598 -5.209 778 HD2 LYS 101 2HD LYS 101 -0.277 -4.810 -3.921 779 HD3 LYS 101 3HD LYS 101 0.250 -6.379 -3.321 780 HE2 LYS 101 2HE LYS 101 2.450 -5.536 -2.822 781 HE3 LYS 101 3HE LYS 101 2.110 -4.002 -3.630 782 HZ1 LYS 101 1HZ LYS 101 0.856 -5.029 -1.149 783 HZ2 LYS 101 2HZ LYS 101 0.323 -3.654 -1.969 784 HZ3 LYS 101 3HZ LYS 101 1.876 -3.688 -1.294 785 HA PRO 102 HA PRO 102 1.813 -1.402 -9.746 786 HB2 PRO 102 2HB PRO 102 -0.309 -1.538 -11.566 787 HB3 PRO 102 3HB PRO 102 1.042 -2.685 -11.507 788 HG2 PRO 102 2HG PRO 102 -1.705 -2.953 -10.328 789 HG3 PRO 102 3HG PRO 102 -0.733 -4.160 -11.201 790 HD2 PRO 102 2HD PRO 102 -0.918 -4.216 -8.527 791 HD3 PRO 102 3HD PRO 102 0.621 -4.606 -9.339 792 H LEU 103 H LEU 103 -1.634 -1.198 -8.749 793 HA LEU 103 HA LEU 103 -2.110 1.445 -9.677 794 HB2 LEU 103 2HB LEU 103 -3.793 -0.447 -9.033 795 HB3 LEU 103 3HB LEU 103 -3.618 0.104 -7.382 796 HG LEU 103 HG LEU 103 -5.687 0.932 -8.512 797 HD11 LEU 103 1HD1 LEU 103 -5.596 3.302 -7.890 798 HD12 LEU 103 2HD1 LEU 103 -3.839 3.197 -7.730 799 HD13 LEU 103 3HD1 LEU 103 -4.883 2.261 -6.663 800 HD21 LEU 103 1HD2 LEU 103 -4.830 1.111 -10.785 801 HD22 LEU 103 2HD2 LEU 103 -3.845 2.501 -10.322 802 HD23 LEU 103 3HD2 LEU 103 -5.605 2.608 -10.270 803 H LEU 104 H LEU 104 -1.404 0.130 -6.465 804 HA LEU 104 HA LEU 104 -1.466 2.475 -4.945 805 HB2 LEU 104 2HB LEU 104 -1.521 0.211 -3.975 806 HB3 LEU 104 3HB LEU 104 0.124 -0.087 -4.499 807 HG LEU 104 HG LEU 104 0.911 1.698 -2.919 808 HD11 LEU 104 1HD1 LEU 104 -0.611 2.565 -1.179 809 HD12 LEU 104 2HD1 LEU 104 -1.978 1.790 -1.983 810 HD13 LEU 104 3HD1 LEU 104 -1.096 3.087 -2.791 811 HD21 LEU 104 1HD2 LEU 104 0.941 -0.670 -2.253 812 HD22 LEU 104 2HD2 LEU 104 -0.700 -0.529 -1.616 813 HD23 LEU 104 3HD2 LEU 104 0.621 0.371 -0.869 814 H ASP 105 H ASP 105 1.185 0.858 -6.642 815 HA ASP 105 HA ASP 105 3.298 2.436 -5.626 816 HB2 ASP 105 2HB ASP 105 3.580 0.169 -6.641 817 HB3 ASP 105 3HB ASP 105 3.224 0.851 -8.228 818 H VAL 106 H VAL 106 1.582 2.540 -8.756 819 HA VAL 106 HA VAL 106 2.883 4.730 -9.911 820 HB VAL 106 HB VAL 106 0.068 3.629 -10.332 821 HG11 VAL 106 1HG1 VAL 106 0.005 5.984 -11.044 822 HG12 VAL 106 2HG1 VAL 106 -0.080 4.912 -12.438 823 HG13 VAL 106 3HG1 VAL 106 1.432 5.742 -12.056 824 HG21 VAL 106 1HG2 VAL 106 1.905 2.122 -10.958 825 HG22 VAL 106 2HG2 VAL 106 2.605 3.368 -11.993 826 HG23 VAL 106 3HG2 VAL 106 1.036 2.668 -12.392 827 H THR 107 H THR 107 -0.047 4.661 -7.863 828 HA THR 107 HA THR 107 -0.622 7.452 -8.102 829 HB THR 107 HB THR 107 -1.677 5.552 -5.956 830 HG1 THR 107 HG1 THR 107 -2.613 4.566 -7.570 831 HG21 THR 107 1HG2 THR 107 -2.256 7.947 -5.596 832 HG22 THR 107 2HG2 THR 107 -3.680 7.003 -6.025 833 HG23 THR 107 3HG2 THR 107 -2.910 8.033 -7.232 834 H CYS 108 H CYS 108 1.206 5.538 -5.738 835 HA CYS 108 HA CYS 108 1.602 7.639 -3.821 836 HB2 CYS 108 2HB CYS 108 3.147 5.058 -4.310 837 HB3 CYS 108 3HB CYS 108 3.470 6.148 -2.962 838 HG CYS 108 HG CYS 108 0.377 4.775 -3.424 839 H LYS 109 H LYS 109 3.419 6.441 -6.619 840 HA LYS 109 HA LYS 109 5.643 8.210 -6.420 841 HB2 LYS 109 2HB LYS 109 4.594 6.351 -8.541 842 HB3 LYS 109 3HB LYS 109 5.671 7.632 -9.082 843 HG2 LYS 109 2HG LYS 109 6.861 5.504 -8.652 844 HG3 LYS 109 3HG LYS 109 7.457 6.822 -7.641 845 HD2 LYS 109 2HD LYS 109 6.187 5.958 -5.723 846 HD3 LYS 109 3HD LYS 109 5.499 4.679 -6.727 847 HE2 LYS 109 2HE LYS 109 8.443 5.011 -6.063 848 HE3 LYS 109 3HE LYS 109 7.342 3.847 -5.325 849 HZ1 LYS 109 1HZ LYS 109 8.105 3.935 -8.194 850 HZ2 LYS 109 2HZ LYS 109 7.020 2.840 -7.504 851 HZ3 LYS 109 3HZ LYS 109 8.646 2.815 -7.050 852 H THR 110 H THR 110 2.426 8.529 -7.843 853 HA THR 110 HA THR 110 2.751 10.856 -9.364 854 HB THR 110 HB THR 110 0.316 9.995 -7.730 855 HG1 THR 110 HG1 THR 110 1.407 8.810 -9.756 856 HG21 THR 110 1HG2 THR 110 -1.015 11.376 -9.297 857 HG22 THR 110 2HG2 THR 110 0.467 11.951 -10.061 858 HG23 THR 110 3HG2 THR 110 0.117 12.376 -8.384 859 H VAL 111 H VAL 111 2.048 10.487 -5.868 860 HA VAL 111 HA VAL 111 1.994 13.301 -5.294 861 HB VAL 111 HB VAL 111 2.579 11.130 -3.226 862 HG11 VAL 111 1HG1 VAL 111 1.508 12.705 -1.664 863 HG12 VAL 111 2HG1 VAL 111 1.263 13.857 -2.976 864 HG13 VAL 111 3HG1 VAL 111 2.900 13.437 -2.464 865 HG21 VAL 111 1HG2 VAL 111 0.583 10.430 -4.471 866 HG22 VAL 111 2HG2 VAL 111 -0.164 12.002 -4.188 867 HG23 VAL 111 3HG2 VAL 111 0.165 10.923 -2.829 868 H ALA 112 H ALA 112 4.422 10.747 -5.090 869 HA ALA 112 HA ALA 112 6.460 12.140 -3.748 870 HB1 ALA 112 1HB ALA 112 6.430 9.695 -3.985 871 HB2 ALA 112 2HB ALA 112 7.956 10.360 -4.569 872 HB3 ALA 112 3HB ALA 112 6.719 9.839 -5.719 873 H ASN 113 H ASN 113 5.524 12.058 -7.142 874 HA ASN 113 HA ASN 113 7.810 13.382 -8.247 875 HB2 ASN 113 2HB ASN 113 4.971 13.001 -9.293 876 HB3 ASN 113 3HB ASN 113 6.197 13.876 -10.207 877 HD21 ASN 113 1HD2 ASN 113 4.776 11.417 -10.900 878 HD22 ASN 113 2HD2 ASN 113 5.989 10.219 -11.173 879 H MET 114 H MET 114 4.775 14.487 -6.823 880 HA MET 114 HA MET 114 4.935 17.203 -7.711 881 HB2 MET 114 2HB MET 114 3.380 16.082 -5.334 882 HB3 MET 114 3HB MET 114 3.137 17.660 -6.073 883 HG2 MET 114 2HG MET 114 2.523 16.452 -8.212 884 HG3 MET 114 3HG MET 114 2.545 14.958 -7.281 885 HE1 MET 114 1HE MET 114 1.372 16.280 -4.429 886 HE2 MET 114 2HE MET 114 0.862 14.686 -4.988 887 HE3 MET 114 3HE MET 114 -0.343 15.908 -4.599 888 H ILE 115 H ILE 115 6.162 15.476 -4.887 889 HA ILE 115 HA ILE 115 7.170 17.971 -3.658 890 HB ILE 115 HB ILE 115 7.633 16.639 -1.639 891 HG12 ILE 115 2HG1 ILE 115 6.458 14.222 -3.106 892 HG13 ILE 115 3HG1 ILE 115 8.181 14.477 -2.868 893 HG21 ILE 115 1HG2 ILE 115 5.384 17.618 -1.873 894 HG22 ILE 115 2HG2 ILE 115 5.309 16.099 -0.979 895 HG23 ILE 115 3HG2 ILE 115 4.812 16.152 -2.672 896 HD11 ILE 115 1HD1 ILE 115 7.307 12.890 -1.273 897 HD12 ILE 115 2HD1 ILE 115 6.138 14.077 -0.693 898 HD13 ILE 115 3HD1 ILE 115 7.864 14.346 -0.449 899 H ARG 116 H ARG 116 8.291 15.860 -5.898 900 HA ARG 116 HA ARG 116 10.658 14.729 -4.942 901 HB2 ARG 116 2HB ARG 116 9.448 14.123 -7.085 902 HB3 ARG 116 3HB ARG 116 10.099 15.583 -7.813 903 HG2 ARG 116 2HG ARG 116 12.440 14.559 -7.154 904 HG3 ARG 116 3HG ARG 116 11.540 13.044 -7.034 905 HD2 ARG 116 2HD ARG 116 12.520 13.213 -9.243 906 HD3 ARG 116 3HD ARG 116 10.766 13.382 -9.396 907 HE ARG 116 HE ARG 116 11.819 15.951 -9.134 908 HH11 ARG 116 1HH1 ARG 116 12.037 13.342 -11.495 909 HH12 ARG 116 2HH1 ARG 116 12.315 14.419 -12.827 910 HH21 ARG 116 1HH2 ARG 116 12.197 17.331 -10.864 911 HH22 ARG 116 2HH2 ARG 116 12.404 16.695 -12.467 912 H GLY 117 H GLY 117 10.243 17.711 -6.850 913 HA2 GLY 117 2HA GLY 117 11.868 19.576 -6.201 914 HA3 GLY 117 3HA GLY 117 13.118 18.375 -6.528 915 H1 SER 2 1H SER 2 14.454 -15.308 15.232 916 H2 SER 2 2H SER 2 14.122 -14.487 16.668 917 H3 SER 2 3H SER 2 14.813 -16.032 16.713 918 HA SER 2 HA SER 2 16.411 -14.284 17.176 919 HB2 SER 2 2HB SER 2 16.932 -15.751 14.552 920 HB3 SER 2 3HB SER 2 18.155 -15.165 15.686 921 HG SER 2 HG SER 2 17.405 -17.500 15.750 922 H LEU 3 H LEU 3 17.909 -12.699 16.092 923 HA LEU 3 HA LEU 3 16.373 -10.648 14.743 924 HB2 LEU 3 2HB LEU 3 19.333 -10.715 15.479 925 HB3 LEU 3 3HB LEU 3 18.457 -9.298 14.921 926 HG LEU 3 HG LEU 3 17.917 -10.755 17.536 927 HD11 LEU 3 1HD1 LEU 3 18.938 -8.809 18.638 928 HD12 LEU 3 2HD1 LEU 3 19.347 -8.119 17.064 929 HD13 LEU 3 3HD1 LEU 3 20.090 -9.632 17.587 930 HD21 LEU 3 1HD2 LEU 3 16.760 -8.144 16.500 931 HD22 LEU 3 2HD2 LEU 3 16.488 -8.837 18.101 932 HD23 LEU 3 3HD2 LEU 3 15.894 -9.675 16.671 933 H VAL 4 H VAL 4 16.305 -10.302 12.583 934 HA VAL 4 HA VAL 4 18.501 -11.217 10.821 935 HB VAL 4 HB VAL 4 16.994 -10.647 8.905 936 HG11 VAL 4 1HG1 VAL 4 15.426 -12.550 9.152 937 HG12 VAL 4 2HG1 VAL 4 15.768 -12.605 10.883 938 HG13 VAL 4 3HG1 VAL 4 17.047 -12.955 9.718 939 HG21 VAL 4 1HG2 VAL 4 15.614 -8.901 9.941 940 HG22 VAL 4 2HG2 VAL 4 14.889 -10.081 11.033 941 HG23 VAL 4 3HG2 VAL 4 14.580 -10.179 9.298 942 H LYS 5 H LYS 5 19.614 -9.697 9.597 943 HA LYS 5 HA LYS 5 19.664 -6.989 10.733 944 HB2 LYS 5 2HB LYS 5 21.657 -8.392 8.906 945 HB3 LYS 5 3HB LYS 5 21.894 -6.839 9.700 946 HG2 LYS 5 2HG LYS 5 21.725 -8.029 11.919 947 HG3 LYS 5 3HG LYS 5 21.691 -9.558 11.037 948 HD2 LYS 5 2HD LYS 5 23.913 -9.025 10.057 949 HD3 LYS 5 3HD LYS 5 23.936 -7.510 10.963 950 HE2 LYS 5 2HE LYS 5 23.840 -8.832 13.083 951 HE3 LYS 5 3HE LYS 5 23.967 -10.311 12.124 952 HZ1 LYS 5 1HZ LYS 5 25.959 -8.113 12.213 953 HZ2 LYS 5 2HZ LYS 5 26.101 -9.513 11.275 954 HZ3 LYS 5 3HZ LYS 5 26.114 -9.615 12.965 955 H LEU 6 H LEU 6 18.745 -5.356 9.649 956 HA LEU 6 HA LEU 6 18.313 -5.533 6.719 957 HB2 LEU 6 2HB LEU 6 16.625 -3.977 8.732 958 HB3 LEU 6 3HB LEU 6 16.319 -4.127 7.012 959 HG LEU 6 HG LEU 6 16.091 -6.356 9.074 960 HD11 LEU 6 1HD1 LEU 6 14.256 -4.749 9.212 961 HD12 LEU 6 2HD1 LEU 6 13.684 -6.291 8.585 962 HD13 LEU 6 3HD1 LEU 6 13.933 -4.933 7.484 963 HD21 LEU 6 1HD2 LEU 6 16.883 -7.288 6.955 964 HD22 LEU 6 2HD2 LEU 6 15.565 -6.499 6.088 965 HD23 LEU 6 3HD2 LEU 6 15.216 -7.771 7.261 966 H GLU 7 H GLU 7 20.319 -4.514 6.207 967 HA GLU 7 HA GLU 7 21.055 -1.942 7.289 968 HB2 GLU 7 2HB GLU 7 22.040 -3.317 4.747 969 HB3 GLU 7 3HB GLU 7 22.709 -1.826 5.405 970 HG2 GLU 7 2HG GLU 7 24.208 -3.477 6.087 971 HG3 GLU 7 3HG GLU 7 23.228 -3.169 7.515 972 H SER 8 H SER 8 19.965 -0.112 6.823 973 HA SER 8 HA SER 8 18.294 0.327 4.560 974 HB2 SER 8 2HB SER 8 18.436 2.746 5.328 975 HB3 SER 8 3HB SER 8 17.974 1.610 6.597 976 HG SER 8 HG SER 8 19.914 1.810 7.523 977 H SER 9 H SER 9 18.804 2.405 3.129 978 HA SER 9 HA SER 9 21.046 1.969 1.470 979 HB2 SER 9 2HB SER 9 20.435 4.146 0.429 980 HB3 SER 9 3HB SER 9 19.022 3.132 0.671 981 HG SER 9 HG SER 9 18.570 5.213 1.354 982 H ASP 10 H ASP 10 20.566 3.902 4.321 983 HA ASP 10 HA ASP 10 23.078 5.358 4.179 984 HB2 ASP 10 2HB ASP 10 20.980 6.338 5.110 985 HB3 ASP 10 3HB ASP 10 20.992 5.135 6.390 986 H GLU 11 H GLU 11 22.506 2.208 4.736 987 HA GLU 11 HA GLU 11 23.834 0.494 5.339 988 HB2 GLU 11 2HB GLU 11 25.845 2.599 6.218 989 HB3 GLU 11 3HB GLU 11 26.179 0.880 6.060 990 HG2 GLU 11 2HG GLU 11 25.766 1.013 3.633 991 HG3 GLU 11 3HG GLU 11 25.405 2.731 3.787 992 H LYS 12 H LYS 12 22.253 2.342 7.473 993 HA LYS 12 HA LYS 12 23.300 1.452 9.982 994 HB2 LYS 12 2HB LYS 12 20.580 2.564 9.200 995 HB3 LYS 12 3HB LYS 12 21.003 2.176 10.858 996 HG2 LYS 12 2HG LYS 12 22.744 4.101 9.325 997 HG3 LYS 12 3HG LYS 12 21.188 4.650 9.929 998 HD2 LYS 12 2HD LYS 12 22.765 5.283 11.578 999 HD3 LYS 12 3HD LYS 12 21.933 3.883 12.243 1000 HE2 LYS 12 2HE LYS 12 23.861 2.466 11.600 1001 HE3 LYS 12 3HE LYS 12 24.683 3.890 10.963 1002 HZ1 LYS 12 1HZ LYS 12 24.655 4.851 13.184 1003 HZ2 LYS 12 2HZ LYS 12 25.441 3.353 13.189 1004 HZ3 LYS 12 3HZ LYS 12 23.868 3.484 13.794 1005 H VAL 13 H VAL 13 23.112 -0.491 10.883 1006 HA VAL 13 HA VAL 13 21.710 -2.619 9.461 1007 HB VAL 13 HB VAL 13 23.582 -2.812 11.875 1008 HG11 VAL 13 1HG1 VAL 13 23.906 -5.155 11.211 1009 HG12 VAL 13 2HG1 VAL 13 22.774 -4.951 9.872 1010 HG13 VAL 13 3HG1 VAL 13 22.204 -4.823 11.535 1011 HG21 VAL 13 1HG2 VAL 13 25.413 -3.302 10.313 1012 HG22 VAL 13 2HG2 VAL 13 24.735 -1.707 9.987 1013 HG23 VAL 13 3HG2 VAL 13 24.334 -3.063 8.937 1014 H PHE 14 H PHE 14 19.554 -2.423 10.005 1015 HA PHE 14 HA PHE 14 18.633 -2.158 12.747 1016 HB2 PHE 14 2HB PHE 14 17.121 -2.573 10.133 1017 HB3 PHE 14 3HB PHE 14 16.342 -2.366 11.699 1018 HD1 PHE 14 HD1 PHE 14 18.040 -0.648 8.934 1019 HD2 PHE 14 HD2 PHE 14 16.474 -0.173 12.885 1020 HE1 PHE 14 HE1 PHE 14 18.111 1.798 8.672 1021 HE2 PHE 14 HE2 PHE 14 16.546 2.270 12.611 1022 HZ PHE 14 HZ PHE 14 17.365 3.259 10.509 1023 H GLU 15 H GLU 15 19.555 -3.971 13.682 1024 HA GLU 15 HA GLU 15 18.909 -6.674 12.891 1025 HB2 GLU 15 2HB GLU 15 20.082 -5.642 15.510 1026 HB3 GLU 15 3HB GLU 15 20.085 -7.316 14.955 1027 HG2 GLU 15 2HG GLU 15 21.527 -6.657 13.040 1028 HG3 GLU 15 3HG GLU 15 21.534 -5.002 13.636 1029 H ILE 16 H ILE 16 16.694 -6.805 12.835 1030 HA ILE 16 HA ILE 16 15.160 -6.369 15.338 1031 HB ILE 16 HB ILE 16 14.735 -4.660 13.509 1032 HG12 ILE 16 2HG1 ILE 16 12.290 -6.376 14.127 1033 HG13 ILE 16 3HG1 ILE 16 13.026 -5.266 15.273 1034 HG21 ILE 16 1HG2 ILE 16 13.458 -5.294 11.494 1035 HG22 ILE 16 2HG2 ILE 16 13.542 -6.992 11.960 1036 HG23 ILE 16 3HG2 ILE 16 15.017 -6.123 11.540 1037 HD11 ILE 16 1HD1 ILE 16 11.747 -4.521 12.650 1038 HD12 ILE 16 2HD1 ILE 16 12.519 -3.395 13.770 1039 HD13 ILE 16 3HD1 ILE 16 11.081 -4.284 14.264 1040 H GLU 17 H GLU 17 13.316 -7.843 15.601 1041 HA GLU 17 HA GLU 17 14.007 -10.545 15.246 1042 HB2 GLU 17 2HB GLU 17 11.228 -9.424 15.821 1043 HB3 GLU 17 3HB GLU 17 11.769 -11.066 16.150 1044 HG2 GLU 17 2HG GLU 17 13.374 -10.216 17.823 1045 HG3 GLU 17 3HG GLU 17 12.863 -8.563 17.484 1046 H LYS 18 H LYS 18 13.405 -12.117 13.798 1047 HA LYS 18 HA LYS 18 12.918 -11.422 11.126 1048 HB2 LYS 18 2HB LYS 18 14.052 -13.543 11.842 1049 HB3 LYS 18 3HB LYS 18 12.505 -14.172 12.394 1050 HG2 LYS 18 2HG LYS 18 11.635 -14.127 10.082 1051 HG3 LYS 18 3HG LYS 18 13.146 -13.409 9.517 1052 HD2 LYS 18 2HD LYS 18 13.143 -15.783 8.977 1053 HD3 LYS 18 3HD LYS 18 14.366 -15.475 10.208 1054 HE2 LYS 18 2HE LYS 18 13.175 -17.529 10.714 1055 HE3 LYS 18 3HE LYS 18 12.796 -16.326 11.942 1056 HZ1 LYS 18 1HZ LYS 18 10.806 -17.444 11.329 1057 HZ2 LYS 18 2HZ LYS 18 11.084 -17.183 9.683 1058 HZ3 LYS 18 3HZ LYS 18 10.721 -15.880 10.690 1059 H GLU 19 H GLU 19 10.732 -12.332 13.701 1060 HA GLU 19 HA GLU 19 8.368 -12.862 12.297 1061 HB2 GLU 19 2HB GLU 19 8.600 -11.533 15.028 1062 HB3 GLU 19 3HB GLU 19 7.202 -12.396 14.398 1063 HG2 GLU 19 2HG GLU 19 8.527 -14.494 14.375 1064 HG3 GLU 19 3HG GLU 19 9.890 -13.617 15.074 1065 H ILE 20 H ILE 20 9.733 -9.807 13.430 1066 HA ILE 20 HA ILE 20 7.491 -8.151 12.682 1067 HB ILE 20 HB ILE 20 10.346 -7.231 13.272 1068 HG12 ILE 20 2HG1 ILE 20 8.091 -7.682 15.288 1069 HG13 ILE 20 3HG1 ILE 20 9.503 -8.714 15.112 1070 HG21 ILE 20 1HG2 ILE 20 8.876 -5.502 12.295 1071 HG22 ILE 20 2HG2 ILE 20 9.254 -5.116 13.972 1072 HG23 ILE 20 3HG2 ILE 20 7.676 -5.788 13.558 1073 HD11 ILE 20 1HD1 ILE 20 10.944 -6.902 15.821 1074 HD12 ILE 20 2HD1 ILE 20 9.686 -7.218 17.015 1075 HD13 ILE 20 3HD1 ILE 20 9.553 -5.824 15.949 1076 H ALA 21 H ALA 21 10.609 -9.053 11.281 1077 HA ALA 21 HA ALA 21 10.509 -7.426 8.949 1078 HB1 ALA 21 1HB ALA 21 12.580 -8.454 9.779 1079 HB2 ALA 21 2HB ALA 21 12.280 -8.904 8.101 1080 HB3 ALA 21 3HB ALA 21 11.953 -10.058 9.397 1081 H CYS 22 H CYS 22 9.076 -10.531 9.753 1082 HA CYS 22 HA CYS 22 8.198 -11.189 7.090 1083 HB2 CYS 22 2HB CYS 22 7.414 -12.318 9.798 1084 HB3 CYS 22 3HB CYS 22 6.867 -12.973 8.254 1085 HG CYS 22 HG CYS 22 10.200 -12.638 8.577 1086 H MET 23 H MET 23 6.933 -9.227 9.701 1087 HA MET 23 HA MET 23 4.243 -8.940 8.822 1088 HB2 MET 23 2HB MET 23 6.033 -6.972 10.310 1089 HB3 MET 23 3HB MET 23 4.307 -6.742 10.074 1090 HG2 MET 23 2HG MET 23 3.818 -8.710 11.426 1091 HG3 MET 23 3HG MET 23 5.538 -9.066 11.577 1092 HE1 MET 23 1HE MET 23 3.570 -5.339 13.530 1093 HE2 MET 23 2HE MET 23 2.659 -6.505 12.573 1094 HE3 MET 23 3HE MET 23 3.842 -5.455 11.790 1095 H SER 24 H SER 24 7.267 -7.505 7.702 1096 HA SER 24 HA SER 24 6.063 -6.016 5.543 1097 HB2 SER 24 2HB SER 24 8.887 -7.156 5.819 1098 HB3 SER 24 3HB SER 24 8.361 -6.006 4.590 1099 HG SER 24 HG SER 24 8.397 -4.458 5.998 1100 H VAL 25 H VAL 25 4.935 -7.080 3.983 1101 HA VAL 25 HA VAL 25 5.039 -9.859 3.459 1102 HB VAL 25 HB VAL 25 3.919 -7.628 1.693 1103 HG11 VAL 25 1HG1 VAL 25 3.383 -10.623 1.532 1104 HG12 VAL 25 2HG1 VAL 25 4.275 -9.663 0.352 1105 HG13 VAL 25 3HG1 VAL 25 2.550 -9.380 0.591 1106 HG21 VAL 25 1HG2 VAL 25 2.857 -7.692 3.919 1107 HG22 VAL 25 2HG2 VAL 25 2.496 -9.409 3.719 1108 HG23 VAL 25 3HG2 VAL 25 1.721 -8.215 2.673 1109 H THR 26 H THR 26 6.831 -7.134 2.140 1110 HA THR 26 HA THR 26 7.828 -8.392 -0.220 1111 HB THR 26 HB THR 26 8.862 -5.999 1.360 1112 HG1 THR 26 HG1 THR 26 7.839 -4.900 -0.445 1113 HG21 THR 26 1HG2 THR 26 10.111 -5.365 -0.673 1114 HG22 THR 26 2HG2 THR 26 9.650 -6.885 -1.442 1115 HG23 THR 26 3HG2 THR 26 10.700 -6.898 -0.023 1116 H ILE 27 H ILE 27 9.209 -7.942 3.057 1117 HA ILE 27 HA ILE 27 11.690 -9.283 2.458 1118 HB ILE 27 HB ILE 27 10.464 -8.312 5.075 1119 HG12 ILE 27 2HG1 ILE 27 12.450 -6.787 5.123 1120 HG13 ILE 27 3HG1 ILE 27 12.995 -7.446 3.589 1121 HG21 ILE 27 1HG2 ILE 27 13.114 -9.788 4.820 1122 HG22 ILE 27 2HG2 ILE 27 11.674 -10.361 5.663 1123 HG23 ILE 27 3HG2 ILE 27 12.545 -8.954 6.268 1124 HD11 ILE 27 1HD1 ILE 27 11.023 -6.502 2.502 1125 HD12 ILE 27 2HD1 ILE 27 11.970 -5.272 3.338 1126 HD13 ILE 27 3HD1 ILE 27 10.473 -5.868 4.054 1127 H LYS 28 H LYS 28 8.587 -10.192 3.917 1128 HA LYS 28 HA LYS 28 9.081 -12.833 4.697 1129 HB2 LYS 28 2HB LYS 28 6.951 -11.808 5.240 1130 HB3 LYS 28 3HB LYS 28 6.586 -11.505 3.545 1131 HG2 LYS 28 2HG LYS 28 6.345 -13.922 3.154 1132 HG3 LYS 28 3HG LYS 28 6.734 -14.242 4.846 1133 HD2 LYS 28 2HD LYS 28 4.693 -13.198 5.596 1134 HD3 LYS 28 3HD LYS 28 4.357 -12.556 3.983 1135 HE2 LYS 28 2HE LYS 28 2.979 -14.565 4.606 1136 HE3 LYS 28 3HE LYS 28 3.903 -14.762 3.117 1137 HZ1 LYS 28 1HZ LYS 28 4.791 -15.781 5.761 1138 HZ2 LYS 28 2HZ LYS 28 5.488 -16.107 4.252 1139 HZ3 LYS 28 3HZ LYS 28 3.952 -16.711 4.624 1140 H ASN 29 H ASN 29 7.982 -11.579 1.552 1141 HA ASN 29 HA ASN 29 7.974 -13.984 0.094 1142 HB2 ASN 29 2HB ASN 29 8.179 -11.075 -0.791 1143 HB3 ASN 29 3HB ASN 29 8.210 -12.391 -1.959 1144 HD21 ASN 29 1HD2 ASN 29 6.302 -11.646 -2.924 1145 HD22 ASN 29 2HD2 ASN 29 4.760 -11.820 -2.173 1146 H MET 30 H MET 30 10.538 -11.565 0.632 1147 HA MET 30 HA MET 30 12.455 -12.541 -1.181 1148 HB2 MET 30 2HB MET 30 12.768 -10.974 1.409 1149 HB3 MET 30 3HB MET 30 14.164 -11.450 0.452 1150 HG2 MET 30 2HG MET 30 13.277 -10.165 -1.464 1151 HG3 MET 30 3HG MET 30 11.908 -9.658 -0.466 1152 HE1 MET 30 1HE MET 30 12.560 -7.094 -1.090 1153 HE2 MET 30 2HE MET 30 13.974 -7.633 -1.999 1154 HE3 MET 30 3HE MET 30 14.144 -6.395 -0.755 1155 H ILE 31 H ILE 31 12.102 -13.192 2.316 1156 HA ILE 31 HA ILE 31 14.300 -14.906 2.626 1157 HB ILE 31 HB ILE 31 11.712 -14.747 4.260 1158 HG12 ILE 31 2HG1 ILE 31 14.473 -13.542 4.795 1159 HG13 ILE 31 3HG1 ILE 31 13.069 -12.650 4.226 1160 HG21 ILE 31 1HG2 ILE 31 12.914 -15.922 6.089 1161 HG22 ILE 31 2HG2 ILE 31 14.300 -16.160 5.025 1162 HG23 ILE 31 3HG2 ILE 31 12.764 -16.944 4.657 1163 HD11 ILE 31 1HD1 ILE 31 11.916 -13.152 6.337 1164 HD12 ILE 31 2HD1 ILE 31 13.421 -12.264 6.571 1165 HD13 ILE 31 3HD1 ILE 31 13.360 -13.993 6.909 1166 H GLU 32 H GLU 32 10.858 -15.666 1.996 1167 HA GLU 32 HA GLU 32 11.207 -18.509 2.074 1168 HB2 GLU 32 2HB GLU 32 8.926 -16.868 0.900 1169 HB3 GLU 32 3HB GLU 32 8.886 -18.604 1.204 1170 HG2 GLU 32 2HG GLU 32 9.128 -18.232 3.610 1171 HG3 GLU 32 3HG GLU 32 9.267 -16.494 3.351 1172 H ASP 33 H ASP 33 11.236 -16.128 -0.559 1173 HA ASP 33 HA ASP 33 11.148 -17.956 -2.752 1174 HB2 ASP 33 2HB ASP 33 10.593 -15.577 -3.047 1175 HB3 ASP 33 3HB ASP 33 12.234 -15.104 -2.613 1176 H ILE 34 H ILE 34 13.789 -16.486 -0.916 1177 HA ILE 34 HA ILE 34 15.933 -17.649 -2.440 1178 HB ILE 34 HB ILE 34 15.986 -16.541 0.418 1179 HG12 ILE 34 2HG1 ILE 34 15.255 -14.791 -1.129 1180 HG13 ILE 34 3HG1 ILE 34 16.890 -14.444 -0.605 1181 HG21 ILE 34 1HG2 ILE 34 17.937 -17.963 -0.011 1182 HG22 ILE 34 2HG2 ILE 34 18.422 -16.272 0.094 1183 HG23 ILE 34 3HG2 ILE 34 18.307 -17.059 -1.481 1184 HD11 ILE 34 1HD1 ILE 34 16.058 -15.571 -3.274 1185 HD12 ILE 34 2HD1 ILE 34 17.723 -15.277 -2.767 1186 HD13 ILE 34 3HD1 ILE 34 16.602 -13.929 -2.932 1187 H GLY 35 H GLY 35 14.084 -18.524 0.444 1188 HA2 GLY 35 2HA GLY 35 13.637 -20.781 1.079 1189 HA3 GLY 35 3HA GLY 35 15.177 -21.279 0.396 1190 H GLU 36 H GLU 36 15.011 -18.421 2.318 1191 HA GLU 36 HA GLU 36 15.634 -17.723 4.333 1192 HB2 GLU 36 2HB GLU 36 14.213 -19.521 5.295 1193 HB3 GLU 36 3HB GLU 36 15.563 -20.647 5.213 1194 HG2 GLU 36 2HG GLU 36 16.827 -19.186 6.793 1195 HG3 GLU 36 3HG GLU 36 15.416 -18.142 6.928 1196 H SER 37 H SER 37 17.626 -16.991 4.861 1197 HA SER 37 HA SER 37 19.998 -18.683 4.495 1198 HB2 SER 37 2HB SER 37 19.522 -16.054 3.025 1199 HB3 SER 37 3HB SER 37 21.087 -16.865 3.118 1200 HG SER 37 HG SER 37 19.341 -18.678 2.307 1201 H ASP 38 H ASP 38 21.886 -17.814 5.363 1202 HA ASP 38 HA ASP 38 21.653 -16.273 7.781 1203 HB2 ASP 38 2HB ASP 38 24.105 -17.328 6.299 1204 HB3 ASP 38 3HB ASP 38 24.128 -16.633 7.915 1205 H SER 39 H SER 39 22.105 -15.494 4.505 1206 HA SER 39 HA SER 39 23.637 -13.149 4.598 1207 HB2 SER 39 2HB SER 39 21.396 -13.870 2.658 1208 HB3 SER 39 3HB SER 39 22.671 -12.681 2.382 1209 HG SER 39 HG SER 39 24.032 -14.227 1.926 1210 HA PRO 40 HA PRO 40 20.553 -10.345 6.492 1211 HB2 PRO 40 2HB PRO 40 21.944 -7.998 6.043 1212 HB3 PRO 40 3HB PRO 40 22.322 -9.107 7.374 1213 HG2 PRO 40 2HG PRO 40 23.674 -8.826 4.717 1214 HG3 PRO 40 3HG PRO 40 24.392 -9.045 6.328 1215 HD2 PRO 40 2HD PRO 40 24.131 -11.101 4.573 1216 HD3 PRO 40 3HD PRO 40 24.018 -11.335 6.331 1217 H ILE 41 H ILE 41 19.155 -8.594 5.702 1218 HA ILE 41 HA ILE 41 18.840 -8.613 2.749 1219 HB ILE 41 HB ILE 41 16.722 -8.094 4.891 1220 HG12 ILE 41 2HG1 ILE 41 17.384 -10.478 4.857 1221 HG13 ILE 41 3HG1 ILE 41 15.745 -10.285 4.254 1222 HG21 ILE 41 1HG2 ILE 41 15.070 -8.159 3.049 1223 HG22 ILE 41 2HG2 ILE 41 16.380 -8.301 1.880 1224 HG23 ILE 41 3HG2 ILE 41 16.220 -6.835 2.848 1225 HD11 ILE 41 1HD1 ILE 41 18.221 -10.772 2.596 1226 HD12 ILE 41 2HD1 ILE 41 16.597 -10.532 1.946 1227 HD13 ILE 41 3HD1 ILE 41 16.943 -11.933 2.956 1228 HA PRO 42 HA PRO 42 19.914 -4.194 3.553 1229 HB2 PRO 42 2HB PRO 42 21.307 -3.745 1.258 1230 HB3 PRO 42 3HB PRO 42 22.035 -4.588 2.640 1231 HG2 PRO 42 2HG PRO 42 20.928 -5.732 0.105 1232 HG3 PRO 42 3HG PRO 42 22.388 -6.196 1.006 1233 HD2 PRO 42 2HD PRO 42 19.967 -7.544 1.170 1234 HD3 PRO 42 3HD PRO 42 21.216 -7.575 2.434 1235 H LEU 43 H LEU 43 18.461 -2.675 3.105 1236 HA LEU 43 HA LEU 43 16.705 -2.822 0.737 1237 HB2 LEU 43 2HB LEU 43 16.303 -1.419 3.419 1238 HB3 LEU 43 3HB LEU 43 15.109 -1.540 2.136 1239 HG LEU 43 HG LEU 43 16.226 -3.941 3.641 1240 HD11 LEU 43 1HD1 LEU 43 15.001 -2.572 5.220 1241 HD12 LEU 43 2HD1 LEU 43 14.076 -4.026 4.858 1242 HD13 LEU 43 3HD1 LEU 43 13.613 -2.485 4.132 1243 HD21 LEU 43 1HD2 LEU 43 13.882 -3.734 1.720 1244 HD22 LEU 43 2HD2 LEU 43 14.314 -5.170 2.652 1245 HD23 LEU 43 3HD2 LEU 43 15.421 -4.552 1.430 1246 HA PRO 44 HA PRO 44 19.586 0.754 0.002 1247 HB2 PRO 44 2HB PRO 44 19.957 0.467 -2.655 1248 HB3 PRO 44 3HB PRO 44 20.672 -0.682 -1.505 1249 HG2 PRO 44 2HG PRO 44 18.177 -0.984 -3.147 1250 HG3 PRO 44 3HG PRO 44 19.494 -2.152 -2.885 1251 HD2 PRO 44 2HD PRO 44 17.124 -2.201 -1.476 1252 HD3 PRO 44 3HD PRO 44 18.658 -2.833 -0.839 1253 H ASN 45 H ASN 45 16.373 0.306 -0.934 1254 HA ASN 45 HA ASN 45 16.018 2.709 -2.526 1255 HB2 ASN 45 2HB ASN 45 14.615 0.740 -2.957 1256 HB3 ASN 45 3HB ASN 45 14.035 0.736 -1.299 1257 HD21 ASN 45 1HD2 ASN 45 13.807 2.298 -4.416 1258 HD22 ASN 45 2HD2 ASN 45 12.359 3.172 -4.086 1259 H VAL 46 H VAL 46 15.457 1.666 0.808 1260 HA VAL 46 HA VAL 46 14.239 4.260 1.526 1261 HB VAL 46 HB VAL 46 12.878 2.267 2.025 1262 HG11 VAL 46 1HG1 VAL 46 15.125 1.353 3.850 1263 HG12 VAL 46 2HG1 VAL 46 14.648 0.600 2.330 1264 HG13 VAL 46 3HG1 VAL 46 13.536 0.592 3.701 1265 HG21 VAL 46 1HG2 VAL 46 12.374 2.722 4.401 1266 HG22 VAL 46 2HG2 VAL 46 12.620 4.213 3.494 1267 HG23 VAL 46 3HG2 VAL 46 13.892 3.610 4.558 1268 H THR 47 H THR 47 15.202 5.617 3.000 1269 HA THR 47 HA THR 47 17.971 5.184 3.754 1270 HB THR 47 HB THR 47 17.772 7.485 4.773 1271 HG1 THR 47 HG1 THR 47 15.851 8.437 4.908 1272 HG21 THR 47 1HG2 THR 47 18.447 7.283 2.406 1273 HG22 THR 47 2HG2 THR 47 17.447 8.717 2.648 1274 HG23 THR 47 3HG2 THR 47 16.751 7.273 1.911 1275 H SER 48 H SER 48 18.570 5.910 6.076 1276 HA SER 48 HA SER 48 17.694 3.902 7.860 1277 HB2 SER 48 2HB SER 48 19.180 5.129 9.503 1278 HB3 SER 48 3HB SER 48 19.956 4.730 7.970 1279 HG SER 48 HG SER 48 20.361 6.894 8.610 1280 H THR 49 H THR 49 17.147 7.404 7.806 1281 HA THR 49 HA THR 49 15.800 7.708 10.249 1282 HB THR 49 HB THR 49 14.987 9.886 9.195 1283 HG1 THR 49 HG1 THR 49 15.408 10.251 7.083 1284 HG21 THR 49 1HG2 THR 49 17.179 9.827 10.353 1285 HG22 THR 49 2HG2 THR 49 17.259 10.876 8.936 1286 HG23 THR 49 3HG2 THR 49 17.955 9.257 8.873 1287 H ILE 50 H ILE 50 14.603 6.914 7.024 1288 HA ILE 50 HA ILE 50 11.796 7.178 7.707 1289 HB ILE 50 HB ILE 50 13.119 6.003 5.216 1290 HG12 ILE 50 2HG1 ILE 50 13.760 8.336 5.434 1291 HG13 ILE 50 3HG1 ILE 50 12.551 8.229 4.164 1292 HG21 ILE 50 1HG2 ILE 50 10.815 5.200 5.438 1293 HG22 ILE 50 2HG2 ILE 50 10.947 6.335 4.098 1294 HG23 ILE 50 3HG2 ILE 50 10.233 6.857 5.623 1295 HD11 ILE 50 1HD1 ILE 50 12.114 9.219 6.984 1296 HD12 ILE 50 2HD1 ILE 50 10.846 9.048 5.768 1297 HD13 ILE 50 3HD1 ILE 50 12.167 10.185 5.511 1298 H LEU 51 H LEU 51 14.067 4.524 7.003 1299 HA LEU 51 HA LEU 51 12.283 2.352 7.269 1300 HB2 LEU 51 2HB LEU 51 14.499 2.228 6.124 1301 HB3 LEU 51 3HB LEU 51 15.307 2.383 7.675 1302 HG LEU 51 HG LEU 51 14.406 0.187 8.387 1303 HD11 LEU 51 1HD1 LEU 51 12.283 0.189 7.182 1304 HD12 LEU 51 2HD1 LEU 51 13.194 -1.273 6.829 1305 HD13 LEU 51 3HD1 LEU 51 13.128 0.028 5.639 1306 HD21 LEU 51 1HD2 LEU 51 16.582 0.231 7.229 1307 HD22 LEU 51 2HD2 LEU 51 15.776 0.020 5.676 1308 HD23 LEU 51 3HD2 LEU 51 15.710 -1.262 6.889 1309 H GLU 52 H GLU 52 14.111 4.198 9.606 1310 HA GLU 52 HA GLU 52 14.084 2.450 11.807 1311 HB2 GLU 52 2HB GLU 52 15.517 4.475 11.679 1312 HB3 GLU 52 3HB GLU 52 14.093 5.504 11.833 1313 HG2 GLU 52 2HG GLU 52 13.672 4.633 14.084 1314 HG3 GLU 52 3HG GLU 52 15.023 3.509 13.929 1315 H LYS 53 H LYS 53 11.849 5.091 10.901 1316 HA LYS 53 HA LYS 53 10.107 4.875 13.134 1317 HB2 LYS 53 2HB LYS 53 9.225 5.839 10.383 1318 HB3 LYS 53 3HB LYS 53 8.604 6.327 11.954 1319 HG2 LYS 53 2HG LYS 53 10.795 7.463 12.398 1320 HG3 LYS 53 3HG LYS 53 11.280 7.048 10.751 1321 HD2 LYS 53 2HD LYS 53 9.056 8.253 10.045 1322 HD3 LYS 53 3HD LYS 53 9.117 8.962 11.658 1323 HE2 LYS 53 2HE LYS 53 11.187 9.227 9.467 1324 HE3 LYS 53 3HE LYS 53 10.113 10.486 10.075 1325 HZ1 LYS 53 1HZ LYS 53 12.368 9.201 11.497 1326 HZ2 LYS 53 2HZ LYS 53 11.242 10.203 12.260 1327 HZ3 LYS 53 3HZ LYS 53 12.225 10.821 11.032 1328 H VAL 54 H VAL 54 10.063 3.478 9.903 1329 HA VAL 54 HA VAL 54 7.509 2.310 9.891 1330 HB VAL 54 HB VAL 54 10.041 1.556 8.355 1331 HG11 VAL 54 1HG1 VAL 54 8.569 0.375 6.754 1332 HG12 VAL 54 2HG1 VAL 54 7.191 0.659 7.817 1333 HG13 VAL 54 3HG1 VAL 54 8.522 -0.364 8.355 1334 HG21 VAL 54 1HG2 VAL 54 9.042 2.832 6.492 1335 HG22 VAL 54 2HG2 VAL 54 9.229 3.855 7.916 1336 HG23 VAL 54 3HG2 VAL 54 7.639 3.221 7.491 1337 H LEU 55 H LEU 55 10.699 0.905 10.670 1338 HA LEU 55 HA LEU 55 9.682 -1.667 11.435 1339 HB2 LEU 55 2HB LEU 55 12.399 -0.368 11.841 1340 HB3 LEU 55 3HB LEU 55 12.039 -2.022 12.308 1341 HG LEU 55 HG LEU 55 12.030 -0.921 9.468 1342 HD11 LEU 55 1HD1 LEU 55 14.279 -1.235 10.392 1343 HD12 LEU 55 2HD1 LEU 55 13.953 -2.394 9.109 1344 HD13 LEU 55 3HD1 LEU 55 13.899 -2.913 10.795 1345 HD21 LEU 55 1HD2 LEU 55 10.266 -2.609 9.677 1346 HD22 LEU 55 2HD2 LEU 55 11.404 -3.751 10.393 1347 HD23 LEU 55 3HD2 LEU 55 11.605 -3.236 8.716 1348 H ASP 56 H ASP 56 10.293 1.317 13.139 1349 HA ASP 56 HA ASP 56 10.409 0.332 15.809 1350 HB2 ASP 56 2HB ASP 56 11.300 2.531 15.258 1351 HB3 ASP 56 3HB ASP 56 9.733 3.086 14.682 1352 H TYR 57 H TYR 57 7.781 1.874 13.940 1353 HA TYR 57 HA TYR 57 5.708 1.589 15.810 1354 HB2 TYR 57 2HB TYR 57 5.406 3.066 13.890 1355 HB3 TYR 57 3HB TYR 57 5.589 1.728 12.761 1356 HD1 TYR 57 HD1 TYR 57 3.690 0.225 12.278 1357 HD2 TYR 57 HD2 TYR 57 3.293 3.294 15.231 1358 HE1 TYR 57 HE1 TYR 57 1.276 -0.189 12.365 1359 HE2 TYR 57 HE2 TYR 57 0.875 2.878 15.306 1360 HH TYR 57 HH TYR 57 -0.891 1.878 14.060 1361 H CYS 58 H CYS 58 6.712 -0.528 13.112 1362 HA CYS 58 HA CYS 58 4.711 -2.508 13.437 1363 HB2 CYS 58 2HB CYS 58 7.439 -2.693 12.099 1364 HB3 CYS 58 3HB CYS 58 6.152 -3.891 11.929 1365 HG CYS 58 HG CYS 58 6.692 -1.353 10.076 1366 H ARG 59 H ARG 59 7.899 -2.106 14.878 1367 HA ARG 59 HA ARG 59 8.172 -4.645 16.108 1368 HB2 ARG 59 2HB ARG 59 10.103 -3.180 15.915 1369 HB3 ARG 59 3HB ARG 59 9.320 -1.926 16.870 1370 HG2 ARG 59 2HG ARG 59 9.442 -3.334 18.872 1371 HG3 ARG 59 3HG ARG 59 10.139 -4.656 17.926 1372 HD2 ARG 59 2HD ARG 59 11.849 -3.404 19.217 1373 HD3 ARG 59 3HD ARG 59 12.142 -3.334 17.477 1374 HE ARG 59 HE ARG 59 10.637 -1.077 18.265 1375 HH11 ARG 59 1HH1 ARG 59 13.912 -2.347 18.573 1376 HH12 ARG 59 2HH1 ARG 59 14.629 -0.775 18.715 1377 HH21 ARG 59 1HH2 ARG 59 11.591 0.968 18.439 1378 HH22 ARG 59 2HH2 ARG 59 13.308 1.109 18.645 1379 H HIS 60 H HIS 60 6.977 -1.539 17.351 1380 HA HIS 60 HA HIS 60 6.092 -2.423 19.880 1381 HB2 HIS 60 2HB HIS 60 6.447 -0.064 19.432 1382 HB3 HIS 60 3HB HIS 60 5.236 -0.067 18.153 1383 HD1 HIS 60 HD1 HIS 60 2.856 0.361 18.831 1384 HD2 HIS 60 HD2 HIS 60 5.324 -0.236 22.109 1385 HE1 HIS 60 HE1 HIS 60 1.462 0.930 20.828 1386 HE2 HIS 60 HE2 HIS 60 3.046 0.782 22.767 1387 H HIS 61 H HIS 61 4.524 -2.365 16.732 1388 HA HIS 61 HA HIS 61 1.889 -3.054 17.670 1389 HB2 HIS 61 2HB HIS 61 2.500 -1.809 15.466 1390 HB3 HIS 61 3HB HIS 61 2.901 -3.392 14.810 1391 HD1 HIS 61 HD1 HIS 61 0.766 -5.183 15.021 1392 HD2 HIS 61 HD2 HIS 61 -0.107 -1.119 15.077 1393 HE1 HIS 61 HE1 HIS 61 -1.680 -5.013 14.496 1394 HE2 HIS 61 HE2 HIS 61 -2.163 -2.544 14.423 1395 H HIS 62 H HIS 62 4.788 -4.794 16.844 1396 HA HIS 62 HA HIS 62 3.514 -7.405 16.763 1397 HB2 HIS 62 2HB HIS 62 5.612 -6.963 15.509 1398 HB3 HIS 62 3HB HIS 62 6.464 -6.650 17.019 1399 HD1 HIS 62 HD1 HIS 62 4.709 -9.476 15.197 1400 HD2 HIS 62 HD2 HIS 62 7.497 -8.895 18.222 1401 HE1 HIS 62 HE1 HIS 62 5.530 -11.766 15.808 1402 HE2 HIS 62 HE2 HIS 62 7.113 -11.400 17.730 1403 H GLN 63 H GLN 63 5.031 -5.308 19.164 1404 HA GLN 63 HA GLN 63 5.198 -7.231 21.282 1405 HB2 GLN 63 2HB GLN 63 4.965 -4.200 21.569 1406 HB3 GLN 63 3HB GLN 63 5.528 -5.324 22.796 1407 HG2 GLN 63 2HG GLN 63 6.942 -4.475 20.270 1408 HG3 GLN 63 3HG GLN 63 7.444 -4.205 21.931 1409 HE21 GLN 63 1HE2 GLN 63 7.423 -6.413 19.272 1410 HE22 GLN 63 2HE2 GLN 63 8.424 -7.628 19.986 1411 H HIS 64 H HIS 64 2.736 -5.004 20.131 1412 HA HIS 64 HA HIS 64 0.705 -6.331 21.823 1413 HB2 HIS 64 2HB HIS 64 0.796 -3.354 21.115 1414 HB3 HIS 64 3HB HIS 64 -0.525 -4.160 21.953 1415 HD1 HIS 64 HD1 HIS 64 -0.169 -4.738 24.443 1416 HD2 HIS 64 HD2 HIS 64 3.085 -2.847 22.685 1417 HE1 HIS 64 HE1 HIS 64 1.339 -4.099 26.341 1418 HE2 HIS 64 HE2 HIS 64 3.382 -3.134 25.241 1419 HA PRO 65 HA PRO 65 -0.139 -6.872 17.262 1420 HB2 PRO 65 2HB PRO 65 -1.131 -9.433 17.427 1421 HB3 PRO 65 3HB PRO 65 0.604 -9.071 17.364 1422 HG2 PRO 65 2HG PRO 65 -1.101 -9.658 19.764 1423 HG3 PRO 65 3HG PRO 65 0.502 -10.304 19.340 1424 HD2 PRO 65 2HD PRO 65 0.223 -8.290 21.122 1425 HD3 PRO 65 3HD PRO 65 1.614 -8.368 20.016 1426 H GLY 66 H GLY 66 -2.208 -7.164 20.063 1427 HA2 GLY 66 2HA GLY 66 -4.429 -5.903 18.787 1428 HA3 GLY 66 3HA GLY 66 -4.711 -7.637 18.957 1429 H GLY 67 H GLY 67 -6.194 -7.733 20.560 1430 HA2 GLY 67 2HA GLY 67 -6.886 -7.910 22.754 1431 HA3 GLY 67 3HA GLY 67 -5.406 -7.128 23.291 1432 H SER 68 H SER 68 -5.289 -4.736 22.599 1433 HA SER 68 HA SER 68 -7.871 -3.327 22.678 1434 HB2 SER 68 2HB SER 68 -5.526 -2.790 24.570 1435 HB3 SER 68 3HB SER 68 -7.000 -1.821 24.472 1436 HG SER 68 HG SER 68 -7.976 -4.112 24.850 1437 H GLY 69 H GLY 69 -7.093 -0.775 22.655 1438 HA2 GLY 69 2HA GLY 69 -5.665 0.848 21.667 1439 HA3 GLY 69 3HA GLY 69 -4.962 -0.390 20.640 1440 H LEU 70 H LEU 70 -7.757 -1.400 20.046 1441 HA LEU 70 HA LEU 70 -8.168 0.013 17.619 1442 HB2 LEU 70 2HB LEU 70 -10.001 -1.977 19.019 1443 HB3 LEU 70 3HB LEU 70 -10.139 -1.474 17.341 1444 HG LEU 70 HG LEU 70 -7.802 -3.036 18.518 1445 HD11 LEU 70 1HD1 LEU 70 -8.626 -4.943 17.193 1446 HD12 LEU 70 2HD1 LEU 70 -10.031 -3.997 16.696 1447 HD13 LEU 70 3HD1 LEU 70 -9.806 -4.423 18.394 1448 HD21 LEU 70 1HD2 LEU 70 -8.306 -2.212 15.636 1449 HD22 LEU 70 2HD2 LEU 70 -7.026 -3.298 16.176 1450 HD23 LEU 70 3HD2 LEU 70 -7.022 -1.614 16.692 1451 H ASP 71 H ASP 71 -10.015 -0.084 20.680 1452 HA ASP 71 HA ASP 71 -11.699 2.198 19.902 1453 HB2 ASP 71 2HB ASP 71 -12.769 0.350 21.128 1454 HB3 ASP 71 3HB ASP 71 -11.611 0.503 22.444 1455 H ASP 72 H ASP 72 -9.042 1.374 22.030 1456 HA ASP 72 HA ASP 72 -9.056 3.590 23.760 1457 HB2 ASP 72 2HB ASP 72 -6.694 1.832 22.956 1458 HB3 ASP 72 3HB ASP 72 -6.768 2.860 24.379 1459 H ILE 73 H ILE 73 -7.563 3.051 20.630 1460 HA ILE 73 HA ILE 73 -6.216 4.161 19.238 1461 HB ILE 73 HB ILE 73 -7.468 6.682 20.426 1462 HG12 ILE 73 2HG1 ILE 73 -9.205 5.139 19.564 1463 HG13 ILE 73 3HG1 ILE 73 -9.080 6.554 18.530 1464 HG21 ILE 73 1HG2 ILE 73 -6.032 6.280 17.766 1465 HG22 ILE 73 2HG2 ILE 73 -5.429 7.204 19.143 1466 HG23 ILE 73 3HG2 ILE 73 -6.854 7.761 18.267 1467 HD11 ILE 73 1HD1 ILE 73 -7.955 3.812 17.939 1468 HD12 ILE 73 2HD1 ILE 73 -7.800 5.226 16.893 1469 HD13 ILE 73 3HD1 ILE 73 -9.390 4.538 17.217 1470 HA PRO 74 HA PRO 74 -2.903 4.612 22.386 1471 HB2 PRO 74 2HB PRO 74 -1.131 3.760 20.124 1472 HB3 PRO 74 3HB PRO 74 -1.326 3.041 21.736 1473 HG2 PRO 74 2HG PRO 74 -2.291 1.815 19.566 1474 HG3 PRO 74 3HG PRO 74 -3.184 1.779 21.107 1475 HD2 PRO 74 2HD PRO 74 -3.662 3.527 18.688 1476 HD3 PRO 74 3HD PRO 74 -4.836 2.632 19.686 1477 HA PRO 75 HA PRO 75 -1.720 8.857 21.095 1478 HB2 PRO 75 2HB PRO 75 0.254 8.288 23.333 1479 HB3 PRO 75 3HB PRO 75 -0.728 9.741 23.034 1480 HG2 PRO 75 2HG PRO 75 -1.480 8.053 24.909 1481 HG3 PRO 75 3HG PRO 75 -2.702 8.747 23.815 1482 HD2 PRO 75 2HD PRO 75 -1.492 5.992 23.794 1483 HD3 PRO 75 3HD PRO 75 -3.166 6.496 23.458 1484 H TYR 76 H TYR 76 0.397 6.101 21.478 1485 HA TYR 76 HA TYR 76 2.797 6.861 20.350 1486 HB2 TYR 76 2HB TYR 76 2.245 4.662 21.455 1487 HB3 TYR 76 3HB TYR 76 1.376 4.176 20.011 1488 HD1 TYR 76 HD1 TYR 76 2.685 3.748 17.856 1489 HD2 TYR 76 HD2 TYR 76 4.656 4.451 21.595 1490 HE1 TYR 76 HE1 TYR 76 4.754 2.770 16.958 1491 HE2 TYR 76 HE2 TYR 76 6.711 3.469 20.683 1492 HH TYR 76 HH TYR 76 7.235 2.877 17.446 1493 H ASP 77 H ASP 77 -0.079 5.565 18.687 1494 HA ASP 77 HA ASP 77 0.913 5.519 16.046 1495 HB2 ASP 77 2HB ASP 77 -1.938 5.703 17.117 1496 HB3 ASP 77 3HB ASP 77 -1.561 5.447 15.416 1497 H ARG 78 H ARG 78 -0.787 7.973 17.893 1498 HA ARG 78 HA ARG 78 -1.183 9.858 15.759 1499 HB2 ARG 78 2HB ARG 78 -1.148 10.395 18.762 1500 HB3 ARG 78 3HB ARG 78 -1.906 11.392 17.520 1501 HG2 ARG 78 2HG ARG 78 -3.439 9.509 17.008 1502 HG3 ARG 78 3HG ARG 78 -2.755 8.600 18.352 1503 HD2 ARG 78 2HD ARG 78 -4.263 11.232 18.514 1504 HD3 ARG 78 3HD ARG 78 -4.836 9.652 19.053 1505 HE ARG 78 HE ARG 78 -2.396 10.587 20.325 1506 HH11 ARG 78 1HH1 ARG 78 -5.915 10.486 20.562 1507 HH12 ARG 78 2HH1 ARG 78 -5.919 10.787 22.274 1508 HH21 ARG 78 1HH2 ARG 78 -2.423 11.026 22.549 1509 HH22 ARG 78 2HH2 ARG 78 -3.943 11.095 23.398 1510 H ASP 79 H ASP 79 1.295 9.289 18.159 1511 HA ASP 79 HA ASP 79 2.763 11.678 17.542 1512 HB2 ASP 79 2HB ASP 79 3.345 9.360 19.402 1513 HB3 ASP 79 3HB ASP 79 4.539 10.624 19.098 1514 H PHE 80 H PHE 80 2.719 8.421 16.392 1515 HA PHE 80 HA PHE 80 5.181 8.384 14.968 1516 HB2 PHE 80 2HB PHE 80 3.962 6.296 15.269 1517 HB3 PHE 80 3HB PHE 80 2.535 6.939 14.465 1518 HD1 PHE 80 HD1 PHE 80 2.240 6.563 12.137 1519 HD2 PHE 80 HD2 PHE 80 6.139 6.064 13.835 1520 HE1 PHE 80 HE1 PHE 80 3.073 5.709 9.988 1521 HE2 PHE 80 HE2 PHE 80 6.951 5.209 11.680 1522 HZ PHE 80 HZ PHE 80 5.430 5.039 9.754 1523 H CYS 81 H CYS 81 2.022 9.739 14.321 1524 HA CYS 81 HA CYS 81 2.383 10.474 11.596 1525 HB2 CYS 81 2HB CYS 81 0.471 11.590 13.686 1526 HB3 CYS 81 3HB CYS 81 0.322 11.799 11.942 1527 HG CYS 81 HG CYS 81 0.214 8.871 11.668 1528 H LYS 82 H LYS 82 3.784 11.789 14.425 1529 HA LYS 82 HA LYS 82 3.880 14.576 13.573 1530 HB2 LYS 82 2HB LYS 82 5.440 13.236 15.818 1531 HB3 LYS 82 3HB LYS 82 5.192 14.964 15.601 1532 HG2 LYS 82 2HG LYS 82 3.074 12.915 16.266 1533 HG3 LYS 82 3HG LYS 82 3.785 14.074 17.387 1534 HD2 LYS 82 2HD LYS 82 2.783 15.937 16.101 1535 HD3 LYS 82 3HD LYS 82 2.094 14.779 14.954 1536 HE2 LYS 82 2HE LYS 82 0.442 15.559 16.649 1537 HE3 LYS 82 3HE LYS 82 0.698 13.812 16.705 1538 HZ1 LYS 82 1HZ LYS 82 0.648 14.978 18.898 1539 HZ2 LYS 82 2HZ LYS 82 2.118 15.704 18.494 1540 HZ3 LYS 82 3HZ LYS 82 2.012 14.021 18.633 1541 H VAL 83 H VAL 83 4.789 13.952 11.495 1542 HA VAL 83 HA VAL 83 7.746 13.942 11.471 1543 HB VAL 83 HB VAL 83 7.688 12.543 9.382 1544 HG11 VAL 83 1HG1 VAL 83 6.429 11.160 11.782 1545 HG12 VAL 83 2HG1 VAL 83 8.153 11.437 11.528 1546 HG13 VAL 83 3HG1 VAL 83 7.269 10.359 10.451 1547 HG21 VAL 83 1HG2 VAL 83 5.391 13.022 8.630 1548 HG22 VAL 83 2HG2 VAL 83 4.731 12.149 10.012 1549 HG23 VAL 83 3HG2 VAL 83 5.638 11.281 8.772 1550 H ASP 84 H ASP 84 8.494 14.763 9.214 1551 HA ASP 84 HA ASP 84 7.239 17.280 8.665 1552 HB2 ASP 84 2HB ASP 84 9.348 15.846 6.990 1553 HB3 ASP 84 3HB ASP 84 8.935 17.556 6.899 1554 H GLN 85 H GLN 85 6.402 17.953 6.562 1555 HA GLN 85 HA GLN 85 4.291 16.391 5.633 1556 HB2 GLN 85 2HB GLN 85 4.378 18.872 5.552 1557 HB3 GLN 85 3HB GLN 85 5.592 18.812 4.293 1558 HG2 GLN 85 2HG GLN 85 2.839 17.623 3.881 1559 HG3 GLN 85 3HG GLN 85 3.138 19.337 3.639 1560 HE21 GLN 85 1HE2 GLN 85 3.727 16.146 2.396 1561 HE22 GLN 85 2HE2 GLN 85 4.342 16.642 0.868 1562 HA PRO 86 HA PRO 86 6.912 15.054 1.719 1563 HB2 PRO 86 2HB PRO 86 9.768 15.537 2.481 1564 HB3 PRO 86 3HB PRO 86 8.925 15.901 0.960 1565 HG2 PRO 86 2HG PRO 86 9.634 17.868 2.616 1566 HG3 PRO 86 3HG PRO 86 8.089 17.932 1.733 1567 HD2 PRO 86 2HD PRO 86 8.583 17.117 4.607 1568 HD3 PRO 86 3HD PRO 86 7.351 18.222 3.944 1569 H THR 87 H THR 87 8.655 14.766 4.832 1570 HA THR 87 HA THR 87 9.692 12.179 4.652 1571 HB THR 87 HB THR 87 8.714 13.679 7.122 1572 HG1 THR 87 HG1 THR 87 11.243 13.842 7.113 1573 HG21 THR 87 1HG2 THR 87 10.276 12.292 8.433 1574 HG22 THR 87 2HG2 THR 87 10.679 11.359 6.994 1575 HG23 THR 87 3HG2 THR 87 9.051 11.279 7.671 1576 H LEU 88 H LEU 88 6.493 13.276 5.477 1577 HA LEU 88 HA LEU 88 5.301 10.985 6.552 1578 HB2 LEU 88 2HB LEU 88 4.513 13.508 6.295 1579 HB3 LEU 88 3HB LEU 88 3.805 12.964 4.788 1580 HG LEU 88 HG LEU 88 3.087 11.881 7.547 1581 HD11 LEU 88 1HD1 LEU 88 2.381 14.217 7.288 1582 HD12 LEU 88 2HD1 LEU 88 0.991 13.136 7.318 1583 HD13 LEU 88 3HD1 LEU 88 1.542 13.816 5.785 1584 HD21 LEU 88 1HD2 LEU 88 1.821 11.345 4.846 1585 HD22 LEU 88 2HD2 LEU 88 1.169 10.818 6.404 1586 HD23 LEU 88 3HD2 LEU 88 2.715 10.191 5.841 1587 H PHE 89 H PHE 89 5.562 12.129 3.184 1588 HA PHE 89 HA PHE 89 4.190 9.892 2.018 1589 HB2 PHE 89 2HB PHE 89 5.896 12.081 0.775 1590 HB3 PHE 89 3HB PHE 89 5.026 10.867 -0.162 1591 HD1 PHE 89 HD1 PHE 89 2.456 10.602 1.090 1592 HD2 PHE 89 HD2 PHE 89 4.769 14.149 0.511 1593 HE1 PHE 89 HE1 PHE 89 0.413 11.949 1.144 1594 HE2 PHE 89 HE2 PHE 89 2.710 15.485 0.564 1595 HZ PHE 89 HZ PHE 89 0.532 14.392 0.890 1596 H GLU 90 H GLU 90 7.570 10.651 2.675 1597 HA GLU 90 HA GLU 90 8.810 8.556 1.267 1598 HB2 GLU 90 2HB GLU 90 9.620 9.764 3.943 1599 HB3 GLU 90 3HB GLU 90 10.659 8.786 2.918 1600 HG2 GLU 90 2HG GLU 90 9.505 11.478 2.174 1601 HG3 GLU 90 3HG GLU 90 11.139 11.209 2.763 1602 H LEU 91 H LEU 91 7.202 8.634 4.411 1603 HA LEU 91 HA LEU 91 7.786 5.973 5.242 1604 HB2 LEU 91 2HB LEU 91 5.523 7.844 6.036 1605 HB3 LEU 91 3HB LEU 91 5.842 6.308 6.823 1606 HG LEU 91 HG LEU 91 7.733 8.698 6.810 1607 HD11 LEU 91 1HD1 LEU 91 6.006 7.599 9.061 1608 HD12 LEU 91 2HD1 LEU 91 5.731 9.104 8.181 1609 HD13 LEU 91 3HD1 LEU 91 7.163 8.930 9.190 1610 HD21 LEU 91 1HD2 LEU 91 7.983 6.047 8.274 1611 HD22 LEU 91 2HD2 LEU 91 9.079 7.423 8.409 1612 HD23 LEU 91 3HD2 LEU 91 8.947 6.557 6.886 1613 H ILE 92 H ILE 92 5.161 7.382 3.288 1614 HA ILE 92 HA ILE 92 3.555 5.018 3.082 1615 HB ILE 92 HB ILE 92 3.681 7.436 1.205 1616 HG12 ILE 92 2HG1 ILE 92 1.817 6.790 3.539 1617 HG13 ILE 92 3HG1 ILE 92 2.992 8.095 3.461 1618 HG21 ILE 92 1HG2 ILE 92 2.709 5.491 0.030 1619 HG22 ILE 92 2HG2 ILE 92 1.480 6.715 0.332 1620 HG23 ILE 92 3HG2 ILE 92 1.543 5.266 1.337 1621 HD11 ILE 92 1HD1 ILE 92 0.799 8.982 3.179 1622 HD12 ILE 92 2HD1 ILE 92 0.446 7.853 1.874 1623 HD13 ILE 92 3HD1 ILE 92 1.653 9.120 1.644 1624 H LEU 93 H LEU 93 6.139 6.420 1.105 1625 HA LEU 93 HA LEU 93 6.139 4.567 -1.034 1626 HB2 LEU 93 2HB LEU 93 8.357 6.333 0.071 1627 HB3 LEU 93 3HB LEU 93 8.487 5.438 -1.435 1628 HG LEU 93 HG LEU 93 6.430 7.623 -0.916 1629 HD11 LEU 93 1HD1 LEU 93 8.699 8.565 -0.946 1630 HD12 LEU 93 2HD1 LEU 93 7.780 9.070 -2.360 1631 HD13 LEU 93 3HD1 LEU 93 9.007 7.808 -2.512 1632 HD21 LEU 93 1HD2 LEU 93 7.144 6.199 -3.500 1633 HD22 LEU 93 2HD2 LEU 93 6.005 7.537 -3.335 1634 HD23 LEU 93 3HD2 LEU 93 5.657 5.990 -2.571 1635 H ALA 94 H ALA 94 7.832 4.647 2.072 1636 HA ALA 94 HA ALA 94 9.366 2.244 1.707 1637 HB1 ALA 94 1HB ALA 94 9.874 2.471 4.113 1638 HB2 ALA 94 2HB ALA 94 8.645 3.734 4.261 1639 HB3 ALA 94 3HB ALA 94 10.077 4.007 3.269 1640 H ALA 95 H ALA 95 6.212 3.033 3.075 1641 HA ALA 95 HA ALA 95 5.668 0.520 4.321 1642 HB1 ALA 95 1HB ALA 95 4.511 2.641 4.898 1643 HB2 ALA 95 2HB ALA 95 3.399 1.319 4.558 1644 HB3 ALA 95 3HB ALA 95 3.670 2.584 3.352 1645 H ASN 96 H ASN 96 5.179 1.799 1.082 1646 HA ASN 96 HA ASN 96 3.690 -0.470 0.072 1647 HB2 ASN 96 2HB ASN 96 3.392 1.771 -0.922 1648 HB3 ASN 96 3HB ASN 96 5.096 1.843 -1.351 1649 HD21 ASN 96 1HD2 ASN 96 4.554 2.170 -3.538 1650 HD22 ASN 96 2HD2 ASN 96 3.999 0.887 -4.546 1651 H TYR 97 H TYR 97 7.045 0.679 0.006 1652 HA TYR 97 HA TYR 97 8.159 -1.254 -1.725 1653 HB2 TYR 97 2HB TYR 97 9.382 0.785 -1.333 1654 HB3 TYR 97 3HB TYR 97 9.415 0.523 0.404 1655 HD1 TYR 97 HD1 TYR 97 11.443 -0.261 1.324 1656 HD2 TYR 97 HD2 TYR 97 10.602 -1.173 -2.767 1657 HE1 TYR 97 HE1 TYR 97 13.632 -1.349 1.122 1658 HE2 TYR 97 HE2 TYR 97 12.796 -2.261 -2.964 1659 HH TYR 97 HH TYR 97 14.976 -2.270 -1.882 1660 H LEU 98 H LEU 98 7.645 -1.279 1.777 1661 HA LEU 98 HA LEU 98 8.871 -3.948 2.052 1662 HB2 LEU 98 2HB LEU 98 7.653 -2.173 4.206 1663 HB3 LEU 98 3HB LEU 98 8.597 -3.630 4.460 1664 HG LEU 98 HG LEU 98 9.622 -0.972 3.402 1665 HD11 LEU 98 1HD1 LEU 98 10.931 -0.887 5.459 1666 HD12 LEU 98 2HD1 LEU 98 10.254 -2.430 5.985 1667 HD13 LEU 98 3HD1 LEU 98 9.213 -1.017 5.822 1668 HD21 LEU 98 1HD2 LEU 98 10.779 -2.794 2.249 1669 HD22 LEU 98 2HD2 LEU 98 11.185 -3.534 3.798 1670 HD23 LEU 98 3HD2 LEU 98 11.859 -1.963 3.367 1671 H ASP 99 H ASP 99 5.875 -2.438 1.629 1672 HA ASP 99 HA ASP 99 3.715 -2.879 1.866 1673 HB2 ASP 99 2HB ASP 99 4.334 -4.450 0.008 1674 HB3 ASP 99 3HB ASP 99 4.471 -5.744 1.196 1675 H ILE 100 H ILE 100 4.136 -2.404 4.185 1676 HA ILE 100 HA ILE 100 3.374 -4.668 5.953 1677 HB ILE 100 HB ILE 100 4.230 -1.866 6.823 1678 HG12 ILE 100 2HG1 ILE 100 5.934 -4.385 6.582 1679 HG13 ILE 100 3HG1 ILE 100 6.107 -2.915 5.632 1680 HG21 ILE 100 1HG2 ILE 100 4.531 -2.933 9.036 1681 HG22 ILE 100 2HG2 ILE 100 3.990 -4.477 8.381 1682 HG23 ILE 100 3HG2 ILE 100 2.873 -3.113 8.467 1683 HD11 ILE 100 1HD1 ILE 100 7.817 -3.026 7.292 1684 HD12 ILE 100 2HD1 ILE 100 6.631 -3.217 8.580 1685 HD13 ILE 100 3HD1 ILE 100 6.723 -1.700 7.682 1686 H LYS 101 H LYS 101 1.245 -4.827 6.312 1687 HA LYS 101 HA LYS 101 -0.579 -3.044 5.129 1688 HB2 LYS 101 2HB LYS 101 -1.358 -5.191 7.138 1689 HB3 LYS 101 3HB LYS 101 -2.335 -4.538 5.835 1690 HG2 LYS 101 2HG LYS 101 -0.026 -6.477 5.667 1691 HG3 LYS 101 3HG LYS 101 -1.679 -6.696 5.108 1692 HD2 LYS 101 2HD LYS 101 0.395 -4.858 3.855 1693 HD3 LYS 101 3HD LYS 101 -0.095 -6.431 3.236 1694 HE2 LYS 101 2HE LYS 101 -2.307 -5.630 2.731 1695 HE3 LYS 101 3HE LYS 101 -2.004 -4.097 3.554 1696 HZ1 LYS 101 1HZ LYS 101 -0.725 -5.076 1.068 1697 HZ2 LYS 101 2HZ LYS 101 -0.209 -3.708 1.905 1698 HZ3 LYS 101 3HZ LYS 101 -1.760 -3.749 1.230 1699 HA PRO 102 HA PRO 102 -1.796 -1.534 9.687 1700 HB2 PRO 102 2HB PRO 102 0.316 -1.643 11.522 1701 HB3 PRO 102 3HB PRO 102 -1.018 -2.809 11.448 1702 HG2 PRO 102 2HG PRO 102 1.741 -3.034 10.288 1703 HG3 PRO 102 3HG PRO 102 0.779 -4.260 11.146 1704 HD2 PRO 102 2HD PRO 102 0.990 -4.294 8.471 1705 HD3 PRO 102 3HD PRO 102 -0.550 -4.713 9.266 1706 H LEU 103 H LEU 103 1.650 -1.264 8.714 1707 HA LEU 103 HA LEU 103 2.079 1.378 9.661 1708 HB2 LEU 103 2HB LEU 103 3.797 -0.480 9.012 1709 HB3 LEU 103 3HB LEU 103 3.618 0.079 7.365 1710 HG LEU 103 HG LEU 103 5.669 0.937 8.506 1711 HD11 LEU 103 1HD1 LEU 103 5.535 3.312 7.903 1712 HD12 LEU 103 2HD1 LEU 103 3.780 3.174 7.736 1713 HD13 LEU 103 3HD1 LEU 103 4.846 2.267 6.667 1714 HD21 LEU 103 1HD2 LEU 103 4.804 1.082 10.776 1715 HD22 LEU 103 2HD2 LEU 103 3.791 2.456 10.324 1716 HD23 LEU 103 3HD2 LEU 103 5.550 2.598 10.276 1717 H LEU 104 H LEU 104 1.409 0.074 6.438 1718 HA LEU 104 HA LEU 104 1.434 2.435 4.938 1719 HB2 LEU 104 2HB LEU 104 1.538 0.179 3.948 1720 HB3 LEU 104 3HB LEU 104 -0.106 -0.151 4.460 1721 HG LEU 104 HG LEU 104 -0.916 1.631 2.891 1722 HD11 LEU 104 1HD1 LEU 104 0.596 2.543 1.169 1723 HD12 LEU 104 2HD1 LEU 104 1.975 1.788 1.971 1724 HD13 LEU 104 3HD1 LEU 104 1.065 3.060 2.788 1725 HD21 LEU 104 1HD2 LEU 104 -0.896 -0.731 2.204 1726 HD22 LEU 104 2HD2 LEU 104 0.744 -0.551 1.574 1727 HD23 LEU 104 3HD2 LEU 104 -0.592 0.331 0.831 1728 H ASP 105 H ASP 105 -1.195 0.753 6.615 1729 HA ASP 105 HA ASP 105 -3.333 2.298 5.607 1730 HB2 ASP 105 2HB ASP 105 -3.579 0.025 6.626 1731 HB3 ASP 105 3HB ASP 105 -3.235 0.713 8.214 1732 H VAL 106 H VAL 106 -1.631 2.417 8.739 1733 HA VAL 106 HA VAL 106 -2.974 4.574 9.902 1734 HB VAL 106 HB VAL 106 -0.144 3.517 10.331 1735 HG11 VAL 106 1HG1 VAL 106 -0.125 5.868 11.063 1736 HG12 VAL 106 2HG1 VAL 106 -0.030 4.782 12.446 1737 HG13 VAL 106 3HG1 VAL 106 -1.553 5.591 12.064 1738 HG21 VAL 106 1HG2 VAL 106 -1.963 1.976 10.928 1739 HG22 VAL 106 2HG2 VAL 106 -2.687 3.201 11.973 1740 HG23 VAL 106 3HG2 VAL 106 -1.110 2.518 12.372 1741 H THR 107 H THR 107 -0.034 4.571 7.867 1742 HA THR 107 HA THR 107 0.490 7.370 8.129 1743 HB THR 107 HB THR 107 1.588 5.510 5.970 1744 HG1 THR 107 HG1 THR 107 2.533 4.522 7.578 1745 HG21 THR 107 1HG2 THR 107 2.121 7.917 5.634 1746 HG22 THR 107 2HG2 THR 107 3.563 6.994 6.061 1747 HG23 THR 107 3HG2 THR 107 2.770 7.998 7.275 1748 H CYS 108 H CYS 108 -1.296 5.443 5.742 1749 HA CYS 108 HA CYS 108 -1.722 7.551 3.839 1750 HB2 CYS 108 2HB CYS 108 -3.217 4.937 4.305 1751 HB3 CYS 108 3HB CYS 108 -3.561 6.030 2.964 1752 HG CYS 108 HG CYS 108 -0.441 4.712 3.422 1753 H LYS 109 H LYS 109 -3.522 6.299 6.622 1754 HA LYS 109 HA LYS 109 -5.782 8.023 6.424 1755 HB2 LYS 109 2HB LYS 109 -4.708 6.166 8.533 1756 HB3 LYS 109 3HB LYS 109 -5.817 7.416 9.079 1757 HG2 LYS 109 2HG LYS 109 -6.952 5.267 8.620 1758 HG3 LYS 109 3HG LYS 109 -7.577 6.581 7.624 1759 HD2 LYS 109 2HD LYS 109 -6.268 5.767 5.704 1760 HD3 LYS 109 3HD LYS 109 -5.582 4.481 6.698 1761 HE2 LYS 109 2HE LYS 109 -8.524 4.795 6.020 1762 HE3 LYS 109 3HE LYS 109 -7.411 3.665 5.248 1763 HZ1 LYS 109 1HZ LYS 109 -8.161 3.657 8.117 1764 HZ2 LYS 109 2HZ LYS 109 -7.077 2.585 7.384 1765 HZ3 LYS 109 3HZ LYS 109 -8.711 2.572 6.941 1766 H THR 110 H THR 110 -2.581 8.393 7.870 1767 HA THR 110 HA THR 110 -2.953 10.696 9.410 1768 HB THR 110 HB THR 110 -0.500 9.912 7.767 1769 HG1 THR 110 HG1 THR 110 -1.570 8.693 9.804 1770 HG21 THR 110 1HG2 THR 110 0.799 11.296 9.359 1771 HG22 THR 110 2HG2 THR 110 -0.698 11.830 10.123 1772 HG23 THR 110 3HG2 THR 110 -0.349 12.283 8.453 1773 H VAL 111 H VAL 111 -2.230 10.378 5.912 1774 HA VAL 111 HA VAL 111 -2.221 13.199 5.369 1775 HB VAL 111 HB VAL 111 -2.762 11.041 3.274 1776 HG11 VAL 111 1HG1 VAL 111 -1.706 12.649 1.736 1777 HG12 VAL 111 2HG1 VAL 111 -1.489 13.791 3.063 1778 HG13 VAL 111 3HG1 VAL 111 -3.114 13.348 2.536 1779 HG21 VAL 111 1HG2 VAL 111 -0.761 10.358 4.519 1780 HG22 VAL 111 2HG2 VAL 111 -0.036 11.945 4.256 1781 HG23 VAL 111 3HG2 VAL 111 -0.344 10.878 2.885 1782 H ALA 112 H ALA 112 -4.601 10.606 5.132 1783 HA ALA 112 HA ALA 112 -6.661 11.975 3.799 1784 HB1 ALA 112 1HB ALA 112 -6.588 9.529 4.008 1785 HB2 ALA 112 2HB ALA 112 -8.126 10.161 4.599 1786 HB3 ALA 112 3HB ALA 112 -6.881 9.651 5.744 1787 H ASN 113 H ASN 113 -5.738 11.873 7.202 1788 HA ASN 113 HA ASN 113 -8.058 13.136 8.299 1789 HB2 ASN 113 2HB ASN 113 -5.219 12.802 9.365 1790 HB3 ASN 113 3HB ASN 113 -6.463 13.655 10.276 1791 HD21 ASN 113 1HD2 ASN 113 -5.009 11.199 10.956 1792 HD22 ASN 113 2HD2 ASN 113 -6.212 9.987 11.213 1793 H MET 114 H MET 114 -5.040 14.316 6.907 1794 HA MET 114 HA MET 114 -5.245 17.025 7.806 1795 HB2 MET 114 2HB MET 114 -3.662 15.928 5.439 1796 HB3 MET 114 3HB MET 114 -3.447 17.515 6.164 1797 HG2 MET 114 2HG MET 114 -2.825 16.320 8.315 1798 HG3 MET 114 3HG MET 114 -2.793 14.830 7.376 1799 HE1 MET 114 1HE MET 114 -1.650 16.191 4.532 1800 HE2 MET 114 2HE MET 114 -1.110 14.611 5.103 1801 HE3 MET 114 3HE MET 114 0.073 15.856 4.712 1802 H ILE 115 H ILE 115 -6.437 15.299 4.972 1803 HA ILE 115 HA ILE 115 -7.472 17.787 3.752 1804 HB ILE 115 HB ILE 115 -7.901 16.463 1.716 1805 HG12 ILE 115 2HG1 ILE 115 -6.695 14.055 3.166 1806 HG13 ILE 115 3HG1 ILE 115 -8.419 14.283 2.927 1807 HG21 ILE 115 1HG2 ILE 115 -5.668 17.474 1.964 1808 HG22 ILE 115 2HG2 ILE 115 -5.567 15.964 1.060 1809 HG23 ILE 115 3HG2 ILE 115 -5.075 16.011 2.754 1810 HD11 ILE 115 1HD1 ILE 115 -7.516 12.723 1.323 1811 HD12 ILE 115 2HD1 ILE 115 -6.365 13.929 0.755 1812 HD13 ILE 115 3HD1 ILE 115 -8.094 14.174 0.506 1813 H ARG 116 H ARG 116 -8.557 15.630 5.973 1814 HA ARG 116 HA ARG 116 -10.900 14.461 5.003 1815 HB2 ARG 116 2HB ARG 116 -9.700 13.858 7.144 1816 HB3 ARG 116 3HB ARG 116 -10.359 15.312 7.880 1817 HG2 ARG 116 2HG ARG 116 -12.696 14.280 7.196 1818 HG3 ARG 116 3HG ARG 116 -11.786 12.770 7.081 1819 HD2 ARG 116 2HD ARG 116 -12.790 12.925 9.277 1820 HD3 ARG 116 3HD ARG 116 -11.039 13.104 9.451 1821 HE ARG 116 HE ARG 116 -12.120 15.671 9.196 1822 HH11 ARG 116 1HH1 ARG 116 -12.274 13.040 11.541 1823 HH12 ARG 116 2HH1 ARG 116 -12.571 14.106 12.878 1824 HH21 ARG 116 1HH2 ARG 116 -12.517 17.030 10.939 1825 HH22 ARG 116 2HH2 ARG 116 -12.709 16.372 12.540 1826 H GLY 117 H GLY 117 -10.515 17.462 6.870 1827 HA2 GLY 117 2HA GLY 117 -12.164 19.304 6.285 1828 HA3 GLY 117 3HA GLY 117 -13.409 18.087 6.570 Start of MODEL 12 1 H1 SER 2 1H SER 2 -16.354 -14.443 -16.272 2 H2 SER 2 2H SER 2 -16.082 -13.709 -17.769 3 H3 SER 2 3H SER 2 -16.905 -15.184 -17.689 4 HA SER 2 HA SER 2 -18.391 -13.345 -18.100 5 HB2 SER 2 2HB SER 2 -18.749 -14.635 -15.357 6 HB3 SER 2 3HB SER 2 -20.037 -14.002 -16.388 7 HG SER 2 HG SER 2 -20.071 -16.003 -17.070 8 H LEU 3 H LEU 3 -19.605 -11.530 -17.043 9 HA LEU 3 HA LEU 3 -17.721 -9.632 -15.894 10 HB2 LEU 3 2HB LEU 3 -20.667 -9.249 -16.571 11 HB3 LEU 3 3HB LEU 3 -19.515 -7.978 -16.197 12 HG LEU 3 HG LEU 3 -19.464 -9.753 -18.667 13 HD11 LEU 3 1HD1 LEU 3 -19.990 -7.704 -19.909 14 HD12 LEU 3 2HD1 LEU 3 -20.100 -6.797 -18.399 15 HD13 LEU 3 3HD1 LEU 3 -21.257 -8.084 -18.746 16 HD21 LEU 3 1HD2 LEU 3 -17.625 -8.324 -19.459 17 HD22 LEU 3 2HD2 LEU 3 -17.184 -9.202 -17.997 18 HD23 LEU 3 3HD2 LEU 3 -17.598 -7.488 -17.903 19 H VAL 4 H VAL 4 -17.403 -9.621 -13.715 20 HA VAL 4 HA VAL 4 -19.569 -10.168 -11.834 21 HB VAL 4 HB VAL 4 -17.856 -9.512 -10.044 22 HG11 VAL 4 1HG1 VAL 4 -18.327 -11.857 -10.603 23 HG12 VAL 4 2HG1 VAL 4 -16.624 -11.639 -10.203 24 HG13 VAL 4 3HG1 VAL 4 -17.116 -11.815 -11.889 25 HG21 VAL 4 1HG2 VAL 4 -16.373 -8.110 -11.425 26 HG22 VAL 4 2HG2 VAL 4 -15.937 -9.504 -12.412 27 HG23 VAL 4 3HG2 VAL 4 -15.463 -9.444 -10.713 28 H LYS 5 H LYS 5 -20.759 -8.706 -10.843 29 HA LYS 5 HA LYS 5 -20.758 -5.985 -11.875 30 HB2 LYS 5 2HB LYS 5 -22.730 -7.450 -10.072 31 HB3 LYS 5 3HB LYS 5 -22.989 -5.880 -10.815 32 HG2 LYS 5 2HG LYS 5 -22.788 -7.005 -13.071 33 HG3 LYS 5 3HG LYS 5 -22.761 -8.554 -12.223 34 HD2 LYS 5 2HD LYS 5 -25.002 -8.060 -11.266 35 HD3 LYS 5 3HD LYS 5 -25.016 -6.511 -12.117 36 HE2 LYS 5 2HE LYS 5 -24.833 -7.788 -14.282 37 HE3 LYS 5 3HE LYS 5 -25.028 -9.277 -13.359 38 HZ1 LYS 5 1HZ LYS 5 -26.982 -7.051 -13.505 39 HZ2 LYS 5 2HZ LYS 5 -27.185 -8.470 -12.608 40 HZ3 LYS 5 3HZ LYS 5 -27.113 -8.539 -14.297 41 H LEU 6 H LEU 6 -18.881 -5.216 -10.798 42 HA LEU 6 HA LEU 6 -18.670 -5.216 -7.904 43 HB2 LEU 6 2HB LEU 6 -16.982 -3.813 -10.009 44 HB3 LEU 6 3HB LEU 6 -16.580 -3.936 -8.301 45 HG LEU 6 HG LEU 6 -16.738 -6.235 -10.289 46 HD11 LEU 6 1HD1 LEU 6 -14.328 -6.457 -9.913 47 HD12 LEU 6 2HD1 LEU 6 -14.350 -5.044 -8.858 48 HD13 LEU 6 3HD1 LEU 6 -14.738 -4.876 -10.571 49 HD21 LEU 6 1HD2 LEU 6 -17.528 -7.012 -8.107 50 HD22 LEU 6 2HD2 LEU 6 -16.083 -6.367 -7.326 51 HD23 LEU 6 3HD2 LEU 6 -15.948 -7.700 -8.474 52 H GLU 7 H GLU 7 -20.473 -4.092 -7.203 53 HA GLU 7 HA GLU 7 -21.059 -1.402 -8.082 54 HB2 GLU 7 2HB GLU 7 -22.867 -2.921 -7.356 55 HB3 GLU 7 3HB GLU 7 -22.171 -3.014 -5.740 56 HG2 GLU 7 2HG GLU 7 -22.585 -0.604 -5.413 57 HG3 GLU 7 3HG GLU 7 -23.253 -0.482 -7.038 58 H SER 8 H SER 8 -20.407 0.446 -7.158 59 HA SER 8 HA SER 8 -18.393 0.477 -5.045 60 HB2 SER 8 2HB SER 8 -18.273 2.917 -5.685 61 HB3 SER 8 3HB SER 8 -18.034 1.831 -7.053 62 HG SER 8 HG SER 8 -19.966 2.351 -7.851 63 H SER 9 H SER 9 -18.626 2.353 -3.416 64 HA SER 9 HA SER 9 -21.032 2.182 -1.886 65 HB2 SER 9 2HB SER 9 -19.959 3.932 -0.463 66 HB3 SER 9 3HB SER 9 -18.844 2.617 -0.832 67 HG SER 9 HG SER 9 -18.670 5.253 -1.438 68 H ASP 10 H ASP 10 -20.181 4.062 -4.606 69 HA ASP 10 HA ASP 10 -22.190 6.164 -4.207 70 HB2 ASP 10 2HB ASP 10 -19.968 6.724 -5.167 71 HB3 ASP 10 3HB ASP 10 -20.240 5.602 -6.489 72 H GLU 11 H GLU 11 -22.324 3.009 -5.001 73 HA GLU 11 HA GLU 11 -24.039 1.683 -5.592 74 HB2 GLU 11 2HB GLU 11 -25.544 3.546 -4.834 75 HB3 GLU 11 3HB GLU 11 -25.513 4.203 -6.464 76 HG2 GLU 11 2HG GLU 11 -26.575 2.049 -7.263 77 HG3 GLU 11 3HG GLU 11 -26.737 1.581 -5.572 78 H LYS 12 H LYS 12 -22.145 3.382 -7.771 79 HA LYS 12 HA LYS 12 -23.418 2.528 -10.222 80 HB2 LYS 12 2HB LYS 12 -20.605 3.590 -9.775 81 HB3 LYS 12 3HB LYS 12 -21.310 3.251 -11.352 82 HG2 LYS 12 2HG LYS 12 -23.135 4.948 -10.743 83 HG3 LYS 12 3HG LYS 12 -22.110 5.395 -9.376 84 HD2 LYS 12 2HD LYS 12 -20.241 5.819 -11.081 85 HD3 LYS 12 3HD LYS 12 -21.467 5.644 -12.337 86 HE2 LYS 12 2HE LYS 12 -21.459 7.722 -10.122 87 HE3 LYS 12 3HE LYS 12 -21.075 8.009 -11.820 88 HZ1 LYS 12 1HZ LYS 12 -23.327 7.418 -12.400 89 HZ2 LYS 12 2HZ LYS 12 -23.332 8.676 -11.267 90 HZ3 LYS 12 3HZ LYS 12 -23.700 7.097 -10.783 91 H VAL 13 H VAL 13 -23.236 0.668 -11.210 92 HA VAL 13 HA VAL 13 -21.688 -1.512 -9.993 93 HB VAL 13 HB VAL 13 -24.013 -1.533 -11.990 94 HG11 VAL 13 1HG1 VAL 13 -22.616 -3.531 -12.270 95 HG12 VAL 13 2HG1 VAL 13 -24.166 -3.957 -11.550 96 HG13 VAL 13 3HG1 VAL 13 -22.719 -3.871 -10.541 97 HG21 VAL 13 1HG2 VAL 13 -24.665 -0.712 -9.753 98 HG22 VAL 13 2HG2 VAL 13 -23.996 -2.167 -9.011 99 HG23 VAL 13 3HG2 VAL 13 -25.391 -2.285 -10.086 100 H PHE 14 H PHE 14 -19.719 -1.795 -10.894 101 HA PHE 14 HA PHE 14 -19.242 -1.317 -13.760 102 HB2 PHE 14 2HB PHE 14 -17.271 -1.807 -11.480 103 HB3 PHE 14 3HB PHE 14 -16.837 -1.415 -13.145 104 HD1 PHE 14 HD1 PHE 14 -17.870 -0.051 -9.928 105 HD2 PHE 14 HD2 PHE 14 -17.508 0.844 -14.095 106 HE1 PHE 14 HE1 PHE 14 -18.071 2.350 -9.438 107 HE2 PHE 14 HE2 PHE 14 -17.699 3.241 -13.590 108 HZ PHE 14 HZ PHE 14 -17.984 3.997 -11.267 109 H GLU 15 H GLU 15 -20.074 -3.072 -14.734 110 HA GLU 15 HA GLU 15 -19.622 -5.795 -13.865 111 HB2 GLU 15 2HB GLU 15 -20.832 -4.785 -16.471 112 HB3 GLU 15 3HB GLU 15 -20.974 -6.411 -15.803 113 HG2 GLU 15 2HG GLU 15 -22.261 -5.499 -13.894 114 HG3 GLU 15 3HG GLU 15 -22.105 -3.885 -14.581 115 H ILE 16 H ILE 16 -17.290 -5.716 -13.885 116 HA ILE 16 HA ILE 16 -15.980 -5.654 -16.539 117 HB ILE 16 HB ILE 16 -15.125 -4.077 -14.762 118 HG12 ILE 16 2HG1 ILE 16 -13.026 -6.176 -15.497 119 HG13 ILE 16 3HG1 ILE 16 -13.643 -4.985 -16.634 120 HG21 ILE 16 1HG2 ILE 16 -14.238 -6.593 -13.301 121 HG22 ILE 16 2HG2 ILE 16 -15.510 -5.490 -12.777 122 HG23 ILE 16 3HG2 ILE 16 -13.837 -4.935 -12.840 123 HD11 ILE 16 1HD1 ILE 16 -11.517 -4.296 -15.772 124 HD12 ILE 16 2HD1 ILE 16 -12.097 -4.421 -14.112 125 HD13 ILE 16 3HD1 ILE 16 -12.764 -3.191 -15.191 126 H GLU 17 H GLU 17 -14.373 -7.346 -16.967 127 HA GLU 17 HA GLU 17 -15.270 -9.961 -16.575 128 HB2 GLU 17 2HB GLU 17 -12.462 -9.036 -17.322 129 HB3 GLU 17 3HB GLU 17 -13.057 -10.684 -17.477 130 HG2 GLU 17 2HG GLU 17 -13.166 -9.817 -19.654 131 HG3 GLU 17 3HG GLU 17 -14.828 -9.754 -19.080 132 H LYS 18 H LYS 18 -14.863 -11.508 -15.078 133 HA LYS 18 HA LYS 18 -14.188 -10.813 -12.453 134 HB2 LYS 18 2HB LYS 18 -15.653 -12.721 -13.078 135 HB3 LYS 18 3HB LYS 18 -14.255 -13.584 -13.707 136 HG2 LYS 18 2HG LYS 18 -13.283 -13.412 -11.311 137 HG3 LYS 18 3HG LYS 18 -14.905 -12.915 -10.822 138 HD2 LYS 18 2HD LYS 18 -14.660 -15.314 -10.441 139 HD3 LYS 18 3HD LYS 18 -15.807 -15.060 -11.760 140 HE2 LYS 18 2HE LYS 18 -14.009 -15.537 -13.406 141 HE3 LYS 18 3HE LYS 18 -12.871 -15.808 -12.082 142 HZ1 LYS 18 1HZ LYS 18 -14.264 -17.645 -11.339 143 HZ2 LYS 18 2HZ LYS 18 -13.721 -17.879 -12.915 144 HZ3 LYS 18 3HZ LYS 18 -15.319 -17.403 -12.636 145 H GLU 19 H GLU 19 -12.303 -12.326 -14.989 146 HA GLU 19 HA GLU 19 -10.017 -13.111 -13.580 147 HB2 GLU 19 2HB GLU 19 -8.887 -12.999 -15.849 148 HB3 GLU 19 3HB GLU 19 -10.379 -13.927 -15.794 149 HG2 GLU 19 2HG GLU 19 -11.574 -11.860 -16.705 150 HG3 GLU 19 3HG GLU 19 -9.979 -11.160 -16.961 151 H ILE 20 H ILE 20 -10.940 -9.936 -14.765 152 HA ILE 20 HA ILE 20 -8.381 -8.669 -14.197 153 HB ILE 20 HB ILE 20 -11.089 -7.370 -14.760 154 HG12 ILE 20 2HG1 ILE 20 -8.846 -8.120 -16.702 155 HG13 ILE 20 3HG1 ILE 20 -10.444 -8.854 -16.627 156 HG21 ILE 20 1HG2 ILE 20 -9.765 -5.378 -15.387 157 HG22 ILE 20 2HG2 ILE 20 -8.278 -6.212 -14.938 158 HG23 ILE 20 3HG2 ILE 20 -9.483 -5.829 -13.706 159 HD11 ILE 20 1HD1 ILE 20 -9.829 -6.013 -17.417 160 HD12 ILE 20 2HD1 ILE 20 -11.442 -6.726 -17.315 161 HD13 ILE 20 3HD1 ILE 20 -10.279 -7.338 -18.484 162 H ALA 21 H ALA 21 -11.565 -8.976 -12.670 163 HA ALA 21 HA ALA 21 -11.024 -7.406 -10.344 164 HB1 ALA 21 1HB ALA 21 -13.053 -8.446 -9.425 165 HB2 ALA 21 2HB ALA 21 -13.053 -9.626 -10.741 166 HB3 ALA 21 3HB ALA 21 -13.306 -7.916 -11.090 167 H CYS 22 H CYS 22 -10.045 -10.591 -11.264 168 HA CYS 22 HA CYS 22 -9.436 -11.615 -8.652 169 HB2 CYS 22 2HB CYS 22 -8.423 -12.433 -11.401 170 HB3 CYS 22 3HB CYS 22 -8.101 -13.327 -9.916 171 HG CYS 22 HG CYS 22 -11.356 -12.843 -10.308 172 H MET 23 H MET 23 -7.780 -9.574 -10.980 173 HA MET 23 HA MET 23 -5.149 -9.587 -9.893 174 HB2 MET 23 2HB MET 23 -6.606 -7.292 -11.285 175 HB3 MET 23 3HB MET 23 -4.868 -7.408 -11.051 176 HG2 MET 23 2HG MET 23 -4.781 -9.358 -12.536 177 HG3 MET 23 3HG MET 23 -6.535 -9.301 -12.727 178 HE1 MET 23 1HE MET 23 -3.120 -7.465 -13.490 179 HE2 MET 23 2HE MET 23 -4.011 -6.207 -12.628 180 HE3 MET 23 3HE MET 23 -3.679 -6.030 -14.351 181 H SER 24 H SER 24 -8.073 -7.782 -9.110 182 HA SER 24 HA SER 24 -7.039 -6.496 -6.767 183 HB2 SER 24 2HB SER 24 -9.082 -5.643 -7.871 184 HB3 SER 24 3HB SER 24 -9.899 -7.181 -7.578 185 HG SER 24 HG SER 24 -8.811 -5.774 -5.415 186 H VAL 25 H VAL 25 -6.182 -7.758 -5.170 187 HA VAL 25 HA VAL 25 -6.729 -10.544 -4.983 188 HB VAL 25 HB VAL 25 -5.186 -8.771 -3.042 189 HG11 VAL 25 1HG1 VAL 25 -5.174 -11.805 -3.272 190 HG12 VAL 25 2HG1 VAL 25 -5.846 -10.865 -1.939 191 HG13 VAL 25 3HG1 VAL 25 -4.109 -10.848 -2.240 192 HG21 VAL 25 1HG2 VAL 25 -3.159 -9.590 -4.212 193 HG22 VAL 25 2HG2 VAL 25 -4.227 -8.720 -5.313 194 HG23 VAL 25 3HG2 VAL 25 -4.170 -10.484 -5.352 195 H THR 26 H THR 26 -7.875 -7.753 -3.076 196 HA THR 26 HA THR 26 -9.174 -9.206 -1.020 197 HB THR 26 HB THR 26 -9.836 -6.425 -2.086 198 HG1 THR 26 HG1 THR 26 -8.540 -5.742 -0.390 199 HG21 THR 26 1HG2 THR 26 -10.688 -7.699 0.550 200 HG22 THR 26 2HG2 THR 26 -11.760 -7.325 -0.801 201 HG23 THR 26 3HG2 THR 26 -10.961 -6.020 0.071 202 H ILE 27 H ILE 27 -10.473 -7.900 -4.118 203 HA ILE 27 HA ILE 27 -13.147 -8.798 -3.772 204 HB ILE 27 HB ILE 27 -11.603 -8.165 -6.327 205 HG12 ILE 27 2HG1 ILE 27 -13.648 -6.515 -4.755 206 HG13 ILE 27 3HG1 ILE 27 -11.909 -6.241 -4.773 207 HG21 ILE 27 1HG2 ILE 27 -13.787 -8.040 -7.500 208 HG22 ILE 27 2HG2 ILE 27 -14.603 -8.614 -6.046 209 HG23 ILE 27 3HG2 ILE 27 -13.473 -9.667 -6.896 210 HD11 ILE 27 1HD1 ILE 27 -13.788 -5.945 -7.111 211 HD12 ILE 27 2HD1 ILE 27 -12.037 -5.725 -7.174 212 HD13 ILE 27 3HD1 ILE 27 -13.026 -4.650 -6.188 213 H LYS 28 H LYS 28 -10.332 -10.235 -5.379 214 HA LYS 28 HA LYS 28 -11.341 -12.660 -6.303 215 HB2 LYS 28 2HB LYS 28 -9.046 -11.812 -6.764 216 HB3 LYS 28 3HB LYS 28 -8.606 -12.079 -5.084 217 HG2 LYS 28 2HG LYS 28 -9.074 -14.557 -5.471 218 HG3 LYS 28 3HG LYS 28 -9.228 -14.176 -7.186 219 HD2 LYS 28 2HD LYS 28 -6.968 -15.006 -6.690 220 HD3 LYS 28 3HD LYS 28 -6.903 -13.321 -7.214 221 HE2 LYS 28 2HE LYS 28 -5.394 -13.743 -5.311 222 HE3 LYS 28 3HE LYS 28 -6.652 -12.586 -4.882 223 HZ1 LYS 28 1HZ LYS 28 -7.867 -14.471 -3.843 224 HZ2 LYS 28 2HZ LYS 28 -6.384 -14.133 -3.103 225 HZ3 LYS 28 3HZ LYS 28 -6.528 -15.456 -4.144 226 H ASN 29 H ASN 29 -9.959 -11.856 -3.120 227 HA ASN 29 HA ASN 29 -10.219 -14.407 -1.917 228 HB2 ASN 29 2HB ASN 29 -9.865 -11.635 -0.698 229 HB3 ASN 29 3HB ASN 29 -9.968 -13.084 0.295 230 HD21 ASN 29 1HD2 ASN 29 -7.754 -11.255 0.151 231 HD22 ASN 29 2HD2 ASN 29 -6.388 -12.149 -0.417 232 H MET 30 H MET 30 -12.428 -11.658 -2.176 233 HA MET 30 HA MET 30 -14.368 -12.486 -0.274 234 HB2 MET 30 2HB MET 30 -14.607 -10.699 -2.735 235 HB3 MET 30 3HB MET 30 -15.967 -11.015 -1.666 236 HG2 MET 30 2HG MET 30 -14.742 -9.986 0.206 237 HG3 MET 30 3HG MET 30 -13.377 -9.672 -0.869 238 HE1 MET 30 1HE MET 30 -13.502 -7.072 -0.106 239 HE2 MET 30 2HE MET 30 -14.905 -7.420 0.906 240 HE3 MET 30 3HE MET 30 -14.960 -6.093 -0.253 241 H ILE 31 H ILE 31 -14.131 -12.951 -3.794 242 HA ILE 31 HA ILE 31 -16.520 -14.396 -4.190 243 HB ILE 31 HB ILE 31 -13.951 -14.435 -5.852 244 HG12 ILE 31 2HG1 ILE 31 -16.496 -12.766 -6.222 245 HG13 ILE 31 3HG1 ILE 31 -14.975 -12.156 -5.583 246 HG21 ILE 31 1HG2 ILE 31 -16.751 -15.329 -6.658 247 HG22 ILE 31 2HG2 ILE 31 -15.363 -16.385 -6.396 248 HG23 ILE 31 3HG2 ILE 31 -15.354 -15.239 -7.734 249 HD11 ILE 31 1HD1 ILE 31 -15.260 -11.508 -7.887 250 HD12 ILE 31 2HD1 ILE 31 -15.443 -13.192 -8.375 251 HD13 ILE 31 3HD1 ILE 31 -13.900 -12.620 -7.739 252 H GLU 32 H GLU 32 -13.229 -15.429 -3.412 253 HA GLU 32 HA GLU 32 -13.701 -18.262 -3.628 254 HB2 GLU 32 2HB GLU 32 -11.430 -16.743 -2.277 255 HB3 GLU 32 3HB GLU 32 -11.444 -18.475 -2.607 256 HG2 GLU 32 2HG GLU 32 -11.479 -18.055 -5.015 257 HG3 GLU 32 3HG GLU 32 -11.561 -16.317 -4.736 258 H ASP 33 H ASP 33 -13.827 -15.898 -1.011 259 HA ASP 33 HA ASP 33 -13.850 -17.744 1.187 260 HB2 ASP 33 2HB ASP 33 -13.125 -15.388 1.437 261 HB3 ASP 33 3HB ASP 33 -14.748 -14.827 1.058 262 H ILE 34 H ILE 34 -16.334 -16.017 -0.629 263 HA ILE 34 HA ILE 34 -18.601 -17.195 0.691 264 HB ILE 34 HB ILE 34 -18.381 -15.813 -2.032 265 HG12 ILE 34 2HG1 ILE 34 -19.311 -14.699 0.665 266 HG13 ILE 34 3HG1 ILE 34 -17.766 -14.349 -0.101 267 HG21 ILE 34 1HG2 ILE 34 -20.391 -17.237 -1.953 268 HG22 ILE 34 2HG2 ILE 34 -20.845 -15.536 -1.925 269 HG23 ILE 34 3HG2 ILE 34 -20.892 -16.484 -0.438 270 HD11 ILE 34 1HD1 ILE 34 -20.492 -13.561 -1.124 271 HD12 ILE 34 2HD1 ILE 34 -18.966 -13.256 -1.958 272 HD13 ILE 34 3HD1 ILE 34 -19.280 -12.509 -0.394 273 H GLY 35 H GLY 35 -16.478 -18.038 -1.956 274 HA2 GLY 35 2HA GLY 35 -16.118 -20.274 -2.677 275 HA3 GLY 35 3HA GLY 35 -17.787 -20.668 -2.281 276 H GLU 36 H GLU 36 -19.313 -18.965 -3.468 277 HA GLU 36 HA GLU 36 -18.543 -18.537 -6.282 278 HB2 GLU 36 2HB GLU 36 -21.136 -19.868 -5.348 279 HB3 GLU 36 3HB GLU 36 -20.796 -19.380 -7.003 280 HG2 GLU 36 2HG GLU 36 -18.980 -21.029 -7.139 281 HG3 GLU 36 3HG GLU 36 -19.255 -21.485 -5.461 282 H SER 37 H SER 37 -19.002 -16.423 -6.815 283 HA SER 37 HA SER 37 -21.161 -15.011 -5.356 284 HB2 SER 37 2HB SER 37 -18.467 -13.801 -6.097 285 HB3 SER 37 3HB SER 37 -19.791 -12.976 -5.271 286 HG SER 37 HG SER 37 -19.266 -15.202 -3.932 287 H ASP 38 H ASP 38 -22.512 -15.520 -7.150 288 HA ASP 38 HA ASP 38 -22.041 -14.284 -9.743 289 HB2 ASP 38 2HB ASP 38 -23.348 -16.399 -9.542 290 HB3 ASP 38 3HB ASP 38 -24.574 -15.562 -8.601 291 H SER 39 H SER 39 -23.794 -13.600 -6.780 292 HA SER 39 HA SER 39 -25.437 -11.474 -7.633 293 HB2 SER 39 2HB SER 39 -24.298 -12.032 -4.860 294 HB3 SER 39 3HB SER 39 -25.653 -10.962 -5.216 295 HG SER 39 HG SER 39 -25.914 -13.393 -4.611 296 HA PRO 40 HA PRO 40 -22.627 -8.011 -8.278 297 HB2 PRO 40 2HB PRO 40 -24.705 -6.416 -6.747 298 HB3 PRO 40 3HB PRO 40 -23.958 -6.079 -8.330 299 HG2 PRO 40 2HG PRO 40 -26.435 -7.008 -8.214 300 HG3 PRO 40 3HG PRO 40 -25.311 -7.622 -9.450 301 HD2 PRO 40 2HD PRO 40 -26.202 -8.930 -6.888 302 HD3 PRO 40 3HD PRO 40 -25.918 -9.654 -8.488 303 H ILE 41 H ILE 41 -20.792 -7.788 -7.136 304 HA ILE 41 HA ILE 41 -20.632 -8.152 -4.293 305 HB ILE 41 HB ILE 41 -18.470 -7.317 -6.288 306 HG12 ILE 41 2HG1 ILE 41 -17.592 -9.724 -5.750 307 HG13 ILE 41 3HG1 ILE 41 -19.188 -10.036 -5.086 308 HG21 ILE 41 1HG2 ILE 41 -16.802 -7.812 -4.514 309 HG22 ILE 41 2HG2 ILE 41 -18.114 -8.088 -3.365 310 HG23 ILE 41 3HG2 ILE 41 -17.874 -6.485 -4.058 311 HD11 ILE 41 1HD1 ILE 41 -18.957 -10.891 -7.354 312 HD12 ILE 41 2HD1 ILE 41 -18.581 -9.274 -7.949 313 HD13 ILE 41 3HD1 ILE 41 -20.181 -9.622 -7.288 314 HA PRO 42 HA PRO 42 -21.182 -3.644 -3.706 315 HB2 PRO 42 2HB PRO 42 -22.156 -3.719 -1.168 316 HB3 PRO 42 3HB PRO 42 -23.145 -4.208 -2.558 317 HG2 PRO 42 2HG PRO 42 -21.822 -5.900 -0.502 318 HG3 PRO 42 3HG PRO 42 -23.330 -6.178 -1.398 319 HD2 PRO 42 2HD PRO 42 -20.778 -7.296 -1.994 320 HD3 PRO 42 3HD PRO 42 -22.234 -7.366 -3.008 321 H LEU 43 H LEU 43 -19.438 -2.437 -3.351 322 HA LEU 43 HA LEU 43 -17.484 -3.094 -1.231 323 HB2 LEU 43 2HB LEU 43 -17.174 -1.404 -3.749 324 HB3 LEU 43 3HB LEU 43 -15.909 -1.677 -2.560 325 HG LEU 43 HG LEU 43 -17.180 -3.864 -4.262 326 HD11 LEU 43 1HD1 LEU 43 -15.061 -3.910 -5.523 327 HD12 LEU 43 2HD1 LEU 43 -14.487 -2.509 -4.615 328 HD13 LEU 43 3HD1 LEU 43 -15.887 -2.359 -5.679 329 HD21 LEU 43 1HD2 LEU 43 -14.801 -3.990 -2.373 330 HD22 LEU 43 2HD2 LEU 43 -15.315 -5.285 -3.457 331 HD23 LEU 43 3HD2 LEU 43 -16.374 -4.767 -2.149 332 HA PRO 44 HA PRO 44 -19.956 0.409 0.444 333 HB2 PRO 44 2HB PRO 44 -19.508 -0.057 3.088 334 HB3 PRO 44 3HB PRO 44 -20.593 -1.083 2.127 335 HG2 PRO 44 2HG PRO 44 -17.709 -1.566 2.841 336 HG3 PRO 44 3HG PRO 44 -19.099 -2.670 2.995 337 HD2 PRO 44 2HD PRO 44 -17.421 -2.815 0.889 338 HD3 PRO 44 3HD PRO 44 -19.160 -3.133 0.710 339 H ASN 45 H ASN 45 -16.570 0.094 0.340 340 HA ASN 45 HA ASN 45 -16.264 2.906 1.122 341 HB2 ASN 45 2HB ASN 45 -15.571 1.566 3.109 342 HB3 ASN 45 3HB ASN 45 -14.382 0.722 2.119 343 HD21 ASN 45 1HD2 ASN 45 -12.571 1.439 3.227 344 HD22 ASN 45 2HD2 ASN 45 -12.065 3.090 3.267 345 H VAL 46 H VAL 46 -16.445 2.757 -1.296 346 HA VAL 46 HA VAL 46 -14.020 3.854 -2.156 347 HB VAL 46 HB VAL 46 -13.303 1.508 -2.613 348 HG11 VAL 46 1HG1 VAL 46 -15.466 0.449 -3.067 349 HG12 VAL 46 2HG1 VAL 46 -14.326 0.128 -4.372 350 HG13 VAL 46 3HG1 VAL 46 -15.601 1.330 -4.591 351 HG21 VAL 46 1HG2 VAL 46 -13.703 3.150 -5.144 352 HG22 VAL 46 2HG2 VAL 46 -12.533 1.843 -4.944 353 HG23 VAL 46 3HG2 VAL 46 -12.378 3.316 -3.987 354 H THR 47 H THR 47 -14.646 5.520 -3.373 355 HA THR 47 HA THR 47 -17.323 5.866 -4.307 356 HB THR 47 HB THR 47 -16.411 7.973 -5.353 357 HG1 THR 47 HG1 THR 47 -13.935 7.078 -4.220 358 HG21 THR 47 1HG2 THR 47 -17.195 7.992 -3.003 359 HG22 THR 47 2HG2 THR 47 -15.848 9.105 -3.239 360 HG23 THR 47 3HG2 THR 47 -15.575 7.547 -2.455 361 H SER 48 H SER 48 -17.936 6.259 -6.547 362 HA SER 48 HA SER 48 -17.442 3.994 -8.119 363 HB2 SER 48 2HB SER 48 -18.877 5.176 -9.809 364 HB3 SER 48 3HB SER 48 -19.567 5.138 -8.186 365 HG SER 48 HG SER 48 -19.783 7.215 -8.813 366 H THR 49 H THR 49 -16.450 7.364 -8.602 367 HA THR 49 HA THR 49 -15.268 7.148 -11.123 368 HB THR 49 HB THR 49 -14.034 9.265 -10.434 369 HG1 THR 49 HG1 THR 49 -14.241 9.980 -8.362 370 HG21 THR 49 1HG2 THR 49 -17.022 9.191 -9.816 371 HG22 THR 49 2HG2 THR 49 -16.303 9.445 -11.408 372 HG23 THR 49 3HG2 THR 49 -16.085 10.651 -10.138 373 H ILE 50 H ILE 50 -13.827 6.857 -7.881 374 HA ILE 50 HA ILE 50 -11.132 6.505 -8.755 375 HB ILE 50 HB ILE 50 -12.443 5.833 -6.078 376 HG12 ILE 50 2HG1 ILE 50 -12.603 8.229 -6.662 377 HG13 ILE 50 3HG1 ILE 50 -11.505 7.995 -5.310 378 HG21 ILE 50 1HG2 ILE 50 -9.482 6.060 -6.726 379 HG22 ILE 50 2HG2 ILE 50 -10.349 4.582 -6.305 380 HG23 ILE 50 3HG2 ILE 50 -10.169 5.869 -5.113 381 HD11 ILE 50 1HD1 ILE 50 -9.593 8.250 -6.840 382 HD12 ILE 50 2HD1 ILE 50 -10.653 9.656 -6.839 383 HD13 ILE 50 3HD1 ILE 50 -10.716 8.514 -8.179 384 H LEU 51 H LEU 51 -13.707 4.262 -7.739 385 HA LEU 51 HA LEU 51 -12.310 1.838 -7.880 386 HB2 LEU 51 2HB LEU 51 -14.563 2.054 -6.860 387 HB3 LEU 51 3HB LEU 51 -15.266 2.331 -8.445 388 HG LEU 51 HG LEU 51 -14.631 0.015 -9.129 389 HD11 LEU 51 1HD1 LEU 51 -13.654 -0.336 -6.275 390 HD12 LEU 51 2HD1 LEU 51 -12.658 -0.329 -7.733 391 HD13 LEU 51 3HD1 LEU 51 -13.826 -1.620 -7.476 392 HD21 LEU 51 1HD2 LEU 51 -16.871 0.398 -8.195 393 HD22 LEU 51 2HD2 LEU 51 -16.266 0.080 -6.567 394 HD23 LEU 51 3HD2 LEU 51 -16.277 -1.208 -7.776 395 H GLU 52 H GLU 52 -14.042 3.668 -10.361 396 HA GLU 52 HA GLU 52 -13.865 1.875 -12.525 397 HB2 GLU 52 2HB GLU 52 -15.379 3.779 -12.604 398 HB3 GLU 52 3HB GLU 52 -14.045 4.917 -12.445 399 HG2 GLU 52 2HG GLU 52 -13.193 4.184 -14.664 400 HG3 GLU 52 3HG GLU 52 -14.571 3.098 -14.810 401 H LYS 53 H LYS 53 -11.753 4.547 -11.499 402 HA LYS 53 HA LYS 53 -9.888 4.508 -13.601 403 HB2 LYS 53 2HB LYS 53 -9.517 5.324 -10.687 404 HB3 LYS 53 3HB LYS 53 -8.345 5.650 -11.958 405 HG2 LYS 53 2HG LYS 53 -10.013 7.074 -13.122 406 HG3 LYS 53 3HG LYS 53 -11.166 6.748 -11.827 407 HD2 LYS 53 2HD LYS 53 -10.157 8.913 -11.408 408 HD3 LYS 53 3HD LYS 53 -9.569 7.783 -10.188 409 HE2 LYS 53 2HE LYS 53 -7.719 9.146 -10.956 410 HE3 LYS 53 3HE LYS 53 -7.471 7.501 -11.531 411 HZ1 LYS 53 1HZ LYS 53 -8.374 8.196 -13.688 412 HZ2 LYS 53 2HZ LYS 53 -6.996 9.078 -13.269 413 HZ3 LYS 53 3HZ LYS 53 -8.526 9.783 -13.119 414 H VAL 54 H VAL 54 -9.925 2.779 -10.508 415 HA VAL 54 HA VAL 54 -7.338 1.592 -10.748 416 HB VAL 54 HB VAL 54 -9.703 0.869 -8.945 417 HG11 VAL 54 1HG1 VAL 54 -6.809 -0.049 -8.712 418 HG12 VAL 54 2HG1 VAL 54 -8.191 -1.062 -9.135 419 HG13 VAL 54 3HG1 VAL 54 -8.086 -0.348 -7.527 420 HG21 VAL 54 1HG2 VAL 54 -8.830 3.154 -8.573 421 HG22 VAL 54 2HG2 VAL 54 -7.205 2.510 -8.336 422 HG23 VAL 54 3HG2 VAL 54 -8.490 2.110 -7.192 423 H LEU 55 H LEU 55 -10.653 0.433 -11.412 424 HA LEU 55 HA LEU 55 -9.944 -2.229 -12.171 425 HB2 LEU 55 2HB LEU 55 -12.433 -0.585 -12.774 426 HB3 LEU 55 3HB LEU 55 -12.266 -2.280 -13.202 427 HG LEU 55 HG LEU 55 -12.301 -1.158 -10.371 428 HD11 LEU 55 1HD1 LEU 55 -14.463 -2.300 -10.146 429 HD12 LEU 55 2HD1 LEU 55 -14.384 -2.816 -11.832 430 HD13 LEU 55 3HD1 LEU 55 -14.507 -1.101 -11.436 431 HD21 LEU 55 1HD2 LEU 55 -10.825 -3.114 -10.471 432 HD22 LEU 55 2HD2 LEU 55 -12.090 -4.059 -11.257 433 HD23 LEU 55 3HD2 LEU 55 -12.307 -3.500 -9.596 434 H ASP 56 H ASP 56 -10.176 0.800 -13.942 435 HA ASP 56 HA ASP 56 -10.092 -0.278 -16.595 436 HB2 ASP 56 2HB ASP 56 -10.954 2.025 -16.060 437 HB3 ASP 56 3HB ASP 56 -9.319 2.531 -15.653 438 H TYR 57 H TYR 57 -7.648 1.108 -14.383 439 HA TYR 57 HA TYR 57 -5.369 0.761 -15.994 440 HB2 TYR 57 2HB TYR 57 -5.233 2.122 -13.967 441 HB3 TYR 57 3HB TYR 57 -5.605 0.731 -12.949 442 HD1 TYR 57 HD1 TYR 57 -3.002 2.182 -15.212 443 HD2 TYR 57 HD2 TYR 57 -3.829 -0.789 -12.245 444 HE1 TYR 57 HE1 TYR 57 -0.609 1.647 -15.063 445 HE2 TYR 57 HE2 TYR 57 -1.431 -1.309 -12.094 446 HH TYR 57 HH TYR 57 0.977 0.649 -13.515 447 H CYS 58 H CYS 58 -6.858 -1.404 -13.586 448 HA CYS 58 HA CYS 58 -5.073 -3.556 -13.778 449 HB2 CYS 58 2HB CYS 58 -8.028 -3.536 -13.044 450 HB3 CYS 58 3HB CYS 58 -6.977 -4.939 -12.852 451 HG CYS 58 HG CYS 58 -7.497 -2.487 -10.784 452 H ARG 59 H ARG 59 -7.928 -2.714 -15.738 453 HA ARG 59 HA ARG 59 -7.990 -5.054 -17.343 454 HB2 ARG 59 2HB ARG 59 -9.947 -3.651 -17.331 455 HB3 ARG 59 3HB ARG 59 -9.035 -2.241 -17.866 456 HG2 ARG 59 2HG ARG 59 -8.735 -3.199 -20.076 457 HG3 ARG 59 3HG ARG 59 -9.446 -4.728 -19.567 458 HD2 ARG 59 2HD ARG 59 -11.018 -2.140 -19.492 459 HD3 ARG 59 3HD ARG 59 -10.899 -3.112 -20.960 460 HE ARG 59 HE ARG 59 -11.740 -4.955 -19.220 461 HH11 ARG 59 1HH1 ARG 59 -12.948 -1.696 -19.751 462 HH12 ARG 59 2HH1 ARG 59 -14.575 -2.104 -19.289 463 HH21 ARG 59 1HH2 ARG 59 -13.883 -5.488 -18.680 464 HH22 ARG 59 2HH2 ARG 59 -15.106 -4.244 -18.685 465 H HIS 60 H HIS 60 -6.301 -1.950 -17.728 466 HA HIS 60 HA HIS 60 -5.213 -2.376 -20.309 467 HB2 HIS 60 2HB HIS 60 -4.331 -0.607 -18.000 468 HB3 HIS 60 3HB HIS 60 -3.459 -0.635 -19.528 469 HD1 HIS 60 HD1 HIS 60 -4.015 1.870 -19.877 470 HD2 HIS 60 HD2 HIS 60 -7.371 -0.577 -19.705 471 HE1 HIS 60 HE1 HIS 60 -5.922 3.268 -20.719 472 HE2 HIS 60 HE2 HIS 60 -7.951 1.861 -20.319 473 H HIS 61 H HIS 61 -3.903 -3.035 -17.070 474 HA HIS 61 HA HIS 61 -1.431 -4.160 -18.050 475 HB2 HIS 61 2HB HIS 61 -1.795 -2.940 -15.781 476 HB3 HIS 61 3HB HIS 61 -2.487 -4.452 -15.207 477 HD1 HIS 61 HD1 HIS 61 -0.774 -6.586 -15.350 478 HD2 HIS 61 HD2 HIS 61 0.943 -2.804 -15.614 479 HE1 HIS 61 HE1 HIS 61 1.678 -6.927 -14.931 480 HE2 HIS 61 HE2 HIS 61 2.710 -4.658 -15.250 481 H HIS 62 H HIS 62 -4.619 -5.362 -17.538 482 HA HIS 62 HA HIS 62 -3.892 -8.159 -17.348 483 HB2 HIS 62 2HB HIS 62 -6.090 -7.172 -16.517 484 HB3 HIS 62 3HB HIS 62 -6.588 -7.003 -18.196 485 HD1 HIS 62 HD1 HIS 62 -6.028 -9.521 -15.509 486 HD2 HIS 62 HD2 HIS 62 -7.283 -9.461 -19.473 487 HE1 HIS 62 HE1 HIS 62 -6.971 -11.800 -15.955 488 HE2 HIS 62 HE2 HIS 62 -7.734 -11.739 -18.347 489 H GLN 63 H GLN 63 -4.812 -5.878 -19.902 490 HA GLN 63 HA GLN 63 -4.785 -7.750 -22.080 491 HB2 GLN 63 2HB GLN 63 -4.573 -4.705 -22.098 492 HB3 GLN 63 3HB GLN 63 -4.794 -5.700 -23.534 493 HG2 GLN 63 2HG GLN 63 -6.749 -5.399 -21.237 494 HG3 GLN 63 3HG GLN 63 -6.910 -4.709 -22.849 495 HE21 GLN 63 1HE2 GLN 63 -8.636 -6.583 -21.334 496 HE22 GLN 63 2HE2 GLN 63 -8.845 -7.949 -22.367 497 H HIS 64 H HIS 64 -2.381 -5.886 -20.405 498 HA HIS 64 HA HIS 64 -0.250 -7.061 -22.095 499 HB2 HIS 64 2HB HIS 64 -0.245 -4.279 -20.820 500 HB3 HIS 64 3HB HIS 64 1.132 -5.015 -21.635 501 HD1 HIS 64 HD1 HIS 64 1.088 -5.045 -24.222 502 HD2 HIS 64 HD2 HIS 64 -2.315 -3.356 -22.545 503 HE1 HIS 64 HE1 HIS 64 -0.135 -3.983 -26.121 504 HE2 HIS 64 HE2 HIS 64 -2.287 -3.194 -25.122 505 HA PRO 65 HA PRO 65 0.070 -8.321 -17.604 506 HB2 PRO 65 2HB PRO 65 -0.366 -10.955 -17.793 507 HB3 PRO 65 3HB PRO 65 -1.705 -9.817 -18.056 508 HG2 PRO 65 2HG PRO 65 -0.106 -11.342 -20.076 509 HG3 PRO 65 3HG PRO 65 -1.848 -10.987 -20.049 510 HD2 PRO 65 2HD PRO 65 0.106 -9.533 -21.484 511 HD3 PRO 65 3HD PRO 65 -1.555 -8.999 -21.148 512 H GLY 66 H GLY 66 2.261 -8.145 -19.822 513 HA2 GLY 66 2HA GLY 66 4.108 -10.290 -19.150 514 HA3 GLY 66 3HA GLY 66 4.370 -8.985 -20.294 515 H GLY 67 H GLY 67 3.431 -8.662 -16.889 516 HA2 GLY 67 2HA GLY 67 4.356 -7.611 -15.097 517 HA3 GLY 67 3HA GLY 67 5.915 -8.127 -15.726 518 H SER 68 H SER 68 7.166 -6.693 -16.875 519 HA SER 68 HA SER 68 6.211 -3.949 -17.401 520 HB2 SER 68 2HB SER 68 8.817 -4.650 -15.960 521 HB3 SER 68 3HB SER 68 8.355 -3.029 -16.488 522 HG SER 68 HG SER 68 7.560 -2.963 -14.530 523 H GLY 69 H GLY 69 6.813 -3.271 -19.395 524 HA2 GLY 69 2HA GLY 69 8.985 -4.698 -20.852 525 HA3 GLY 69 3HA GLY 69 7.553 -4.015 -21.624 526 H LEU 70 H LEU 70 10.187 -3.335 -22.398 527 HA LEU 70 HA LEU 70 10.863 -0.744 -21.240 528 HB2 LEU 70 2HB LEU 70 12.625 -2.405 -21.810 529 HB3 LEU 70 3HB LEU 70 12.121 -2.378 -23.491 530 HG LEU 70 HG LEU 70 12.860 -0.024 -23.679 531 HD11 LEU 70 1HD1 LEU 70 12.514 0.725 -21.381 532 HD12 LEU 70 2HD1 LEU 70 14.166 1.053 -21.897 533 HD13 LEU 70 3HD1 LEU 70 13.834 -0.307 -20.822 534 HD21 LEU 70 1HD2 LEU 70 15.030 -1.865 -22.620 535 HD22 LEU 70 2HD2 LEU 70 15.284 -0.434 -23.622 536 HD23 LEU 70 3HD2 LEU 70 14.420 -1.822 -24.278 537 H ASP 71 H ASP 71 8.408 -0.487 -22.128 538 HA ASP 71 HA ASP 71 8.459 1.463 -24.245 539 HB2 ASP 71 2HB ASP 71 8.345 -0.766 -25.484 540 HB3 ASP 71 3HB ASP 71 6.809 -1.078 -24.689 541 H ASP 72 H ASP 72 7.766 1.008 -21.364 542 HA ASP 72 HA ASP 72 4.871 1.171 -21.161 543 HB2 ASP 72 2HB ASP 72 5.208 0.909 -18.765 544 HB3 ASP 72 3HB ASP 72 6.200 -0.275 -19.606 545 H ILE 73 H ILE 73 4.988 2.896 -18.737 546 HA ILE 73 HA ILE 73 4.174 4.938 -18.318 547 HB ILE 73 HB ILE 73 6.395 5.984 -20.143 548 HG12 ILE 73 2HG1 ILE 73 7.308 4.465 -18.385 549 HG13 ILE 73 3HG1 ILE 73 7.827 6.125 -18.129 550 HG21 ILE 73 1HG2 ILE 73 4.738 7.721 -19.603 551 HG22 ILE 73 2HG2 ILE 73 6.265 8.058 -18.790 552 HG23 ILE 73 3HG2 ILE 73 4.911 7.388 -17.877 553 HD11 ILE 73 1HD1 ILE 73 7.276 5.061 -16.028 554 HD12 ILE 73 2HD1 ILE 73 5.657 4.674 -16.609 555 HD13 ILE 73 3HD1 ILE 73 6.126 6.356 -16.359 556 HA PRO 74 HA PRO 74 1.670 5.069 -22.302 557 HB2 PRO 74 2HB PRO 74 -0.540 4.451 -20.348 558 HB3 PRO 74 3HB PRO 74 -0.204 3.734 -21.941 559 HG2 PRO 74 2HG PRO 74 0.264 2.345 -19.725 560 HG3 PRO 74 3HG PRO 74 1.397 2.254 -21.097 561 HD2 PRO 74 2HD PRO 74 1.641 3.878 -18.559 562 HD3 PRO 74 3HD PRO 74 2.858 2.861 -19.365 563 HA PRO 75 HA PRO 75 0.345 9.338 -21.456 564 HB2 PRO 75 2HB PRO 75 -1.972 8.621 -23.266 565 HB3 PRO 75 3HB PRO 75 -0.857 10.004 -23.352 566 HG2 PRO 75 2HG PRO 75 -0.588 7.990 -25.054 567 HG3 PRO 75 3HG PRO 75 0.854 8.749 -24.335 568 HD2 PRO 75 2HD PRO 75 -0.461 6.134 -23.626 569 HD3 PRO 75 3HD PRO 75 1.269 6.537 -23.724 570 H TYR 76 H TYR 76 -1.911 6.622 -21.299 571 HA TYR 76 HA TYR 76 -4.003 7.683 -19.806 572 HB2 TYR 76 2HB TYR 76 -4.267 5.480 -20.732 573 HB3 TYR 76 3HB TYR 76 -2.852 4.865 -19.880 574 HD1 TYR 76 HD1 TYR 76 -6.254 6.331 -19.204 575 HD2 TYR 76 HD2 TYR 76 -3.176 3.711 -17.822 576 HE1 TYR 76 HE1 TYR 76 -7.674 5.633 -17.327 577 HE2 TYR 76 HE2 TYR 76 -4.598 3.009 -15.955 578 HH TYR 76 HH TYR 76 -7.856 3.564 -15.824 579 H ASP 77 H ASP 77 -1.024 6.097 -18.601 580 HA ASP 77 HA ASP 77 -1.634 6.189 -15.850 581 HB2 ASP 77 2HB ASP 77 1.025 5.968 -17.312 582 HB3 ASP 77 3HB ASP 77 0.891 5.854 -15.558 583 H ARG 78 H ARG 78 -0.055 8.506 -17.978 584 HA ARG 78 HA ARG 78 0.762 10.401 -16.015 585 HB2 ARG 78 2HB ARG 78 -0.072 10.896 -18.908 586 HB3 ARG 78 3HB ARG 78 0.830 12.020 -17.895 587 HG2 ARG 78 2HG ARG 78 1.785 9.312 -18.843 588 HG3 ARG 78 3HG ARG 78 2.298 10.872 -19.482 589 HD2 ARG 78 2HD ARG 78 2.844 9.780 -16.695 590 HD3 ARG 78 3HD ARG 78 4.017 10.022 -17.996 591 HE ARG 78 HE ARG 78 2.911 12.500 -17.585 592 HH11 ARG 78 1HH1 ARG 78 4.692 10.243 -15.543 593 HH12 ARG 78 2HH1 ARG 78 5.356 11.506 -14.551 594 HH21 ARG 78 1HH2 ARG 78 3.773 14.119 -16.218 595 HH22 ARG 78 2HH2 ARG 78 4.844 13.664 -14.927 596 H ASP 79 H ASP 79 -2.205 10.091 -17.964 597 HA ASP 79 HA ASP 79 -3.567 12.285 -16.792 598 HB2 ASP 79 2HB ASP 79 -4.504 9.961 -18.494 599 HB3 ASP 79 3HB ASP 79 -5.658 11.121 -17.844 600 H PHE 80 H PHE 80 -3.186 8.987 -15.815 601 HA PHE 80 HA PHE 80 -5.329 8.807 -13.929 602 HB2 PHE 80 2HB PHE 80 -4.122 6.812 -14.872 603 HB3 PHE 80 3HB PHE 80 -2.672 7.275 -13.996 604 HD1 PHE 80 HD1 PHE 80 -6.032 5.790 -13.719 605 HD2 PHE 80 HD2 PHE 80 -2.544 6.955 -11.533 606 HE1 PHE 80 HE1 PHE 80 -6.789 4.477 -11.787 607 HE2 PHE 80 HE2 PHE 80 -3.319 5.639 -9.604 608 HZ PHE 80 HZ PHE 80 -5.445 4.401 -9.733 609 H CYS 81 H CYS 81 -1.959 9.827 -13.832 610 HA CYS 81 HA CYS 81 -1.787 10.395 -11.034 611 HB2 CYS 81 2HB CYS 81 -0.086 11.393 -13.359 612 HB3 CYS 81 3HB CYS 81 0.345 11.498 -11.652 613 HG CYS 81 HG CYS 81 -0.364 8.411 -12.741 614 H LYS 82 H LYS 82 -2.981 12.178 -13.823 615 HA LYS 82 HA LYS 82 -2.995 14.790 -12.607 616 HB2 LYS 82 2HB LYS 82 -4.588 13.725 -14.980 617 HB3 LYS 82 3HB LYS 82 -4.498 15.420 -14.509 618 HG2 LYS 82 2HG LYS 82 -2.132 15.495 -15.056 619 HG3 LYS 82 3HG LYS 82 -2.119 13.760 -15.371 620 HD2 LYS 82 2HD LYS 82 -3.864 14.217 -17.200 621 HD3 LYS 82 3HD LYS 82 -3.496 15.931 -16.986 622 HE2 LYS 82 2HE LYS 82 -1.186 15.563 -17.665 623 HE3 LYS 82 3HE LYS 82 -1.439 13.815 -17.713 624 HZ1 LYS 82 1HZ LYS 82 -3.038 14.137 -19.510 625 HZ2 LYS 82 2HZ LYS 82 -1.523 14.768 -19.922 626 HZ3 LYS 82 3HZ LYS 82 -2.773 15.810 -19.468 627 H VAL 83 H VAL 83 -3.924 14.020 -10.561 628 HA VAL 83 HA VAL 83 -6.819 14.473 -10.469 629 HB VAL 83 HB VAL 83 -7.060 12.742 -8.643 630 HG11 VAL 83 1HG1 VAL 83 -7.225 10.754 -10.085 631 HG12 VAL 83 2HG1 VAL 83 -6.256 11.561 -11.320 632 HG13 VAL 83 3HG1 VAL 83 -7.849 12.190 -10.899 633 HG21 VAL 83 1HG2 VAL 83 -4.703 12.524 -7.980 634 HG22 VAL 83 2HG2 VAL 83 -4.318 11.777 -9.531 635 HG23 VAL 83 3HG2 VAL 83 -5.381 10.948 -8.393 636 H ASP 84 H ASP 84 -7.470 15.242 -8.311 637 HA ASP 84 HA ASP 84 -5.661 17.263 -7.389 638 HB2 ASP 84 2HB ASP 84 -8.326 17.208 -7.529 639 HB3 ASP 84 3HB ASP 84 -8.215 16.531 -5.910 640 H GLN 85 H GLN 85 -5.186 17.552 -4.964 641 HA GLN 85 HA GLN 85 -3.548 15.477 -4.082 642 HB2 GLN 85 2HB GLN 85 -3.141 17.813 -3.435 643 HB3 GLN 85 3HB GLN 85 -4.599 17.828 -2.456 644 HG2 GLN 85 2HG GLN 85 -2.594 17.624 -1.055 645 HG3 GLN 85 3HG GLN 85 -3.613 16.194 -0.913 646 HE21 GLN 85 1HE2 GLN 85 -2.832 14.202 -1.690 647 HE22 GLN 85 2HE2 GLN 85 -1.180 13.971 -2.109 648 HA PRO 86 HA PRO 86 -7.005 14.111 -0.783 649 HB2 PRO 86 2HB PRO 86 -9.611 14.591 -1.696 650 HB3 PRO 86 3HB PRO 86 -8.770 15.581 -0.488 651 HG2 PRO 86 2HG PRO 86 -9.040 16.058 -3.443 652 HG3 PRO 86 3HG PRO 86 -9.235 17.206 -2.097 653 HD2 PRO 86 2HD PRO 86 -6.983 17.185 -3.511 654 HD3 PRO 86 3HD PRO 86 -6.916 17.373 -1.738 655 H THR 87 H THR 87 -7.639 14.242 -4.271 656 HA THR 87 HA THR 87 -8.937 11.724 -4.515 657 HB THR 87 HB THR 87 -7.509 13.232 -6.752 658 HG1 THR 87 HG1 THR 87 -10.100 13.748 -5.655 659 HG21 THR 87 1HG2 THR 87 -10.048 11.557 -6.765 660 HG22 THR 87 2HG2 THR 87 -8.482 11.045 -7.390 661 HG23 THR 87 3HG2 THR 87 -9.335 12.378 -8.163 662 H LEU 88 H LEU 88 -5.556 12.748 -4.690 663 HA LEU 88 HA LEU 88 -4.301 10.396 -5.605 664 HB2 LEU 88 2HB LEU 88 -3.387 12.536 -3.643 665 HB3 LEU 88 3HB LEU 88 -2.330 11.236 -4.163 666 HG LEU 88 HG LEU 88 -3.579 13.236 -6.091 667 HD11 LEU 88 1HD1 LEU 88 -1.400 14.376 -6.142 668 HD12 LEU 88 2HD1 LEU 88 -0.794 13.306 -4.877 669 HD13 LEU 88 3HD1 LEU 88 -2.107 14.430 -4.529 670 HD21 LEU 88 1HD2 LEU 88 -1.288 11.268 -6.464 671 HD22 LEU 88 2HD2 LEU 88 -1.885 12.407 -7.672 672 HD23 LEU 88 3HD2 LEU 88 -2.919 11.095 -7.119 673 H PHE 89 H PHE 89 -5.189 11.431 -2.310 674 HA PHE 89 HA PHE 89 -4.322 9.098 -0.930 675 HB2 PHE 89 2HB PHE 89 -6.345 11.236 -0.144 676 HB3 PHE 89 3HB PHE 89 -5.803 9.964 0.943 677 HD1 PHE 89 HD1 PHE 89 -3.067 9.772 1.050 678 HD2 PHE 89 HD2 PHE 89 -5.282 13.322 0.144 679 HE1 PHE 89 HE1 PHE 89 -1.185 11.157 1.828 680 HE2 PHE 89 HE2 PHE 89 -3.385 14.692 0.920 681 HZ PHE 89 HZ PHE 89 -1.337 13.614 1.752 682 H GLU 90 H GLU 90 -7.338 9.914 -2.544 683 HA GLU 90 HA GLU 90 -8.923 7.732 -1.666 684 HB2 GLU 90 2HB GLU 90 -9.040 9.390 -4.214 685 HB3 GLU 90 3HB GLU 90 -10.254 8.183 -3.803 686 HG2 GLU 90 2HG GLU 90 -9.587 10.631 -2.143 687 HG3 GLU 90 3HG GLU 90 -10.957 10.483 -3.243 688 H LEU 91 H LEU 91 -6.635 8.081 -4.359 689 HA LEU 91 HA LEU 91 -7.052 5.520 -5.550 690 HB2 LEU 91 2HB LEU 91 -4.590 7.311 -5.612 691 HB3 LEU 91 3HB LEU 91 -4.836 5.914 -6.648 692 HG LEU 91 HG LEU 91 -6.533 8.444 -6.687 693 HD11 LEU 91 1HD1 LEU 91 -5.469 8.912 -8.855 694 HD12 LEU 91 2HD1 LEU 91 -4.434 7.497 -8.664 695 HD13 LEU 91 3HD1 LEU 91 -4.281 8.858 -7.553 696 HD21 LEU 91 1HD2 LEU 91 -7.856 6.471 -7.316 697 HD22 LEU 91 2HD2 LEU 91 -6.647 6.022 -8.521 698 HD23 LEU 91 3HD2 LEU 91 -7.577 7.509 -8.713 699 H ILE 92 H ILE 92 -4.916 6.709 -2.997 700 HA ILE 92 HA ILE 92 -3.426 4.324 -2.539 701 HB ILE 92 HB ILE 92 -4.018 6.640 -0.619 702 HG12 ILE 92 2HG1 ILE 92 -1.556 6.151 -2.373 703 HG13 ILE 92 3HG1 ILE 92 -2.837 7.296 -2.746 704 HG21 ILE 92 1HG2 ILE 92 -1.878 4.482 -0.394 705 HG22 ILE 92 2HG2 ILE 92 -3.294 4.647 0.643 706 HG23 ILE 92 3HG2 ILE 92 -2.035 5.880 0.671 707 HD11 ILE 92 1HD1 ILE 92 -2.274 8.571 -0.736 708 HD12 ILE 92 2HD1 ILE 92 -0.911 8.427 -1.845 709 HD13 ILE 92 3HD1 ILE 92 -0.969 7.436 -0.388 710 H LEU 93 H LEU 93 -6.446 5.626 -1.154 711 HA LEU 93 HA LEU 93 -6.930 3.617 0.779 712 HB2 LEU 93 2HB LEU 93 -8.626 5.733 -0.526 713 HB3 LEU 93 3HB LEU 93 -9.490 4.407 0.230 714 HG LEU 93 HG LEU 93 -7.598 6.346 1.631 715 HD11 LEU 93 1HD1 LEU 93 -9.783 7.330 1.121 716 HD12 LEU 93 2HD1 LEU 93 -9.633 7.055 2.860 717 HD13 LEU 93 3HD1 LEU 93 -10.606 5.958 1.873 718 HD21 LEU 93 1HD2 LEU 93 -7.343 4.116 2.638 719 HD22 LEU 93 2HD2 LEU 93 -9.094 3.962 2.799 720 HD23 LEU 93 3HD2 LEU 93 -8.224 5.179 3.737 721 H ALA 94 H ALA 94 -8.006 3.948 -2.597 722 HA ALA 94 HA ALA 94 -9.731 1.694 -2.644 723 HB1 ALA 94 1HB ALA 94 -9.936 3.538 -4.249 724 HB2 ALA 94 2HB ALA 94 -9.739 2.000 -5.090 725 HB3 ALA 94 3HB ALA 94 -8.378 3.122 -4.963 726 H ALA 95 H ALA 95 -6.353 2.167 -3.630 727 HA ALA 95 HA ALA 95 -5.911 -0.400 -4.742 728 HB1 ALA 95 1HB ALA 95 -3.544 0.176 -4.643 729 HB2 ALA 95 2HB ALA 95 -3.892 1.504 -3.529 730 HB3 ALA 95 3HB ALA 95 -4.492 1.563 -5.184 731 H ASN 96 H ASN 96 -5.401 0.884 -1.446 732 HA ASN 96 HA ASN 96 -4.244 -1.526 -0.370 733 HB2 ASN 96 2HB ASN 96 -3.793 0.747 0.561 734 HB3 ASN 96 3HB ASN 96 -5.470 0.866 1.082 735 HD21 ASN 96 1HD2 ASN 96 -4.705 1.198 3.236 736 HD22 ASN 96 2HD2 ASN 96 -4.140 -0.116 4.201 737 H TYR 97 H TYR 97 -7.488 -0.221 -0.640 738 HA TYR 97 HA TYR 97 -8.838 -1.997 1.163 739 HB2 TYR 97 2HB TYR 97 -9.813 0.180 0.639 740 HB3 TYR 97 3HB TYR 97 -9.860 -0.194 -1.078 741 HD1 TYR 97 HD1 TYR 97 -11.888 -1.036 -2.006 742 HD2 TYR 97 HD2 TYR 97 -11.267 -1.365 2.216 743 HE1 TYR 97 HE1 TYR 97 -14.176 -1.893 -1.734 744 HE2 TYR 97 HE2 TYR 97 -13.558 -2.217 2.475 745 HH TYR 97 HH TYR 97 -15.424 -3.292 -0.103 746 H LEU 98 H LEU 98 -8.199 -1.967 -2.300 747 HA LEU 98 HA LEU 98 -9.678 -4.449 -2.792 748 HB2 LEU 98 2HB LEU 98 -8.151 -2.624 -4.692 749 HB3 LEU 98 3HB LEU 98 -9.104 -4.016 -5.175 750 HG LEU 98 HG LEU 98 -10.181 -1.462 -3.919 751 HD11 LEU 98 1HD1 LEU 98 -11.247 -1.055 -6.085 752 HD12 LEU 98 2HD1 LEU 98 -10.505 -2.513 -6.748 753 HD13 LEU 98 3HD1 LEU 98 -9.495 -1.153 -6.249 754 HD21 LEU 98 1HD2 LEU 98 -11.713 -3.927 -4.806 755 HD22 LEU 98 2HD2 LEU 98 -12.438 -2.393 -4.321 756 HD23 LEU 98 3HD2 LEU 98 -11.524 -3.341 -3.152 757 H ASP 99 H ASP 99 -6.623 -3.580 -1.776 758 HA ASP 99 HA ASP 99 -4.590 -4.518 -1.597 759 HB2 ASP 99 2HB ASP 99 -6.163 -6.282 -0.527 760 HB3 ASP 99 3HB ASP 99 -5.955 -7.208 -2.003 761 H ILE 100 H ILE 100 -4.391 -3.446 -3.782 762 HA ILE 100 HA ILE 100 -3.479 -5.377 -5.838 763 HB ILE 100 HB ILE 100 -4.461 -2.524 -6.393 764 HG12 ILE 100 2HG1 ILE 100 -5.928 -5.163 -6.822 765 HG13 ILE 100 3HG1 ILE 100 -6.360 -3.929 -5.652 766 HG21 ILE 100 1HG2 ILE 100 -2.797 -3.397 -8.018 767 HG22 ILE 100 2HG2 ILE 100 -4.379 -3.211 -8.772 768 HG23 ILE 100 3HG2 ILE 100 -3.811 -4.814 -8.302 769 HD11 ILE 100 1HD1 ILE 100 -6.891 -2.398 -7.491 770 HD12 ILE 100 2HD1 ILE 100 -7.842 -3.879 -7.536 771 HD13 ILE 100 3HD1 ILE 100 -6.493 -3.670 -8.648 772 H LYS 101 H LYS 101 -1.430 -5.471 -4.972 773 HA LYS 101 HA LYS 101 0.122 -3.368 -4.031 774 HB2 LYS 101 2HB LYS 101 0.437 -6.037 -4.017 775 HB3 LYS 101 3HB LYS 101 1.496 -5.706 -5.374 776 HG2 LYS 101 2HG LYS 101 1.787 -4.511 -2.592 777 HG3 LYS 101 3HG LYS 101 2.671 -5.913 -3.191 778 HD2 LYS 101 2HD LYS 101 3.712 -4.475 -4.941 779 HD3 LYS 101 3HD LYS 101 2.863 -3.080 -4.274 780 HE2 LYS 101 2HE LYS 101 4.055 -3.413 -2.121 781 HE3 LYS 101 3HE LYS 101 4.939 -4.765 -2.833 782 HZ1 LYS 101 1HZ LYS 101 6.269 -2.785 -2.900 783 HZ2 LYS 101 2HZ LYS 101 5.057 -1.924 -3.705 784 HZ3 LYS 101 3HZ LYS 101 5.843 -3.203 -4.481 785 HA PRO 102 HA PRO 102 1.966 -3.027 -8.745 786 HB2 PRO 102 2HB PRO 102 -0.782 -3.472 -9.964 787 HB3 PRO 102 3HB PRO 102 0.827 -3.735 -10.681 788 HG2 PRO 102 2HG PRO 102 -0.532 -5.808 -9.792 789 HG3 PRO 102 3HG PRO 102 1.211 -5.688 -9.446 790 HD2 PRO 102 2HD PRO 102 -1.121 -5.194 -7.616 791 HD3 PRO 102 3HD PRO 102 0.462 -5.926 -7.258 792 H LEU 103 H LEU 103 -1.516 -2.131 -8.347 793 HA LEU 103 HA LEU 103 -1.199 0.455 -9.498 794 HB2 LEU 103 2HB LEU 103 -3.332 -0.900 -9.456 795 HB3 LEU 103 3HB LEU 103 -3.499 -0.535 -7.752 796 HG LEU 103 HG LEU 103 -4.899 0.840 -9.502 797 HD11 LEU 103 1HD1 LEU 103 -4.904 2.876 -8.145 798 HD12 LEU 103 2HD1 LEU 103 -3.398 2.390 -7.364 799 HD13 LEU 103 3HD1 LEU 103 -4.865 1.442 -7.121 800 HD21 LEU 103 1HD2 LEU 103 -2.986 1.367 -10.997 801 HD22 LEU 103 2HD2 LEU 103 -2.298 2.393 -9.742 802 HD23 LEU 103 3HD2 LEU 103 -3.852 2.803 -10.469 803 H LEU 104 H LEU 104 -1.278 -0.750 -6.195 804 HA LEU 104 HA LEU 104 -1.359 1.692 -4.790 805 HB2 LEU 104 2HB LEU 104 -1.833 -0.508 -3.760 806 HB3 LEU 104 3HB LEU 104 -0.156 -0.982 -3.962 807 HG LEU 104 HG LEU 104 0.530 0.766 -2.324 808 HD11 LEU 104 1HD1 LEU 104 -1.252 2.415 -2.668 809 HD12 LEU 104 2HD1 LEU 104 -1.140 1.969 -0.969 810 HD13 LEU 104 3HD1 LEU 104 -2.441 1.312 -1.967 811 HD21 LEU 104 1HD2 LEU 104 -0.344 -0.351 -0.315 812 HD22 LEU 104 2HD2 LEU 104 0.079 -1.526 -1.555 813 HD23 LEU 104 3HD2 LEU 104 -1.616 -1.116 -1.271 814 H ASP 105 H ASP 105 1.286 -0.230 -6.098 815 HA ASP 105 HA ASP 105 3.400 1.237 -4.838 816 HB2 ASP 105 2HB ASP 105 3.499 -1.214 -5.560 817 HB3 ASP 105 3HB ASP 105 3.674 -0.648 -7.221 818 H VAL 106 H VAL 106 1.914 1.221 -8.070 819 HA VAL 106 HA VAL 106 3.574 3.126 -9.319 820 HB VAL 106 HB VAL 106 0.623 2.490 -9.817 821 HG11 VAL 106 1HG1 VAL 106 0.870 3.601 -12.025 822 HG12 VAL 106 2HG1 VAL 106 2.489 4.140 -11.573 823 HG13 VAL 106 3HG1 VAL 106 1.080 4.737 -10.695 824 HG21 VAL 106 1HG2 VAL 106 2.140 0.592 -10.233 825 HG22 VAL 106 2HG2 VAL 106 3.113 1.582 -11.320 826 HG23 VAL 106 3HG2 VAL 106 1.445 1.183 -11.742 827 H THR 107 H THR 107 0.559 3.508 -7.439 828 HA THR 107 HA THR 107 0.363 6.326 -7.636 829 HB THR 107 HB THR 107 -0.792 4.488 -5.484 830 HG1 THR 107 HG1 THR 107 -1.919 3.835 -7.161 831 HG21 THR 107 1HG2 THR 107 -2.500 6.262 -5.169 832 HG22 THR 107 2HG2 THR 107 -1.649 7.299 -6.315 833 HG23 THR 107 3HG2 THR 107 -0.889 6.867 -4.782 834 H CYS 108 H CYS 108 1.927 4.202 -5.258 835 HA CYS 108 HA CYS 108 2.612 6.177 -3.334 836 HB2 CYS 108 2HB CYS 108 3.796 3.422 -3.862 837 HB3 CYS 108 3HB CYS 108 4.248 4.425 -2.485 838 HG CYS 108 HG CYS 108 0.951 3.794 -2.857 839 H LYS 109 H LYS 109 4.338 4.833 -6.148 840 HA LYS 109 HA LYS 109 6.786 6.236 -5.798 841 HB2 LYS 109 2HB LYS 109 5.530 4.652 -8.001 842 HB3 LYS 109 3HB LYS 109 6.637 5.894 -8.561 843 HG2 LYS 109 2HG LYS 109 7.816 3.800 -8.378 844 HG3 LYS 109 3HG LYS 109 8.435 4.908 -7.156 845 HD2 LYS 109 2HD LYS 109 7.048 3.758 -5.439 846 HD3 LYS 109 3HD LYS 109 6.457 2.646 -6.678 847 HE2 LYS 109 2HE LYS 109 8.787 1.840 -7.039 848 HE3 LYS 109 3HE LYS 109 9.346 2.919 -5.757 849 HZ1 LYS 109 1HZ LYS 109 7.786 1.712 -4.252 850 HZ2 LYS 109 2HZ LYS 109 9.067 0.777 -4.829 851 HZ3 LYS 109 3HZ LYS 109 7.521 0.594 -5.496 852 H THR 110 H THR 110 3.882 6.947 -7.741 853 HA THR 110 HA THR 110 4.759 9.261 -9.020 854 HB THR 110 HB THR 110 1.921 8.427 -8.288 855 HG1 THR 110 HG1 THR 110 2.268 7.054 -9.842 856 HG21 THR 110 1HG2 THR 110 2.822 10.517 -10.324 857 HG22 THR 110 2HG2 THR 110 1.953 10.847 -8.824 858 HG23 THR 110 3HG2 THR 110 1.172 9.931 -10.110 859 H VAL 111 H VAL 111 2.807 8.983 -6.012 860 HA VAL 111 HA VAL 111 2.532 11.755 -5.549 861 HB VAL 111 HB VAL 111 1.885 11.186 -3.219 862 HG11 VAL 111 1HG1 VAL 111 0.196 11.061 -5.001 863 HG12 VAL 111 2HG1 VAL 111 -0.116 9.854 -3.754 864 HG13 VAL 111 3HG1 VAL 111 0.603 9.367 -5.290 865 HG21 VAL 111 1HG2 VAL 111 3.450 9.351 -2.752 866 HG22 VAL 111 2HG2 VAL 111 2.644 8.326 -3.937 867 HG23 VAL 111 3HG2 VAL 111 1.791 8.816 -2.473 868 H ALA 112 H ALA 112 5.045 9.467 -4.661 869 HA ALA 112 HA ALA 112 6.530 11.198 -2.934 870 HB1 ALA 112 1HB ALA 112 8.279 9.494 -3.074 871 HB2 ALA 112 2HB ALA 112 7.404 8.702 -4.392 872 HB3 ALA 112 3HB ALA 112 6.696 8.773 -2.781 873 H ASN 113 H ASN 113 6.565 10.524 -6.375 874 HA ASN 113 HA ASN 113 9.074 11.794 -6.943 875 HB2 ASN 113 2HB ASN 113 6.785 10.908 -8.742 876 HB3 ASN 113 3HB ASN 113 8.269 11.627 -9.362 877 HD21 ASN 113 1HD2 ASN 113 7.152 8.965 -9.834 878 HD22 ASN 113 2HD2 ASN 113 8.369 7.842 -9.340 879 H MET 114 H MET 114 5.684 12.822 -7.008 880 HA MET 114 HA MET 114 6.104 15.270 -8.426 881 HB2 MET 114 2HB MET 114 3.756 14.361 -6.712 882 HB3 MET 114 3HB MET 114 3.752 15.811 -7.709 883 HG2 MET 114 2HG MET 114 4.057 14.407 -9.722 884 HG3 MET 114 3HG MET 114 4.021 12.967 -8.707 885 HE1 MET 114 1HE MET 114 1.699 13.938 -6.565 886 HE2 MET 114 2HE MET 114 1.783 12.298 -7.211 887 HE3 MET 114 3HE MET 114 0.279 13.210 -7.314 888 H ILE 115 H ILE 115 5.843 14.461 -4.968 889 HA ILE 115 HA ILE 115 5.940 17.155 -3.980 890 HB ILE 115 HB ILE 115 6.430 16.108 -1.750 891 HG12 ILE 115 2HG1 ILE 115 6.545 13.542 -3.406 892 HG13 ILE 115 3HG1 ILE 115 7.868 14.261 -2.508 893 HG21 ILE 115 1HG2 ILE 115 4.095 16.360 -2.533 894 HG22 ILE 115 2HG2 ILE 115 4.280 14.922 -1.533 895 HG23 ILE 115 3HG2 ILE 115 4.170 14.763 -3.285 896 HD11 ILE 115 1HD1 ILE 115 5.393 13.129 -1.255 897 HD12 ILE 115 2HD1 ILE 115 6.868 13.661 -0.458 898 HD13 ILE 115 3HD1 ILE 115 6.898 12.253 -1.495 899 H ARG 116 H ARG 116 8.403 14.888 -4.963 900 HA ARG 116 HA ARG 116 10.628 16.500 -3.930 901 HB2 ARG 116 2HB ARG 116 10.535 13.917 -5.546 902 HB3 ARG 116 3HB ARG 116 12.035 14.713 -5.067 903 HG2 ARG 116 2HG ARG 116 11.431 14.417 -2.684 904 HG3 ARG 116 3HG ARG 116 9.930 13.620 -3.163 905 HD2 ARG 116 2HD ARG 116 12.728 12.606 -3.793 906 HD3 ARG 116 3HD ARG 116 11.691 12.011 -2.495 907 HE ARG 116 HE ARG 116 10.425 11.855 -5.067 908 HH11 ARG 116 1HH1 ARG 116 12.671 10.168 -2.946 909 HH12 ARG 116 2HH1 ARG 116 12.361 8.623 -3.662 910 HH21 ARG 116 1HH2 ARG 116 10.046 9.803 -6.001 911 HH22 ARG 116 2HH2 ARG 116 10.879 8.413 -5.384 912 H GLY 117 H GLY 117 8.704 16.210 -6.763 913 HA2 GLY 117 2HA GLY 117 8.659 17.764 -8.527 914 HA3 GLY 117 3HA GLY 117 10.336 18.187 -8.210 915 H1 SER 2 1H SER 2 17.374 -13.998 15.565 916 H2 SER 2 2H SER 2 17.263 -13.228 17.063 917 H3 SER 2 3H SER 2 18.099 -14.688 16.926 918 HA SER 2 HA SER 2 19.579 -12.807 17.117 919 HB2 SER 2 2HB SER 2 19.659 -14.190 14.402 920 HB3 SER 2 3HB SER 2 21.035 -13.466 15.240 921 HG SER 2 HG SER 2 21.180 -15.518 15.856 922 H LEU 3 H LEU 3 20.630 -11.018 15.908 923 HA LEU 3 HA LEU 3 18.615 -9.159 14.956 924 HB2 LEU 3 2HB LEU 3 21.616 -8.750 15.276 925 HB3 LEU 3 3HB LEU 3 20.417 -7.489 15.033 926 HG LEU 3 HG LEU 3 20.657 -9.250 17.502 927 HD11 LEU 3 1HD1 LEU 3 21.344 -7.201 18.666 928 HD12 LEU 3 2HD1 LEU 3 21.297 -6.308 17.145 929 HD13 LEU 3 3HD1 LEU 3 22.465 -7.611 17.368 930 HD21 LEU 3 1HD2 LEU 3 18.940 -7.789 18.496 931 HD22 LEU 3 2HD2 LEU 3 18.323 -8.682 17.110 932 HD23 LEU 3 3HD2 LEU 3 18.734 -6.973 16.943 933 H VAL 4 H VAL 4 18.046 -9.172 12.834 934 HA VAL 4 HA VAL 4 19.960 -9.748 10.714 935 HB VAL 4 HB VAL 4 18.038 -9.152 9.132 936 HG11 VAL 4 1HG1 VAL 4 18.596 -11.477 9.691 937 HG12 VAL 4 2HG1 VAL 4 16.854 -11.286 9.497 938 HG13 VAL 4 3HG1 VAL 4 17.553 -11.407 11.114 939 HG21 VAL 4 1HG2 VAL 4 16.724 -7.724 10.646 940 HG22 VAL 4 2HG2 VAL 4 16.424 -9.095 11.714 941 HG23 VAL 4 3HG2 VAL 4 15.747 -9.082 10.083 942 H LYS 5 H LYS 5 21.034 -8.308 9.578 943 HA LYS 5 HA LYS 5 21.123 -5.561 10.535 944 HB2 LYS 5 2HB LYS 5 22.891 -7.050 8.547 945 HB3 LYS 5 3HB LYS 5 23.221 -5.463 9.223 946 HG2 LYS 5 2HG LYS 5 23.286 -6.539 11.508 947 HG3 LYS 5 3HG LYS 5 23.165 -8.106 10.705 948 HD2 LYS 5 2HD LYS 5 25.286 -7.637 9.495 949 HD3 LYS 5 3HD LYS 5 25.398 -6.074 10.314 950 HE2 LYS 5 2HE LYS 5 25.420 -7.336 12.513 951 HE3 LYS 5 3HE LYS 5 25.556 -8.827 11.580 952 HZ1 LYS 5 1HZ LYS 5 27.477 -6.565 11.554 953 HZ2 LYS 5 2HZ LYS 5 27.615 -7.965 10.617 954 HZ3 LYS 5 3HZ LYS 5 27.709 -8.062 12.303 955 H LEU 6 H LEU 6 19.133 -4.814 9.674 956 HA LEU 6 HA LEU 6 18.578 -4.881 6.825 957 HB2 LEU 6 2HB LEU 6 17.130 -3.440 9.081 958 HB3 LEU 6 3HB LEU 6 16.535 -3.614 7.434 959 HG LEU 6 HG LEU 6 16.952 -5.860 9.442 960 HD11 LEU 6 1HD1 LEU 6 14.515 -6.110 9.366 961 HD12 LEU 6 2HD1 LEU 6 14.394 -4.717 8.290 962 HD13 LEU 6 3HD1 LEU 6 14.984 -4.512 9.940 963 HD21 LEU 6 1HD2 LEU 6 17.475 -6.680 7.198 964 HD22 LEU 6 2HD2 LEU 6 15.943 -6.058 6.584 965 HD23 LEU 6 3HD2 LEU 6 15.956 -7.367 7.770 966 H GLU 7 H GLU 7 20.283 -3.756 5.904 967 HA GLU 7 HA GLU 7 20.945 -1.045 6.652 968 HB2 GLU 7 2HB GLU 7 22.663 -2.564 5.756 969 HB3 GLU 7 3HB GLU 7 21.774 -2.727 4.243 970 HG2 GLU 7 2HG GLU 7 22.142 -0.333 3.763 971 HG3 GLU 7 3HG GLU 7 23.004 -0.148 5.288 972 H SER 8 H SER 8 20.181 0.785 5.760 973 HA SER 8 HA SER 8 17.913 0.744 3.923 974 HB2 SER 8 2HB SER 8 17.852 3.205 4.505 975 HB3 SER 8 3HB SER 8 17.785 2.153 5.917 976 HG SER 8 HG SER 8 19.800 2.691 6.460 977 H SER 9 H SER 9 17.915 2.609 2.258 978 HA SER 9 HA SER 9 20.105 2.418 0.428 979 HB2 SER 9 2HB SER 9 18.854 4.134 -0.879 980 HB3 SER 9 3HB SER 9 17.809 2.817 -0.360 981 HG SER 9 HG SER 9 17.777 5.480 0.321 982 H ASP 10 H ASP 10 19.581 4.341 3.203 983 HA ASP 10 HA ASP 10 21.519 6.429 2.528 984 HB2 ASP 10 2HB ASP 10 19.420 7.002 3.730 985 HB3 ASP 10 3HB ASP 10 19.857 5.916 5.038 986 H GLU 11 H GLU 11 21.758 3.287 3.382 987 HA GLU 11 HA GLU 11 23.557 1.984 3.783 988 HB2 GLU 11 2HB GLU 11 24.924 3.852 2.807 989 HB3 GLU 11 3HB GLU 11 25.108 4.532 4.416 990 HG2 GLU 11 2HG GLU 11 26.303 2.427 5.095 991 HG3 GLU 11 3HG GLU 11 26.214 1.890 3.416 992 H LYS 12 H LYS 12 21.939 3.744 6.131 993 HA LYS 12 HA LYS 12 23.486 2.937 8.437 994 HB2 LYS 12 2HB LYS 12 20.629 3.970 8.293 995 HB3 LYS 12 3HB LYS 12 21.508 3.656 9.786 996 HG2 LYS 12 2HG LYS 12 23.243 5.351 8.950 997 HG3 LYS 12 3HG LYS 12 22.062 5.782 7.713 998 HD2 LYS 12 2HD LYS 12 20.410 6.216 9.638 999 HD3 LYS 12 3HD LYS 12 21.790 6.080 10.729 1000 HE2 LYS 12 2HE LYS 12 21.492 8.097 8.477 1001 HE3 LYS 12 3HE LYS 12 21.297 8.431 10.196 1002 HZ1 LYS 12 1HZ LYS 12 23.614 7.872 10.532 1003 HZ2 LYS 12 2HZ LYS 12 23.460 9.111 9.391 1004 HZ3 LYS 12 3HZ LYS 12 23.802 7.534 8.885 1005 H VAL 13 H VAL 13 23.430 1.098 9.466 1006 HA VAL 13 HA VAL 13 21.768 -1.110 8.476 1007 HB VAL 13 HB VAL 13 24.299 -1.074 10.197 1008 HG11 VAL 13 1HG1 VAL 13 22.957 -3.066 10.669 1009 HG12 VAL 13 2HG1 VAL 13 24.416 -3.505 9.786 1010 HG13 VAL 13 3HG1 VAL 13 22.865 -3.445 8.947 1011 HG21 VAL 13 1HG2 VAL 13 24.692 -0.282 7.889 1012 HG22 VAL 13 2HG2 VAL 13 23.962 -1.754 7.246 1013 HG23 VAL 13 3HG2 VAL 13 25.468 -1.843 8.162 1014 H PHE 14 H PHE 14 19.938 -1.425 9.604 1015 HA PHE 14 HA PHE 14 19.775 -0.870 12.490 1016 HB2 PHE 14 2HB PHE 14 17.569 -1.416 10.446 1017 HB3 PHE 14 3HB PHE 14 17.313 -1.005 12.144 1018 HD1 PHE 14 HD1 PHE 14 17.968 0.322 8.823 1019 HD2 PHE 14 HD2 PHE 14 18.083 1.266 12.991 1020 HE1 PHE 14 HE1 PHE 14 18.097 2.718 8.283 1021 HE2 PHE 14 HE2 PHE 14 18.201 3.661 12.442 1022 HZ PHE 14 HZ PHE 14 18.214 4.387 10.090 1023 H GLU 15 H GLU 15 20.712 -2.592 13.423 1024 HA GLU 15 HA GLU 15 20.211 -5.333 12.621 1025 HB2 GLU 15 2HB GLU 15 21.719 -4.292 15.059 1026 HB3 GLU 15 3HB GLU 15 21.802 -5.918 14.378 1027 HG2 GLU 15 2HG GLU 15 22.841 -5.008 12.330 1028 HG3 GLU 15 3HG GLU 15 22.726 -3.386 13.004 1029 H ILE 16 H ILE 16 17.894 -5.265 12.926 1030 HA ILE 16 HA ILE 16 16.921 -5.182 15.719 1031 HB ILE 16 HB ILE 16 15.846 -3.643 14.033 1032 HG12 ILE 16 2HG1 ILE 16 13.871 -5.738 15.055 1033 HG13 ILE 16 3HG1 ILE 16 14.614 -4.528 16.087 1034 HG21 ILE 16 1HG2 ILE 16 14.806 -6.192 12.733 1035 HG22 ILE 16 2HG2 ILE 16 15.996 -5.090 12.039 1036 HG23 ILE 16 3HG2 ILE 16 14.340 -4.544 12.298 1037 HD11 ILE 16 1HD1 ILE 16 12.394 -3.863 15.484 1038 HD12 ILE 16 2HD1 ILE 16 12.763 -4.012 13.768 1039 HD13 ILE 16 3HD1 ILE 16 13.548 -2.761 14.736 1040 H GLU 17 H GLU 17 15.404 -6.871 16.379 1041 HA GLU 17 HA GLU 17 16.251 -9.488 15.923 1042 HB2 GLU 17 2HB GLU 17 13.543 -8.565 16.974 1043 HB3 GLU 17 3HB GLU 17 14.170 -10.203 17.091 1044 HG2 GLU 17 2HG GLU 17 14.517 -9.280 19.224 1045 HG3 GLU 17 3HG GLU 17 16.100 -9.237 18.463 1046 H LYS 18 H LYS 18 15.707 -11.050 14.509 1047 HA LYS 18 HA LYS 18 14.710 -10.427 11.974 1048 HB2 LYS 18 2HB LYS 18 16.263 -12.306 12.469 1049 HB3 LYS 18 3HB LYS 18 14.953 -13.169 13.269 1050 HG2 LYS 18 2HG LYS 18 13.713 -13.041 11.003 1051 HG3 LYS 18 3HG LYS 18 15.259 -12.537 10.321 1052 HD2 LYS 18 2HD LYS 18 14.992 -14.938 10.001 1053 HD3 LYS 18 3HD LYS 18 16.287 -14.658 11.169 1054 HE2 LYS 18 2HE LYS 18 14.720 -15.142 13.024 1055 HE3 LYS 18 3HE LYS 18 13.420 -15.414 11.860 1056 HZ1 LYS 18 1HZ LYS 18 14.723 -17.243 10.935 1057 HZ2 LYS 18 2HZ LYS 18 14.357 -17.494 12.566 1058 HZ3 LYS 18 3HZ LYS 18 15.913 -17.009 12.111 1059 H GLU 19 H GLU 19 13.146 -11.886 14.756 1060 HA GLU 19 HA GLU 19 10.723 -12.727 13.625 1061 HB2 GLU 19 2HB GLU 19 9.862 -12.587 16.009 1062 HB3 GLU 19 3HB GLU 19 11.339 -13.521 15.793 1063 HG2 GLU 19 2HG GLU 19 12.623 -11.433 16.521 1064 HG3 GLU 19 3HG GLU 19 11.067 -10.740 16.970 1065 H ILE 20 H ILE 20 11.750 -9.537 14.650 1066 HA ILE 20 HA ILE 20 9.134 -8.289 14.368 1067 HB ILE 20 HB ILE 20 11.881 -6.966 14.597 1068 HG12 ILE 20 2HG1 ILE 20 9.881 -7.689 16.799 1069 HG13 ILE 20 3HG1 ILE 20 11.461 -8.421 16.554 1070 HG21 ILE 20 1HG2 ILE 20 10.623 -4.967 15.339 1071 HG22 ILE 20 2HG2 ILE 20 9.102 -5.821 15.079 1072 HG23 ILE 20 3HG2 ILE 20 10.151 -5.453 13.709 1073 HD11 ILE 20 1HD1 ILE 20 10.927 -5.571 17.362 1074 HD12 ILE 20 2HD1 ILE 20 12.521 -6.277 17.090 1075 HD13 ILE 20 3HD1 ILE 20 11.503 -6.876 18.397 1076 H ALA 21 H ALA 21 12.121 -8.608 12.480 1077 HA ALA 21 HA ALA 21 11.299 -7.074 10.212 1078 HB1 ALA 21 1HB ALA 21 13.210 -8.120 9.070 1079 HB2 ALA 21 2HB ALA 21 13.380 -9.274 10.397 1080 HB3 ALA 21 3HB ALA 21 13.656 -7.556 10.681 1081 H CYS 22 H CYS 22 10.467 -10.250 11.289 1082 HA CYS 22 HA CYS 22 9.577 -11.327 8.789 1083 HB2 CYS 22 2HB CYS 22 8.875 -12.083 11.652 1084 HB3 CYS 22 3HB CYS 22 8.378 -13.003 10.232 1085 HG CYS 22 HG CYS 22 11.662 -12.522 10.246 1086 H MET 23 H MET 23 8.163 -9.268 11.272 1087 HA MET 23 HA MET 23 5.435 -9.290 10.500 1088 HB2 MET 23 2HB MET 23 7.029 -6.945 11.642 1089 HB3 MET 23 3HB MET 23 5.276 -7.086 11.633 1090 HG2 MET 23 2HG MET 23 5.408 -8.999 13.161 1091 HG3 MET 23 3HG MET 23 7.169 -8.904 13.139 1092 HE1 MET 23 1HE MET 23 3.824 -7.141 14.276 1093 HE2 MET 23 2HE MET 23 4.559 -5.878 13.286 1094 HE3 MET 23 3HE MET 23 4.440 -5.670 15.033 1095 H SER 24 H SER 24 8.219 -7.481 9.329 1096 HA SER 24 HA SER 24 6.898 -6.254 7.103 1097 HB2 SER 24 2HB SER 24 9.054 -5.371 7.934 1098 HB3 SER 24 3HB SER 24 9.839 -6.912 7.575 1099 HG SER 24 HG SER 24 8.490 -5.547 5.537 1100 H VAL 25 H VAL 25 5.867 -7.548 5.637 1101 HA VAL 25 HA VAL 25 6.401 -10.337 5.434 1102 HB VAL 25 HB VAL 25 4.640 -8.603 3.649 1103 HG11 VAL 25 1HG1 VAL 25 4.652 -11.634 3.951 1104 HG12 VAL 25 2HG1 VAL 25 5.163 -10.727 2.526 1105 HG13 VAL 25 3HG1 VAL 25 3.473 -10.697 3.029 1106 HG21 VAL 25 1HG2 VAL 25 2.767 -9.392 5.069 1107 HG22 VAL 25 2HG2 VAL 25 3.955 -8.491 6.011 1108 HG23 VAL 25 3HG2 VAL 25 3.909 -10.254 6.104 1109 H THR 26 H THR 26 7.290 -7.576 3.354 1110 HA THR 26 HA THR 26 8.357 -9.053 1.186 1111 HB THR 26 HB THR 26 9.123 -6.256 2.140 1112 HG1 THR 26 HG1 THR 26 7.646 -5.596 0.580 1113 HG21 THR 26 1HG2 THR 26 9.679 -7.570 -0.553 1114 HG22 THR 26 2HG2 THR 26 10.893 -7.154 0.659 1115 HG23 THR 26 3HG2 THR 26 9.983 -5.877 -0.146 1116 H ILE 27 H ILE 27 10.005 -7.685 4.089 1117 HA ILE 27 HA ILE 27 12.626 -8.575 3.444 1118 HB ILE 27 HB ILE 27 11.391 -7.903 6.154 1119 HG12 ILE 27 2HG1 ILE 27 13.224 -6.268 4.328 1120 HG13 ILE 27 3HG1 ILE 27 11.499 -6.002 4.548 1121 HG21 ILE 27 1HG2 ILE 27 13.696 -7.747 7.061 1122 HG22 ILE 27 2HG2 ILE 27 14.340 -8.341 5.529 1123 HG23 ILE 27 3HG2 ILE 27 13.325 -9.386 6.523 1124 HD11 ILE 27 1HD1 ILE 27 13.636 -5.660 6.642 1125 HD12 ILE 27 2HD1 ILE 27 11.903 -5.450 6.907 1126 HD13 ILE 27 3HD1 ILE 27 12.763 -4.384 5.794 1127 H LYS 28 H LYS 28 10.033 -9.992 5.397 1128 HA LYS 28 HA LYS 28 11.159 -12.392 6.242 1129 HB2 LYS 28 2HB LYS 28 8.928 -11.550 6.956 1130 HB3 LYS 28 3HB LYS 28 8.295 -11.841 5.342 1131 HG2 LYS 28 2HG LYS 28 8.814 -14.311 5.708 1132 HG3 LYS 28 3HG LYS 28 9.166 -13.901 7.387 1133 HD2 LYS 28 2HD LYS 28 6.873 -14.752 7.181 1134 HD3 LYS 28 3HD LYS 28 6.855 -13.057 7.673 1135 HE2 LYS 28 2HE LYS 28 5.133 -13.544 5.970 1136 HE3 LYS 28 3HE LYS 28 6.311 -12.371 5.380 1137 HZ1 LYS 28 1HZ LYS 28 7.431 -14.255 4.229 1138 HZ2 LYS 28 2HZ LYS 28 5.868 -13.948 3.662 1139 HZ3 LYS 28 3HZ LYS 28 6.151 -15.254 4.691 1140 H ASN 29 H ASN 29 9.413 -11.661 3.219 1141 HA ASN 29 HA ASN 29 9.556 -14.238 2.046 1142 HB2 ASN 29 2HB ASN 29 9.046 -11.499 0.808 1143 HB3 ASN 29 3HB ASN 29 9.027 -12.976 -0.147 1144 HD21 ASN 29 1HD2 ASN 29 6.855 -11.121 0.235 1145 HD22 ASN 29 2HD2 ASN 29 5.563 -12.002 0.971 1146 H MET 30 H MET 30 11.747 -11.469 1.997 1147 HA MET 30 HA MET 30 13.461 -12.311 -0.106 1148 HB2 MET 30 2HB MET 30 13.960 -10.477 2.279 1149 HB3 MET 30 3HB MET 30 15.196 -10.805 1.073 1150 HG2 MET 30 2HG MET 30 13.757 -9.824 -0.672 1151 HG3 MET 30 3HG MET 30 12.523 -9.492 0.546 1152 HE1 MET 30 1HE MET 30 12.560 -6.901 -0.300 1153 HE2 MET 30 2HE MET 30 13.847 -7.272 -1.448 1154 HE3 MET 30 3HE MET 30 14.025 -5.919 -0.329 1155 H ILE 31 H ILE 31 13.636 -12.724 3.426 1156 HA ILE 31 HA ILE 31 16.068 -14.146 3.561 1157 HB ILE 31 HB ILE 31 13.716 -14.177 5.519 1158 HG12 ILE 31 2HG1 ILE 31 16.273 -12.486 5.555 1159 HG13 ILE 31 3HG1 ILE 31 14.684 -11.895 5.094 1160 HG21 ILE 31 1HG2 ILE 31 16.601 -15.040 5.990 1161 HG22 ILE 31 2HG2 ILE 31 15.200 -16.109 5.916 1162 HG23 ILE 31 3HG2 ILE 31 15.346 -14.942 7.229 1163 HD11 ILE 31 1HD1 ILE 31 15.236 -11.205 7.333 1164 HD12 ILE 31 2HD1 ILE 31 15.490 -12.879 7.824 1165 HD13 ILE 31 3HD1 ILE 31 13.876 -12.326 7.369 1166 H GLU 32 H GLU 32 12.714 -15.216 3.187 1167 HA GLU 32 HA GLU 32 13.225 -18.044 3.392 1168 HB2 GLU 32 2HB GLU 32 10.818 -16.556 2.260 1169 HB3 GLU 32 3HB GLU 32 10.869 -18.283 2.612 1170 HG2 GLU 32 2HG GLU 32 11.118 -17.857 4.981 1171 HG3 GLU 32 3HG GLU 32 11.260 -16.124 4.702 1172 H ASP 33 H ASP 33 13.018 -15.730 0.744 1173 HA ASP 33 HA ASP 33 12.820 -17.604 -1.414 1174 HB2 ASP 33 2HB ASP 33 12.041 -15.261 -1.612 1175 HB3 ASP 33 3HB ASP 33 13.692 -14.678 -1.433 1176 H ILE 34 H ILE 34 15.488 -15.825 0.063 1177 HA ILE 34 HA ILE 34 17.595 -17.042 -1.476 1178 HB ILE 34 HB ILE 34 17.697 -15.590 1.216 1179 HG12 ILE 34 2HG1 ILE 34 18.258 -14.519 -1.597 1180 HG13 ILE 34 3HG1 ILE 34 16.823 -14.171 -0.642 1181 HG21 ILE 34 1HG2 ILE 34 19.695 -16.998 0.910 1182 HG22 ILE 34 2HG2 ILE 34 20.122 -15.292 0.800 1183 HG23 ILE 34 3HG2 ILE 34 19.996 -16.266 -0.667 1184 HD11 ILE 34 1HD1 ILE 34 19.647 -13.340 0.016 1185 HD12 ILE 34 2HD1 ILE 34 18.229 -13.030 1.023 1186 HD13 ILE 34 3HD1 ILE 34 18.345 -12.312 -0.583 1187 H GLY 35 H GLY 35 15.780 -17.830 1.400 1188 HA2 GLY 35 2HA GLY 35 15.541 -20.039 2.245 1189 HA3 GLY 35 3HA GLY 35 17.161 -20.427 1.677 1190 H GLU 36 H GLU 36 18.801 -18.710 2.625 1191 HA GLU 36 HA GLU 36 18.362 -18.194 5.504 1192 HB2 GLU 36 2HB GLU 36 20.860 -19.481 4.291 1193 HB3 GLU 36 3HB GLU 36 20.678 -19.006 5.976 1194 HG2 GLU 36 2HG GLU 36 18.932 -20.710 6.280 1195 HG3 GLU 36 3HG GLU 36 19.063 -21.163 4.582 1196 H SER 37 H SER 37 18.894 -16.064 5.916 1197 HA SER 37 HA SER 37 20.832 -14.687 4.137 1198 HB2 SER 37 2HB SER 37 18.228 -13.493 5.171 1199 HB3 SER 37 3HB SER 37 19.425 -12.663 4.175 1200 HG SER 37 HG SER 37 18.747 -14.967 3.007 1201 H ASP 38 H ASP 38 22.353 -15.217 5.837 1202 HA ASP 38 HA ASP 38 22.187 -13.899 8.412 1203 HB2 ASP 38 2HB ASP 38 23.429 -16.034 8.105 1204 HB3 ASP 38 3HB ASP 38 24.567 -15.231 7.033 1205 H SER 39 H SER 39 23.594 -13.269 5.266 1206 HA SER 39 HA SER 39 25.311 -11.118 5.876 1207 HB2 SER 39 2HB SER 39 23.846 -11.704 3.271 1208 HB3 SER 39 3HB SER 39 25.275 -10.685 3.452 1209 HG SER 39 HG SER 39 25.517 -13.011 2.778 1210 HA PRO 40 HA PRO 40 22.567 -7.655 6.777 1211 HB2 PRO 40 2HB PRO 40 24.428 -6.077 4.972 1212 HB3 PRO 40 3HB PRO 40 23.875 -5.707 6.623 1213 HG2 PRO 40 2HG PRO 40 26.330 -6.616 6.235 1214 HG3 PRO 40 3HG PRO 40 25.368 -7.208 7.611 1215 HD2 PRO 40 2HD PRO 40 25.966 -8.578 4.997 1216 HD3 PRO 40 3HD PRO 40 25.881 -9.261 6.635 1217 H ILE 41 H ILE 41 20.608 -7.433 5.858 1218 HA ILE 41 HA ILE 41 20.113 -7.871 3.058 1219 HB ILE 41 HB ILE 41 18.203 -7.011 5.283 1220 HG12 ILE 41 2HG1 ILE 41 17.283 -9.432 4.908 1221 HG13 ILE 41 3HG1 ILE 41 18.789 -9.754 4.063 1222 HG21 ILE 41 1HG2 ILE 41 16.338 -7.555 3.738 1223 HG22 ILE 41 2HG2 ILE 41 17.499 -7.849 2.442 1224 HG23 ILE 41 3HG2 ILE 41 17.332 -6.231 3.125 1225 HD11 ILE 41 1HD1 ILE 41 18.839 -10.564 6.355 1226 HD12 ILE 41 2HD1 ILE 41 18.523 -8.940 6.963 1227 HD13 ILE 41 3HD1 ILE 41 20.037 -9.290 6.124 1228 HA PRO 42 HA PRO 42 20.538 -3.360 2.327 1229 HB2 PRO 42 2HB PRO 42 21.161 -3.464 -0.315 1230 HB3 PRO 42 3HB PRO 42 22.333 -3.936 0.932 1231 HG2 PRO 42 2HG PRO 42 20.732 -5.661 -0.891 1232 HG3 PRO 42 3HG PRO 42 22.363 -5.912 -0.237 1233 HD2 PRO 42 2HD PRO 42 19.966 -7.062 0.761 1234 HD3 PRO 42 3HD PRO 42 21.552 -7.068 1.559 1235 H LEU 43 H LEU 43 18.763 -2.156 2.159 1236 HA LEU 43 HA LEU 43 16.563 -2.884 0.317 1237 HB2 LEU 43 2HB LEU 43 16.545 -1.150 2.827 1238 HB3 LEU 43 3HB LEU 43 15.147 -1.455 1.806 1239 HG LEU 43 HG LEU 43 16.639 -3.600 3.376 1240 HD11 LEU 43 1HD1 LEU 43 14.690 -3.643 4.882 1241 HD12 LEU 43 2HD1 LEU 43 13.995 -2.264 4.026 1242 HD13 LEU 43 3HD1 LEU 43 15.511 -2.082 4.910 1243 HD21 LEU 43 1HD2 LEU 43 14.055 -3.781 1.787 1244 HD22 LEU 43 2HD2 LEU 43 14.705 -5.053 2.825 1245 HD23 LEU 43 3HD2 LEU 43 15.596 -4.548 1.393 1246 HA PRO 44 HA PRO 44 18.788 0.603 -1.714 1247 HB2 PRO 44 2HB PRO 44 18.020 0.101 -4.279 1248 HB3 PRO 44 3HB PRO 44 19.219 -0.914 -3.447 1249 HG2 PRO 44 2HG PRO 44 16.267 -1.406 -3.782 1250 HG3 PRO 44 3HG PRO 44 17.628 -2.510 -4.099 1251 HD2 PRO 44 2HD PRO 44 16.239 -2.642 -1.793 1252 HD3 PRO 44 3HD PRO 44 17.993 -2.939 -1.834 1253 H ASN 45 H ASN 45 15.438 0.259 -1.208 1254 HA ASN 45 HA ASN 45 15.010 3.058 -1.988 1255 HB2 ASN 45 2HB ASN 45 14.095 1.656 -3.843 1256 HB3 ASN 45 3HB ASN 45 13.038 0.838 -2.693 1257 HD21 ASN 45 1HD2 ASN 45 11.100 1.547 -3.605 1258 HD22 ASN 45 2HD2 ASN 45 10.602 3.200 -3.633 1259 H VAL 46 H VAL 46 15.491 2.962 0.393 1260 HA VAL 46 HA VAL 46 13.176 4.057 1.522 1261 HB VAL 46 HB VAL 46 12.547 1.710 2.107 1262 HG11 VAL 46 1HG1 VAL 46 14.763 0.686 2.314 1263 HG12 VAL 46 2HG1 VAL 46 13.795 0.382 3.757 1264 HG13 VAL 46 3HG1 VAL 46 15.071 1.603 3.793 1265 HG21 VAL 46 1HG2 VAL 46 13.233 3.406 4.539 1266 HG22 VAL 46 2HG2 VAL 46 12.061 2.087 4.506 1267 HG23 VAL 46 3HG2 VAL 46 11.776 3.539 3.549 1268 H THR 47 H THR 47 13.913 5.746 2.656 1269 HA THR 47 HA THR 47 16.694 6.129 3.234 1270 HB THR 47 HB THR 47 15.895 8.252 4.355 1271 HG1 THR 47 HG1 THR 47 13.301 7.423 3.476 1272 HG21 THR 47 1HG2 THR 47 16.410 8.237 1.930 1273 HG22 THR 47 2HG2 THR 47 15.093 9.348 2.298 1274 HG23 THR 47 3HG2 THR 47 14.743 7.777 1.575 1275 H SER 48 H SER 48 17.574 6.563 5.377 1276 HA SER 48 HA SER 48 17.293 4.326 7.038 1277 HB2 SER 48 2HB SER 48 18.916 5.529 8.517 1278 HB3 SER 48 3HB SER 48 19.401 5.502 6.821 1279 HG SER 48 HG SER 48 19.664 7.582 7.390 1280 H THR 49 H THR 49 16.329 7.698 7.571 1281 HA THR 49 HA THR 49 15.468 7.518 10.227 1282 HB THR 49 HB THR 49 14.132 9.617 9.654 1283 HG1 THR 49 HG1 THR 49 13.977 10.231 7.587 1284 HG21 THR 49 1HG2 THR 49 17.033 9.561 8.722 1285 HG22 THR 49 2HG2 THR 49 16.486 9.835 10.379 1286 HG23 THR 49 3HG2 THR 49 16.121 11.018 9.122 1287 H ILE 50 H ILE 50 13.653 7.176 7.180 1288 HA ILE 50 HA ILE 50 11.086 6.810 8.371 1289 HB ILE 50 HB ILE 50 12.074 6.104 5.566 1290 HG12 ILE 50 2HG1 ILE 50 12.283 8.510 6.081 1291 HG13 ILE 50 3HG1 ILE 50 11.020 8.248 4.886 1292 HG21 ILE 50 1HG2 ILE 50 9.207 6.322 6.561 1293 HG22 ILE 50 2HG2 ILE 50 10.031 4.842 6.066 1294 HG23 ILE 50 3HG2 ILE 50 9.699 6.104 4.881 1295 HD11 ILE 50 1HD1 ILE 50 9.320 8.516 6.644 1296 HD12 ILE 50 2HD1 ILE 50 10.361 9.929 6.491 1297 HD13 ILE 50 3HD1 ILE 50 10.601 8.806 7.827 1298 H LEU 51 H LEU 51 13.544 4.565 7.103 1299 HA LEU 51 HA LEU 51 12.185 2.134 7.437 1300 HB2 LEU 51 2HB LEU 51 14.302 2.344 6.158 1301 HB3 LEU 51 3HB LEU 51 15.183 2.655 7.647 1302 HG LEU 51 HG LEU 51 14.658 0.347 8.437 1303 HD11 LEU 51 1HD1 LEU 51 13.353 -0.066 5.727 1304 HD12 LEU 51 2HD1 LEU 51 12.536 -0.036 7.291 1305 HD13 LEU 51 3HD1 LEU 51 13.678 -1.324 6.922 1306 HD21 LEU 51 1HD2 LEU 51 16.767 0.733 7.233 1307 HD22 LEU 51 2HD2 LEU 51 15.975 0.379 5.697 1308 HD23 LEU 51 3HD2 LEU 51 16.145 -0.885 6.918 1309 H GLU 52 H GLU 52 14.191 4.003 9.670 1310 HA GLU 52 HA GLU 52 14.268 2.242 11.866 1311 HB2 GLU 52 2HB GLU 52 15.781 4.151 11.714 1312 HB3 GLU 52 3HB GLU 52 14.433 5.286 11.746 1313 HG2 GLU 52 2HG GLU 52 13.907 4.575 14.058 1314 HG3 GLU 52 3HG GLU 52 15.268 3.455 14.020 1315 H LYS 53 H LYS 53 12.046 4.897 11.043 1316 HA LYS 53 HA LYS 53 10.439 4.901 13.343 1317 HB2 LYS 53 2HB LYS 53 9.723 5.648 10.475 1318 HB3 LYS 53 3HB LYS 53 8.704 5.994 11.865 1319 HG2 LYS 53 2HG LYS 53 10.499 7.438 12.803 1320 HG3 LYS 53 3HG LYS 53 11.476 7.113 11.373 1321 HD2 LYS 53 2HD LYS 53 10.399 9.267 11.078 1322 HD3 LYS 53 3HD LYS 53 9.666 8.124 9.952 1323 HE2 LYS 53 2HE LYS 53 7.922 9.480 10.958 1324 HE3 LYS 53 3HE LYS 53 7.765 7.829 11.557 1325 HZ1 LYS 53 1HZ LYS 53 8.921 8.525 13.588 1326 HZ2 LYS 53 2HZ LYS 53 7.507 9.415 13.346 1327 HZ3 LYS 53 3HZ LYS 53 9.007 10.111 13.007 1328 H VAL 54 H VAL 54 10.128 3.094 10.311 1329 HA VAL 54 HA VAL 54 7.593 1.903 10.883 1330 HB VAL 54 HB VAL 54 9.727 1.159 8.824 1331 HG11 VAL 54 1HG1 VAL 54 6.834 0.222 8.955 1332 HG12 VAL 54 2HG1 VAL 54 8.264 -0.775 9.229 1333 HG13 VAL 54 3HG1 VAL 54 7.964 -0.093 7.632 1334 HG21 VAL 54 1HG2 VAL 54 8.801 3.435 8.519 1335 HG22 VAL 54 2HG2 VAL 54 7.164 2.776 8.487 1336 HG23 VAL 54 3HG2 VAL 54 8.307 2.364 7.207 1337 H LEU 55 H LEU 55 10.971 0.774 11.173 1338 HA LEU 55 HA LEU 55 10.378 -1.882 12.043 1339 HB2 LEU 55 2HB LEU 55 12.904 -0.210 12.331 1340 HB3 LEU 55 3HB LEU 55 12.803 -1.899 12.799 1341 HG LEU 55 HG LEU 55 12.496 -0.820 9.968 1342 HD11 LEU 55 1HD1 LEU 55 14.628 -1.950 9.509 1343 HD12 LEU 55 2HD1 LEU 55 14.751 -2.435 11.202 1344 HD13 LEU 55 3HD1 LEU 55 14.809 -0.726 10.766 1345 HD21 LEU 55 1HD2 LEU 55 11.060 -2.784 10.274 1346 HD22 LEU 55 2HD2 LEU 55 12.418 -3.707 10.921 1347 HD23 LEU 55 3HD2 LEU 55 12.431 -3.178 9.236 1348 H ASP 56 H ASP 56 10.807 1.171 13.715 1349 HA ASP 56 HA ASP 56 11.045 0.146 16.375 1350 HB2 ASP 56 2HB ASP 56 11.826 2.436 15.693 1351 HB3 ASP 56 3HB ASP 56 10.153 2.935 15.480 1352 H TYR 57 H TYR 57 8.339 1.489 14.451 1353 HA TYR 57 HA TYR 57 6.279 1.163 16.342 1354 HB2 TYR 57 2HB TYR 57 5.877 2.478 14.319 1355 HB3 TYR 57 3HB TYR 57 6.135 1.069 13.291 1356 HD1 TYR 57 HD1 TYR 57 3.807 2.547 15.827 1357 HD2 TYR 57 HD2 TYR 57 4.302 -0.473 12.833 1358 HE1 TYR 57 HE1 TYR 57 1.419 1.991 15.971 1359 HE2 TYR 57 HE2 TYR 57 1.909 -1.013 12.978 1360 HH TYR 57 HH TYR 57 -0.333 0.944 14.648 1361 H CYS 58 H CYS 58 7.481 -1.043 13.814 1362 HA CYS 58 HA CYS 58 5.747 -3.199 14.254 1363 HB2 CYS 58 2HB CYS 58 8.595 -3.178 13.181 1364 HB3 CYS 58 3HB CYS 58 7.543 -4.594 13.143 1365 HG CYS 58 HG CYS 58 7.789 -2.177 10.980 1366 H ARG 59 H ARG 59 8.805 -2.314 15.839 1367 HA ARG 59 HA ARG 59 9.079 -4.611 17.477 1368 HB2 ARG 59 2HB ARG 59 11.002 -3.192 17.205 1369 HB3 ARG 59 3HB ARG 59 10.142 -1.775 17.801 1370 HG2 ARG 59 2HG ARG 59 10.114 -2.663 20.057 1371 HG3 ARG 59 3HG ARG 59 10.772 -4.205 19.514 1372 HD2 ARG 59 2HD ARG 59 12.305 -1.615 19.176 1373 HD3 ARG 59 3HD ARG 59 12.373 -2.552 20.669 1374 HE ARG 59 HE ARG 59 12.995 -4.432 18.880 1375 HH11 ARG 59 1HH1 ARG 59 14.257 -1.157 19.161 1376 HH12 ARG 59 2HH1 ARG 59 15.813 -1.578 18.518 1377 HH21 ARG 59 1HH2 ARG 59 15.052 -4.987 18.142 1378 HH22 ARG 59 2HH2 ARG 59 16.264 -3.757 17.935 1379 H HIS 60 H HIS 60 7.413 -1.513 18.000 1380 HA HIS 60 HA HIS 60 6.654 -1.894 20.706 1381 HB2 HIS 60 2HB HIS 60 5.466 -0.190 18.482 1382 HB3 HIS 60 3HB HIS 60 4.797 -0.189 20.109 1383 HD1 HIS 60 HD1 HIS 60 5.361 2.345 20.255 1384 HD2 HIS 60 HD2 HIS 60 8.687 -0.112 19.840 1385 HE1 HIS 60 HE1 HIS 60 7.341 3.774 20.843 1386 HE2 HIS 60 HE2 HIS 60 9.328 2.341 20.324 1387 H HIS 61 H HIS 61 4.964 -2.614 17.661 1388 HA HIS 61 HA HIS 61 2.646 -3.751 18.947 1389 HB2 HIS 61 2HB HIS 61 2.723 -2.575 16.629 1390 HB3 HIS 61 3HB HIS 61 3.355 -4.095 16.007 1391 HD1 HIS 61 HD1 HIS 61 1.687 -6.240 16.426 1392 HD2 HIS 61 HD2 HIS 61 -0.014 -2.462 16.782 1393 HE1 HIS 61 HE1 HIS 61 -0.796 -6.603 16.303 1394 HE2 HIS 61 HE2 HIS 61 -1.806 -4.318 16.573 1395 H HIS 62 H HIS 62 5.763 -4.942 18.109 1396 HA HIS 62 HA HIS 62 5.028 -7.749 18.045 1397 HB2 HIS 62 2HB HIS 62 7.095 -6.754 16.923 1398 HB3 HIS 62 3HB HIS 62 7.806 -6.576 18.523 1399 HD1 HIS 62 HD1 HIS 62 6.913 -9.115 15.942 1400 HD2 HIS 62 HD2 HIS 62 8.662 -9.015 19.715 1401 HE1 HIS 62 HE1 HIS 62 7.929 -11.381 16.279 1402 HE2 HIS 62 HE2 HIS 62 9.027 -11.280 18.531 1403 H GLN 63 H GLN 63 6.219 -5.410 20.416 1404 HA GLN 63 HA GLN 63 6.476 -7.239 22.616 1405 HB2 GLN 63 2HB GLN 63 6.248 -4.195 22.594 1406 HB3 GLN 63 3HB GLN 63 6.644 -5.157 24.016 1407 HG2 GLN 63 2HG GLN 63 8.305 -4.904 21.492 1408 HG3 GLN 63 3HG GLN 63 8.665 -4.190 23.061 1409 HE21 GLN 63 1HE2 GLN 63 10.144 -6.135 21.341 1410 HE22 GLN 63 2HE2 GLN 63 10.471 -7.483 22.361 1411 H HIS 64 H HIS 64 3.875 -5.426 21.197 1412 HA HIS 64 HA HIS 64 1.965 -6.583 23.138 1413 HB2 HIS 64 2HB HIS 64 1.799 -3.822 21.826 1414 HB3 HIS 64 3HB HIS 64 0.518 -4.554 22.790 1415 HD1 HIS 64 HD1 HIS 64 0.797 -4.494 25.351 1416 HD2 HIS 64 HD2 HIS 64 4.064 -2.910 23.325 1417 HE1 HIS 64 HE1 HIS 64 2.212 -3.405 27.103 1418 HE2 HIS 64 HE2 HIS 64 4.267 -2.635 25.889 1419 HA PRO 65 HA PRO 65 1.133 -7.946 18.746 1420 HB2 PRO 65 2HB PRO 65 1.635 -10.564 18.933 1421 HB3 PRO 65 3HB PRO 65 2.975 -9.403 19.025 1422 HG2 PRO 65 2HG PRO 65 1.629 -10.903 21.240 1423 HG3 PRO 65 3HG PRO 65 3.354 -10.540 21.010 1424 HD2 PRO 65 2HD PRO 65 1.571 -9.065 22.629 1425 HD3 PRO 65 3HD PRO 65 3.175 -8.527 22.087 1426 H GLY 66 H GLY 66 -0.786 -7.703 21.169 1427 HA2 GLY 66 2HA GLY 66 -2.672 -9.898 20.780 1428 HA3 GLY 66 3HA GLY 66 -2.793 -8.585 21.942 1429 H GLY 67 H GLY 67 -2.294 -8.321 18.442 1430 HA2 GLY 67 2HA GLY 67 -3.445 -7.317 16.755 1431 HA3 GLY 67 3HA GLY 67 -4.906 -7.817 17.592 1432 H SER 68 H SER 68 -6.020 -6.356 18.824 1433 HA SER 68 HA SER 68 -5.006 -3.608 19.202 1434 HB2 SER 68 2HB SER 68 -7.745 -4.337 18.054 1435 HB3 SER 68 3HB SER 68 -7.255 -2.712 18.533 1436 HG SER 68 HG SER 68 -6.804 -2.728 16.437 1437 H GLY 69 H GLY 69 -5.380 -2.895 21.215 1438 HA2 GLY 69 2HA GLY 69 -7.350 -4.297 22.959 1439 HA3 GLY 69 3HA GLY 69 -5.843 -3.579 23.530 1440 H LEU 70 H LEU 70 -8.398 -2.917 24.595 1441 HA LEU 70 HA LEU 70 -9.220 -0.346 23.501 1442 HB2 LEU 70 2HB LEU 70 -10.862 -2.020 24.328 1443 HB3 LEU 70 3HB LEU 70 -10.155 -1.937 25.933 1444 HG LEU 70 HG LEU 70 -10.920 0.407 26.146 1445 HD11 LEU 70 1HD1 LEU 70 -10.886 1.104 23.806 1446 HD12 LEU 70 2HD1 LEU 70 -12.465 1.414 24.520 1447 HD13 LEU 70 3HD1 LEU 70 -12.244 0.034 23.443 1448 HD21 LEU 70 1HD2 LEU 70 -13.166 -1.503 25.414 1449 HD22 LEU 70 2HD2 LEU 70 -13.320 -0.055 26.410 1450 HD23 LEU 70 3HD2 LEU 70 -12.352 -1.411 26.977 1451 H ASP 71 H ASP 71 -6.628 -0.118 24.126 1452 HA ASP 71 HA ASP 71 -6.459 1.930 26.156 1453 HB2 ASP 71 2HB ASP 71 -6.212 -0.266 27.442 1454 HB3 ASP 71 3HB ASP 71 -4.776 -0.609 26.493 1455 H ASP 72 H ASP 72 -6.128 1.421 23.242 1456 HA ASP 72 HA ASP 72 -3.283 1.562 22.645 1457 HB2 ASP 72 2HB ASP 72 -3.947 1.278 20.323 1458 HB3 ASP 72 3HB ASP 72 -4.840 0.119 21.300 1459 H ILE 73 H ILE 73 -3.696 3.261 20.253 1460 HA ILE 73 HA ILE 73 -2.955 5.303 19.706 1461 HB ILE 73 HB ILE 73 -4.964 6.352 21.766 1462 HG12 ILE 73 2HG1 ILE 73 -6.050 4.810 20.135 1463 HG13 ILE 73 3HG1 ILE 73 -6.607 6.464 19.927 1464 HG21 ILE 73 1HG2 ILE 73 -3.394 8.099 21.025 1465 HG22 ILE 73 2HG2 ILE 73 -5.008 8.413 20.391 1466 HG23 ILE 73 3HG2 ILE 73 -3.764 7.747 19.334 1467 HD11 ILE 73 1HD1 ILE 73 -6.290 5.388 17.787 1468 HD12 ILE 73 2HD1 ILE 73 -4.614 5.018 18.180 1469 HD13 ILE 73 3HD1 ILE 73 -5.121 6.695 17.972 1470 HA PRO 74 HA PRO 74 -0.001 5.524 23.365 1471 HB2 PRO 74 2HB PRO 74 1.951 4.888 21.158 1472 HB3 PRO 74 3HB PRO 74 1.832 4.196 22.792 1473 HG2 PRO 74 2HG PRO 74 1.102 2.763 20.678 1474 HG3 PRO 74 3HG PRO 74 0.149 2.688 22.182 1475 HD2 PRO 74 2HD PRO 74 -0.423 4.268 19.667 1476 HD3 PRO 74 3HD PRO 74 -1.521 3.257 20.636 1477 HA PRO 75 HA PRO 75 1.180 9.793 22.297 1478 HB2 PRO 75 2HB PRO 75 3.706 9.099 23.818 1479 HB3 PRO 75 3HB PRO 75 2.614 10.489 24.017 1480 HG2 PRO 75 2HG PRO 75 2.546 8.513 25.774 1481 HG3 PRO 75 3HG PRO 75 1.027 9.255 25.212 1482 HD2 PRO 75 2HD PRO 75 2.262 6.631 24.398 1483 HD3 PRO 75 3HD PRO 75 0.557 7.028 24.702 1484 H TYR 76 H TYR 76 3.420 7.081 21.909 1485 HA TYR 76 HA TYR 76 5.313 8.134 20.166 1486 HB2 TYR 76 2HB TYR 76 5.702 5.953 21.087 1487 HB3 TYR 76 3HB TYR 76 4.199 5.312 20.424 1488 HD1 TYR 76 HD1 TYR 76 7.489 6.778 19.319 1489 HD2 TYR 76 HD2 TYR 76 4.280 4.121 18.371 1490 HE1 TYR 76 HE1 TYR 76 8.679 6.038 17.306 1491 HE2 TYR 76 HE2 TYR 76 5.474 3.376 16.368 1492 HH TYR 76 HH TYR 76 8.689 3.926 15.846 1493 H ASP 77 H ASP 77 2.220 6.531 19.348 1494 HA ASP 77 HA ASP 77 2.498 6.578 16.541 1495 HB2 ASP 77 2HB ASP 77 0.032 6.371 18.316 1496 HB3 ASP 77 3HB ASP 77 -0.035 6.211 16.559 1497 H ARG 78 H ARG 78 1.183 8.915 18.809 1498 HA ARG 78 HA ARG 78 0.100 10.767 16.939 1499 HB2 ARG 78 2HB ARG 78 1.279 11.310 19.701 1500 HB3 ARG 78 3HB ARG 78 0.252 12.417 18.794 1501 HG2 ARG 78 2HG ARG 78 -0.557 9.713 19.884 1502 HG3 ARG 78 3HG ARG 78 -1.009 11.277 20.556 1503 HD2 ARG 78 2HD ARG 78 -1.876 10.118 17.880 1504 HD3 ARG 78 3HD ARG 78 -2.889 10.407 19.298 1505 HE ARG 78 HE ARG 78 -1.824 12.865 18.660 1506 HH11 ARG 78 1HH1 ARG 78 -3.871 10.565 16.951 1507 HH12 ARG 78 2HH1 ARG 78 -4.652 11.795 16.012 1508 HH21 ARG 78 1HH2 ARG 78 -2.842 14.443 17.378 1509 HH22 ARG 78 2HH2 ARG 78 -4.075 13.974 16.250 1510 H ASP 79 H ASP 79 3.292 10.508 18.502 1511 HA ASP 79 HA ASP 79 4.474 12.700 17.135 1512 HB2 ASP 79 2HB ASP 79 5.642 10.426 18.758 1513 HB3 ASP 79 3HB ASP 79 6.689 11.589 17.949 1514 H PHE 80 H PHE 80 4.000 9.387 16.277 1515 HA PHE 80 HA PHE 80 5.908 9.176 14.153 1516 HB2 PHE 80 2HB PHE 80 4.853 7.191 15.277 1517 HB3 PHE 80 3HB PHE 80 3.302 7.622 14.574 1518 HD1 PHE 80 HD1 PHE 80 6.616 6.153 13.922 1519 HD2 PHE 80 HD2 PHE 80 2.878 7.252 12.149 1520 HE1 PHE 80 HE1 PHE 80 7.146 4.803 11.937 1521 HE2 PHE 80 HE2 PHE 80 3.426 5.899 10.168 1522 HZ PHE 80 HZ PHE 80 5.562 4.678 10.064 1523 H CYS 81 H CYS 81 2.546 10.164 14.437 1524 HA CYS 81 HA CYS 81 2.029 10.668 11.672 1525 HB2 CYS 81 2HB CYS 81 0.618 11.677 14.179 1526 HB3 CYS 81 3HB CYS 81 -0.024 11.778 12.538 1527 HG CYS 81 HG CYS 81 0.843 8.703 13.563 1528 H LYS 82 H LYS 82 3.504 12.528 14.270 1529 HA LYS 82 HA LYS 82 3.368 15.108 12.988 1530 HB2 LYS 82 2HB LYS 82 5.234 14.104 15.177 1531 HB3 LYS 82 3HB LYS 82 5.066 15.789 14.689 1532 HG2 LYS 82 2HG LYS 82 2.785 15.856 15.519 1533 HG3 LYS 82 3HG LYS 82 2.823 14.124 15.861 1534 HD2 LYS 82 2HD LYS 82 4.774 14.610 17.451 1535 HD3 LYS 82 3HD LYS 82 4.391 16.321 17.255 1536 HE2 LYS 82 2HE LYS 82 2.192 15.988 18.238 1537 HE3 LYS 82 3HE LYS 82 2.429 14.237 18.271 1538 HZ1 LYS 82 1HZ LYS 82 4.255 14.549 19.836 1539 HZ2 LYS 82 2HZ LYS 82 2.823 15.218 20.442 1540 HZ3 LYS 82 3HZ LYS 82 4.017 16.225 19.805 1541 H VAL 83 H VAL 83 4.051 14.329 10.881 1542 HA VAL 83 HA VAL 83 6.917 14.753 10.438 1543 HB VAL 83 HB VAL 83 6.948 12.993 8.626 1544 HG11 VAL 83 1HG1 VAL 83 7.281 11.024 10.064 1545 HG12 VAL 83 2HG1 VAL 83 6.466 11.848 11.396 1546 HG13 VAL 83 3HG1 VAL 83 7.997 12.470 10.778 1547 HG21 VAL 83 1HG2 VAL 83 4.531 12.765 8.246 1548 HG22 VAL 83 2HG2 VAL 83 4.331 12.034 9.840 1549 HG23 VAL 83 3HG2 VAL 83 5.260 11.198 8.595 1550 H ASP 84 H ASP 84 7.304 15.524 8.244 1551 HA ASP 84 HA ASP 84 5.395 17.510 7.505 1552 HB2 ASP 84 2HB ASP 84 8.053 17.462 7.336 1553 HB3 ASP 84 3HB ASP 84 7.760 16.748 5.755 1554 H GLN 85 H GLN 85 4.619 17.756 5.152 1555 HA GLN 85 HA GLN 85 2.908 15.653 4.513 1556 HB2 GLN 85 2HB GLN 85 2.395 17.971 3.861 1557 HB3 GLN 85 3HB GLN 85 3.721 17.968 2.710 1558 HG2 GLN 85 2HG GLN 85 1.584 17.702 1.558 1559 HG3 GLN 85 3HG GLN 85 2.571 16.259 1.364 1560 HE21 GLN 85 1HE2 GLN 85 1.858 14.305 2.292 1561 HE22 GLN 85 2HE2 GLN 85 0.266 14.113 2.929 1562 HA PRO 86 HA PRO 86 5.957 14.289 0.896 1563 HB2 PRO 86 2HB PRO 86 8.652 14.794 1.438 1564 HB3 PRO 86 3HB PRO 86 7.649 15.760 0.340 1565 HG2 PRO 86 2HG PRO 86 8.306 16.277 3.223 1566 HG3 PRO 86 3HG PRO 86 8.305 17.407 1.849 1567 HD2 PRO 86 2HD PRO 86 6.256 17.380 3.553 1568 HD3 PRO 86 3HD PRO 86 5.960 17.551 1.803 1569 H THR 87 H THR 87 7.006 14.448 4.251 1570 HA THR 87 HA THR 87 8.357 11.950 4.352 1571 HB THR 87 HB THR 87 7.202 13.465 6.734 1572 HG1 THR 87 HG1 THR 87 9.567 14.024 5.228 1573 HG21 THR 87 1HG2 THR 87 9.754 11.831 6.437 1574 HG22 THR 87 2HG2 THR 87 8.286 11.296 7.256 1575 HG23 THR 87 3HG2 THR 87 9.210 12.651 7.904 1576 H LEU 88 H LEU 88 5.011 12.936 4.923 1577 HA LEU 88 HA LEU 88 3.889 10.595 6.005 1578 HB2 LEU 88 2HB LEU 88 2.741 12.688 4.118 1579 HB3 LEU 88 3HB LEU 88 1.760 11.388 4.774 1580 HG LEU 88 HG LEU 88 3.197 13.430 6.516 1581 HD11 LEU 88 1HD1 LEU 88 1.033 14.555 6.796 1582 HD12 LEU 88 2HD1 LEU 88 0.290 13.456 5.631 1583 HD13 LEU 88 3HD1 LEU 88 1.543 14.583 5.108 1584 HD21 LEU 88 1HD2 LEU 88 0.979 11.455 7.183 1585 HD22 LEU 88 2HD2 LEU 88 1.708 12.618 8.294 1586 HD23 LEU 88 3HD2 LEU 88 2.676 11.301 7.645 1587 H PHE 89 H PHE 89 4.383 11.555 2.614 1588 HA PHE 89 HA PHE 89 3.354 9.194 1.402 1589 HB2 PHE 89 2HB PHE 89 5.229 11.333 0.330 1590 HB3 PHE 89 3HB PHE 89 4.553 10.045 -0.661 1591 HD1 PHE 89 HD1 PHE 89 1.831 9.830 -0.344 1592 HD2 PHE 89 HD2 PHE 89 4.120 13.407 0.140 1593 HE1 PHE 89 HE1 PHE 89 -0.152 11.185 -0.881 1594 HE2 PHE 89 HE2 PHE 89 2.129 14.750 -0.400 1595 HZ PHE 89 HZ PHE 89 -0.004 13.643 -0.913 1596 H GLU 90 H GLU 90 6.543 10.060 2.599 1597 HA GLU 90 HA GLU 90 8.031 7.870 1.579 1598 HB2 GLU 90 2HB GLU 90 8.428 9.584 4.058 1599 HB3 GLU 90 3HB GLU 90 9.589 8.378 3.521 1600 HG2 GLU 90 2HG GLU 90 8.708 10.777 1.913 1601 HG3 GLU 90 3HG GLU 90 10.192 10.681 2.862 1602 H LEU 91 H LEU 91 6.077 8.258 4.518 1603 HA LEU 91 HA LEU 91 6.654 5.723 5.697 1604 HB2 LEU 91 2HB LEU 91 4.204 7.509 6.012 1605 HB3 LEU 91 3HB LEU 91 4.574 6.134 7.040 1606 HG LEU 91 HG LEU 91 6.249 8.671 6.829 1607 HD11 LEU 91 1HD1 LEU 91 5.454 9.178 9.101 1608 HD12 LEU 91 2HD1 LEU 91 4.411 7.754 9.064 1609 HD13 LEU 91 3HD1 LEU 91 4.117 9.094 7.953 1610 HD21 LEU 91 1HD2 LEU 91 7.656 6.722 7.332 1611 HD22 LEU 91 2HD2 LEU 91 6.603 6.287 8.680 1612 HD23 LEU 91 3HD2 LEU 91 7.535 7.786 8.734 1613 H ILE 92 H ILE 92 4.220 6.853 3.397 1614 HA ILE 92 HA ILE 92 2.705 4.453 3.156 1615 HB ILE 92 HB ILE 92 3.050 6.737 1.140 1616 HG12 ILE 92 2HG1 ILE 92 0.819 6.270 3.185 1617 HG13 ILE 92 3HG1 ILE 92 2.126 7.430 3.378 1618 HG21 ILE 92 1HG2 ILE 92 0.912 4.568 1.214 1619 HG22 ILE 92 2HG2 ILE 92 2.192 4.720 0.011 1620 HG23 ILE 92 3HG2 ILE 92 0.930 5.948 0.111 1621 HD11 ILE 92 1HD1 ILE 92 1.312 8.664 1.430 1622 HD12 ILE 92 2HD1 ILE 92 0.093 8.529 2.697 1623 HD13 ILE 92 3HD1 ILE 92 -0.014 7.511 1.260 1624 H LEU 93 H LEU 93 5.526 5.753 1.388 1625 HA LEU 93 HA LEU 93 5.825 3.710 -0.539 1626 HB2 LEU 93 2HB LEU 93 7.642 5.833 0.568 1627 HB3 LEU 93 3HB LEU 93 8.434 4.491 -0.232 1628 HG LEU 93 HG LEU 93 6.444 6.416 -1.501 1629 HD11 LEU 93 1HD1 LEU 93 8.674 7.368 -1.173 1630 HD12 LEU 93 2HD1 LEU 93 8.396 7.059 -2.884 1631 HD13 LEU 93 3HD1 LEU 93 9.423 5.969 -1.952 1632 HD21 LEU 93 1HD2 LEU 93 6.121 4.142 -2.416 1633 HD22 LEU 93 2HD2 LEU 93 7.846 4.020 -2.765 1634 HD23 LEU 93 3HD2 LEU 93 6.851 5.209 -3.614 1635 H ALA 94 H ALA 94 7.263 4.102 2.688 1636 HA ALA 94 HA ALA 94 9.002 1.863 2.566 1637 HB1 ALA 94 1HB ALA 94 9.383 3.743 4.092 1638 HB2 ALA 94 2HB ALA 94 9.305 2.226 4.986 1639 HB3 ALA 94 3HB ALA 94 7.927 3.334 5.000 1640 H ALA 95 H ALA 95 5.762 2.339 3.925 1641 HA ALA 95 HA ALA 95 5.479 -0.200 5.151 1642 HB1 ALA 95 1HB ALA 95 3.108 0.357 5.307 1643 HB2 ALA 95 2HB ALA 95 3.316 1.660 4.131 1644 HB3 ALA 95 3HB ALA 95 4.098 1.760 5.707 1645 H ASN 96 H ASN 96 4.591 1.013 1.920 1646 HA ASN 96 HA ASN 96 3.338 -1.423 1.038 1647 HB2 ASN 96 2HB ASN 96 2.761 0.824 0.119 1648 HB3 ASN 96 3HB ASN 96 4.368 0.947 -0.590 1649 HD21 ASN 96 1HD2 ASN 96 3.360 1.215 -2.633 1650 HD22 ASN 96 2HD2 ASN 96 2.696 -0.128 -3.487 1651 H TYR 97 H TYR 97 6.576 -0.082 0.877 1652 HA TYR 97 HA TYR 97 7.699 -1.890 -1.041 1653 HB2 TYR 97 2HB TYR 97 8.724 0.297 -0.694 1654 HB3 TYR 97 3HB TYR 97 8.973 -0.030 1.015 1655 HD1 TYR 97 HD1 TYR 97 11.105 -0.832 1.717 1656 HD2 TYR 97 HD2 TYR 97 9.981 -1.305 -2.381 1657 HE1 TYR 97 HE1 TYR 97 13.348 -1.693 1.198 1658 HE2 TYR 97 HE2 TYR 97 12.227 -2.157 -2.891 1659 HH TYR 97 HH TYR 97 14.404 -3.127 -0.509 1660 H LEU 98 H LEU 98 7.484 -1.801 2.471 1661 HA LEU 98 HA LEU 98 9.038 -4.260 2.821 1662 HB2 LEU 98 2HB LEU 98 7.727 -2.414 4.858 1663 HB3 LEU 98 3HB LEU 98 8.747 -3.789 5.247 1664 HG LEU 98 HG LEU 98 9.641 -1.249 3.831 1665 HD11 LEU 98 1HD1 LEU 98 10.950 -0.797 5.850 1666 HD12 LEU 98 2HD1 LEU 98 10.304 -2.249 6.619 1667 HD13 LEU 98 3HD1 LEU 98 9.231 -0.906 6.219 1668 HD21 LEU 98 1HD2 LEU 98 11.290 -3.687 4.571 1669 HD22 LEU 98 2HD2 LEU 98 11.939 -2.157 3.975 1670 HD23 LEU 98 3HD2 LEU 98 10.900 -3.132 2.941 1671 H ASP 99 H ASP 99 5.874 -3.428 2.165 1672 HA ASP 99 HA ASP 99 3.844 -4.378 2.240 1673 HB2 ASP 99 2HB ASP 99 5.274 -6.168 1.017 1674 HB3 ASP 99 3HB ASP 99 5.248 -7.069 2.522 1675 H ILE 100 H ILE 100 3.889 -3.274 4.412 1676 HA ILE 100 HA ILE 100 3.245 -5.176 6.593 1677 HB ILE 100 HB ILE 100 4.257 -2.306 6.985 1678 HG12 ILE 100 2HG1 ILE 100 5.788 -4.929 7.279 1679 HG13 ILE 100 3HG1 ILE 100 6.067 -3.712 6.045 1680 HG21 ILE 100 1HG2 ILE 100 2.803 -3.167 8.808 1681 HG22 ILE 100 2HG2 ILE 100 4.460 -2.958 9.368 1682 HG23 ILE 100 3HG2 ILE 100 3.857 -4.572 8.992 1683 HD11 ILE 100 1HD1 ILE 100 6.803 -2.148 7.783 1684 HD12 ILE 100 2HD1 ILE 100 7.763 -3.624 7.737 1685 HD13 ILE 100 3HD1 ILE 100 6.555 -3.402 9.000 1686 H LYS 101 H LYS 101 1.108 -5.302 5.985 1687 HA LYS 101 HA LYS 101 -0.565 -3.228 5.192 1688 HB2 LYS 101 2HB LYS 101 -0.848 -5.901 5.247 1689 HB3 LYS 101 3HB LYS 101 -1.753 -5.560 6.711 1690 HG2 LYS 101 2HG LYS 101 -2.372 -4.424 3.954 1691 HG3 LYS 101 3HG LYS 101 -3.177 -5.810 4.689 1692 HD2 LYS 101 2HD LYS 101 -4.027 -4.332 6.501 1693 HD3 LYS 101 3HD LYS 101 -3.240 -2.955 5.728 1694 HE2 LYS 101 2HE LYS 101 -4.667 -3.285 3.719 1695 HE3 LYS 101 3HE LYS 101 -5.473 -4.632 4.530 1696 HZ1 LYS 101 1HZ LYS 101 -6.774 -2.635 4.755 1697 HZ2 LYS 101 2HZ LYS 101 -5.470 -1.796 5.424 1698 HZ3 LYS 101 3HZ LYS 101 -6.174 -3.076 6.270 1699 HA PRO 102 HA PRO 102 -1.846 -2.814 10.082 1700 HB2 PRO 102 2HB PRO 102 1.030 -3.218 10.977 1701 HB3 PRO 102 3HB PRO 102 -0.480 -3.474 11.884 1702 HG2 PRO 102 2HG PRO 102 0.780 -5.558 10.881 1703 HG3 PRO 102 3HG PRO 102 -0.992 -5.456 10.745 1704 HD2 PRO 102 2HD PRO 102 1.097 -4.990 8.637 1705 HD3 PRO 102 3HD PRO 102 -0.513 -5.732 8.487 1706 H LEU 103 H LEU 103 1.558 -1.903 9.256 1707 HA LEU 103 HA LEU 103 1.353 0.704 10.387 1708 HB2 LEU 103 2HB LEU 103 3.479 -0.636 10.123 1709 HB3 LEU 103 3HB LEU 103 3.445 -0.303 8.404 1710 HG LEU 103 HG LEU 103 5.026 1.115 9.952 1711 HD11 LEU 103 1HD1 LEU 103 4.854 3.123 8.570 1712 HD12 LEU 103 2HD1 LEU 103 3.270 2.615 7.981 1713 HD13 LEU 103 3HD1 LEU 103 4.705 1.670 7.584 1714 HD21 LEU 103 1HD2 LEU 103 3.302 1.657 11.655 1715 HD22 LEU 103 2HD2 LEU 103 2.459 2.654 10.469 1716 HD23 LEU 103 3HD2 LEU 103 4.083 3.089 11.000 1717 H LEU 104 H LEU 104 1.048 -0.562 7.120 1718 HA LEU 104 HA LEU 104 0.950 1.846 5.664 1719 HB2 LEU 104 2HB LEU 104 1.298 -0.363 4.621 1720 HB3 LEU 104 3HB LEU 104 -0.331 -0.847 5.052 1721 HG LEU 104 HG LEU 104 -1.243 0.866 3.485 1722 HD11 LEU 104 1HD1 LEU 104 0.556 2.525 3.545 1723 HD12 LEU 104 2HD1 LEU 104 0.229 2.030 1.887 1724 HD13 LEU 104 3HD1 LEU 104 1.651 1.405 2.728 1725 HD21 LEU 104 1HD2 LEU 104 -0.643 -0.291 1.399 1726 HD22 LEU 104 2HD2 LEU 104 -0.894 -1.441 2.708 1727 HD23 LEU 104 3HD2 LEU 104 0.747 -1.039 2.195 1728 H ASP 105 H ASP 105 -1.531 -0.063 7.279 1729 HA ASP 105 HA ASP 105 -3.784 1.399 6.252 1730 HB2 ASP 105 2HB ASP 105 -3.761 -1.055 7.028 1731 HB3 ASP 105 3HB ASP 105 -3.767 -0.453 8.683 1732 H VAL 106 H VAL 106 -1.908 1.414 9.302 1733 HA VAL 106 HA VAL 106 -3.418 3.329 10.722 1734 HB VAL 106 HB VAL 106 -0.421 2.728 10.889 1735 HG11 VAL 106 1HG1 VAL 106 -0.422 3.880 13.092 1736 HG12 VAL 106 2HG1 VAL 106 -2.089 4.395 12.823 1737 HG13 VAL 106 3HG1 VAL 106 -0.801 4.991 11.776 1738 HG21 VAL 106 1HG2 VAL 106 -1.865 0.828 11.511 1739 HG22 VAL 106 2HG2 VAL 106 -2.712 1.834 12.687 1740 HG23 VAL 106 3HG2 VAL 106 -1.004 1.452 12.918 1741 H THR 107 H THR 107 -0.648 3.716 8.509 1742 HA THR 107 HA THR 107 -0.477 6.536 8.621 1743 HB THR 107 HB THR 107 0.438 4.663 6.386 1744 HG1 THR 107 HG1 THR 107 1.771 4.050 7.916 1745 HG21 THR 107 1HG2 THR 107 2.084 6.440 5.844 1746 HG22 THR 107 2HG2 THR 107 1.365 7.493 7.063 1747 HG23 THR 107 3HG2 THR 107 0.435 7.030 5.637 1748 H CYS 108 H CYS 108 -2.292 4.347 6.479 1749 HA CYS 108 HA CYS 108 -3.223 6.287 4.618 1750 HB2 CYS 108 2HB CYS 108 -4.297 3.525 5.312 1751 HB3 CYS 108 3HB CYS 108 -4.930 4.507 3.992 1752 HG CYS 108 HG CYS 108 -1.602 3.905 3.981 1753 H LYS 109 H LYS 109 -4.555 5.006 7.652 1754 HA LYS 109 HA LYS 109 -7.052 6.374 7.555 1755 HB2 LYS 109 2HB LYS 109 -5.547 4.819 9.613 1756 HB3 LYS 109 3HB LYS 109 -6.586 6.066 10.285 1757 HG2 LYS 109 2HG LYS 109 -7.790 3.988 10.253 1758 HG3 LYS 109 3HG LYS 109 -8.523 5.076 9.071 1759 HD2 LYS 109 2HD LYS 109 -7.323 3.881 7.256 1760 HD3 LYS 109 3HD LYS 109 -6.617 2.788 8.455 1761 HE2 LYS 109 2HE LYS 109 -8.903 2.029 9.079 1762 HE3 LYS 109 3HE LYS 109 -9.581 3.086 7.834 1763 HZ1 LYS 109 1HZ LYS 109 -8.255 1.825 6.193 1764 HZ2 LYS 109 2HZ LYS 109 -9.408 0.884 6.980 1765 HZ3 LYS 109 3HZ LYS 109 -7.781 0.763 7.419 1766 H THR 110 H THR 110 -3.948 7.124 9.139 1767 HA THR 110 HA THR 110 -4.679 9.455 10.470 1768 HB THR 110 HB THR 110 -1.942 8.634 9.410 1769 HG1 THR 110 HG1 THR 110 -2.115 7.269 11.008 1770 HG21 THR 110 1HG2 THR 110 -2.613 10.749 11.505 1771 HG22 THR 110 2HG2 THR 110 -1.937 11.062 9.905 1772 HG23 THR 110 3HG2 THR 110 -0.995 10.178 11.103 1773 H VAL 111 H VAL 111 -3.101 9.144 7.245 1774 HA VAL 111 HA VAL 111 -2.941 11.913 6.701 1775 HB VAL 111 HB VAL 111 -2.543 11.326 4.326 1776 HG11 VAL 111 1HG1 VAL 111 -0.658 11.217 5.895 1777 HG12 VAL 111 2HG1 VAL 111 -0.488 9.992 4.638 1778 HG13 VAL 111 3HG1 VAL 111 -1.027 9.527 6.254 1779 HG21 VAL 111 1HG2 VAL 111 -4.139 9.482 4.038 1780 HG22 VAL 111 2HG2 VAL 111 -3.198 8.462 5.126 1781 HG23 VAL 111 3HG2 VAL 111 -2.520 8.959 3.574 1782 H ALA 112 H ALA 112 -5.513 9.560 6.162 1783 HA ALA 112 HA ALA 112 -7.206 11.246 4.575 1784 HB1 ALA 112 1HB ALA 112 -8.925 9.518 4.948 1785 HB2 ALA 112 2HB ALA 112 -7.898 8.754 6.167 1786 HB3 ALA 112 3HB ALA 112 -7.381 8.798 4.482 1787 H ASN 113 H ASN 113 -6.835 10.641 8.022 1788 HA ASN 113 HA ASN 113 -9.266 11.914 8.870 1789 HB2 ASN 113 2HB ASN 113 -6.764 11.109 10.417 1790 HB3 ASN 113 3HB ASN 113 -8.180 11.824 11.182 1791 HD21 ASN 113 1HD2 ASN 113 -6.945 9.170 11.552 1792 HD22 ASN 113 2HD2 ASN 113 -8.204 8.030 11.255 1793 H MET 114 H MET 114 -5.895 12.962 8.500 1794 HA MET 114 HA MET 114 -6.174 15.439 9.902 1795 HB2 MET 114 2HB MET 114 -4.025 14.520 7.953 1796 HB3 MET 114 3HB MET 114 -3.932 15.995 8.904 1797 HG2 MET 114 2HG MET 114 -3.969 14.645 10.975 1798 HG3 MET 114 3HG MET 114 -4.015 13.176 10.000 1799 HE1 MET 114 1HE MET 114 -1.995 14.094 7.551 1800 HE2 MET 114 2HE MET 114 -1.985 12.488 8.279 1801 HE3 MET 114 3HE MET 114 -0.487 13.409 8.159 1802 H ILE 115 H ILE 115 -6.313 14.539 6.456 1803 HA ILE 115 HA ILE 115 -6.531 17.222 5.460 1804 HB ILE 115 HB ILE 115 -7.201 16.187 3.292 1805 HG12 ILE 115 2HG1 ILE 115 -7.133 13.571 4.872 1806 HG13 ILE 115 3HG1 ILE 115 -8.548 14.299 4.128 1807 HG21 ILE 115 1HG2 ILE 115 -4.810 16.445 3.838 1808 HG22 ILE 115 2HG2 ILE 115 -5.075 14.995 2.871 1809 HG23 ILE 115 3HG2 ILE 115 -4.799 14.853 4.608 1810 HD11 ILE 115 1HD1 ILE 115 -6.165 13.233 2.614 1811 HD12 ILE 115 2HD1 ILE 115 -7.678 13.834 1.927 1812 HD13 ILE 115 3HD1 ILE 115 -7.673 12.367 2.902 1813 H ARG 116 H ARG 116 -8.833 14.982 6.774 1814 HA ARG 116 HA ARG 116 -11.176 16.553 5.956 1815 HB2 ARG 116 2HB ARG 116 -10.893 14.014 7.618 1816 HB3 ARG 116 3HB ARG 116 -12.438 14.803 7.298 1817 HG2 ARG 116 2HG ARG 116 -12.128 14.444 4.872 1818 HG3 ARG 116 3HG ARG 116 -10.574 13.669 5.186 1819 HD2 ARG 116 2HD ARG 116 -13.260 12.654 6.180 1820 HD3 ARG 116 3HD ARG 116 -12.391 12.033 4.774 1821 HE ARG 116 HE ARG 116 -10.805 11.961 7.163 1822 HH11 ARG 116 1HH1 ARG 116 -13.267 10.173 5.391 1823 HH12 ARG 116 2HH1 ARG 116 -12.833 8.653 6.101 1824 HH21 ARG 116 1HH2 ARG 116 -10.262 9.953 8.078 1825 HH22 ARG 116 2HH2 ARG 116 -11.137 8.528 7.615 1826 H GLY 117 H GLY 117 -8.930 16.356 8.542 1827 HA2 GLY 117 2HA GLY 117 -8.700 17.970 10.234 1828 HA3 GLY 117 3HA GLY 117 -10.409 18.364 10.106 Start of MODEL 13 1 H1 SER 2 1H SER 2 -16.921 -15.746 -17.261 2 H2 SER 2 2H SER 2 -15.959 -14.990 -16.099 3 H3 SER 2 3H SER 2 -16.315 -14.194 -17.551 4 HA SER 2 HA SER 2 -18.603 -14.059 -16.997 5 HB2 SER 2 2HB SER 2 -17.795 -15.494 -14.433 6 HB3 SER 2 3HB SER 2 -19.404 -14.850 -14.779 7 HG SER 2 HG SER 2 -19.808 -16.567 -15.901 8 H LEU 3 H LEU 3 -19.317 -12.168 -16.055 9 HA LEU 3 HA LEU 3 -17.291 -10.395 -14.930 10 HB2 LEU 3 2HB LEU 3 -20.229 -9.855 -15.548 11 HB3 LEU 3 3HB LEU 3 -19.026 -8.646 -15.131 12 HG LEU 3 HG LEU 3 -19.016 -10.323 -17.672 13 HD11 LEU 3 1HD1 LEU 3 -19.574 -8.234 -18.839 14 HD12 LEU 3 2HD1 LEU 3 -19.704 -7.392 -17.291 15 HD13 LEU 3 3HD1 LEU 3 -20.831 -8.691 -17.690 16 HD21 LEU 3 1HD2 LEU 3 -16.744 -9.771 -16.984 17 HD22 LEU 3 2HD2 LEU 3 -17.170 -8.064 -16.842 18 HD23 LEU 3 3HD2 LEU 3 -17.195 -8.856 -18.419 19 H VAL 4 H VAL 4 -16.988 -10.297 -12.753 20 HA VAL 4 HA VAL 4 -19.154 -10.936 -10.878 21 HB VAL 4 HB VAL 4 -17.446 -10.403 -9.073 22 HG11 VAL 4 1HG1 VAL 4 -16.645 -12.571 -11.049 23 HG12 VAL 4 2HG1 VAL 4 -17.863 -12.720 -9.784 24 HG13 VAL 4 3HG1 VAL 4 -16.168 -12.496 -9.350 25 HG21 VAL 4 1HG2 VAL 4 -15.501 -10.235 -11.405 26 HG22 VAL 4 2HG2 VAL 4 -15.056 -10.248 -9.696 27 HG23 VAL 4 3HG2 VAL 4 -15.978 -8.897 -10.358 28 H LYS 5 H LYS 5 -20.257 -9.463 -9.740 29 HA LYS 5 HA LYS 5 -20.261 -6.711 -10.667 30 HB2 LYS 5 2HB LYS 5 -22.062 -8.279 -8.780 31 HB3 LYS 5 3HB LYS 5 -22.303 -6.577 -9.146 32 HG2 LYS 5 2HG LYS 5 -22.583 -7.177 -11.559 33 HG3 LYS 5 3HG LYS 5 -22.468 -8.883 -11.119 34 HD2 LYS 5 2HD LYS 5 -24.469 -8.695 -9.722 35 HD3 LYS 5 3HD LYS 5 -24.554 -6.958 -10.016 36 HE2 LYS 5 2HE LYS 5 -26.204 -8.143 -11.366 37 HE3 LYS 5 3HE LYS 5 -24.993 -7.397 -12.409 38 HZ1 LYS 5 1HZ LYS 5 -25.517 -9.639 -13.109 39 HZ2 LYS 5 2HZ LYS 5 -25.056 -10.248 -11.600 40 HZ3 LYS 5 3HZ LYS 5 -23.908 -9.529 -12.609 41 H LEU 6 H LEU 6 -19.069 -5.187 -9.679 42 HA LEU 6 HA LEU 6 -18.331 -5.465 -6.809 43 HB2 LEU 6 2HB LEU 6 -16.901 -4.310 -9.206 44 HB3 LEU 6 3HB LEU 6 -16.636 -3.536 -7.652 45 HG LEU 6 HG LEU 6 -15.767 -5.624 -6.695 46 HD11 LEU 6 1HD1 LEU 6 -16.215 -6.890 -9.410 47 HD12 LEU 6 2HD1 LEU 6 -17.039 -7.304 -7.906 48 HD13 LEU 6 3HD1 LEU 6 -15.313 -7.610 -8.074 49 HD21 LEU 6 1HD2 LEU 6 -14.206 -4.094 -7.751 50 HD22 LEU 6 2HD2 LEU 6 -14.441 -4.890 -9.311 51 HD23 LEU 6 3HD2 LEU 6 -13.683 -5.763 -7.976 52 H GLU 7 H GLU 7 -20.076 -4.547 -5.849 53 HA GLU 7 HA GLU 7 -21.156 -1.984 -6.684 54 HB2 GLU 7 2HB GLU 7 -22.633 -3.724 -5.722 55 HB3 GLU 7 3HB GLU 7 -21.727 -3.692 -4.210 56 HG2 GLU 7 2HG GLU 7 -22.444 -1.399 -3.778 57 HG3 GLU 7 3HG GLU 7 -23.249 -1.314 -5.344 58 H SER 8 H SER 8 -20.284 -0.097 -6.083 59 HA SER 8 HA SER 8 -18.121 0.084 -4.146 60 HB2 SER 8 2HB SER 8 -18.014 2.455 -4.947 61 HB3 SER 8 3HB SER 8 -17.986 1.306 -6.281 62 HG SER 8 HG SER 8 -19.874 1.977 -6.939 63 H SER 9 H SER 9 -18.181 2.044 -2.660 64 HA SER 9 HA SER 9 -20.297 2.017 -0.801 65 HB2 SER 9 2HB SER 9 -17.949 2.656 -0.236 66 HB3 SER 9 3HB SER 9 -18.139 4.135 -1.188 67 HG SER 9 HG SER 9 -18.945 3.603 1.359 68 H ASP 10 H ASP 10 -19.822 3.789 -3.734 69 HA ASP 10 HA ASP 10 -21.835 5.838 -3.231 70 HB2 ASP 10 2HB ASP 10 -19.718 6.244 -4.541 71 HB3 ASP 10 3HB ASP 10 -20.315 5.156 -5.785 72 H GLU 11 H GLU 11 -22.047 2.633 -3.840 73 HA GLU 11 HA GLU 11 -23.815 1.269 -4.146 74 HB2 GLU 11 2HB GLU 11 -25.452 3.774 -4.715 75 HB3 GLU 11 3HB GLU 11 -26.107 2.175 -4.388 76 HG2 GLU 11 2HG GLU 11 -25.314 2.221 -2.115 77 HG3 GLU 11 3HG GLU 11 -24.383 3.686 -2.400 78 H LYS 12 H LYS 12 -22.259 2.799 -6.526 79 HA LYS 12 HA LYS 12 -23.851 1.823 -8.785 80 HB2 LYS 12 2HB LYS 12 -21.226 3.354 -8.657 81 HB3 LYS 12 3HB LYS 12 -21.926 2.767 -10.163 82 HG2 LYS 12 2HG LYS 12 -23.967 4.134 -9.715 83 HG3 LYS 12 3HG LYS 12 -23.183 4.778 -8.269 84 HD2 LYS 12 2HD LYS 12 -21.371 5.722 -9.694 85 HD3 LYS 12 3HD LYS 12 -22.192 5.110 -11.130 86 HE2 LYS 12 2HE LYS 12 -24.101 6.576 -10.704 87 HE3 LYS 12 3HE LYS 12 -23.375 7.123 -9.190 88 HZ1 LYS 12 1HZ LYS 12 -21.518 8.038 -10.500 89 HZ2 LYS 12 2HZ LYS 12 -23.005 8.737 -10.892 90 HZ3 LYS 12 3HZ LYS 12 -22.318 7.595 -11.926 91 H VAL 13 H VAL 13 -23.506 -0.044 -9.750 92 HA VAL 13 HA VAL 13 -21.474 -1.889 -8.705 93 HB VAL 13 HB VAL 13 -23.968 -2.404 -10.397 94 HG11 VAL 13 1HG1 VAL 13 -22.142 -4.397 -9.015 95 HG12 VAL 13 2HG1 VAL 13 -22.299 -4.153 -10.756 96 HG13 VAL 13 3HG1 VAL 13 -23.660 -4.784 -9.830 97 HG21 VAL 13 1HG2 VAL 13 -24.538 -1.565 -8.146 98 HG22 VAL 13 2HG2 VAL 13 -23.562 -2.836 -7.411 99 HG23 VAL 13 3HG2 VAL 13 -25.008 -3.256 -8.332 100 H PHE 14 H PHE 14 -19.718 -2.339 -9.895 101 HA PHE 14 HA PHE 14 -19.627 -1.804 -12.808 102 HB2 PHE 14 2HB PHE 14 -17.385 -1.956 -10.731 103 HB3 PHE 14 3HB PHE 14 -17.135 -1.703 -12.458 104 HD1 PHE 14 HD1 PHE 14 -17.694 0.447 -13.510 105 HD2 PHE 14 HD2 PHE 14 -18.312 -0.150 -9.316 106 HE1 PHE 14 HE1 PHE 14 -18.011 2.865 -13.205 107 HE2 PHE 14 HE2 PHE 14 -18.624 2.270 -9.026 108 HZ PHE 14 HZ PHE 14 -18.480 3.779 -10.967 109 H GLU 15 H GLU 15 -20.110 -3.676 -13.811 110 HA GLU 15 HA GLU 15 -19.410 -6.284 -12.794 111 HB2 GLU 15 2HB GLU 15 -20.509 -5.535 -15.530 112 HB3 GLU 15 3HB GLU 15 -20.465 -7.149 -14.832 113 HG2 GLU 15 2HG GLU 15 -22.022 -6.356 -13.032 114 HG3 GLU 15 3HG GLU 15 -22.124 -4.806 -13.861 115 H ILE 16 H ILE 16 -17.142 -6.064 -12.634 116 HA ILE 16 HA ILE 16 -15.524 -5.776 -15.071 117 HB ILE 16 HB ILE 16 -14.824 -4.602 -12.966 118 HG12 ILE 16 2HG1 ILE 16 -12.404 -5.305 -12.960 119 HG13 ILE 16 3HG1 ILE 16 -12.836 -6.716 -13.919 120 HG21 ILE 16 1HG2 ILE 16 -13.896 -5.850 -11.056 121 HG22 ILE 16 2HG2 ILE 16 -14.355 -7.374 -11.820 122 HG23 ILE 16 3HG2 ILE 16 -15.602 -6.233 -11.310 123 HD11 ILE 16 1HD1 ILE 16 -11.853 -4.943 -15.267 124 HD12 ILE 16 2HD1 ILE 16 -13.145 -3.844 -14.787 125 HD13 ILE 16 3HD1 ILE 16 -13.515 -5.269 -15.762 126 H GLU 17 H GLU 17 -14.121 -7.446 -15.767 127 HA GLU 17 HA GLU 17 -15.033 -10.108 -15.666 128 HB2 GLU 17 2HB GLU 17 -12.261 -9.081 -16.432 129 HB3 GLU 17 3HB GLU 17 -12.931 -10.653 -16.859 130 HG2 GLU 17 2HG GLU 17 -14.681 -9.572 -18.211 131 HG3 GLU 17 3HG GLU 17 -14.076 -7.987 -17.739 132 H LYS 18 H LYS 18 -14.567 -11.790 -14.343 133 HA LYS 18 HA LYS 18 -13.848 -11.361 -11.699 134 HB2 LYS 18 2HB LYS 18 -15.185 -13.308 -12.422 135 HB3 LYS 18 3HB LYS 18 -13.773 -13.995 -13.222 136 HG2 LYS 18 2HG LYS 18 -12.646 -14.053 -10.928 137 HG3 LYS 18 3HG LYS 18 -14.215 -13.643 -10.236 138 HD2 LYS 18 2HD LYS 18 -15.189 -15.718 -11.110 139 HD3 LYS 18 3HD LYS 18 -13.686 -16.096 -11.958 140 HE2 LYS 18 2HE LYS 18 -12.527 -16.183 -9.721 141 HE3 LYS 18 3HE LYS 18 -14.108 -16.006 -8.954 142 HZ1 LYS 18 1HZ LYS 18 -14.819 -18.059 -9.997 143 HZ2 LYS 18 2HZ LYS 18 -13.411 -18.313 -9.100 144 HZ3 LYS 18 3HZ LYS 18 -13.329 -18.213 -10.783 145 H GLU 19 H GLU 19 -11.893 -12.536 -14.373 146 HA GLU 19 HA GLU 19 -9.554 -13.246 -12.992 147 HB2 GLU 19 2HB GLU 19 -8.453 -13.128 -15.224 148 HB3 GLU 19 3HB GLU 19 -9.973 -14.007 -15.245 149 HG2 GLU 19 2HG GLU 19 -11.070 -11.897 -16.144 150 HG3 GLU 19 3HG GLU 19 -9.448 -11.228 -16.331 151 H ILE 20 H ILE 20 -10.623 -10.084 -14.157 152 HA ILE 20 HA ILE 20 -8.122 -8.713 -13.600 153 HB ILE 20 HB ILE 20 -10.898 -7.576 -14.204 154 HG12 ILE 20 2HG1 ILE 20 -8.532 -8.096 -16.070 155 HG13 ILE 20 3HG1 ILE 20 -10.064 -8.957 -16.074 156 HG21 ILE 20 1HG2 ILE 20 -9.479 -5.912 -13.069 157 HG22 ILE 20 2HG2 ILE 20 -9.750 -5.461 -14.751 158 HG23 ILE 20 3HG2 ILE 20 -8.205 -6.162 -14.267 159 HD11 ILE 20 1HD1 ILE 20 -9.970 -7.410 -17.909 160 HD12 ILE 20 2HD1 ILE 20 -9.642 -6.064 -16.820 161 HD13 ILE 20 3HD1 ILE 20 -11.206 -6.887 -16.764 162 H ALA 21 H ALA 21 -11.181 -9.318 -11.938 163 HA ALA 21 HA ALA 21 -10.719 -7.570 -9.698 164 HB1 ALA 21 1HB ALA 21 -12.660 -8.680 -8.693 165 HB2 ALA 21 2HB ALA 21 -12.618 -9.921 -9.951 166 HB3 ALA 21 3HB ALA 21 -12.982 -8.248 -10.375 167 H CYS 22 H CYS 22 -9.675 -10.788 -10.511 168 HA CYS 22 HA CYS 22 -8.941 -11.673 -7.887 169 HB2 CYS 22 2HB CYS 22 -8.059 -12.609 -10.639 170 HB3 CYS 22 3HB CYS 22 -7.645 -13.432 -9.133 171 HG CYS 22 HG CYS 22 -10.930 -12.913 -9.506 172 H MET 23 H MET 23 -7.413 -9.621 -10.265 173 HA MET 23 HA MET 23 -4.721 -9.638 -9.385 174 HB2 MET 23 2HB MET 23 -6.334 -7.309 -10.518 175 HB3 MET 23 3HB MET 23 -4.580 -7.371 -10.410 176 HG2 MET 23 2HG MET 23 -4.490 -9.170 -12.019 177 HG3 MET 23 3HG MET 23 -6.250 -9.290 -12.037 178 HE1 MET 23 1HE MET 23 -3.158 -6.972 -12.924 179 HE2 MET 23 2HE MET 23 -4.166 -5.900 -11.948 180 HE3 MET 23 3HE MET 23 -3.971 -5.604 -13.676 181 H SER 24 H SER 24 -7.542 -7.837 -8.320 182 HA SER 24 HA SER 24 -6.301 -6.513 -6.093 183 HB2 SER 24 2HB SER 24 -8.390 -5.641 -7.103 184 HB3 SER 24 3HB SER 24 -9.238 -7.132 -6.677 185 HG SER 24 HG SER 24 -7.955 -5.512 -4.747 186 H VAL 25 H VAL 25 -5.531 -7.632 -4.388 187 HA VAL 25 HA VAL 25 -5.949 -10.398 -4.005 188 HB VAL 25 HB VAL 25 -4.678 -8.344 -2.136 189 HG11 VAL 25 1HG1 VAL 25 -3.584 -10.269 -1.000 190 HG12 VAL 25 2HG1 VAL 25 -4.553 -11.383 -1.966 191 HG13 VAL 25 3HG1 VAL 25 -5.339 -10.304 -0.812 192 HG21 VAL 25 1HG2 VAL 25 -3.406 -10.293 -4.103 193 HG22 VAL 25 2HG2 VAL 25 -2.531 -9.200 -3.027 194 HG23 VAL 25 3HG2 VAL 25 -3.541 -8.545 -4.317 195 H THR 26 H THR 26 -7.241 -7.561 -2.264 196 HA THR 26 HA THR 26 -8.544 -8.968 -0.184 197 HB THR 26 HB THR 26 -9.210 -6.205 -1.290 198 HG1 THR 26 HG1 THR 26 -7.737 -5.474 0.242 199 HG21 THR 26 1HG2 THR 26 -10.104 -5.732 0.976 200 HG22 THR 26 2HG2 THR 26 -9.816 -7.407 1.447 201 HG23 THR 26 3HG2 THR 26 -11.007 -7.035 0.199 202 H ILE 27 H ILE 27 -9.856 -7.646 -3.273 203 HA ILE 27 HA ILE 27 -12.564 -8.415 -2.901 204 HB ILE 27 HB ILE 27 -11.013 -7.932 -5.486 205 HG12 ILE 27 2HG1 ILE 27 -12.891 -6.071 -3.959 206 HG13 ILE 27 3HG1 ILE 27 -11.134 -5.991 -3.895 207 HG21 ILE 27 1HG2 ILE 27 -13.202 -7.622 -6.611 208 HG22 ILE 27 2HG2 ILE 27 -14.032 -8.099 -5.130 209 HG23 ILE 27 3HG2 ILE 27 -13.025 -9.266 -5.989 210 HD11 ILE 27 1HD1 ILE 27 -11.068 -5.462 -6.274 211 HD12 ILE 27 2HD1 ILE 27 -12.033 -4.302 -5.363 212 HD13 ILE 27 3HD1 ILE 27 -12.828 -5.534 -6.340 213 H LYS 28 H LYS 28 -9.830 -10.007 -4.491 214 HA LYS 28 HA LYS 28 -10.988 -12.362 -5.434 215 HB2 LYS 28 2HB LYS 28 -8.674 -11.617 -5.942 216 HB3 LYS 28 3HB LYS 28 -8.208 -11.915 -4.274 217 HG2 LYS 28 2HG LYS 28 -8.741 -14.364 -4.650 218 HG3 LYS 28 3HG LYS 28 -8.988 -13.976 -6.355 219 HD2 LYS 28 2HD LYS 28 -6.723 -14.873 -5.966 220 HD3 LYS 28 3HD LYS 28 -6.655 -13.204 -6.544 221 HE2 LYS 28 2HE LYS 28 -5.036 -13.582 -4.736 222 HE3 LYS 28 3HE LYS 28 -6.262 -12.419 -4.233 223 HZ1 LYS 28 1HZ LYS 28 -5.856 -13.952 -2.468 224 HZ2 LYS 28 2HZ LYS 28 -6.091 -15.282 -3.478 225 HZ3 LYS 28 3HZ LYS 28 -7.393 -14.289 -3.081 226 H ASN 29 H ASN 29 -9.563 -11.621 -2.241 227 HA ASN 29 HA ASN 29 -9.946 -14.181 -1.058 228 HB2 ASN 29 2HB ASN 29 -9.567 -11.455 0.275 229 HB3 ASN 29 3HB ASN 29 -9.554 -12.990 1.139 230 HD21 ASN 29 1HD2 ASN 29 -7.435 -11.086 1.069 231 HD22 ASN 29 2HD2 ASN 29 -6.066 -11.860 0.353 232 H MET 30 H MET 30 -12.001 -11.313 -1.285 233 HA MET 30 HA MET 30 -13.985 -12.030 0.604 234 HB2 MET 30 2HB MET 30 -14.153 -10.257 -1.878 235 HB3 MET 30 3HB MET 30 -15.484 -10.447 -0.742 236 HG2 MET 30 2HG MET 30 -14.073 -9.522 1.059 237 HG3 MET 30 3HG MET 30 -12.758 -9.311 -0.096 238 HE1 MET 30 1HE MET 30 -12.743 -6.716 0.867 239 HE2 MET 30 2HE MET 30 -14.185 -7.018 1.838 240 HE3 MET 30 3HE MET 30 -14.139 -5.649 0.728 241 H ILE 31 H ILE 31 -13.693 -12.663 -2.877 242 HA ILE 31 HA ILE 31 -16.152 -14.057 -3.220 243 HB ILE 31 HB ILE 31 -13.609 -14.167 -4.913 244 HG12 ILE 31 2HG1 ILE 31 -16.132 -12.476 -5.291 245 HG13 ILE 31 3HG1 ILE 31 -14.597 -11.870 -4.682 246 HG21 ILE 31 1HG2 ILE 31 -15.042 -16.121 -5.380 247 HG22 ILE 31 2HG2 ILE 31 -15.043 -15.013 -6.752 248 HG23 ILE 31 3HG2 ILE 31 -16.425 -15.056 -5.656 249 HD11 ILE 31 1HD1 ILE 31 -15.106 -12.954 -7.450 250 HD12 ILE 31 2HD1 ILE 31 -13.551 -12.384 -6.837 251 HD13 ILE 31 3HD1 ILE 31 -14.902 -11.261 -6.991 252 H GLU 32 H GLU 32 -12.811 -15.108 -2.568 253 HA GLU 32 HA GLU 32 -13.282 -17.926 -2.672 254 HB2 GLU 32 2HB GLU 32 -11.027 -16.369 -1.342 255 HB3 GLU 32 3HB GLU 32 -11.037 -18.112 -1.584 256 HG2 GLU 32 2HG GLU 32 -11.031 -17.818 -4.017 257 HG3 GLU 32 3HG GLU 32 -11.110 -16.065 -3.820 258 H ASP 33 H ASP 33 -13.603 -15.534 -0.143 259 HA ASP 33 HA ASP 33 -13.634 -17.299 2.117 260 HB2 ASP 33 2HB ASP 33 -13.120 -14.895 2.346 261 HB3 ASP 33 3HB ASP 33 -14.739 -14.464 1.801 262 H ILE 34 H ILE 34 -16.117 -15.844 0.075 263 HA ILE 34 HA ILE 34 -18.351 -17.272 1.262 264 HB ILE 34 HB ILE 34 -18.182 -15.741 -1.384 265 HG12 ILE 34 2HG1 ILE 34 -19.125 -14.727 1.343 266 HG13 ILE 34 3HG1 ILE 34 -17.581 -14.327 0.600 267 HG21 ILE 34 1HG2 ILE 34 -20.653 -15.552 -1.226 268 HG22 ILE 34 2HG2 ILE 34 -20.636 -16.541 0.234 269 HG23 ILE 34 3HG2 ILE 34 -20.139 -17.239 -1.307 270 HD11 ILE 34 1HD1 ILE 34 -19.129 -12.510 0.356 271 HD12 ILE 34 2HD1 ILE 34 -20.308 -13.555 -0.433 272 HD13 ILE 34 3HD1 ILE 34 -18.771 -13.194 -1.229 273 H GLY 35 H GLY 35 -15.823 -18.032 -0.855 274 HA2 GLY 35 2HA GLY 35 -15.302 -20.179 -1.629 275 HA3 GLY 35 3HA GLY 35 -17.008 -20.617 -1.602 276 H GLU 36 H GLU 36 -18.403 -19.406 -3.125 277 HA GLU 36 HA GLU 36 -17.102 -18.503 -5.608 278 HB2 GLU 36 2HB GLU 36 -19.377 -20.553 -5.533 279 HB3 GLU 36 3HB GLU 36 -18.651 -19.868 -6.983 280 HG2 GLU 36 2HG GLU 36 -16.503 -20.975 -6.440 281 HG3 GLU 36 3HG GLU 36 -17.223 -21.649 -4.982 282 H SER 37 H SER 37 -17.802 -16.414 -5.652 283 HA SER 37 HA SER 37 -20.677 -15.863 -5.548 284 HB2 SER 37 2HB SER 37 -20.267 -13.834 -4.098 285 HB3 SER 37 3HB SER 37 -19.994 -15.368 -3.275 286 HG SER 37 HG SER 37 -18.021 -13.639 -4.357 287 H ASP 38 H ASP 38 -20.912 -15.277 -7.621 288 HA ASP 38 HA ASP 38 -19.299 -13.158 -8.842 289 HB2 ASP 38 2HB ASP 38 -20.710 -13.511 -10.821 290 HB3 ASP 38 3HB ASP 38 -20.116 -15.059 -10.235 291 H SER 39 H SER 39 -22.064 -13.515 -6.873 292 HA SER 39 HA SER 39 -23.751 -11.393 -7.525 293 HB2 SER 39 2HB SER 39 -23.158 -12.655 -4.805 294 HB3 SER 39 3HB SER 39 -24.530 -11.593 -5.134 295 HG SER 39 HG SER 39 -24.239 -13.726 -6.875 296 HA PRO 40 HA PRO 40 -21.736 -7.555 -6.766 297 HB2 PRO 40 2HB PRO 40 -23.982 -6.698 -4.939 298 HB3 PRO 40 3HB PRO 40 -23.327 -5.897 -6.385 299 HG2 PRO 40 2HG PRO 40 -25.654 -7.180 -6.494 300 HG3 PRO 40 3HG PRO 40 -24.508 -7.261 -7.853 301 HD2 PRO 40 2HD PRO 40 -25.112 -9.337 -5.765 302 HD3 PRO 40 3HD PRO 40 -24.751 -9.541 -7.491 303 H ILE 41 H ILE 41 -19.907 -7.945 -5.607 304 HA ILE 41 HA ILE 41 -19.743 -8.240 -2.770 305 HB ILE 41 HB ILE 41 -17.578 -7.347 -4.753 306 HG12 ILE 41 2HG1 ILE 41 -16.733 -9.840 -4.190 307 HG13 ILE 41 3HG1 ILE 41 -18.429 -10.114 -3.831 308 HG21 ILE 41 1HG2 ILE 41 -15.933 -7.927 -3.003 309 HG22 ILE 41 2HG2 ILE 41 -17.247 -8.279 -1.882 310 HG23 ILE 41 3HG2 ILE 41 -17.015 -6.635 -2.477 311 HD11 ILE 41 1HD1 ILE 41 -17.307 -9.190 -6.477 312 HD12 ILE 41 2HD1 ILE 41 -19.013 -9.474 -6.129 313 HD13 ILE 41 3HD1 ILE 41 -17.870 -10.817 -6.087 314 HA PRO 42 HA PRO 42 -20.525 -3.725 -2.307 315 HB2 PRO 42 2HB PRO 42 -21.271 -3.709 0.311 316 HB3 PRO 42 3HB PRO 42 -22.351 -4.317 -0.957 317 HG2 PRO 42 2HG PRO 42 -20.661 -5.861 0.969 318 HG3 PRO 42 3HG PRO 42 -22.312 -6.196 0.398 319 HD2 PRO 42 2HD PRO 42 -20.034 -7.433 -0.608 320 HD3 PRO 42 3HD PRO 42 -21.567 -7.288 -1.489 321 H LEU 43 H LEU 43 -18.926 -2.298 -2.033 322 HA LEU 43 HA LEU 43 -16.679 -2.838 -0.178 323 HB2 LEU 43 2HB LEU 43 -16.642 -1.372 -2.858 324 HB3 LEU 43 3HB LEU 43 -15.258 -1.559 -1.796 325 HG LEU 43 HG LEU 43 -16.698 -3.848 -3.199 326 HD11 LEU 43 1HD1 LEU 43 -14.020 -2.591 -3.874 327 HD12 LEU 43 2HD1 LEU 43 -15.506 -2.465 -4.818 328 HD13 LEU 43 3HD1 LEU 43 -14.712 -4.028 -4.637 329 HD21 LEU 43 1HD2 LEU 43 -15.734 -4.612 -1.104 330 HD22 LEU 43 2HD2 LEU 43 -14.175 -3.892 -1.511 331 HD23 LEU 43 3HD2 LEU 43 -14.797 -5.249 -2.455 332 HA PRO 44 HA PRO 44 -18.751 1.039 1.246 333 HB2 PRO 44 2HB PRO 44 -18.718 0.348 3.971 334 HB3 PRO 44 3HB PRO 44 -20.009 -0.068 2.833 335 HG2 PRO 44 2HG PRO 44 -18.179 -1.864 4.125 336 HG3 PRO 44 3HG PRO 44 -19.481 -2.265 2.990 337 HD2 PRO 44 2HD PRO 44 -16.566 -1.979 2.478 338 HD3 PRO 44 3HD PRO 44 -17.794 -2.885 1.567 339 H ASN 45 H ASN 45 -16.430 1.569 0.402 340 HA ASN 45 HA ASN 45 -15.070 3.199 2.344 341 HB2 ASN 45 2HB ASN 45 -14.031 0.950 2.795 342 HB3 ASN 45 3HB ASN 45 -13.542 0.851 1.110 343 HD21 ASN 45 1HD2 ASN 45 -12.889 2.273 4.203 344 HD22 ASN 45 2HD2 ASN 45 -11.382 3.006 3.790 345 H VAL 46 H VAL 46 -14.522 1.516 -0.762 346 HA VAL 46 HA VAL 46 -13.428 3.906 -2.017 347 HB VAL 46 HB VAL 46 -12.338 1.743 -2.457 348 HG11 VAL 46 1HG1 VAL 46 -14.903 0.839 -3.801 349 HG12 VAL 46 2HG1 VAL 46 -14.258 0.227 -2.278 350 HG13 VAL 46 3HG1 VAL 46 -13.374 -0.044 -3.780 351 HG21 VAL 46 1HG2 VAL 46 -13.637 2.877 -4.958 352 HG22 VAL 46 2HG2 VAL 46 -12.203 1.849 -4.926 353 HG23 VAL 46 3HG2 VAL 46 -12.155 3.452 -4.191 354 H THR 47 H THR 47 -14.577 5.287 -3.283 355 HA THR 47 HA THR 47 -17.433 4.933 -3.691 356 HB THR 47 HB THR 47 -17.327 7.214 -4.704 357 HG1 THR 47 HG1 THR 47 -14.658 7.556 -3.980 358 HG21 THR 47 1HG2 THR 47 -16.658 8.451 -2.678 359 HG22 THR 47 2HG2 THR 47 -15.825 7.026 -2.053 360 HG23 THR 47 3HG2 THR 47 -17.581 7.014 -2.239 361 H SER 48 H SER 48 -18.180 5.807 -6.006 362 HA SER 48 HA SER 48 -17.747 3.600 -7.726 363 HB2 SER 48 2HB SER 48 -19.287 4.833 -9.279 364 HB3 SER 48 3HB SER 48 -19.912 4.711 -7.632 365 HG SER 48 HG SER 48 -20.178 6.814 -8.269 366 H THR 49 H THR 49 -16.825 7.027 -7.987 367 HA THR 49 HA THR 49 -15.736 6.953 -10.593 368 HB THR 49 HB THR 49 -14.654 9.126 -9.934 369 HG1 THR 49 HG1 THR 49 -15.571 9.676 -7.613 370 HG21 THR 49 1HG2 THR 49 -17.018 9.176 -10.668 371 HG22 THR 49 2HG2 THR 49 -16.730 10.378 -9.411 372 HG23 THR 49 3HG2 THR 49 -17.549 8.866 -9.013 373 H ILE 50 H ILE 50 -14.319 6.464 -7.398 374 HA ILE 50 HA ILE 50 -11.583 6.358 -8.255 375 HB ILE 50 HB ILE 50 -12.876 5.440 -5.642 376 HG12 ILE 50 2HG1 ILE 50 -13.185 7.844 -6.025 377 HG13 ILE 50 3HG1 ILE 50 -12.021 7.604 -4.728 378 HG21 ILE 50 1HG2 ILE 50 -9.926 5.869 -6.236 379 HG22 ILE 50 2HG2 ILE 50 -10.710 4.318 -5.934 380 HG23 ILE 50 3HG2 ILE 50 -10.613 5.521 -4.648 381 HD11 ILE 50 1HD1 ILE 50 -11.400 8.383 -7.584 382 HD12 ILE 50 2HD1 ILE 50 -10.189 8.074 -6.335 383 HD13 ILE 50 3HD1 ILE 50 -11.322 9.411 -6.155 384 H LEU 51 H LEU 51 -14.030 3.906 -7.342 385 HA LEU 51 HA LEU 51 -12.460 1.597 -7.744 386 HB2 LEU 51 2HB LEU 51 -14.613 1.627 -6.482 387 HB3 LEU 51 3HB LEU 51 -15.487 1.886 -7.984 388 HG LEU 51 HG LEU 51 -14.719 -0.369 -8.790 389 HD11 LEU 51 1HD1 LEU 51 -13.541 -0.703 -6.015 390 HD12 LEU 51 2HD1 LEU 51 -12.638 -0.582 -7.526 391 HD13 LEU 51 3HD1 LEU 51 -13.687 -1.966 -7.241 392 HD21 LEU 51 1HD2 LEU 51 -16.189 -1.723 -7.360 393 HD22 LEU 51 2HD2 LEU 51 -16.918 -0.159 -7.715 394 HD23 LEU 51 3HD2 LEU 51 -16.192 -0.452 -6.132 395 H GLU 52 H GLU 52 -14.401 3.522 -9.954 396 HA GLU 52 HA GLU 52 -14.415 1.887 -12.248 397 HB2 GLU 52 2HB GLU 52 -15.868 3.817 -12.032 398 HB3 GLU 52 3HB GLU 52 -14.509 4.914 -11.880 399 HG2 GLU 52 2HG GLU 52 -14.705 3.344 -14.425 400 HG3 GLU 52 3HG GLU 52 -15.909 4.600 -14.174 401 H LYS 53 H LYS 53 -12.224 4.523 -11.290 402 HA LYS 53 HA LYS 53 -10.361 4.326 -13.394 403 HB2 LYS 53 2HB LYS 53 -10.389 5.597 -10.661 404 HB3 LYS 53 3HB LYS 53 -8.832 5.450 -11.459 405 HG2 LYS 53 2HG LYS 53 -9.738 6.720 -13.408 406 HG3 LYS 53 3HG LYS 53 -11.261 6.926 -12.542 407 HD2 LYS 53 2HD LYS 53 -8.576 7.893 -11.477 408 HD3 LYS 53 3HD LYS 53 -9.680 8.911 -12.401 409 HE2 LYS 53 2HE LYS 53 -10.334 7.582 -9.746 410 HE3 LYS 53 3HE LYS 53 -9.901 9.276 -9.962 411 HZ1 LYS 53 1HZ LYS 53 -12.294 7.934 -11.091 412 HZ2 LYS 53 2HZ LYS 53 -11.848 9.536 -11.398 413 HZ3 LYS 53 3HZ LYS 53 -12.271 9.063 -9.832 414 H VAL 54 H VAL 54 -10.439 2.770 -10.211 415 HA VAL 54 HA VAL 54 -7.847 1.646 -10.216 416 HB VAL 54 HB VAL 54 -10.384 0.973 -8.660 417 HG11 VAL 54 1HG1 VAL 54 -9.042 -0.473 -7.171 418 HG12 VAL 54 2HG1 VAL 54 -7.656 -0.301 -8.250 419 HG13 VAL 54 3HG1 VAL 54 -9.113 -1.122 -8.812 420 HG21 VAL 54 1HG2 VAL 54 -7.767 2.266 -7.787 421 HG22 VAL 54 2HG2 VAL 54 -9.176 1.993 -6.758 422 HG23 VAL 54 3HG2 VAL 54 -9.277 3.118 -8.112 423 H LEU 55 H LEU 55 -11.015 0.322 -11.196 424 HA LEU 55 HA LEU 55 -10.037 -2.278 -11.906 425 HB2 LEU 55 2HB LEU 55 -12.630 -0.852 -12.616 426 HB3 LEU 55 3HB LEU 55 -12.297 -2.529 -13.027 427 HG LEU 55 HG LEU 55 -12.481 -1.421 -10.198 428 HD11 LEU 55 1HD1 LEU 55 -14.572 -2.694 -10.020 429 HD12 LEU 55 2HD1 LEU 55 -14.443 -3.169 -11.715 430 HD13 LEU 55 3HD1 LEU 55 -14.667 -1.471 -11.287 431 HD21 LEU 55 1HD2 LEU 55 -12.082 -4.290 -11.119 432 HD22 LEU 55 2HD2 LEU 55 -12.342 -3.763 -9.455 433 HD23 LEU 55 3HD2 LEU 55 -10.884 -3.274 -10.309 434 H ASP 56 H ASP 56 -10.530 0.743 -13.651 435 HA ASP 56 HA ASP 56 -10.300 -0.328 -16.294 436 HB2 ASP 56 2HB ASP 56 -11.469 1.827 -15.748 437 HB3 ASP 56 3HB ASP 56 -9.915 2.561 -15.392 438 H TYR 57 H TYR 57 -8.034 1.107 -13.994 439 HA TYR 57 HA TYR 57 -5.732 1.157 -15.653 440 HB2 TYR 57 2HB TYR 57 -5.815 2.450 -13.568 441 HB3 TYR 57 3HB TYR 57 -6.014 0.983 -12.615 442 HD1 TYR 57 HD1 TYR 57 -4.096 -0.460 -12.121 443 HD2 TYR 57 HD2 TYR 57 -3.590 3.033 -14.534 444 HE1 TYR 57 HE1 TYR 57 -1.677 -0.682 -11.938 445 HE2 TYR 57 HE2 TYR 57 -1.149 2.800 -14.335 446 HH TYR 57 HH TYR 57 0.515 1.719 -12.959 447 H CYS 58 H CYS 58 -7.041 -1.251 -13.375 448 HA CYS 58 HA CYS 58 -5.061 -3.235 -13.640 449 HB2 CYS 58 2HB CYS 58 -7.981 -3.456 -12.835 450 HB3 CYS 58 3HB CYS 58 -6.827 -4.786 -12.706 451 HG CYS 58 HG CYS 58 -7.429 -2.368 -10.594 452 H ARG 59 H ARG 59 -7.919 -2.513 -15.603 453 HA ARG 59 HA ARG 59 -8.020 -4.748 -17.282 454 HB2 ARG 59 2HB ARG 59 -8.590 -1.821 -17.904 455 HB3 ARG 59 3HB ARG 59 -8.878 -3.110 -19.065 456 HG2 ARG 59 2HG ARG 59 -10.538 -4.121 -17.593 457 HG3 ARG 59 3HG ARG 59 -10.217 -2.903 -16.354 458 HD2 ARG 59 2HD ARG 59 -11.062 -1.137 -17.786 459 HD3 ARG 59 3HD ARG 59 -11.229 -2.247 -19.148 460 HE ARG 59 HE ARG 59 -12.958 -2.050 -16.792 461 HH11 ARG 59 1HH1 ARG 59 -12.215 -3.731 -19.795 462 HH12 ARG 59 2HH1 ARG 59 -13.774 -4.487 -19.896 463 HH21 ARG 59 1HH2 ARG 59 -14.974 -3.073 -16.920 464 HH22 ARG 59 2HH2 ARG 59 -15.340 -4.114 -18.263 465 H HIS 60 H HIS 60 -6.163 -1.705 -17.737 466 HA HIS 60 HA HIS 60 -4.908 -2.386 -20.158 467 HB2 HIS 60 2HB HIS 60 -4.917 -0.054 -19.368 468 HB3 HIS 60 3HB HIS 60 -3.917 -0.482 -17.975 469 HD1 HIS 60 HD1 HIS 60 -1.455 -0.238 -18.295 470 HD2 HIS 60 HD2 HIS 60 -3.442 -0.478 -21.927 471 HE1 HIS 60 HE1 HIS 60 0.331 -0.081 -20.048 472 HE2 HIS 60 HE2 HIS 60 -0.935 0.031 -22.210 473 H HIS 61 H HIS 61 -3.850 -2.872 -16.806 474 HA HIS 61 HA HIS 61 -1.229 -3.812 -17.297 475 HB2 HIS 61 2HB HIS 61 -2.132 -3.020 -15.076 476 HB3 HIS 61 3HB HIS 61 -3.054 -4.511 -14.952 477 HD1 HIS 61 HD1 HIS 61 -1.682 -6.712 -14.504 478 HD2 HIS 61 HD2 HIS 61 0.563 -3.217 -14.441 479 HE1 HIS 61 HE1 HIS 61 0.513 -7.341 -13.468 480 HE2 HIS 61 HE2 HIS 61 1.932 -5.285 -13.696 481 H HIS 62 H HIS 62 -4.354 -5.421 -17.301 482 HA HIS 62 HA HIS 62 -3.294 -8.117 -17.386 483 HB2 HIS 62 2HB HIS 62 -5.387 -7.762 -16.218 484 HB3 HIS 62 3HB HIS 62 -6.115 -7.010 -17.633 485 HD1 HIS 62 HD1 HIS 62 -4.357 -10.374 -17.170 486 HD2 HIS 62 HD2 HIS 62 -7.912 -8.787 -18.604 487 HE1 HIS 62 HE1 HIS 62 -5.619 -12.314 -18.135 488 HE2 HIS 62 HE2 HIS 62 -7.788 -11.340 -18.938 489 H GLN 63 H GLN 63 -4.845 -5.896 -19.683 490 HA GLN 63 HA GLN 63 -5.045 -7.751 -21.863 491 HB2 GLN 63 2HB GLN 63 -5.269 -4.704 -21.778 492 HB3 GLN 63 3HB GLN 63 -5.662 -5.693 -23.184 493 HG2 GLN 63 2HG GLN 63 -7.480 -6.778 -21.958 494 HG3 GLN 63 3HG GLN 63 -7.063 -5.881 -20.500 495 HE21 GLN 63 1HE2 GLN 63 -8.479 -5.654 -23.693 496 HE22 GLN 63 2HE2 GLN 63 -9.248 -4.126 -23.461 497 H HIS 64 H HIS 64 -2.689 -5.409 -20.804 498 HA HIS 64 HA HIS 64 -0.778 -6.390 -22.844 499 HB2 HIS 64 2HB HIS 64 -0.846 -3.651 -21.487 500 HB3 HIS 64 3HB HIS 64 0.452 -4.219 -22.535 501 HD1 HIS 64 HD1 HIS 64 0.148 -3.875 -25.021 502 HD2 HIS 64 HD2 HIS 64 -3.373 -3.243 -22.892 503 HE1 HIS 64 HE1 HIS 64 -1.498 -2.965 -26.679 504 HE2 HIS 64 HE2 HIS 64 -3.653 -2.748 -25.411 505 HA PRO 65 HA PRO 65 0.325 -8.218 -18.695 506 HB2 PRO 65 2HB PRO 65 1.936 -9.914 -20.620 507 HB3 PRO 65 3HB PRO 65 0.979 -10.409 -19.204 508 HG2 PRO 65 2HG PRO 65 -0.008 -10.799 -21.618 509 HG3 PRO 65 3HG PRO 65 -1.070 -10.178 -20.330 510 HD2 PRO 65 2HD PRO 65 0.229 -8.667 -22.598 511 HD3 PRO 65 3HD PRO 65 -1.413 -8.516 -21.931 512 H GLY 66 H GLY 66 1.515 -6.582 -17.873 513 HA2 GLY 66 2HA GLY 66 4.295 -6.713 -17.671 514 HA3 GLY 66 3HA GLY 66 3.932 -5.497 -18.897 515 H GLY 67 H GLY 67 3.051 -3.534 -18.307 516 HA2 GLY 67 2HA GLY 67 1.573 -2.369 -16.646 517 HA3 GLY 67 3HA GLY 67 2.637 -3.020 -15.406 518 H SER 68 H SER 68 3.484 -1.174 -14.585 519 HA SER 68 HA SER 68 4.296 1.072 -16.186 520 HB2 SER 68 2HB SER 68 4.742 0.475 -13.232 521 HB3 SER 68 3HB SER 68 5.023 2.035 -14.012 522 HG SER 68 HG SER 68 2.508 0.808 -14.252 523 H GLY 69 H GLY 69 5.972 0.648 -17.533 524 HA2 GLY 69 2HA GLY 69 8.297 -0.852 -16.987 525 HA3 GLY 69 3HA GLY 69 8.139 0.385 -18.230 526 H LEU 70 H LEU 70 10.417 -0.172 -16.535 527 HA LEU 70 HA LEU 70 10.635 1.584 -14.314 528 HB2 LEU 70 2HB LEU 70 12.767 0.155 -15.958 529 HB3 LEU 70 3HB LEU 70 13.134 1.112 -14.535 530 HG LEU 70 HG LEU 70 11.713 -0.484 -13.164 531 HD11 LEU 70 1HD1 LEU 70 11.152 -2.696 -14.046 532 HD12 LEU 70 2HD1 LEU 70 11.702 -2.210 -15.652 533 HD13 LEU 70 3HD1 LEU 70 10.297 -1.427 -14.927 534 HD21 LEU 70 1HD2 LEU 70 14.147 -0.664 -13.193 535 HD22 LEU 70 2HD2 LEU 70 14.076 -1.712 -14.609 536 HD23 LEU 70 3HD2 LEU 70 13.410 -2.261 -13.069 537 H ASP 71 H ASP 71 10.256 3.679 -14.704 538 HA ASP 71 HA ASP 71 10.549 5.852 -15.246 539 HB2 ASP 71 2HB ASP 71 13.043 5.385 -15.160 540 HB3 ASP 71 3HB ASP 71 13.004 5.063 -16.885 541 H ASP 72 H ASP 72 9.794 3.456 -17.389 542 HA ASP 72 HA ASP 72 9.568 4.881 -19.876 543 HB2 ASP 72 2HB ASP 72 9.875 2.444 -19.871 544 HB3 ASP 72 3HB ASP 72 8.423 2.219 -18.904 545 H ILE 73 H ILE 73 7.113 3.430 -17.723 546 HA ILE 73 HA ILE 73 4.993 3.872 -17.165 547 HB ILE 73 HB ILE 73 5.747 6.808 -17.488 548 HG12 ILE 73 2HG1 ILE 73 7.337 5.650 -15.978 549 HG13 ILE 73 3HG1 ILE 73 6.335 6.775 -15.073 550 HG21 ILE 73 1HG2 ILE 73 3.318 6.513 -17.307 551 HG22 ILE 73 2HG2 ILE 73 3.948 7.251 -15.835 552 HG23 ILE 73 3HG2 ILE 73 3.521 5.540 -15.849 553 HD11 ILE 73 1HD1 ILE 73 4.976 4.886 -14.261 554 HD12 ILE 73 2HD1 ILE 73 6.679 4.720 -13.841 555 HD13 ILE 73 3HD1 ILE 73 6.006 3.771 -15.164 556 HA PRO 74 HA PRO 74 3.294 3.974 -21.454 557 HB2 PRO 74 2HB PRO 74 0.954 2.715 -20.038 558 HB3 PRO 74 3HB PRO 74 1.824 2.163 -21.486 559 HG2 PRO 74 2HG PRO 74 2.163 0.916 -19.168 560 HG3 PRO 74 3HG PRO 74 3.555 1.196 -20.245 561 HD2 PRO 74 2HD PRO 74 2.751 2.712 -17.761 562 HD3 PRO 74 3HD PRO 74 4.367 2.171 -18.280 563 HA PRO 75 HA PRO 75 1.224 7.842 -21.636 564 HB2 PRO 75 2HB PRO 75 -0.742 6.531 -23.536 565 HB3 PRO 75 3HB PRO 75 0.169 8.050 -23.719 566 HG2 PRO 75 2HG PRO 75 1.011 5.900 -24.986 567 HG3 PRO 75 3HG PRO 75 2.193 6.946 -24.161 568 HD2 PRO 75 2HD PRO 75 1.094 4.285 -23.283 569 HD3 PRO 75 3HD PRO 75 2.744 4.927 -23.136 570 H TYR 76 H TYR 76 -1.479 5.432 -21.780 571 HA TYR 76 HA TYR 76 -3.474 6.951 -20.573 572 HB2 TYR 76 2HB TYR 76 -4.280 4.945 -21.525 573 HB3 TYR 76 3HB TYR 76 -3.012 3.966 -20.799 574 HD1 TYR 76 HD1 TYR 76 -6.040 5.985 -19.810 575 HD2 TYR 76 HD2 TYR 76 -3.561 2.614 -18.924 576 HE1 TYR 76 HE1 TYR 76 -7.512 5.382 -17.938 577 HE2 TYR 76 HE2 TYR 76 -5.039 2.016 -17.060 578 HH TYR 76 HH TYR 76 -8.079 3.467 -16.559 579 H ASP 77 H ASP 77 -1.064 4.898 -19.081 580 HA ASP 77 HA ASP 77 -2.133 4.923 -16.431 581 HB2 ASP 77 2HB ASP 77 0.645 4.093 -17.385 582 HB3 ASP 77 3HB ASP 77 -0.138 3.610 -15.879 583 H ARG 78 H ARG 78 0.186 6.854 -18.192 584 HA ARG 78 HA ARG 78 1.231 8.366 -15.982 585 HB2 ARG 78 2HB ARG 78 2.416 8.132 -18.153 586 HB3 ARG 78 3HB ARG 78 1.128 9.010 -18.965 587 HG2 ARG 78 2HG ARG 78 1.698 11.035 -17.639 588 HG3 ARG 78 3HG ARG 78 3.010 10.140 -16.864 589 HD2 ARG 78 2HD ARG 78 4.085 9.814 -19.064 590 HD3 ARG 78 3HD ARG 78 2.778 10.718 -19.837 591 HE ARG 78 HE ARG 78 3.838 12.369 -17.878 592 HH11 ARG 78 1HH1 ARG 78 5.010 10.841 -20.824 593 HH12 ARG 78 2HH1 ARG 78 6.182 12.090 -21.148 594 HH21 ARG 78 1HH2 ARG 78 5.369 13.989 -18.288 595 HH22 ARG 78 2HH2 ARG 78 6.383 13.875 -19.707 596 H ASP 79 H ASP 79 -1.452 8.777 -18.288 597 HA ASP 79 HA ASP 79 -2.337 11.319 -17.305 598 HB2 ASP 79 2HB ASP 79 -3.709 9.199 -18.995 599 HB3 ASP 79 3HB ASP 79 -4.544 10.669 -18.498 600 H PHE 80 H PHE 80 -2.906 8.016 -16.350 601 HA PHE 80 HA PHE 80 -5.105 8.341 -14.604 602 HB2 PHE 80 2HB PHE 80 -4.303 6.127 -15.385 603 HB3 PHE 80 3HB PHE 80 -2.792 6.335 -14.510 604 HD1 PHE 80 HD1 PHE 80 -6.427 5.727 -14.151 605 HD2 PHE 80 HD2 PHE 80 -2.669 5.896 -12.108 606 HE1 PHE 80 HE1 PHE 80 -7.432 4.684 -12.177 607 HE2 PHE 80 HE2 PHE 80 -3.702 4.854 -10.130 608 HZ PHE 80 HZ PHE 80 -6.091 4.253 -10.168 609 H CYS 81 H CYS 81 -1.631 8.814 -14.187 610 HA CYS 81 HA CYS 81 -1.527 9.151 -11.378 611 HB2 CYS 81 2HB CYS 81 0.297 10.331 -13.512 612 HB3 CYS 81 3HB CYS 81 0.694 10.124 -11.807 613 HG CYS 81 HG CYS 81 -0.225 7.236 -13.075 614 H LYS 82 H LYS 82 -2.440 11.315 -13.975 615 HA LYS 82 HA LYS 82 -2.245 13.741 -12.329 616 HB2 LYS 82 2HB LYS 82 -3.051 13.348 -15.239 617 HB3 LYS 82 3HB LYS 82 -2.927 14.912 -14.435 618 HG2 LYS 82 2HG LYS 82 -0.519 14.585 -14.104 619 HG3 LYS 82 3HG LYS 82 -0.619 12.978 -14.831 620 HD2 LYS 82 2HD LYS 82 -1.224 15.605 -16.254 621 HD3 LYS 82 3HD LYS 82 0.243 14.643 -16.448 622 HE2 LYS 82 2HE LYS 82 -1.068 12.787 -17.381 623 HE3 LYS 82 3HE LYS 82 -2.562 13.691 -17.132 624 HZ1 LYS 82 1HZ LYS 82 -1.795 15.333 -18.717 625 HZ2 LYS 82 2HZ LYS 82 -1.807 13.794 -19.425 626 HZ3 LYS 82 3HZ LYS 82 -0.345 14.491 -18.933 627 H VAL 83 H VAL 83 -3.860 13.161 -10.820 628 HA VAL 83 HA VAL 83 -6.629 13.731 -11.737 629 HB VAL 83 HB VAL 83 -7.441 12.386 -9.747 630 HG11 VAL 83 1HG1 VAL 83 -7.163 10.154 -10.775 631 HG12 VAL 83 2HG1 VAL 83 -5.865 10.779 -11.794 632 HG13 VAL 83 3HG1 VAL 83 -7.510 11.387 -11.989 633 HG21 VAL 83 1HG2 VAL 83 -5.383 12.429 -8.387 634 HG22 VAL 83 2HG2 VAL 83 -4.559 11.416 -9.571 635 HG23 VAL 83 3HG2 VAL 83 -5.919 10.768 -8.650 636 H ASP 84 H ASP 84 -7.901 14.393 -9.583 637 HA ASP 84 HA ASP 84 -6.832 16.876 -8.671 638 HB2 ASP 84 2HB ASP 84 -9.249 16.479 -9.007 639 HB3 ASP 84 3HB ASP 84 -9.241 15.256 -7.747 640 H GLN 85 H GLN 85 -6.337 17.427 -6.400 641 HA GLN 85 HA GLN 85 -4.339 15.733 -5.396 642 HB2 GLN 85 2HB GLN 85 -4.061 18.096 -5.088 643 HB3 GLN 85 3HB GLN 85 -5.586 18.250 -4.232 644 HG2 GLN 85 2HG GLN 85 -3.795 18.504 -2.653 645 HG3 GLN 85 3HG GLN 85 -4.601 16.981 -2.317 646 HE21 GLN 85 1HE2 GLN 85 -1.976 17.815 -1.507 647 HE22 GLN 85 2HE2 GLN 85 -0.867 16.652 -2.132 648 HA PRO 86 HA PRO 86 -7.380 14.443 -1.654 649 HB2 PRO 86 2HB PRO 86 -10.000 14.975 -3.069 650 HB3 PRO 86 3HB PRO 86 -9.602 15.081 -1.339 651 HG2 PRO 86 2HG PRO 86 -9.853 17.299 -2.749 652 HG3 PRO 86 3HG PRO 86 -8.537 17.149 -1.555 653 HD2 PRO 86 2HD PRO 86 -8.403 16.902 -4.558 654 HD3 PRO 86 3HD PRO 86 -7.280 17.705 -3.437 655 H THR 87 H THR 87 -8.579 14.187 -5.002 656 HA THR 87 HA THR 87 -9.596 11.588 -5.009 657 HB THR 87 HB THR 87 -8.346 13.152 -7.306 658 HG1 THR 87 HG1 THR 87 -10.862 13.384 -7.541 659 HG21 THR 87 1HG2 THR 87 -9.786 11.832 -8.800 660 HG22 THR 87 2HG2 THR 87 -10.367 10.883 -7.433 661 HG23 THR 87 3HG2 THR 87 -8.676 10.774 -7.925 662 H LEU 88 H LEU 88 -6.304 12.744 -5.445 663 HA LEU 88 HA LEU 88 -5.084 10.373 -6.402 664 HB2 LEU 88 2HB LEU 88 -4.194 12.762 -6.483 665 HB3 LEU 88 3HB LEU 88 -3.765 12.607 -4.794 666 HG LEU 88 HG LEU 88 -2.633 10.667 -6.849 667 HD11 LEU 88 1HD1 LEU 88 -1.446 13.379 -6.185 668 HD12 LEU 88 2HD1 LEU 88 -2.143 12.893 -7.730 669 HD13 LEU 88 3HD1 LEU 88 -0.676 12.114 -7.150 670 HD21 LEU 88 1HD2 LEU 88 -2.283 10.079 -4.495 671 HD22 LEU 88 2HD2 LEU 88 -1.538 11.648 -4.191 672 HD23 LEU 88 3HD2 LEU 88 -0.753 10.490 -5.270 673 H PHE 89 H PHE 89 -5.484 11.752 -3.137 674 HA PHE 89 HA PHE 89 -4.245 9.619 -1.725 675 HB2 PHE 89 2HB PHE 89 -6.230 11.724 -0.770 676 HB3 PHE 89 3HB PHE 89 -5.352 10.629 0.299 677 HD1 PHE 89 HD1 PHE 89 -5.322 13.912 -0.615 678 HD2 PHE 89 HD2 PHE 89 -2.644 10.575 -0.575 679 HE1 PHE 89 HE1 PHE 89 -3.396 15.448 -0.552 680 HE2 PHE 89 HE2 PHE 89 -0.737 12.117 -0.510 681 HZ PHE 89 HZ PHE 89 -1.105 14.551 -0.505 682 H GLU 90 H GLU 90 -7.549 10.137 -2.853 683 HA GLU 90 HA GLU 90 -8.807 8.010 -1.448 684 HB2 GLU 90 2HB GLU 90 -9.553 9.191 -4.159 685 HB3 GLU 90 3HB GLU 90 -10.591 8.170 -3.173 686 HG2 GLU 90 2HG GLU 90 -9.626 10.950 -2.487 687 HG3 GLU 90 3HG GLU 90 -11.256 10.493 -2.961 688 H LEU 91 H LEU 91 -7.085 8.148 -4.546 689 HA LEU 91 HA LEU 91 -7.516 5.455 -5.371 690 HB2 LEU 91 2HB LEU 91 -5.315 7.425 -6.085 691 HB3 LEU 91 3HB LEU 91 -5.484 5.857 -6.851 692 HG LEU 91 HG LEU 91 -7.551 8.095 -7.023 693 HD11 LEU 91 1HD1 LEU 91 -5.457 8.681 -8.201 694 HD12 LEU 91 2HD1 LEU 91 -6.788 8.425 -9.326 695 HD13 LEU 91 3HD1 LEU 91 -5.553 7.178 -9.126 696 HD21 LEU 91 1HD2 LEU 91 -8.605 6.725 -8.765 697 HD22 LEU 91 2HD2 LEU 91 -8.554 5.855 -7.234 698 HD23 LEU 91 3HD2 LEU 91 -7.407 5.451 -8.514 699 H ILE 92 H ILE 92 -5.017 7.015 -3.359 700 HA ILE 92 HA ILE 92 -3.301 4.774 -2.989 701 HB ILE 92 HB ILE 92 -3.766 7.159 -1.121 702 HG12 ILE 92 2HG1 ILE 92 -1.589 6.697 -3.216 703 HG13 ILE 92 3HG1 ILE 92 -2.915 7.842 -3.345 704 HG21 ILE 92 1HG2 ILE 92 -1.490 5.138 -1.078 705 HG22 ILE 92 2HG2 ILE 92 -2.765 5.286 0.130 706 HG23 ILE 92 3HG2 ILE 92 -1.592 6.586 -0.073 707 HD11 ILE 92 1HD1 ILE 92 -0.657 7.970 -1.350 708 HD12 ILE 92 2HD1 ILE 92 -2.004 9.107 -1.455 709 HD13 ILE 92 3HD1 ILE 92 -0.858 8.972 -2.788 710 H LEU 93 H LEU 93 -6.068 6.022 -1.125 711 HA LEU 93 HA LEU 93 -6.061 4.155 0.995 712 HB2 LEU 93 2HB LEU 93 -8.321 5.833 -0.159 713 HB3 LEU 93 3HB LEU 93 -8.475 4.891 1.314 714 HG LEU 93 HG LEU 93 -6.581 7.245 0.923 715 HD11 LEU 93 1HD1 LEU 93 -8.936 7.940 1.025 716 HD12 LEU 93 2HD1 LEU 93 -8.048 8.471 2.448 717 HD13 LEU 93 3HD1 LEU 93 -9.134 7.084 2.558 718 HD21 LEU 93 1HD2 LEU 93 -5.618 5.612 2.476 719 HD22 LEU 93 2HD2 LEU 93 -7.104 5.606 3.427 720 HD23 LEU 93 3HD2 LEU 93 -6.119 7.068 3.335 721 H ALA 94 H ALA 94 -7.656 4.150 -2.164 722 HA ALA 94 HA ALA 94 -9.187 1.752 -1.808 723 HB1 ALA 94 1HB ALA 94 -9.809 3.466 -3.459 724 HB2 ALA 94 2HB ALA 94 -9.578 1.904 -4.237 725 HB3 ALA 94 3HB ALA 94 -8.334 3.153 -4.372 726 H ALA 95 H ALA 95 -5.984 2.482 -3.138 727 HA ALA 95 HA ALA 95 -5.407 -0.102 -4.212 728 HB1 ALA 95 1HB ALA 95 -3.119 0.703 -4.425 729 HB2 ALA 95 2HB ALA 95 -3.471 2.064 -3.352 730 HB3 ALA 95 3HB ALA 95 -4.253 1.957 -4.930 731 H ASN 96 H ASN 96 -4.989 1.352 -1.034 732 HA ASN 96 HA ASN 96 -3.515 -0.820 0.162 733 HB2 ASN 96 2HB ASN 96 -3.343 1.388 1.153 734 HB3 ASN 96 3HB ASN 96 -5.090 1.534 1.305 735 HD21 ASN 96 1HD2 ASN 96 -4.954 1.961 3.500 736 HD22 ASN 96 2HD2 ASN 96 -4.595 0.761 4.680 737 H TYR 97 H TYR 97 -6.910 0.231 0.183 738 HA TYR 97 HA TYR 97 -7.971 -1.686 1.941 739 HB2 TYR 97 2HB TYR 97 -9.154 0.392 1.506 740 HB3 TYR 97 3HB TYR 97 -9.281 0.032 -0.210 741 HD1 TYR 97 HD1 TYR 97 -11.391 -0.696 -0.959 742 HD2 TYR 97 HD2 TYR 97 -10.296 -1.513 3.091 743 HE1 TYR 97 HE1 TYR 97 -13.600 -1.699 -0.571 744 HE2 TYR 97 HE2 TYR 97 -12.505 -2.517 3.482 745 HH TYR 97 HH TYR 97 -14.765 -2.452 2.546 746 H LEU 98 H LEU 98 -7.517 -1.744 -1.553 747 HA LEU 98 HA LEU 98 -8.862 -4.355 -1.823 748 HB2 LEU 98 2HB LEU 98 -7.855 -2.432 -3.964 749 HB3 LEU 98 3HB LEU 98 -8.767 -3.903 -4.258 750 HG LEU 98 HG LEU 98 -9.795 -1.400 -2.864 751 HD11 LEU 98 1HD1 LEU 98 -9.614 -1.099 -5.275 752 HD12 LEU 98 2HD1 LEU 98 -11.307 -1.172 -4.794 753 HD13 LEU 98 3HD1 LEU 98 -10.548 -2.570 -5.560 754 HD21 LEU 98 1HD2 LEU 98 -10.817 -3.325 -1.803 755 HD22 LEU 98 2HD2 LEU 98 -11.260 -4.005 -3.367 756 HD23 LEU 98 3HD2 LEU 98 -12.009 -2.508 -2.811 757 H ASP 99 H ASP 99 -5.800 -3.079 -1.375 758 HA ASP 99 HA ASP 99 -3.669 -3.518 -1.869 759 HB2 ASP 99 2HB ASP 99 -4.093 -5.267 -0.164 760 HB3 ASP 99 3HB ASP 99 -4.485 -6.415 -1.443 761 H ILE 100 H ILE 100 -3.721 -2.762 -3.962 762 HA ILE 100 HA ILE 100 -3.165 -4.804 -6.042 763 HB ILE 100 HB ILE 100 -4.379 -2.035 -6.550 764 HG12 ILE 100 2HG1 ILE 100 -5.747 -4.764 -6.581 765 HG13 ILE 100 3HG1 ILE 100 -6.033 -3.470 -5.425 766 HG21 ILE 100 1HG2 ILE 100 -2.979 -2.860 -8.409 767 HG22 ILE 100 2HG2 ILE 100 -4.679 -2.826 -8.876 768 HG23 ILE 100 3HG2 ILE 100 -3.911 -4.360 -8.463 769 HD11 ILE 100 1HD1 ILE 100 -6.693 -3.401 -8.361 770 HD12 ILE 100 2HD1 ILE 100 -6.941 -2.082 -7.214 771 HD13 ILE 100 3HD1 ILE 100 -7.817 -3.599 -7.017 772 H LYS 101 H LYS 101 -0.990 -4.806 -6.012 773 HA LYS 101 HA LYS 101 0.721 -2.787 -5.155 774 HB2 LYS 101 2HB LYS 101 1.257 -5.192 -6.942 775 HB3 LYS 101 3HB LYS 101 2.539 -4.148 -6.345 776 HG2 LYS 101 2HG LYS 101 0.645 -5.770 -4.617 777 HG3 LYS 101 3HG LYS 101 2.319 -6.185 -4.991 778 HD2 LYS 101 2HD LYS 101 3.043 -4.044 -3.875 779 HD3 LYS 101 3HD LYS 101 1.363 -3.770 -3.403 780 HE2 LYS 101 2HE LYS 101 3.026 -6.178 -2.583 781 HE3 LYS 101 3HE LYS 101 2.737 -4.755 -1.585 782 HZ1 LYS 101 1HZ LYS 101 0.365 -5.233 -1.663 783 HZ2 LYS 101 2HZ LYS 101 1.237 -6.511 -0.982 784 HZ3 LYS 101 3HZ LYS 101 0.662 -6.630 -2.568 785 HA PRO 102 HA PRO 102 1.492 -1.499 -9.925 786 HB2 PRO 102 2HB PRO 102 -1.272 -2.134 -10.976 787 HB3 PRO 102 3HB PRO 102 0.299 -2.209 -11.808 788 HG2 PRO 102 2HG PRO 102 -0.874 -4.450 -11.041 789 HG3 PRO 102 3HG PRO 102 0.882 -4.250 -10.824 790 HD2 PRO 102 2HD PRO 102 -1.313 -4.013 -8.769 791 HD3 PRO 102 3HD PRO 102 0.282 -4.788 -8.632 792 H LEU 103 H LEU 103 -1.745 -1.216 -8.435 793 HA LEU 103 HA LEU 103 -2.288 1.474 -9.308 794 HB2 LEU 103 2HB LEU 103 -3.885 -0.499 -8.349 795 HB3 LEU 103 3HB LEU 103 -3.588 0.300 -6.824 796 HG LEU 103 HG LEU 103 -5.724 1.030 -7.708 797 HD11 LEU 103 1HD1 LEU 103 -5.508 3.478 -7.837 798 HD12 LEU 103 2HD1 LEU 103 -3.758 3.320 -8.014 799 HD13 LEU 103 3HD1 LEU 103 -4.547 2.798 -6.526 800 HD21 LEU 103 1HD2 LEU 103 -4.300 1.898 -10.239 801 HD22 LEU 103 2HD2 LEU 103 -6.016 2.104 -9.877 802 HD23 LEU 103 3HD2 LEU 103 -5.347 0.487 -10.064 803 H LEU 104 H LEU 104 -1.079 -0.037 -6.355 804 HA LEU 104 HA LEU 104 -1.105 2.216 -4.652 805 HB2 LEU 104 2HB LEU 104 -1.110 -0.185 -3.926 806 HB3 LEU 104 3HB LEU 104 0.550 -0.337 -4.442 807 HG LEU 104 HG LEU 104 1.213 1.331 -2.688 808 HD11 LEU 104 1HD1 LEU 104 -1.698 1.189 -1.831 809 HD12 LEU 104 2HD1 LEU 104 -0.870 2.599 -2.499 810 HD13 LEU 104 3HD1 LEU 104 -0.393 1.964 -0.927 811 HD21 LEU 104 1HD2 LEU 104 1.344 -1.090 -2.229 812 HD22 LEU 104 2HD2 LEU 104 -0.313 -1.075 -1.619 813 HD23 LEU 104 3HD2 LEU 104 0.949 -0.183 -0.768 814 H ASP 105 H ASP 105 1.467 0.632 -6.519 815 HA ASP 105 HA ASP 105 3.626 2.137 -5.534 816 HB2 ASP 105 2HB ASP 105 3.946 -0.043 -6.666 817 HB3 ASP 105 3HB ASP 105 3.421 0.654 -8.198 818 H VAL 106 H VAL 106 1.739 2.447 -8.521 819 HA VAL 106 HA VAL 106 3.114 4.618 -9.644 820 HB VAL 106 HB VAL 106 0.318 3.491 -10.050 821 HG11 VAL 106 1HG1 VAL 106 0.137 5.871 -10.646 822 HG12 VAL 106 2HG1 VAL 106 0.057 4.852 -12.082 823 HG13 VAL 106 3HG1 VAL 106 1.542 5.730 -11.706 824 HG21 VAL 106 1HG2 VAL 106 2.190 2.095 -10.772 825 HG22 VAL 106 2HG2 VAL 106 2.839 3.419 -11.742 826 HG23 VAL 106 3HG2 VAL 106 1.296 2.681 -12.177 827 H THR 107 H THR 107 0.088 4.620 -7.701 828 HA THR 107 HA THR 107 -0.371 7.415 -8.024 829 HB THR 107 HB THR 107 -1.577 5.537 -5.945 830 HG1 THR 107 HG1 THR 107 -2.360 4.656 -7.721 831 HG21 THR 107 1HG2 THR 107 -2.660 8.137 -7.104 832 HG22 THR 107 2HG2 THR 107 -1.996 7.956 -5.479 833 HG23 THR 107 3HG2 THR 107 -3.469 7.101 -5.926 834 H CYS 108 H CYS 108 1.041 5.503 -5.359 835 HA CYS 108 HA CYS 108 1.442 7.683 -3.547 836 HB2 CYS 108 2HB CYS 108 2.812 4.965 -3.667 837 HB3 CYS 108 3HB CYS 108 2.899 6.091 -2.306 838 HG CYS 108 HG CYS 108 0.531 3.900 -3.098 839 H LYS 109 H LYS 109 3.320 6.297 -6.175 840 HA LYS 109 HA LYS 109 5.782 7.688 -5.670 841 HB2 LYS 109 2HB LYS 109 5.586 5.564 -6.959 842 HB3 LYS 109 3HB LYS 109 4.741 6.418 -8.240 843 HG2 LYS 109 2HG LYS 109 6.717 7.578 -8.906 844 HG3 LYS 109 3HG LYS 109 7.573 7.158 -7.421 845 HD2 LYS 109 2HD LYS 109 6.687 5.135 -9.525 846 HD3 LYS 109 3HD LYS 109 8.315 5.805 -9.414 847 HE2 LYS 109 2HE LYS 109 8.662 4.780 -7.247 848 HE3 LYS 109 3HE LYS 109 6.973 4.269 -7.163 849 HZ1 LYS 109 1HZ LYS 109 8.511 2.476 -7.772 850 HZ2 LYS 109 2HZ LYS 109 8.913 3.302 -9.196 851 HZ3 LYS 109 3HZ LYS 109 7.334 2.748 -8.951 852 H THR 110 H THR 110 2.820 8.364 -7.454 853 HA THR 110 HA THR 110 3.666 10.555 -9.008 854 HB THR 110 HB THR 110 0.880 9.917 -7.943 855 HG1 THR 110 HG1 THR 110 1.348 8.355 -9.360 856 HG21 THR 110 1HG2 THR 110 0.032 11.401 -9.748 857 HG22 THR 110 2HG2 THR 110 1.686 11.874 -10.140 858 HG23 THR 110 3HG2 THR 110 0.989 12.313 -8.578 859 H VAL 111 H VAL 111 2.086 10.485 -5.770 860 HA VAL 111 HA VAL 111 2.139 13.301 -5.417 861 HB VAL 111 HB VAL 111 0.614 11.856 -4.099 862 HG11 VAL 111 1HG1 VAL 111 3.036 10.985 -2.507 863 HG12 VAL 111 2HG1 VAL 111 2.093 9.969 -3.599 864 HG13 VAL 111 3HG1 VAL 111 1.351 10.610 -2.131 865 HG21 VAL 111 1HG2 VAL 111 2.410 13.558 -2.345 866 HG22 VAL 111 2HG2 VAL 111 0.752 13.075 -1.978 867 HG23 VAL 111 3HG2 VAL 111 1.074 14.148 -3.339 868 H ALA 112 H ALA 112 4.465 10.754 -4.682 869 HA ALA 112 HA ALA 112 6.408 12.301 -3.310 870 HB1 ALA 112 1HB ALA 112 6.764 9.806 -4.996 871 HB2 ALA 112 2HB ALA 112 6.369 9.845 -3.278 872 HB3 ALA 112 3HB ALA 112 7.934 10.441 -3.834 873 H ASN 113 H ASN 113 5.712 11.846 -6.735 874 HA ASN 113 HA ASN 113 8.082 13.184 -7.731 875 HB2 ASN 113 2HB ASN 113 5.484 12.389 -9.131 876 HB3 ASN 113 3HB ASN 113 6.862 13.107 -9.960 877 HD21 ASN 113 1HD2 ASN 113 5.542 10.460 -10.284 878 HD22 ASN 113 2HD2 ASN 113 6.804 9.292 -10.094 879 H MET 114 H MET 114 4.793 14.120 -6.851 880 HA MET 114 HA MET 114 4.777 16.692 -8.112 881 HB2 MET 114 2HB MET 114 3.088 15.675 -5.785 882 HB3 MET 114 3HB MET 114 2.823 17.202 -6.617 883 HG2 MET 114 2HG MET 114 2.496 15.815 -8.738 884 HG3 MET 114 3HG MET 114 2.408 14.413 -7.673 885 HE1 MET 114 1HE MET 114 -0.703 15.614 -5.377 886 HE2 MET 114 2HE MET 114 0.948 16.161 -5.096 887 HE3 MET 114 3HE MET 114 0.630 14.466 -5.466 888 H ILE 115 H ILE 115 5.444 15.585 -4.773 889 HA ILE 115 HA ILE 115 6.198 18.184 -3.814 890 HB ILE 115 HB ILE 115 7.068 17.073 -1.801 891 HG12 ILE 115 2HG1 ILE 115 6.525 14.407 -3.194 892 HG13 ILE 115 3HG1 ILE 115 8.121 15.077 -2.883 893 HG21 ILE 115 1HG2 ILE 115 4.981 16.005 -1.012 894 HG22 ILE 115 2HG2 ILE 115 4.423 15.854 -2.680 895 HG23 ILE 115 3HG2 ILE 115 4.642 17.451 -1.964 896 HD11 ILE 115 1HD1 ILE 115 7.555 13.340 -1.291 897 HD12 ILE 115 2HD1 ILE 115 6.125 14.237 -0.783 898 HD13 ILE 115 3HD1 ILE 115 7.736 14.895 -0.479 899 H ARG 116 H ARG 116 7.865 15.501 -5.348 900 HA ARG 116 HA ARG 116 9.885 15.158 -6.240 901 HB2 ARG 116 2HB ARG 116 9.073 16.947 -7.698 902 HB3 ARG 116 3HB ARG 116 9.712 18.169 -6.616 903 HG2 ARG 116 2HG ARG 116 11.056 17.916 -8.648 904 HG3 ARG 116 3HG ARG 116 11.993 17.557 -7.203 905 HD2 ARG 116 2HD ARG 116 10.712 15.313 -8.777 906 HD3 ARG 116 3HD ARG 116 12.224 16.034 -9.327 907 HE ARG 116 HE ARG 116 12.574 15.395 -6.642 908 HH11 ARG 116 1HH1 ARG 116 12.070 13.627 -9.663 909 HH12 ARG 116 2HH1 ARG 116 12.917 12.220 -9.097 910 HH21 ARG 116 1HH2 ARG 116 13.689 13.556 -5.950 911 HH22 ARG 116 2HH2 ARG 116 13.828 12.182 -7.010 912 H GLY 117 H GLY 117 10.802 14.390 -4.276 913 HA2 GLY 117 2HA GLY 117 12.429 16.141 -2.606 914 HA3 GLY 117 3HA GLY 117 12.184 14.415 -2.409 915 H1 SER 2 1H SER 2 17.093 -15.652 17.027 916 H2 SER 2 2H SER 2 16.126 -14.896 15.869 917 H3 SER 2 3H SER 2 16.444 -14.125 17.341 918 HA SER 2 HA SER 2 18.731 -13.912 16.837 919 HB2 SER 2 2HB SER 2 18.028 -15.324 14.231 920 HB3 SER 2 3HB SER 2 19.602 -14.615 14.605 921 HG SER 2 HG SER 2 20.066 -16.399 15.587 922 H LEU 3 H LEU 3 19.459 -12.014 15.873 923 HA LEU 3 HA LEU 3 17.400 -10.245 14.791 924 HB2 LEU 3 2HB LEU 3 20.319 -9.659 15.445 925 HB3 LEU 3 3HB LEU 3 19.091 -8.469 15.053 926 HG LEU 3 HG LEU 3 19.125 -10.199 17.557 927 HD11 LEU 3 1HD1 LEU 3 19.628 -8.104 18.755 928 HD12 LEU 3 2HD1 LEU 3 19.734 -7.244 17.216 929 HD13 LEU 3 3HD1 LEU 3 20.893 -8.518 17.601 930 HD21 LEU 3 1HD2 LEU 3 16.833 -9.695 16.888 931 HD22 LEU 3 2HD2 LEU 3 17.217 -7.975 16.776 932 HD23 LEU 3 3HD2 LEU 3 17.266 -8.793 18.340 933 H VAL 4 H VAL 4 17.109 -10.124 12.616 934 HA VAL 4 HA VAL 4 19.280 -10.691 10.734 935 HB VAL 4 HB VAL 4 17.568 -10.115 8.936 936 HG11 VAL 4 1HG1 VAL 4 16.781 -12.344 10.842 937 HG12 VAL 4 2HG1 VAL 4 18.006 -12.446 9.579 938 HG13 VAL 4 3HG1 VAL 4 16.311 -12.224 9.143 939 HG21 VAL 4 1HG2 VAL 4 15.619 -10.039 11.270 940 HG22 VAL 4 2HG2 VAL 4 15.176 -10.012 9.562 941 HG23 VAL 4 3HG2 VAL 4 16.079 -8.667 10.259 942 H LYS 5 H LYS 5 20.374 -9.185 9.636 943 HA LYS 5 HA LYS 5 20.338 -6.448 10.604 944 HB2 LYS 5 2HB LYS 5 22.168 -7.962 8.697 945 HB3 LYS 5 3HB LYS 5 22.384 -6.263 9.097 946 HG2 LYS 5 2HG LYS 5 22.662 -6.898 11.493 947 HG3 LYS 5 3HG LYS 5 22.556 -8.597 11.032 948 HD2 LYS 5 2HD LYS 5 24.572 -8.373 9.649 949 HD3 LYS 5 3HD LYS 5 24.649 -6.643 9.991 950 HE2 LYS 5 2HE LYS 5 26.283 -7.861 11.339 951 HE3 LYS 5 3HE LYS 5 25.051 -7.145 12.381 952 HZ1 LYS 5 1HZ LYS 5 25.544 -9.388 13.053 953 HZ2 LYS 5 2HZ LYS 5 25.175 -9.982 11.517 954 HZ3 LYS 5 3HZ LYS 5 23.959 -9.305 12.477 955 H LEU 6 H LEU 6 19.139 -4.922 9.635 956 HA LEU 6 HA LEU 6 18.404 -5.165 6.760 957 HB2 LEU 6 2HB LEU 6 16.952 -4.061 9.169 958 HB3 LEU 6 3HB LEU 6 16.684 -3.270 7.625 959 HG LEU 6 HG LEU 6 15.845 -5.349 6.634 960 HD11 LEU 6 1HD1 LEU 6 16.300 -6.656 9.329 961 HD12 LEU 6 2HD1 LEU 6 17.135 -7.033 7.821 962 HD13 LEU 6 3HD1 LEU 6 15.413 -7.365 7.977 963 HD21 LEU 6 1HD2 LEU 6 14.261 -3.858 7.709 964 HD22 LEU 6 2HD2 LEU 6 14.498 -4.676 9.257 965 HD23 LEU 6 3HD2 LEU 6 13.760 -5.536 7.904 966 H GLU 7 H GLU 7 20.138 -4.215 5.828 967 HA GLU 7 HA GLU 7 21.193 -1.654 6.699 968 HB2 GLU 7 2HB GLU 7 22.676 -3.379 5.724 969 HB3 GLU 7 3HB GLU 7 21.769 -3.336 4.212 970 HG2 GLU 7 2HG GLU 7 22.468 -1.010 3.826 971 HG3 GLU 7 3HG GLU 7 23.323 -0.989 5.373 972 H SER 8 H SER 8 20.306 0.236 6.119 973 HA SER 8 HA SER 8 18.142 0.415 4.187 974 HB2 SER 8 2HB SER 8 17.995 2.772 5.024 975 HB3 SER 8 3HB SER 8 17.981 1.601 6.338 976 HG SER 8 HG SER 8 19.867 2.280 7.007 977 H SER 9 H SER 9 18.161 2.397 2.737 978 HA SER 9 HA SER 9 20.259 2.451 0.870 979 HB2 SER 9 2HB SER 9 17.932 3.085 0.302 980 HB3 SER 9 3HB SER 9 18.060 4.506 1.347 981 HG SER 9 HG SER 9 19.195 4.012 -1.174 982 H ASP 10 H ASP 10 19.776 4.164 3.843 983 HA ASP 10 HA ASP 10 21.779 6.233 3.367 984 HB2 ASP 10 2HB ASP 10 19.670 6.630 4.685 985 HB3 ASP 10 3HB ASP 10 20.253 5.506 5.907 986 H GLU 11 H GLU 11 22.041 3.011 3.910 987 HA GLU 11 HA GLU 11 23.830 1.670 4.221 988 HB2 GLU 11 2HB GLU 11 25.417 4.196 4.841 989 HB3 GLU 11 3HB GLU 11 26.107 2.613 4.496 990 HG2 GLU 11 2HG GLU 11 25.404 2.703 2.204 991 HG3 GLU 11 3HG GLU 11 24.382 4.108 2.495 992 H LYS 12 H LYS 12 22.209 3.114 6.604 993 HA LYS 12 HA LYS 12 23.828 2.161 8.860 994 HB2 LYS 12 2HB LYS 12 21.183 3.662 8.743 995 HB3 LYS 12 3HB LYS 12 21.883 3.072 10.247 996 HG2 LYS 12 2HG LYS 12 23.913 4.464 9.813 997 HG3 LYS 12 3HG LYS 12 23.123 5.118 8.376 998 HD2 LYS 12 2HD LYS 12 21.304 6.035 9.821 999 HD3 LYS 12 3HD LYS 12 22.135 5.412 11.247 1000 HE2 LYS 12 2HE LYS 12 24.038 6.889 10.821 1001 HE3 LYS 12 3HE LYS 12 23.297 7.453 9.319 1002 HZ1 LYS 12 1HZ LYS 12 21.453 8.346 10.652 1003 HZ2 LYS 12 2HZ LYS 12 22.936 9.042 11.071 1004 HZ3 LYS 12 3HZ LYS 12 22.240 7.870 12.067 1005 H VAL 13 H VAL 13 23.479 0.286 9.850 1006 HA VAL 13 HA VAL 13 21.497 -1.582 8.734 1007 HB VAL 13 HB VAL 13 23.995 -2.087 10.426 1008 HG11 VAL 13 1HG1 VAL 13 22.199 -4.086 9.012 1009 HG12 VAL 13 2HG1 VAL 13 22.354 -3.872 10.758 1010 HG13 VAL 13 3HG1 VAL 13 23.724 -4.463 9.818 1011 HG21 VAL 13 1HG2 VAL 13 24.554 -1.209 8.191 1012 HG22 VAL 13 2HG2 VAL 13 23.589 -2.478 7.435 1013 HG23 VAL 13 3HG2 VAL 13 25.040 -2.898 8.348 1014 H PHE 14 H PHE 14 19.736 -2.066 9.897 1015 HA PHE 14 HA PHE 14 19.624 -1.598 12.816 1016 HB2 PHE 14 2HB PHE 14 17.391 -1.726 10.725 1017 HB3 PHE 14 3HB PHE 14 17.132 -1.507 12.455 1018 HD1 PHE 14 HD1 PHE 14 17.690 0.618 13.552 1019 HD2 PHE 14 HD2 PHE 14 18.303 0.107 9.346 1020 HE1 PHE 14 HE1 PHE 14 17.986 3.041 13.293 1021 HE2 PHE 14 HE2 PHE 14 18.594 2.533 9.102 1022 HZ PHE 14 HZ PHE 14 18.440 4.004 11.072 1023 H GLU 15 H GLU 15 20.131 -3.475 13.786 1024 HA GLU 15 HA GLU 15 19.461 -6.082 12.733 1025 HB2 GLU 15 2HB GLU 15 20.553 -5.349 15.480 1026 HB3 GLU 15 3HB GLU 15 20.513 -6.959 14.770 1027 HG2 GLU 15 2HG GLU 15 22.054 -6.130 12.964 1028 HG3 GLU 15 3HG GLU 15 22.167 -4.601 13.828 1029 H ILE 16 H ILE 16 17.202 -5.866 12.571 1030 HA ILE 16 HA ILE 16 15.571 -5.646 15.003 1031 HB ILE 16 HB ILE 16 14.867 -4.448 12.911 1032 HG12 ILE 16 2HG1 ILE 16 12.456 -5.179 12.884 1033 HG13 ILE 16 3HG1 ILE 16 12.901 -6.598 13.827 1034 HG21 ILE 16 1HG2 ILE 16 13.958 -5.675 10.982 1035 HG22 ILE 16 2HG2 ILE 16 14.430 -7.205 11.722 1036 HG23 ILE 16 3HG2 ILE 16 15.667 -6.043 11.235 1037 HD11 ILE 16 1HD1 ILE 16 11.899 -4.850 15.194 1038 HD12 ILE 16 2HD1 ILE 16 13.182 -3.735 14.730 1039 HD13 ILE 16 3HD1 ILE 16 13.562 -5.170 15.686 1040 H GLU 17 H GLU 17 14.187 -7.348 15.671 1041 HA GLU 17 HA GLU 17 15.124 -9.994 15.537 1042 HB2 GLU 17 2HB GLU 17 12.323 -9.014 16.246 1043 HB3 GLU 17 3HB GLU 17 13.001 -10.585 16.672 1044 HG2 GLU 17 2HG GLU 17 14.637 -9.543 18.139 1045 HG3 GLU 17 3HG GLU 17 14.127 -7.937 17.622 1046 H LYS 18 H LYS 18 14.703 -11.656 14.159 1047 HA LYS 18 HA LYS 18 13.986 -11.191 11.524 1048 HB2 LYS 18 2HB LYS 18 15.357 -13.126 12.212 1049 HB3 LYS 18 3HB LYS 18 13.967 -13.849 13.012 1050 HG2 LYS 18 2HG LYS 18 12.834 -13.904 10.714 1051 HG3 LYS 18 3HG LYS 18 14.400 -13.468 10.029 1052 HD2 LYS 18 2HD LYS 18 15.402 -15.537 10.907 1053 HD3 LYS 18 3HD LYS 18 13.890 -15.943 11.727 1054 HE2 LYS 18 2HE LYS 18 12.767 -16.027 9.480 1055 HE3 LYS 18 3HE LYS 18 14.347 -15.796 8.731 1056 HZ1 LYS 18 1HZ LYS 18 15.090 -17.863 9.728 1057 HZ2 LYS 18 2HZ LYS 18 13.697 -18.120 8.804 1058 HZ3 LYS 18 3HZ LYS 18 13.591 -18.072 10.489 1059 H GLU 19 H GLU 19 12.032 -12.421 14.178 1060 HA GLU 19 HA GLU 19 9.721 -13.172 12.776 1061 HB2 GLU 19 2HB GLU 19 8.592 -13.063 14.999 1062 HB3 GLU 19 3HB GLU 19 10.117 -13.934 15.031 1063 HG2 GLU 19 2HG GLU 19 11.192 -11.802 15.924 1064 HG3 GLU 19 3HG GLU 19 9.560 -11.162 16.121 1065 H ILE 20 H ILE 20 10.715 -10.009 14.024 1066 HA ILE 20 HA ILE 20 8.224 -8.651 13.448 1067 HB ILE 20 HB ILE 20 10.981 -7.477 14.075 1068 HG12 ILE 20 2HG1 ILE 20 8.612 -8.053 15.923 1069 HG13 ILE 20 3HG1 ILE 20 10.153 -8.901 15.921 1070 HG21 ILE 20 1HG2 ILE 20 9.530 -5.817 12.963 1071 HG22 ILE 20 2HG2 ILE 20 9.790 -5.389 14.653 1072 HG23 ILE 20 3HG2 ILE 20 8.261 -6.114 14.154 1073 HD11 ILE 20 1HD1 ILE 20 10.043 -7.386 17.772 1074 HD12 ILE 20 2HD1 ILE 20 9.693 -6.026 16.707 1075 HD13 ILE 20 3HD1 ILE 20 11.269 -6.823 16.638 1076 H ALA 21 H ALA 21 11.287 -9.192 11.786 1077 HA ALA 21 HA ALA 21 10.806 -7.414 9.573 1078 HB1 ALA 21 1HB ALA 21 12.768 -8.484 8.563 1079 HB2 ALA 21 2HB ALA 21 12.737 -9.743 9.804 1080 HB3 ALA 21 3HB ALA 21 13.072 -8.070 10.251 1081 H CYS 22 H CYS 22 9.798 -10.649 10.334 1082 HA CYS 22 HA CYS 22 9.084 -11.506 7.695 1083 HB2 CYS 22 2HB CYS 22 8.222 -12.497 10.433 1084 HB3 CYS 22 3HB CYS 22 7.819 -13.304 8.916 1085 HG CYS 22 HG CYS 22 11.100 -12.733 9.298 1086 H MET 23 H MET 23 7.533 -9.511 10.102 1087 HA MET 23 HA MET 23 4.841 -9.555 9.223 1088 HB2 MET 23 2HB MET 23 6.422 -7.239 10.421 1089 HB3 MET 23 3HB MET 23 4.671 -7.308 10.300 1090 HG2 MET 23 2HG MET 23 4.583 -9.150 11.874 1091 HG3 MET 23 3HG MET 23 6.345 -9.250 11.908 1092 HE1 MET 23 1HE MET 23 3.218 -6.989 12.811 1093 HE2 MET 23 2HE MET 23 4.215 -5.889 11.856 1094 HE3 MET 23 3HE MET 23 4.008 -5.619 13.586 1095 H SER 24 H SER 24 7.638 -7.686 8.204 1096 HA SER 24 HA SER 24 6.391 -6.346 5.993 1097 HB2 SER 24 2HB SER 24 8.465 -5.466 7.024 1098 HB3 SER 24 3HB SER 24 9.330 -6.940 6.579 1099 HG SER 24 HG SER 24 8.036 -5.319 4.664 1100 H VAL 25 H VAL 25 5.641 -7.447 4.261 1101 HA VAL 25 HA VAL 25 6.096 -10.202 3.834 1102 HB VAL 25 HB VAL 25 4.807 -8.133 1.995 1103 HG11 VAL 25 1HG1 VAL 25 3.731 -10.051 0.831 1104 HG12 VAL 25 2HG1 VAL 25 4.714 -11.169 1.782 1105 HG13 VAL 25 3HG1 VAL 25 5.487 -10.065 0.644 1106 HG21 VAL 25 1HG2 VAL 25 3.547 -10.119 3.932 1107 HG22 VAL 25 2HG2 VAL 25 2.666 -9.020 2.868 1108 HG23 VAL 25 3HG2 VAL 25 3.666 -8.374 4.170 1109 H THR 26 H THR 26 7.350 -7.323 2.129 1110 HA THR 26 HA THR 26 8.688 -8.682 0.046 1111 HB THR 26 HB THR 26 9.314 -5.926 1.191 1112 HG1 THR 26 HG1 THR 26 7.855 -5.206 -0.393 1113 HG21 THR 26 1HG2 THR 26 10.207 -5.408 -1.061 1114 HG22 THR 26 2HG2 THR 26 9.933 -7.077 -1.563 1115 HG23 THR 26 3HG2 THR 26 11.122 -6.717 -0.309 1116 H ILE 27 H ILE 27 9.961 -7.407 3.169 1117 HA ILE 27 HA ILE 27 12.686 -8.123 2.786 1118 HB ILE 27 HB ILE 27 11.122 -7.701 5.376 1119 HG12 ILE 27 2HG1 ILE 27 12.984 -5.794 3.886 1120 HG13 ILE 27 3HG1 ILE 27 11.226 -5.735 3.816 1121 HG21 ILE 27 1HG2 ILE 27 13.304 -7.384 6.513 1122 HG22 ILE 27 2HG2 ILE 27 14.144 -7.826 5.028 1123 HG23 ILE 27 3HG2 ILE 27 13.150 -9.019 5.863 1124 HD11 ILE 27 1HD1 ILE 27 11.144 -5.241 6.202 1125 HD12 ILE 27 2HD1 ILE 27 12.099 -4.056 5.312 1126 HD13 ILE 27 3HD1 ILE 27 12.905 -5.293 6.272 1127 H LYS 28 H LYS 28 9.973 -9.772 4.351 1128 HA LYS 28 HA LYS 28 11.139 -12.130 5.259 1129 HB2 LYS 28 2HB LYS 28 8.814 -11.414 5.750 1130 HB3 LYS 28 3HB LYS 28 8.369 -11.689 4.072 1131 HG2 LYS 28 2HG LYS 28 8.918 -14.141 4.419 1132 HG3 LYS 28 3HG LYS 28 9.139 -13.774 6.132 1133 HD2 LYS 28 2HD LYS 28 6.885 -14.678 5.712 1134 HD3 LYS 28 3HD LYS 28 6.797 -13.016 6.297 1135 HE2 LYS 28 2HE LYS 28 5.198 -13.397 4.472 1136 HE3 LYS 28 3HE LYS 28 6.417 -12.220 3.985 1137 HZ1 LYS 28 1HZ LYS 28 6.027 -13.752 2.207 1138 HZ2 LYS 28 2HZ LYS 28 6.285 -15.084 3.211 1139 HZ3 LYS 28 3HZ LYS 28 7.571 -14.065 2.819 1140 H ASN 29 H ASN 29 9.729 -11.373 2.060 1141 HA ASN 29 HA ASN 29 10.159 -13.917 0.856 1142 HB2 ASN 29 2HB ASN 29 9.722 -11.182 -0.438 1143 HB3 ASN 29 3HB ASN 29 9.755 -12.698 -1.335 1144 HD21 ASN 29 1HD2 ASN 29 7.597 -10.803 -1.174 1145 HD22 ASN 29 2HD2 ASN 29 6.239 -11.639 -0.509 1146 H MET 30 H MET 30 12.166 -11.027 1.135 1147 HA MET 30 HA MET 30 14.156 -11.680 -0.780 1148 HB2 MET 30 2HB MET 30 14.284 -9.927 1.718 1149 HB3 MET 30 3HB MET 30 15.630 -10.095 0.600 1150 HG2 MET 30 2HG MET 30 14.208 -9.185 -1.220 1151 HG3 MET 30 3HG MET 30 12.907 -8.955 -0.052 1152 HE1 MET 30 1HE MET 30 12.883 -6.363 -0.961 1153 HE2 MET 30 2HE MET 30 14.304 -6.630 -1.972 1154 HE3 MET 30 3HE MET 30 14.277 -5.291 -0.825 1155 H ILE 31 H ILE 31 13.875 -12.351 2.695 1156 HA ILE 31 HA ILE 31 16.349 -13.710 3.032 1157 HB ILE 31 HB ILE 31 13.796 -13.889 4.707 1158 HG12 ILE 31 2HG1 ILE 31 16.294 -12.175 5.126 1159 HG13 ILE 31 3HG1 ILE 31 14.756 -11.577 4.520 1160 HG21 ILE 31 1HG2 ILE 31 15.258 -15.828 5.150 1161 HG22 ILE 31 2HG2 ILE 31 15.237 -14.741 6.539 1162 HG23 ILE 31 3HG2 ILE 31 16.621 -14.747 5.447 1163 HD11 ILE 31 1HD1 ILE 31 15.264 -12.702 7.268 1164 HD12 ILE 31 2HD1 ILE 31 13.705 -12.144 6.658 1165 HD13 ILE 31 3HD1 ILE 31 15.038 -11.006 6.838 1166 H GLU 32 H GLU 32 13.036 -14.791 2.327 1167 HA GLU 32 HA GLU 32 13.539 -17.608 2.409 1168 HB2 GLU 32 2HB GLU 32 11.253 -16.060 1.122 1169 HB3 GLU 32 3HB GLU 32 11.293 -17.807 1.332 1170 HG2 GLU 32 2HG GLU 32 11.320 -17.546 3.776 1171 HG3 GLU 32 3HG GLU 32 11.331 -15.791 3.599 1172 H ASP 33 H ASP 33 13.815 -15.188 -0.099 1173 HA ASP 33 HA ASP 33 13.872 -16.914 -2.381 1174 HB2 ASP 33 2HB ASP 33 13.362 -14.489 -2.545 1175 HB3 ASP 33 3HB ASP 33 14.994 -14.090 -2.017 1176 H ILE 34 H ILE 34 16.348 -15.455 -0.328 1177 HA ILE 34 HA ILE 34 18.600 -16.843 -1.510 1178 HB ILE 34 HB ILE 34 18.388 -15.373 1.173 1179 HG12 ILE 34 2HG1 ILE 34 19.348 -14.287 -1.522 1180 HG13 ILE 34 3HG1 ILE 34 17.791 -13.922 -0.790 1181 HG21 ILE 34 1HG2 ILE 34 20.855 -15.155 1.036 1182 HG22 ILE 34 2HG2 ILE 34 20.859 -16.116 -0.444 1183 HG23 ILE 34 3HG2 ILE 34 20.361 -16.849 1.081 1184 HD11 ILE 34 1HD1 ILE 34 19.310 -12.090 -0.487 1185 HD12 ILE 34 2HD1 ILE 34 20.497 -13.136 0.288 1186 HD13 ILE 34 3HD1 ILE 34 18.949 -12.816 1.079 1187 H GLY 35 H GLY 35 16.083 -17.626 0.628 1188 HA2 GLY 35 2HA GLY 35 15.553 -19.788 1.360 1189 HA3 GLY 35 3HA GLY 35 17.256 -20.229 1.325 1190 H GLU 36 H GLU 36 18.655 -19.041 2.867 1191 HA GLU 36 HA GLU 36 17.349 -18.188 5.369 1192 HB2 GLU 36 2HB GLU 36 19.627 -20.230 5.232 1193 HB3 GLU 36 3HB GLU 36 18.903 -19.589 6.704 1194 HG2 GLU 36 2HG GLU 36 16.740 -20.667 6.083 1195 HG3 GLU 36 3HG GLU 36 17.508 -21.337 4.650 1196 H SER 37 H SER 37 18.027 -16.096 5.442 1197 HA SER 37 HA SER 37 20.903 -15.515 5.360 1198 HB2 SER 37 2HB SER 37 20.446 -13.455 3.949 1199 HB3 SER 37 3HB SER 37 20.225 -14.981 3.095 1200 HG SER 37 HG SER 37 18.221 -13.277 4.152 1201 H ASP 38 H ASP 38 21.120 -14.949 7.457 1202 HA ASP 38 HA ASP 38 19.471 -12.835 8.654 1203 HB2 ASP 38 2HB ASP 38 20.769 -13.219 10.690 1204 HB3 ASP 38 3HB ASP 38 20.223 -14.764 10.057 1205 H SER 39 H SER 39 22.224 -13.154 6.714 1206 HA SER 39 HA SER 39 23.905 -11.029 7.408 1207 HB2 SER 39 2HB SER 39 23.311 -12.263 4.680 1208 HB3 SER 39 3HB SER 39 24.674 -11.190 5.013 1209 HG SER 39 HG SER 39 24.433 -13.332 6.739 1210 HA PRO 40 HA PRO 40 21.834 -7.204 6.692 1211 HB2 PRO 40 2HB PRO 40 24.078 -6.306 4.873 1212 HB3 PRO 40 3HB PRO 40 23.408 -5.521 6.323 1213 HG2 PRO 40 2HG PRO 40 25.751 -6.777 6.434 1214 HG3 PRO 40 3HG PRO 40 24.600 -6.881 7.788 1215 HD2 PRO 40 2HD PRO 40 25.232 -8.931 5.678 1216 HD3 PRO 40 3HD PRO 40 24.879 -9.158 7.406 1217 H ILE 41 H ILE 41 20.010 -7.598 5.521 1218 HA ILE 41 HA ILE 41 19.877 -7.858 2.673 1219 HB ILE 41 HB ILE 41 17.681 -7.020 4.644 1220 HG12 ILE 41 2HG1 ILE 41 16.870 -9.514 4.050 1221 HG13 ILE 41 3HG1 ILE 41 18.570 -9.768 3.698 1222 HG21 ILE 41 1HG2 ILE 41 16.062 -7.596 2.861 1223 HG22 ILE 41 2HG2 ILE 41 17.393 -7.917 1.751 1224 HG23 ILE 41 3HG2 ILE 41 17.136 -6.284 2.367 1225 HD11 ILE 41 1HD1 ILE 41 17.424 -8.886 6.350 1226 HD12 ILE 41 2HD1 ILE 41 19.135 -9.149 6.008 1227 HD13 ILE 41 3HD1 ILE 41 18.003 -10.502 5.945 1228 HA PRO 42 HA PRO 42 20.593 -3.327 2.295 1229 HB2 PRO 42 2HB PRO 42 21.339 -3.259 -0.325 1230 HB3 PRO 42 3HB PRO 42 22.429 -3.861 0.936 1231 HG2 PRO 42 2HG PRO 42 20.784 -5.413 -1.017 1232 HG3 PRO 42 3HG PRO 42 22.435 -5.726 -0.438 1233 HD2 PRO 42 2HD PRO 42 20.169 -7.012 0.535 1234 HD3 PRO 42 3HD PRO 42 21.695 -6.860 1.426 1235 H LEU 43 H LEU 43 18.985 -1.905 2.021 1236 HA LEU 43 HA LEU 43 16.741 -2.462 0.167 1237 HB2 LEU 43 2HB LEU 43 16.679 -1.043 2.871 1238 HB3 LEU 43 3HB LEU 43 15.299 -1.223 1.804 1239 HG LEU 43 HG LEU 43 16.755 -3.521 3.174 1240 HD11 LEU 43 1HD1 LEU 43 14.063 -2.301 3.856 1241 HD12 LEU 43 2HD1 LEU 43 15.544 -2.175 4.808 1242 HD13 LEU 43 3HD1 LEU 43 14.767 -3.742 4.602 1243 HD21 LEU 43 1HD2 LEU 43 15.804 -4.266 1.066 1244 HD22 LEU 43 2HD2 LEU 43 14.238 -3.566 1.479 1245 HD23 LEU 43 3HD2 LEU 43 14.870 -4.931 2.406 1246 HA PRO 44 HA PRO 44 18.756 1.477 -1.180 1247 HB2 PRO 44 2HB PRO 44 18.736 0.829 -3.917 1248 HB3 PRO 44 3HB PRO 44 20.033 0.428 -2.782 1249 HG2 PRO 44 2HG PRO 44 18.252 -1.392 -4.106 1250 HG3 PRO 44 3HG PRO 44 19.551 -1.776 -2.960 1251 HD2 PRO 44 2HD PRO 44 16.626 -1.551 -2.477 1252 HD3 PRO 44 3HD PRO 44 17.860 -2.454 -1.569 1253 H ASN 45 H ASN 45 16.433 1.979 -0.342 1254 HA ASN 45 HA ASN 45 15.057 3.612 -2.267 1255 HB2 ASN 45 2HB ASN 45 14.064 1.348 -2.763 1256 HB3 ASN 45 3HB ASN 45 13.556 1.219 -1.086 1257 HD21 ASN 45 1HD2 ASN 45 12.927 2.694 -4.166 1258 HD22 ASN 45 2HD2 ASN 45 11.395 3.382 -3.764 1259 H VAL 46 H VAL 46 14.543 1.876 0.814 1260 HA VAL 46 HA VAL 46 13.389 4.226 2.100 1261 HB VAL 46 HB VAL 46 12.334 2.040 2.501 1262 HG11 VAL 46 1HG1 VAL 46 14.907 1.146 3.837 1263 HG12 VAL 46 2HG1 VAL 46 14.273 0.552 2.301 1264 HG13 VAL 46 3HG1 VAL 46 13.388 0.243 3.796 1265 HG21 VAL 46 1HG2 VAL 46 13.606 3.145 5.028 1266 HG22 VAL 46 2HG2 VAL 46 12.185 2.100 4.969 1267 HG23 VAL 46 3HG2 VAL 46 12.122 3.715 4.263 1268 H THR 47 H THR 47 14.502 5.607 3.394 1269 HA THR 47 HA THR 47 17.366 5.299 3.800 1270 HB THR 47 HB THR 47 17.209 7.565 4.862 1271 HG1 THR 47 HG1 THR 47 14.520 7.804 4.094 1272 HG21 THR 47 1HG2 THR 47 16.552 8.822 2.849 1273 HG22 THR 47 2HG2 THR 47 15.743 7.399 2.193 1274 HG23 THR 47 3HG2 THR 47 17.496 7.403 2.396 1275 H SER 48 H SER 48 18.125 6.102 6.123 1276 HA SER 48 HA SER 48 17.708 3.875 7.813 1277 HB2 SER 48 2HB SER 48 19.219 5.095 9.398 1278 HB3 SER 48 3HB SER 48 19.854 5.038 7.751 1279 HG SER 48 HG SER 48 20.079 7.123 8.344 1280 H THR 49 H THR 49 16.728 7.278 8.129 1281 HA THR 49 HA THR 49 15.642 7.148 10.733 1282 HB THR 49 HB THR 49 14.538 9.319 10.123 1283 HG1 THR 49 HG1 THR 49 15.509 9.859 7.770 1284 HG21 THR 49 1HG2 THR 49 16.897 9.396 10.851 1285 HG22 THR 49 2HG2 THR 49 16.597 10.610 9.607 1286 HG23 THR 49 3HG2 THR 49 17.433 9.113 9.191 1287 H ILE 50 H ILE 50 14.238 6.692 7.526 1288 HA ILE 50 HA ILE 50 11.501 6.545 8.368 1289 HB ILE 50 HB ILE 50 12.815 5.682 5.748 1290 HG12 ILE 50 2HG1 ILE 50 13.091 8.086 6.171 1291 HG13 ILE 50 3HG1 ILE 50 11.940 7.851 4.862 1292 HG21 ILE 50 1HG2 ILE 50 9.858 6.067 6.336 1293 HG22 ILE 50 2HG2 ILE 50 10.661 4.530 6.012 1294 HG23 ILE 50 3HG2 ILE 50 10.556 5.753 4.745 1295 HD11 ILE 50 1HD1 ILE 50 11.287 8.573 7.724 1296 HD12 ILE 50 2HD1 ILE 50 10.089 8.265 6.463 1297 HD13 ILE 50 3HD1 ILE 50 11.202 9.624 6.311 1298 H LEU 51 H LEU 51 13.975 4.133 7.430 1299 HA LEU 51 HA LEU 51 12.433 1.798 7.769 1300 HB2 LEU 51 2HB LEU 51 14.602 1.885 6.535 1301 HB3 LEU 51 3HB LEU 51 15.453 2.128 8.052 1302 HG LEU 51 HG LEU 51 14.720 -0.150 8.808 1303 HD11 LEU 51 1HD1 LEU 51 13.552 -0.454 6.023 1304 HD12 LEU 51 2HD1 LEU 51 12.644 -0.368 7.535 1305 HD13 LEU 51 3HD1 LEU 51 13.712 -1.734 7.231 1306 HD21 LEU 51 1HD2 LEU 51 16.215 -1.457 7.361 1307 HD22 LEU 51 2HD2 LEU 51 16.918 0.111 7.745 1308 HD23 LEU 51 3HD2 LEU 51 16.203 -0.166 6.154 1309 H GLU 52 H GLU 52 14.332 3.710 10.027 1310 HA GLU 52 HA GLU 52 14.363 2.027 12.289 1311 HB2 GLU 52 2HB GLU 52 15.804 3.975 12.124 1312 HB3 GLU 52 3HB GLU 52 14.439 5.066 11.991 1313 HG2 GLU 52 2HG GLU 52 14.666 3.434 14.501 1314 HG3 GLU 52 3HG GLU 52 15.823 4.740 14.281 1315 H LYS 53 H LYS 53 12.157 4.665 11.379 1316 HA LYS 53 HA LYS 53 10.296 4.412 13.474 1317 HB2 LYS 53 2HB LYS 53 10.307 5.736 10.766 1318 HB3 LYS 53 3HB LYS 53 8.752 5.555 11.565 1319 HG2 LYS 53 2HG LYS 53 9.633 6.803 13.531 1320 HG3 LYS 53 3HG LYS 53 11.165 7.034 12.682 1321 HD2 LYS 53 2HD LYS 53 8.476 8.002 11.621 1322 HD3 LYS 53 3HD LYS 53 9.576 9.010 12.561 1323 HE2 LYS 53 2HE LYS 53 10.264 7.716 9.895 1324 HE3 LYS 53 3HE LYS 53 9.775 9.397 10.114 1325 HZ1 LYS 53 1HZ LYS 53 12.205 8.125 11.252 1326 HZ2 LYS 53 2HZ LYS 53 11.701 9.705 11.571 1327 HZ3 LYS 53 3HZ LYS 53 12.151 9.264 10.000 1328 H VAL 54 H VAL 54 10.396 2.916 10.268 1329 HA VAL 54 HA VAL 54 7.818 1.759 10.246 1330 HB VAL 54 HB VAL 54 10.369 1.146 8.688 1331 HG11 VAL 54 1HG1 VAL 54 9.052 -0.293 7.171 1332 HG12 VAL 54 2HG1 VAL 54 7.661 -0.157 8.247 1333 HG13 VAL 54 3HG1 VAL 54 9.126 -0.968 8.800 1334 HG21 VAL 54 1HG2 VAL 54 7.738 2.415 7.825 1335 HG22 VAL 54 2HG2 VAL 54 9.154 2.175 6.797 1336 HG23 VAL 54 3HG2 VAL 54 9.235 3.284 8.167 1337 H LEU 55 H LEU 55 10.997 0.465 11.229 1338 HA LEU 55 HA LEU 55 10.054 -2.166 11.875 1339 HB2 LEU 55 2HB LEU 55 12.625 -0.716 12.620 1340 HB3 LEU 55 3HB LEU 55 12.313 -2.404 13.006 1341 HG LEU 55 HG LEU 55 12.490 -1.252 10.196 1342 HD11 LEU 55 1HD1 LEU 55 14.598 -2.493 10.003 1343 HD12 LEU 55 2HD1 LEU 55 14.471 -2.998 11.689 1344 HD13 LEU 55 3HD1 LEU 55 14.670 -1.292 11.290 1345 HD21 LEU 55 1HD2 LEU 55 12.124 -4.143 11.062 1346 HD22 LEU 55 2HD2 LEU 55 12.385 -3.581 9.409 1347 HD23 LEU 55 3HD2 LEU 55 10.916 -3.127 10.265 1348 H ASP 56 H ASP 56 10.510 0.828 13.693 1349 HA ASP 56 HA ASP 56 10.256 -0.326 16.302 1350 HB2 ASP 56 2HB ASP 56 11.426 1.862 15.837 1351 HB3 ASP 56 3HB ASP 56 9.856 2.597 15.532 1352 H TYR 57 H TYR 57 8.006 1.171 14.025 1353 HA TYR 57 HA TYR 57 5.694 1.151 15.673 1354 HB2 TYR 57 2HB TYR 57 5.777 2.477 13.607 1355 HB3 TYR 57 3HB TYR 57 5.997 1.029 12.630 1356 HD1 TYR 57 HD1 TYR 57 4.105 -0.420 12.105 1357 HD2 TYR 57 HD2 TYR 57 3.543 3.030 14.559 1358 HE1 TYR 57 HE1 TYR 57 1.698 -0.662 11.877 1359 HE2 TYR 57 HE2 TYR 57 1.104 2.783 14.318 1360 HH TYR 57 HH TYR 57 -0.528 1.722 12.928 1361 H CYS 58 H CYS 58 7.035 -1.201 13.349 1362 HA CYS 58 HA CYS 58 5.082 -3.213 13.584 1363 HB2 CYS 58 2HB CYS 58 8.005 -3.387 12.779 1364 HB3 CYS 58 3HB CYS 58 6.867 -4.730 12.629 1365 HG CYS 58 HG CYS 58 7.439 -2.275 10.553 1366 H ARG 59 H ARG 59 7.926 -2.489 15.561 1367 HA ARG 59 HA ARG 59 8.044 -4.751 17.206 1368 HB2 ARG 59 2HB ARG 59 8.597 -1.829 17.875 1369 HB3 ARG 59 3HB ARG 59 8.887 -3.130 19.022 1370 HG2 ARG 59 2HG ARG 59 10.553 -4.117 17.529 1371 HG3 ARG 59 3HG ARG 59 10.237 -2.870 16.322 1372 HD2 ARG 59 2HD ARG 59 11.079 -1.142 17.796 1373 HD3 ARG 59 3HD ARG 59 11.242 -2.283 19.132 1374 HE ARG 59 HE ARG 59 12.978 -2.021 16.792 1375 HH11 ARG 59 1HH1 ARG 59 12.260 -3.772 19.752 1376 HH12 ARG 59 2HH1 ARG 59 13.825 -4.511 19.837 1377 HH21 ARG 59 1HH2 ARG 59 15.019 -2.988 16.913 1378 HH22 ARG 59 2HH2 ARG 59 15.391 -4.063 18.226 1379 H HIS 60 H HIS 60 6.158 -1.730 17.711 1380 HA HIS 60 HA HIS 60 4.891 -2.467 20.112 1381 HB2 HIS 60 2HB HIS 60 4.867 -0.122 19.366 1382 HB3 HIS 60 3HB HIS 60 3.891 -0.540 17.955 1383 HD1 HIS 60 HD1 HIS 60 1.427 -0.279 18.254 1384 HD2 HIS 60 HD2 HIS 60 3.365 -0.662 21.903 1385 HE1 HIS 60 HE1 HIS 60 -0.380 -0.220 19.987 1386 HE2 HIS 60 HE2 HIS 60 0.841 -0.212 22.177 1387 H HIS 61 H HIS 61 3.854 -2.882 16.748 1388 HA HIS 61 HA HIS 61 1.248 -3.863 17.209 1389 HB2 HIS 61 2HB HIS 61 2.144 -3.024 15.009 1390 HB3 HIS 61 3HB HIS 61 3.086 -4.499 14.857 1391 HD1 HIS 61 HD1 HIS 61 1.726 -6.725 14.421 1392 HD2 HIS 61 HD2 HIS 61 -0.542 -3.242 14.335 1393 HE1 HIS 61 HE1 HIS 61 -0.443 -7.361 13.337 1394 HE2 HIS 61 HE2 HIS 61 -1.879 -5.314 13.570 1395 H HIS 62 H HIS 62 4.389 -5.467 17.148 1396 HA HIS 62 HA HIS 62 3.355 -8.169 17.198 1397 HB2 HIS 62 2HB HIS 62 5.470 -7.776 16.083 1398 HB3 HIS 62 3HB HIS 62 6.153 -7.021 17.519 1399 HD1 HIS 62 HD1 HIS 62 4.459 -10.410 16.999 1400 HD2 HIS 62 HD2 HIS 62 7.978 -8.783 18.506 1401 HE1 HIS 62 HE1 HIS 62 5.764 -12.350 17.908 1402 HE2 HIS 62 HE2 HIS 62 7.900 -11.346 18.776 1403 H GLN 63 H GLN 63 4.879 -5.975 19.540 1404 HA GLN 63 HA GLN 63 5.080 -7.864 21.688 1405 HB2 GLN 63 2HB GLN 63 5.296 -4.814 21.639 1406 HB3 GLN 63 3HB GLN 63 5.662 -5.807 23.046 1407 HG2 GLN 63 2HG GLN 63 7.508 -6.887 21.858 1408 HG3 GLN 63 3HG GLN 63 7.112 -6.006 20.388 1409 HE21 GLN 63 1HE2 GLN 63 8.459 -5.739 23.607 1410 HE22 GLN 63 2HE2 GLN 63 9.248 -4.222 23.362 1411 H HIS 64 H HIS 64 2.698 -5.533 20.668 1412 HA HIS 64 HA HIS 64 0.808 -6.568 22.702 1413 HB2 HIS 64 2HB HIS 64 0.851 -3.799 21.404 1414 HB3 HIS 64 3HB HIS 64 -0.433 -4.392 22.454 1415 HD1 HIS 64 HD1 HIS 64 -0.102 -4.099 24.932 1416 HD2 HIS 64 HD2 HIS 64 3.397 -3.401 22.803 1417 HE1 HIS 64 HE1 HIS 64 1.546 -3.219 26.607 1418 HE2 HIS 64 HE2 HIS 64 3.680 -2.909 25.323 1419 HA PRO 65 HA PRO 65 -0.236 -8.323 18.497 1420 HB2 PRO 65 2HB PRO 65 -1.826 -10.102 20.357 1421 HB3 PRO 65 3HB PRO 65 -0.827 -10.546 18.953 1422 HG2 PRO 65 2HG PRO 65 0.116 -10.955 21.380 1423 HG3 PRO 65 3HG PRO 65 1.188 -10.280 20.127 1424 HD2 PRO 65 2HD PRO 65 -0.196 -8.851 22.394 1425 HD3 PRO 65 3HD PRO 65 1.457 -8.648 21.768 1426 H GLY 66 H GLY 66 -1.443 -6.645 17.753 1427 HA2 GLY 66 2HA GLY 66 -4.230 -6.868 17.509 1428 HA3 GLY 66 3HA GLY 66 -3.896 -5.667 18.760 1429 H GLY 67 H GLY 67 -3.003 -3.690 18.215 1430 HA2 GLY 67 2HA GLY 67 -1.552 -2.489 16.563 1431 HA3 GLY 67 3HA GLY 67 -2.629 -3.112 15.322 1432 H SER 68 H SER 68 -3.466 -1.257 14.547 1433 HA SER 68 HA SER 68 -4.306 0.946 16.191 1434 HB2 SER 68 2HB SER 68 -4.677 0.420 13.216 1435 HB3 SER 68 3HB SER 68 -4.981 1.962 14.026 1436 HG SER 68 HG SER 68 -2.477 0.760 14.379 1437 H GLY 69 H GLY 69 -6.005 0.479 17.494 1438 HA2 GLY 69 2HA GLY 69 -8.295 -1.050 16.880 1439 HA3 GLY 69 3HA GLY 69 -8.172 0.155 18.158 1440 H LEU 70 H LEU 70 -10.428 -0.399 16.439 1441 HA LEU 70 HA LEU 70 -10.698 1.423 14.286 1442 HB2 LEU 70 2HB LEU 70 -12.811 -0.056 15.908 1443 HB3 LEU 70 3HB LEU 70 -13.184 0.925 14.499 1444 HG LEU 70 HG LEU 70 -11.753 -0.634 13.104 1445 HD11 LEU 70 1HD1 LEU 70 -11.168 -2.857 13.948 1446 HD12 LEU 70 2HD1 LEU 70 -11.721 -2.401 15.563 1447 HD13 LEU 70 3HD1 LEU 70 -10.327 -1.592 14.847 1448 HD21 LEU 70 1HD2 LEU 70 -14.183 -0.838 13.126 1449 HD22 LEU 70 2HD2 LEU 70 -14.104 -1.908 14.526 1450 HD23 LEU 70 3HD2 LEU 70 -13.431 -2.426 12.978 1451 H ASP 71 H ASP 71 -10.336 3.497 14.717 1452 HA ASP 71 HA ASP 71 -10.624 5.647 15.304 1453 HB2 ASP 71 2HB ASP 71 -13.105 5.192 15.205 1454 HB3 ASP 71 3HB ASP 71 -13.075 4.823 16.922 1455 H ASP 72 H ASP 72 -9.869 3.230 17.405 1456 HA ASP 72 HA ASP 72 -9.627 4.609 19.908 1457 HB2 ASP 72 2HB ASP 72 -9.906 2.191 19.911 1458 HB3 ASP 72 3HB ASP 72 -8.515 1.968 18.855 1459 H ILE 73 H ILE 73 -7.166 3.235 17.711 1460 HA ILE 73 HA ILE 73 -5.052 3.718 17.173 1461 HB ILE 73 HB ILE 73 -5.855 6.635 17.534 1462 HG12 ILE 73 2HG1 ILE 73 -7.424 5.473 16.004 1463 HG13 ILE 73 3HG1 ILE 73 -6.435 6.625 15.117 1464 HG21 ILE 73 1HG2 ILE 73 -3.422 6.369 17.354 1465 HG22 ILE 73 2HG2 ILE 73 -4.057 7.121 15.892 1466 HG23 ILE 73 3HG2 ILE 73 -3.611 5.415 15.881 1467 HD11 ILE 73 1HD1 ILE 73 -5.045 4.764 14.288 1468 HD12 ILE 73 2HD1 ILE 73 -6.744 4.580 13.857 1469 HD13 ILE 73 3HD1 ILE 73 -6.065 3.624 15.171 1470 HA PRO 74 HA PRO 74 -3.384 3.785 21.474 1471 HB2 PRO 74 2HB PRO 74 -1.009 2.588 20.070 1472 HB3 PRO 74 3HB PRO 74 -1.890 1.995 21.493 1473 HG2 PRO 74 2HG PRO 74 -2.170 0.788 19.142 1474 HG3 PRO 74 3HG PRO 74 -3.577 1.010 20.210 1475 HD2 PRO 74 2HD PRO 74 -2.792 2.594 17.765 1476 HD3 PRO 74 3HD PRO 74 -4.398 2.011 18.264 1477 HA PRO 75 HA PRO 75 -1.383 7.682 21.704 1478 HB2 PRO 75 2HB PRO 75 0.589 6.397 23.610 1479 HB3 PRO 75 3HB PRO 75 -0.362 7.889 23.804 1480 HG2 PRO 75 2HG PRO 75 -1.153 5.698 25.033 1481 HG3 PRO 75 3HG PRO 75 -2.356 6.733 24.225 1482 HD2 PRO 75 2HD PRO 75 -1.202 4.109 23.312 1483 HD3 PRO 75 3HD PRO 75 -2.864 4.724 23.163 1484 H TYR 76 H TYR 76 1.341 5.292 21.822 1485 HA TYR 76 HA TYR 76 3.324 6.851 20.641 1486 HB2 TYR 76 2HB TYR 76 4.152 4.847 21.576 1487 HB3 TYR 76 3HB TYR 76 2.903 3.852 20.831 1488 HD1 TYR 76 HD1 TYR 76 5.915 5.932 19.902 1489 HD2 TYR 76 HD2 TYR 76 3.470 2.560 18.917 1490 HE1 TYR 76 HE1 TYR 76 7.403 5.387 18.027 1491 HE2 TYR 76 HE2 TYR 76 4.966 2.021 17.049 1492 HH TYR 76 HH TYR 76 8.002 3.483 16.622 1493 H ASP 77 H ASP 77 0.962 4.756 19.118 1494 HA ASP 77 HA ASP 77 2.027 4.849 16.471 1495 HB2 ASP 77 2HB ASP 77 -0.752 3.982 17.397 1496 HB3 ASP 77 3HB ASP 77 0.033 3.540 15.880 1497 H ARG 78 H ARG 78 -0.301 6.724 18.263 1498 HA ARG 78 HA ARG 78 -1.370 8.264 16.085 1499 HB2 ARG 78 2HB ARG 78 -2.544 7.956 18.259 1500 HB3 ARG 78 3HB ARG 78 -1.274 8.856 19.080 1501 HG2 ARG 78 2HG ARG 78 -1.897 10.884 17.800 1502 HG3 ARG 78 3HG ARG 78 -3.168 9.969 16.982 1503 HD2 ARG 78 2HD ARG 78 -4.292 9.581 19.143 1504 HD3 ARG 78 3HD ARG 78 -3.012 10.477 19.973 1505 HE ARG 78 HE ARG 78 -4.057 12.162 18.019 1506 HH11 ARG 78 1HH1 ARG 78 -5.212 10.615 20.969 1507 HH12 ARG 78 2HH1 ARG 78 -6.376 11.860 21.303 1508 HH21 ARG 78 1HH2 ARG 78 -5.588 13.780 18.460 1509 HH22 ARG 78 2HH2 ARG 78 -6.586 13.656 19.874 1510 H ASP 79 H ASP 79 1.311 8.675 18.403 1511 HA ASP 79 HA ASP 79 2.154 11.247 17.480 1512 HB2 ASP 79 2HB ASP 79 3.579 9.107 19.094 1513 HB3 ASP 79 3HB ASP 79 4.391 10.595 18.622 1514 H PHE 80 H PHE 80 2.788 7.970 16.459 1515 HA PHE 80 HA PHE 80 4.973 8.345 14.719 1516 HB2 PHE 80 2HB PHE 80 4.195 6.108 15.459 1517 HB3 PHE 80 3HB PHE 80 2.684 6.314 14.586 1518 HD1 PHE 80 HD1 PHE 80 6.320 5.734 14.232 1519 HD2 PHE 80 HD2 PHE 80 2.576 5.930 12.171 1520 HE1 PHE 80 HE1 PHE 80 7.345 4.735 12.246 1521 HE2 PHE 80 HE2 PHE 80 3.627 4.930 10.181 1522 HZ PHE 80 HZ PHE 80 6.017 4.336 10.222 1523 H CYS 81 H CYS 81 1.499 8.788 14.298 1524 HA CYS 81 HA CYS 81 1.400 9.165 11.494 1525 HB2 CYS 81 2HB CYS 81 -0.448 10.289 13.640 1526 HB3 CYS 81 3HB CYS 81 -0.836 10.096 11.931 1527 HG CYS 81 HG CYS 81 0.128 7.209 13.169 1528 H LYS 82 H LYS 82 2.252 11.306 14.136 1529 HA LYS 82 HA LYS 82 2.073 13.748 12.519 1530 HB2 LYS 82 2HB LYS 82 2.869 13.332 15.426 1531 HB3 LYS 82 3HB LYS 82 2.725 14.900 14.636 1532 HG2 LYS 82 2HG LYS 82 0.326 14.563 14.313 1533 HG3 LYS 82 3HG LYS 82 0.438 12.935 14.989 1534 HD2 LYS 82 2HD LYS 82 1.022 15.518 16.500 1535 HD3 LYS 82 3HD LYS 82 -0.441 14.544 16.654 1536 HE2 LYS 82 2HE LYS 82 0.894 12.652 17.506 1537 HE3 LYS 82 3HE LYS 82 2.370 13.598 17.327 1538 HZ1 LYS 82 1HZ LYS 82 1.546 15.139 18.975 1539 HZ2 LYS 82 2HZ LYS 82 1.571 13.570 19.605 1540 HZ3 LYS 82 3HZ LYS 82 0.108 14.268 19.120 1541 H VAL 83 H VAL 83 3.694 13.251 11.014 1542 HA VAL 83 HA VAL 83 6.453 13.811 11.952 1543 HB VAL 83 HB VAL 83 7.290 12.499 9.947 1544 HG11 VAL 83 1HG1 VAL 83 7.030 10.246 10.930 1545 HG12 VAL 83 2HG1 VAL 83 5.717 10.836 11.954 1546 HG13 VAL 83 3HG1 VAL 83 7.355 11.457 12.173 1547 HG21 VAL 83 1HG2 VAL 83 5.236 12.545 8.579 1548 HG22 VAL 83 2HG2 VAL 83 4.419 11.499 9.739 1549 HG23 VAL 83 3HG2 VAL 83 5.791 10.886 8.813 1550 H ASP 84 H ASP 84 7.728 14.537 9.812 1551 HA ASP 84 HA ASP 84 6.620 17.018 8.924 1552 HB2 ASP 84 2HB ASP 84 9.044 16.639 9.250 1553 HB3 ASP 84 3HB ASP 84 9.043 15.426 7.980 1554 H GLN 85 H GLN 85 6.118 17.581 6.670 1555 HA GLN 85 HA GLN 85 4.166 15.868 5.621 1556 HB2 GLN 85 2HB GLN 85 3.860 18.232 5.357 1557 HB3 GLN 85 3HB GLN 85 5.385 18.419 4.507 1558 HG2 GLN 85 2HG GLN 85 3.602 18.674 2.929 1559 HG3 GLN 85 3HG GLN 85 4.422 17.162 2.577 1560 HE21 GLN 85 1HE2 GLN 85 1.823 17.971 1.751 1561 HE22 GLN 85 2HE2 GLN 85 0.717 16.795 2.347 1562 HA PRO 86 HA PRO 86 7.251 14.688 1.875 1563 HB2 PRO 86 2HB PRO 86 9.862 15.224 3.312 1564 HB3 PRO 86 3HB PRO 86 9.473 15.355 1.580 1565 HG2 PRO 86 2HG PRO 86 9.688 17.552 3.036 1566 HG3 PRO 86 3HG PRO 86 8.390 17.409 1.825 1567 HD2 PRO 86 2HD PRO 86 8.218 17.123 4.820 1568 HD3 PRO 86 3HD PRO 86 7.096 17.918 3.693 1569 H THR 87 H THR 87 8.438 14.389 5.233 1570 HA THR 87 HA THR 87 9.460 11.790 5.198 1571 HB THR 87 HB THR 87 8.222 13.325 7.522 1572 HG1 THR 87 HG1 THR 87 10.622 13.637 7.862 1573 HG21 THR 87 1HG2 THR 87 9.608 11.949 9.006 1574 HG22 THR 87 2HG2 THR 87 10.200 11.019 7.631 1575 HG23 THR 87 3HG2 THR 87 8.500 10.918 8.096 1576 H LEU 88 H LEU 88 6.157 12.914 5.633 1577 HA LEU 88 HA LEU 88 4.963 10.514 6.559 1578 HB2 LEU 88 2HB LEU 88 4.043 12.890 6.673 1579 HB3 LEU 88 3HB LEU 88 3.620 12.755 4.980 1580 HG LEU 88 HG LEU 88 2.506 10.772 7.003 1581 HD11 LEU 88 1HD1 LEU 88 1.286 13.478 6.376 1582 HD12 LEU 88 2HD1 LEU 88 1.986 12.977 7.915 1583 HD13 LEU 88 3HD1 LEU 88 0.529 12.189 7.318 1584 HD21 LEU 88 1HD2 LEU 88 2.171 10.212 4.639 1585 HD22 LEU 88 2HD2 LEU 88 1.406 11.775 4.354 1586 HD23 LEU 88 3HD2 LEU 88 0.634 10.592 5.413 1587 H PHE 89 H PHE 89 5.368 11.940 3.318 1588 HA PHE 89 HA PHE 89 4.142 9.823 1.866 1589 HB2 PHE 89 2HB PHE 89 6.109 11.966 0.960 1590 HB3 PHE 89 3HB PHE 89 5.251 10.881 -0.135 1591 HD1 PHE 89 HD1 PHE 89 5.171 14.144 0.844 1592 HD2 PHE 89 HD2 PHE 89 2.541 10.773 0.720 1593 HE1 PHE 89 HE1 PHE 89 3.225 15.655 0.799 1594 HE2 PHE 89 HE2 PHE 89 0.615 12.288 0.670 1595 HZ PHE 89 HZ PHE 89 0.947 14.725 0.713 1596 H GLU 90 H GLU 90 7.431 10.357 3.018 1597 HA GLU 90 HA GLU 90 8.727 8.277 1.582 1598 HB2 GLU 90 2HB GLU 90 9.442 9.441 4.307 1599 HB3 GLU 90 3HB GLU 90 10.495 8.435 3.324 1600 HG2 GLU 90 2HG GLU 90 9.502 11.198 2.617 1601 HG3 GLU 90 3HG GLU 90 11.123 10.787 3.160 1602 H LEU 91 H LEU 91 7.001 8.338 4.686 1603 HA LEU 91 HA LEU 91 7.454 5.635 5.460 1604 HB2 LEU 91 2HB LEU 91 5.226 7.568 6.198 1605 HB3 LEU 91 3HB LEU 91 5.415 5.992 6.941 1606 HG LEU 91 HG LEU 91 7.453 8.252 7.149 1607 HD11 LEU 91 1HD1 LEU 91 5.353 8.800 8.333 1608 HD12 LEU 91 2HD1 LEU 91 6.682 8.542 9.458 1609 HD13 LEU 91 3HD1 LEU 91 5.460 7.285 9.237 1610 HD21 LEU 91 1HD2 LEU 91 8.518 6.870 8.876 1611 HD22 LEU 91 2HD2 LEU 91 8.483 6.026 7.330 1612 HD23 LEU 91 3HD2 LEU 91 7.338 5.585 8.600 1613 H ILE 92 H ILE 92 4.951 7.196 3.457 1614 HA ILE 92 HA ILE 92 3.261 4.943 3.048 1615 HB ILE 92 HB ILE 92 3.707 7.364 1.221 1616 HG12 ILE 92 2HG1 ILE 92 1.528 6.843 3.300 1617 HG13 ILE 92 3HG1 ILE 92 2.841 8.002 3.450 1618 HG21 ILE 92 1HG2 ILE 92 1.454 5.320 1.129 1619 HG22 ILE 92 2HG2 ILE 92 2.734 5.506 -0.071 1620 HG23 ILE 92 3HG2 ILE 92 1.544 6.788 0.152 1621 HD11 ILE 92 1HD1 ILE 92 0.586 8.133 1.450 1622 HD12 ILE 92 2HD1 ILE 92 1.917 9.285 1.577 1623 HD13 ILE 92 3HD1 ILE 92 0.770 9.115 2.904 1624 H LEU 93 H LEU 93 6.022 6.250 1.205 1625 HA LEU 93 HA LEU 93 6.040 4.408 -0.938 1626 HB2 LEU 93 2HB LEU 93 8.292 6.080 0.241 1627 HB3 LEU 93 3HB LEU 93 8.439 5.175 -1.257 1628 HG LEU 93 HG LEU 93 6.526 7.501 -0.792 1629 HD11 LEU 93 1HD1 LEU 93 8.873 8.221 -0.870 1630 HD12 LEU 93 2HD1 LEU 93 7.979 8.785 -2.276 1631 HD13 LEU 93 3HD1 LEU 93 9.081 7.414 -2.427 1632 HD21 LEU 93 1HD2 LEU 93 5.583 5.902 -2.389 1633 HD22 LEU 93 2HD2 LEU 93 7.068 5.937 -3.340 1634 HD23 LEU 93 3HD2 LEU 93 6.069 7.386 -3.208 1635 H ALA 94 H ALA 94 7.631 4.388 2.225 1636 HA ALA 94 HA ALA 94 9.188 2.012 1.847 1637 HB1 ALA 94 1HB ALA 94 9.781 3.711 3.523 1638 HB2 ALA 94 2HB ALA 94 9.564 2.136 4.279 1639 HB3 ALA 94 3HB ALA 94 8.305 3.367 4.425 1640 H ALA 95 H ALA 95 5.971 2.688 3.172 1641 HA ALA 95 HA ALA 95 5.425 0.082 4.213 1642 HB1 ALA 95 1HB ALA 95 3.127 0.858 4.428 1643 HB2 ALA 95 2HB ALA 95 3.468 2.239 3.378 1644 HB3 ALA 95 3HB ALA 95 4.245 2.117 4.955 1645 H ASN 96 H ASN 96 4.997 1.582 1.061 1646 HA ASN 96 HA ASN 96 3.548 -0.592 -0.165 1647 HB2 ASN 96 2HB ASN 96 3.344 1.631 -1.124 1648 HB3 ASN 96 3HB ASN 96 5.091 1.797 -1.283 1649 HD21 ASN 96 1HD2 ASN 96 4.942 2.220 -3.475 1650 HD22 ASN 96 2HD2 ASN 96 4.608 1.004 -4.642 1651 H TYR 97 H TYR 97 6.935 0.509 -0.174 1652 HA TYR 97 HA TYR 97 8.015 -1.371 -1.965 1653 HB2 TYR 97 2HB TYR 97 9.180 0.710 -1.499 1654 HB3 TYR 97 3HB TYR 97 9.311 0.329 0.211 1655 HD1 TYR 97 HD1 TYR 97 11.426 -0.396 0.955 1656 HD2 TYR 97 HD2 TYR 97 10.352 -1.154 -3.115 1657 HE1 TYR 97 HE1 TYR 97 13.649 -1.366 0.556 1658 HE2 TYR 97 HE2 TYR 97 12.574 -2.127 -3.515 1659 HH TYR 97 HH TYR 97 14.836 -2.031 -2.569 1660 H LEU 98 H LEU 98 7.550 -1.496 1.527 1661 HA LEU 98 HA LEU 98 8.931 -4.093 1.760 1662 HB2 LEU 98 2HB LEU 98 7.899 -2.218 3.929 1663 HB3 LEU 98 3HB LEU 98 8.827 -3.681 4.202 1664 HG LEU 98 HG LEU 98 9.831 -1.144 2.851 1665 HD11 LEU 98 1HD1 LEU 98 9.641 -0.884 5.267 1666 HD12 LEU 98 2HD1 LEU 98 11.336 -0.927 4.786 1667 HD13 LEU 98 3HD1 LEU 98 10.595 -2.347 5.530 1668 HD21 LEU 98 1HD2 LEU 98 10.876 -3.039 1.764 1669 HD22 LEU 98 2HD2 LEU 98 11.323 -3.739 3.319 1670 HD23 LEU 98 3HD2 LEU 98 12.056 -2.224 2.788 1671 H ASP 99 H ASP 99 5.855 -2.845 1.334 1672 HA ASP 99 HA ASP 99 3.726 -3.326 1.793 1673 HB2 ASP 99 2HB ASP 99 4.199 -5.042 0.064 1674 HB3 ASP 99 3HB ASP 99 4.574 -6.208 1.335 1675 H ILE 100 H ILE 100 3.780 -2.602 3.905 1676 HA ILE 100 HA ILE 100 3.234 -4.678 5.953 1677 HB ILE 100 HB ILE 100 4.411 -1.903 6.501 1678 HG12 ILE 100 2HG1 ILE 100 5.811 -4.617 6.493 1679 HG13 ILE 100 3HG1 ILE 100 6.086 -3.299 5.361 1680 HG21 ILE 100 1HG2 ILE 100 3.019 -2.772 8.347 1681 HG22 ILE 100 2HG2 ILE 100 4.717 -2.724 8.818 1682 HG23 ILE 100 3HG2 ILE 100 3.969 -4.260 8.381 1683 HD11 ILE 100 1HD1 ILE 100 6.734 -3.272 8.300 1684 HD12 ILE 100 2HD1 ILE 100 6.974 -1.933 7.175 1685 HD13 ILE 100 3HD1 ILE 100 7.866 -3.436 6.958 1686 H LYS 101 H LYS 101 1.062 -4.711 5.907 1687 HA LYS 101 HA LYS 101 -0.675 -2.702 5.079 1688 HB2 LYS 101 2HB LYS 101 -1.179 -5.143 6.829 1689 HB3 LYS 101 3HB LYS 101 -2.476 -4.110 6.245 1690 HG2 LYS 101 2HG LYS 101 -0.547 -5.664 4.495 1691 HG3 LYS 101 3HG LYS 101 -2.213 -6.125 4.859 1692 HD2 LYS 101 2HD LYS 101 -2.984 -3.978 3.785 1693 HD3 LYS 101 3HD LYS 101 -1.311 -3.657 3.322 1694 HE2 LYS 101 2HE LYS 101 -2.922 -6.077 2.444 1695 HE3 LYS 101 3HE LYS 101 -2.642 -4.632 1.477 1696 HZ1 LYS 101 1HZ LYS 101 -0.257 -5.085 1.590 1697 HZ2 LYS 101 2HZ LYS 101 -1.107 -6.342 0.854 1698 HZ3 LYS 101 3HZ LYS 101 -0.560 -6.510 2.447 1699 HA PRO 102 HA PRO 102 -1.473 -1.497 9.867 1700 HB2 PRO 102 2HB PRO 102 1.295 -2.111 10.919 1701 HB3 PRO 102 3HB PRO 102 -0.278 -2.222 11.744 1702 HG2 PRO 102 2HG PRO 102 0.927 -4.435 10.946 1703 HG3 PRO 102 3HG PRO 102 -0.831 -4.253 10.723 1704 HD2 PRO 102 2HD PRO 102 1.373 -3.952 8.683 1705 HD3 PRO 102 3HD PRO 102 -0.208 -4.750 8.525 1706 H LEU 103 H LEU 103 1.765 -1.148 8.396 1707 HA LEU 103 HA LEU 103 2.269 1.534 9.312 1708 HB2 LEU 103 2HB LEU 103 3.893 -0.403 8.324 1709 HB3 LEU 103 3HB LEU 103 3.590 0.418 6.813 1710 HG LEU 103 HG LEU 103 5.715 1.158 7.716 1711 HD11 LEU 103 1HD1 LEU 103 5.467 3.601 7.888 1712 HD12 LEU 103 2HD1 LEU 103 3.719 3.418 8.056 1713 HD13 LEU 103 3HD1 LEU 103 4.519 2.932 6.561 1714 HD21 LEU 103 1HD2 LEU 103 4.272 1.964 10.257 1715 HD22 LEU 103 2HD2 LEU 103 5.987 2.198 9.905 1716 HD23 LEU 103 3HD2 LEU 103 5.337 0.569 10.062 1717 H LEU 104 H LEU 104 1.084 0.053 6.335 1718 HA LEU 104 HA LEU 104 1.092 2.334 4.667 1719 HB2 LEU 104 2HB LEU 104 1.150 -0.050 3.895 1720 HB3 LEU 104 3HB LEU 104 -0.512 -0.247 4.406 1721 HG LEU 104 HG LEU 104 -1.203 1.447 2.683 1722 HD11 LEU 104 1HD1 LEU 104 1.709 1.361 1.824 1723 HD12 LEU 104 2HD1 LEU 104 0.860 2.747 2.514 1724 HD13 LEU 104 3HD1 LEU 104 0.393 2.132 0.932 1725 HD21 LEU 104 1HD2 LEU 104 -1.306 -0.962 2.185 1726 HD22 LEU 104 2HD2 LEU 104 0.351 -0.921 1.578 1727 HD23 LEU 104 3HD2 LEU 104 -0.919 -0.030 0.739 1728 H ASP 105 H ASP 105 -1.474 0.687 6.494 1729 HA ASP 105 HA ASP 105 -3.654 2.171 5.516 1730 HB2 ASP 105 2HB ASP 105 -3.936 -0.021 6.644 1731 HB3 ASP 105 3HB ASP 105 -3.432 0.686 8.180 1732 H VAL 106 H VAL 106 -1.787 2.470 8.523 1733 HA VAL 106 HA VAL 106 -3.181 4.611 9.669 1734 HB VAL 106 HB VAL 106 -0.378 3.507 10.069 1735 HG11 VAL 106 1HG1 VAL 106 -0.219 5.878 10.708 1736 HG12 VAL 106 2HG1 VAL 106 -0.134 4.835 12.126 1737 HG13 VAL 106 3HG1 VAL 106 -1.628 5.704 11.762 1738 HG21 VAL 106 1HG2 VAL 106 -2.231 2.078 10.763 1739 HG22 VAL 106 2HG2 VAL 106 -2.904 3.379 11.749 1740 HG23 VAL 106 3HG2 VAL 106 -1.355 2.656 12.180 1741 H THR 107 H THR 107 -0.142 4.680 7.750 1742 HA THR 107 HA THR 107 0.282 7.472 8.117 1743 HB THR 107 HB THR 107 1.516 5.643 6.010 1744 HG1 THR 107 HG1 THR 107 2.302 4.740 7.777 1745 HG21 THR 107 1HG2 THR 107 2.564 8.237 7.214 1746 HG22 THR 107 2HG2 THR 107 1.908 8.073 5.584 1747 HG23 THR 107 3HG2 THR 107 3.389 7.229 6.024 1748 H CYS 108 H CYS 108 -1.099 5.586 5.419 1749 HA CYS 108 HA CYS 108 -1.520 7.790 3.642 1750 HB2 CYS 108 2HB CYS 108 -2.846 5.052 3.706 1751 HB3 CYS 108 3HB CYS 108 -2.938 6.197 2.363 1752 HG CYS 108 HG CYS 108 -0.550 4.025 3.132 1753 H LYS 109 H LYS 109 -3.384 6.344 6.240 1754 HA LYS 109 HA LYS 109 -5.869 7.697 5.736 1755 HB2 LYS 109 2HB LYS 109 -5.645 5.556 6.996 1756 HB3 LYS 109 3HB LYS 109 -4.817 6.404 8.291 1757 HG2 LYS 109 2HG LYS 109 -6.810 7.523 8.970 1758 HG3 LYS 109 3HG LYS 109 -7.656 7.114 7.476 1759 HD2 LYS 109 2HD LYS 109 -6.738 5.060 9.534 1760 HD3 LYS 109 3HD LYS 109 -8.371 5.724 9.461 1761 HE2 LYS 109 2HE LYS 109 -8.726 4.751 7.264 1762 HE3 LYS 109 3HE LYS 109 -7.040 4.231 7.175 1763 HZ1 LYS 109 1HZ LYS 109 -8.586 2.436 7.749 1764 HZ2 LYS 109 2HZ LYS 109 -9.000 3.242 9.176 1765 HZ3 LYS 109 3HZ LYS 109 -7.418 2.685 8.945 1766 H THR 110 H THR 110 -2.931 8.386 7.558 1767 HA THR 110 HA THR 110 -3.812 10.541 9.143 1768 HB THR 110 HB THR 110 -1.013 9.957 8.076 1769 HG1 THR 110 HG1 THR 110 -1.437 8.367 9.462 1770 HG21 THR 110 1HG2 THR 110 -0.190 11.413 9.918 1771 HG22 THR 110 2HG2 THR 110 -1.849 11.867 10.302 1772 HG23 THR 110 3HG2 THR 110 -1.143 12.335 8.754 1773 H VAL 111 H VAL 111 -2.197 10.547 5.919 1774 HA VAL 111 HA VAL 111 -2.287 13.364 5.601 1775 HB VAL 111 HB VAL 111 -0.742 11.953 4.277 1776 HG11 VAL 111 1HG1 VAL 111 -3.148 11.082 2.658 1777 HG12 VAL 111 2HG1 VAL 111 -2.199 10.060 3.737 1778 HG13 VAL 111 3HG1 VAL 111 -1.458 10.729 2.283 1779 HG21 VAL 111 1HG2 VAL 111 -2.546 13.664 2.534 1780 HG22 VAL 111 2HG2 VAL 111 -0.882 13.203 2.166 1781 HG23 VAL 111 3HG2 VAL 111 -1.222 14.252 3.542 1782 H ALA 112 H ALA 112 -4.585 10.808 4.821 1783 HA ALA 112 HA ALA 112 -6.524 12.372 3.452 1784 HB1 ALA 112 1HB ALA 112 -6.871 9.813 5.040 1785 HB2 ALA 112 2HB ALA 112 -6.455 9.919 3.329 1786 HB3 ALA 112 3HB ALA 112 -8.035 10.474 3.886 1787 H ASN 113 H ASN 113 -5.848 11.855 6.866 1788 HA ASN 113 HA ASN 113 -8.240 13.139 7.877 1789 HB2 ASN 113 2HB ASN 113 -5.631 12.367 9.272 1790 HB3 ASN 113 3HB ASN 113 -7.025 13.050 10.106 1791 HD21 ASN 113 1HD2 ASN 113 -5.638 10.418 10.354 1792 HD22 ASN 113 2HD2 ASN 113 -6.882 9.233 10.171 1793 H MET 114 H MET 114 -4.950 14.129 7.048 1794 HA MET 114 HA MET 114 -4.987 16.690 8.321 1795 HB2 MET 114 2HB MET 114 -3.264 15.727 5.994 1796 HB3 MET 114 3HB MET 114 -3.026 17.241 6.854 1797 HG2 MET 114 2HG MET 114 -2.688 15.830 8.954 1798 HG3 MET 114 3HG MET 114 -2.594 14.441 7.873 1799 HE1 MET 114 1HE MET 114 0.507 15.718 5.588 1800 HE2 MET 114 2HE MET 114 -1.151 16.251 5.322 1801 HE3 MET 114 3HE MET 114 -0.813 14.551 5.650 1802 H ILE 115 H ILE 115 -5.642 15.597 4.974 1803 HA ILE 115 HA ILE 115 -6.414 18.203 4.039 1804 HB ILE 115 HB ILE 115 -7.271 17.104 2.015 1805 HG12 ILE 115 2HG1 ILE 115 -6.683 14.439 3.389 1806 HG13 ILE 115 3HG1 ILE 115 -8.288 15.083 3.074 1807 HG21 ILE 115 1HG2 ILE 115 -5.158 16.088 1.216 1808 HG22 ILE 115 2HG2 ILE 115 -4.603 15.926 2.884 1809 HG23 ILE 115 3HG2 ILE 115 -4.849 17.528 2.189 1810 HD11 ILE 115 1HD1 ILE 115 -7.693 13.365 1.483 1811 HD12 ILE 115 2HD1 ILE 115 -6.271 14.278 0.982 1812 HD13 ILE 115 3HD1 ILE 115 -7.886 14.918 0.672 1813 H ARG 116 H ARG 116 -8.060 15.481 5.521 1814 HA ARG 116 HA ARG 116 -10.072 15.103 6.401 1815 HB2 ARG 116 2HB ARG 116 -9.261 16.852 7.913 1816 HB3 ARG 116 3HB ARG 116 -9.918 18.103 6.872 1817 HG2 ARG 116 2HG ARG 116 -11.254 17.780 8.898 1818 HG3 ARG 116 3HG ARG 116 -12.191 17.445 7.451 1819 HD2 ARG 116 2HD ARG 116 -10.887 15.180 8.972 1820 HD3 ARG 116 3HD ARG 116 -12.408 15.877 9.534 1821 HE ARG 116 HE ARG 116 -12.752 15.298 6.833 1822 HH11 ARG 116 1HH1 ARG 116 -12.210 13.466 9.805 1823 HH12 ARG 116 2HH1 ARG 116 -13.041 12.058 9.217 1824 HH21 ARG 116 1HH2 ARG 116 -13.840 13.457 6.103 1825 HH22 ARG 116 2HH2 ARG 116 -13.963 12.054 7.126 1826 H GLY 117 H GLY 117 -11.022 14.382 4.471 1827 HA2 GLY 117 2HA GLY 117 -12.615 16.189 2.823 1828 HA3 GLY 117 3HA GLY 117 -12.358 14.471 2.567 Start of MODEL 14 1 H1 SER 2 1H SER 2 -14.392 -14.033 -17.414 2 H2 SER 2 2H SER 2 -15.108 -13.255 -18.730 3 H3 SER 2 3H SER 2 -15.275 -14.929 -18.543 4 HA SER 2 HA SER 2 -17.281 -13.727 -17.926 5 HB2 SER 2 2HB SER 2 -15.869 -15.093 -15.596 6 HB3 SER 2 3HB SER 2 -17.613 -14.908 -15.796 7 HG SER 2 HG SER 2 -16.902 -16.960 -16.463 8 H LEU 3 H LEU 3 -18.257 -12.074 -16.769 9 HA LEU 3 HA LEU 3 -16.528 -10.038 -15.556 10 HB2 LEU 3 2HB LEU 3 -19.512 -9.988 -16.172 11 HB3 LEU 3 3HB LEU 3 -18.548 -8.611 -15.659 12 HG LEU 3 HG LEU 3 -18.109 -10.091 -18.287 13 HD11 LEU 3 1HD1 LEU 3 -19.645 -7.526 -17.817 14 HD12 LEU 3 2HD1 LEU 3 -20.317 -9.081 -18.315 15 HD13 LEU 3 3HD1 LEU 3 -19.227 -8.210 -19.392 16 HD21 LEU 3 1HD2 LEU 3 -16.766 -8.114 -18.905 17 HD22 LEU 3 2HD2 LEU 3 -16.106 -8.923 -17.487 18 HD23 LEU 3 3HD2 LEU 3 -17.025 -7.426 -17.297 19 H VAL 4 H VAL 4 -16.242 -10.066 -13.360 20 HA VAL 4 HA VAL 4 -18.356 -11.010 -11.567 21 HB VAL 4 HB VAL 4 -16.773 -10.477 -9.695 22 HG11 VAL 4 1HG1 VAL 4 -15.206 -12.340 -10.110 23 HG12 VAL 4 2HG1 VAL 4 -15.606 -12.304 -11.829 24 HG13 VAL 4 3HG1 VAL 4 -16.840 -12.747 -10.647 25 HG21 VAL 4 1HG2 VAL 4 -14.391 -9.952 -10.191 26 HG22 VAL 4 2HG2 VAL 4 -15.462 -8.658 -10.727 27 HG23 VAL 4 3HG2 VAL 4 -14.785 -9.785 -11.906 28 H LYS 5 H LYS 5 -19.698 -9.702 -10.505 29 HA LYS 5 HA LYS 5 -19.923 -6.944 -11.401 30 HB2 LYS 5 2HB LYS 5 -21.774 -8.662 -9.691 31 HB3 LYS 5 3HB LYS 5 -22.160 -7.059 -10.313 32 HG2 LYS 5 2HG LYS 5 -21.958 -7.946 -12.631 33 HG3 LYS 5 3HG LYS 5 -21.661 -9.556 -11.965 34 HD2 LYS 5 2HD LYS 5 -23.901 -9.552 -10.930 35 HD3 LYS 5 3HD LYS 5 -24.193 -7.915 -11.528 36 HE2 LYS 5 2HE LYS 5 -24.028 -8.764 -13.856 37 HE3 LYS 5 3HE LYS 5 -23.783 -10.398 -13.234 38 HZ1 LYS 5 1HZ LYS 5 -25.967 -10.273 -12.207 39 HZ2 LYS 5 2HZ LYS 5 -26.065 -10.046 -13.879 40 HZ3 LYS 5 3HZ LYS 5 -26.199 -8.723 -12.835 41 H LEU 6 H LEU 6 -18.363 -5.759 -10.287 42 HA LEU 6 HA LEU 6 -18.227 -5.945 -7.357 43 HB2 LEU 6 2HB LEU 6 -16.509 -4.362 -9.302 44 HB3 LEU 6 3HB LEU 6 -16.256 -4.451 -7.562 45 HG LEU 6 HG LEU 6 -15.975 -6.746 -9.551 46 HD11 LEU 6 1HD1 LEU 6 -14.112 -5.179 -9.623 47 HD12 LEU 6 2HD1 LEU 6 -13.614 -6.725 -8.942 48 HD13 LEU 6 3HD1 LEU 6 -13.881 -5.339 -7.879 49 HD21 LEU 6 1HD2 LEU 6 -16.908 -7.613 -7.453 50 HD22 LEU 6 2HD2 LEU 6 -15.632 -6.819 -6.528 51 HD23 LEU 6 3HD2 LEU 6 -15.234 -8.128 -7.642 52 H GLU 7 H GLU 7 -20.143 -5.003 -6.742 53 HA GLU 7 HA GLU 7 -20.941 -2.367 -7.579 54 HB2 GLU 7 2HB GLU 7 -22.628 -3.998 -6.852 55 HB3 GLU 7 3HB GLU 7 -21.887 -4.094 -5.257 56 HG2 GLU 7 2HG GLU 7 -22.498 -1.762 -4.799 57 HG3 GLU 7 3HG GLU 7 -23.135 -1.589 -6.434 58 H SER 8 H SER 8 -20.451 -0.469 -6.636 59 HA SER 8 HA SER 8 -18.361 -0.291 -4.640 60 HB2 SER 8 2HB SER 8 -18.571 2.177 -5.101 61 HB3 SER 8 3HB SER 8 -18.326 1.229 -6.570 62 HG SER 8 HG SER 8 -20.336 1.630 -7.203 63 H SER 9 H SER 9 -18.691 1.434 -2.863 64 HA SER 9 HA SER 9 -20.867 0.920 -1.147 65 HB2 SER 9 2HB SER 9 -20.010 2.950 0.103 66 HB3 SER 9 3HB SER 9 -18.758 1.762 -0.260 67 HG SER 9 HG SER 9 -19.050 4.349 -1.158 68 H ASP 10 H ASP 10 -20.451 3.106 -3.815 69 HA ASP 10 HA ASP 10 -22.727 4.819 -3.232 70 HB2 ASP 10 2HB ASP 10 -20.593 5.610 -4.358 71 HB3 ASP 10 3HB ASP 10 -21.024 4.640 -5.757 72 H GLU 11 H GLU 11 -22.647 1.705 -4.128 73 HA GLU 11 HA GLU 11 -24.225 0.258 -4.765 74 HB2 GLU 11 2HB GLU 11 -25.987 2.712 -5.065 75 HB3 GLU 11 3HB GLU 11 -26.585 1.065 -5.261 76 HG2 GLU 11 2HG GLU 11 -26.025 0.557 -2.931 77 HG3 GLU 11 3HG GLU 11 -25.333 2.169 -2.720 78 H LYS 12 H LYS 12 -22.646 2.131 -6.854 79 HA LYS 12 HA LYS 12 -24.070 1.292 -9.285 80 HB2 LYS 12 2HB LYS 12 -21.581 3.005 -8.909 81 HB3 LYS 12 3HB LYS 12 -22.281 2.599 -10.481 82 HG2 LYS 12 2HG LYS 12 -24.409 3.706 -9.768 83 HG3 LYS 12 3HG LYS 12 -23.620 4.202 -8.265 84 HD2 LYS 12 2HD LYS 12 -21.993 5.537 -9.559 85 HD3 LYS 12 3HD LYS 12 -22.735 5.010 -11.074 86 HE2 LYS 12 2HE LYS 12 -24.831 6.155 -10.438 87 HE3 LYS 12 3HE LYS 12 -24.097 6.665 -8.914 88 HZ1 LYS 12 1HZ LYS 12 -23.236 7.459 -11.635 89 HZ2 LYS 12 2HZ LYS 12 -22.439 7.880 -10.208 90 HZ3 LYS 12 3HZ LYS 12 -24.007 8.441 -10.489 91 H VAL 13 H VAL 13 -23.587 -0.497 -10.329 92 HA VAL 13 HA VAL 13 -21.496 -2.266 -9.323 93 HB VAL 13 HB VAL 13 -23.635 -2.802 -11.431 94 HG11 VAL 13 1HG1 VAL 13 -23.200 -5.202 -10.966 95 HG12 VAL 13 2HG1 VAL 13 -21.902 -4.748 -9.858 96 HG13 VAL 13 3HG1 VAL 13 -21.757 -4.387 -11.579 97 HG21 VAL 13 1HG2 VAL 13 -24.940 -3.905 -9.644 98 HG22 VAL 13 2HG2 VAL 13 -24.680 -2.199 -9.270 99 HG23 VAL 13 3HG2 VAL 13 -23.721 -3.436 -8.453 100 H PHE 14 H PHE 14 -19.581 -2.427 -10.281 101 HA PHE 14 HA PHE 14 -19.204 -1.693 -13.122 102 HB2 PHE 14 2HB PHE 14 -17.199 -1.765 -10.829 103 HB3 PHE 14 3HB PHE 14 -16.780 -1.434 -12.505 104 HD1 PHE 14 HD1 PHE 14 -17.197 0.738 -13.496 105 HD2 PHE 14 HD2 PHE 14 -18.561 -0.122 -9.528 106 HE1 PHE 14 HE1 PHE 14 -17.672 3.122 -13.139 107 HE2 PHE 14 HE2 PHE 14 -19.035 2.263 -9.185 108 HZ PHE 14 HZ PHE 14 -18.589 3.886 -10.985 109 H GLU 15 H GLU 15 -19.527 -3.545 -14.215 110 HA GLU 15 HA GLU 15 -18.685 -6.151 -13.236 111 HB2 GLU 15 2HB GLU 15 -19.900 -5.356 -15.922 112 HB3 GLU 15 3HB GLU 15 -19.711 -7.002 -15.314 113 HG2 GLU 15 2HG GLU 15 -21.258 -6.498 -13.458 114 HG3 GLU 15 3HG GLU 15 -21.459 -4.853 -14.063 115 H ILE 16 H ILE 16 -16.503 -6.168 -13.164 116 HA ILE 16 HA ILE 16 -14.908 -5.658 -15.613 117 HB ILE 16 HB ILE 16 -14.255 -4.428 -13.488 118 HG12 ILE 16 2HG1 ILE 16 -11.792 -4.973 -13.553 119 HG13 ILE 16 3HG1 ILE 16 -12.152 -6.402 -14.519 120 HG21 ILE 16 1HG2 ILE 16 -13.217 -5.639 -11.618 121 HG22 ILE 16 2HG2 ILE 16 -13.571 -7.181 -12.402 122 HG23 ILE 16 3HG2 ILE 16 -14.893 -6.148 -11.852 123 HD11 ILE 16 1HD1 ILE 16 -12.676 -3.547 -15.341 124 HD12 ILE 16 2HD1 ILE 16 -12.973 -4.990 -16.314 125 HD13 ILE 16 3HD1 ILE 16 -11.325 -4.556 -15.863 126 H GLU 17 H GLU 17 -13.407 -7.353 -16.266 127 HA GLU 17 HA GLU 17 -14.385 -10.012 -16.004 128 HB2 GLU 17 2HB GLU 17 -11.678 -9.092 -17.075 129 HB3 GLU 17 3HB GLU 17 -12.423 -10.667 -17.353 130 HG2 GLU 17 2HG GLU 17 -14.266 -9.581 -18.583 131 HG3 GLU 17 3HG GLU 17 -13.539 -8.003 -18.291 132 H LYS 18 H LYS 18 -13.534 -11.769 -14.864 133 HA LYS 18 HA LYS 18 -12.684 -11.207 -12.226 134 HB2 LYS 18 2HB LYS 18 -14.108 -13.138 -12.791 135 HB3 LYS 18 3HB LYS 18 -12.794 -13.865 -13.710 136 HG2 LYS 18 2HG LYS 18 -11.468 -14.098 -11.618 137 HG3 LYS 18 3HG LYS 18 -12.793 -13.376 -10.704 138 HD2 LYS 18 2HD LYS 18 -12.781 -15.830 -10.495 139 HD3 LYS 18 3HD LYS 18 -14.253 -15.257 -11.282 140 HE2 LYS 18 2HE LYS 18 -13.335 -15.899 -13.481 141 HE3 LYS 18 3HE LYS 18 -11.831 -16.413 -12.713 142 HZ1 LYS 18 1HZ LYS 18 -14.507 -17.592 -12.228 143 HZ2 LYS 18 2HZ LYS 18 -13.058 -18.104 -11.521 144 HZ3 LYS 18 3HZ LYS 18 -13.292 -18.269 -13.186 145 H GLU 19 H GLU 19 -10.994 -12.573 -15.034 146 HA GLU 19 HA GLU 19 -8.488 -13.176 -13.993 147 HB2 GLU 19 2HB GLU 19 -7.678 -12.836 -16.368 148 HB3 GLU 19 3HB GLU 19 -9.092 -13.872 -16.211 149 HG2 GLU 19 2HG GLU 19 -10.545 -11.948 -16.869 150 HG3 GLU 19 3HG GLU 19 -9.095 -10.966 -17.101 151 H ILE 20 H ILE 20 -9.838 -10.065 -14.785 152 HA ILE 20 HA ILE 20 -7.394 -8.536 -14.515 153 HB ILE 20 HB ILE 20 -10.321 -7.667 -14.608 154 HG12 ILE 20 2HG1 ILE 20 -8.249 -7.752 -16.853 155 HG13 ILE 20 3HG1 ILE 20 -9.618 -8.840 -16.682 156 HG21 ILE 20 1HG2 ILE 20 -9.478 -5.412 -15.136 157 HG22 ILE 20 2HG2 ILE 20 -7.820 -5.977 -14.919 158 HG23 ILE 20 3HG2 ILE 20 -8.933 -5.955 -13.549 159 HD11 ILE 20 1HD1 ILE 20 -9.739 -5.880 -17.249 160 HD12 ILE 20 2HD1 ILE 20 -11.140 -6.928 -17.008 161 HD13 ILE 20 3HD1 ILE 20 -10.061 -7.198 -18.375 162 H ALA 21 H ALA 21 -10.320 -9.220 -12.594 163 HA ALA 21 HA ALA 21 -9.690 -7.495 -10.387 164 HB1 ALA 21 1HB ALA 21 -11.720 -8.437 -9.356 165 HB2 ALA 21 2HB ALA 21 -11.789 -9.676 -10.614 166 HB3 ALA 21 3HB ALA 21 -12.013 -7.978 -11.037 167 H CYS 22 H CYS 22 -8.574 -10.604 -11.229 168 HA CYS 22 HA CYS 22 -8.179 -11.783 -8.662 169 HB2 CYS 22 2HB CYS 22 -6.795 -12.270 -11.331 170 HB3 CYS 22 3HB CYS 22 -6.517 -13.246 -9.889 171 HG CYS 22 HG CYS 22 -9.267 -13.992 -9.722 172 H MET 23 H MET 23 -6.360 -9.438 -10.556 173 HA MET 23 HA MET 23 -3.867 -9.591 -9.189 174 HB2 MET 23 2HB MET 23 -5.051 -7.198 -10.656 175 HB3 MET 23 3HB MET 23 -3.357 -7.417 -10.232 176 HG2 MET 23 2HG MET 23 -3.281 -9.414 -11.720 177 HG3 MET 23 3HG MET 23 -4.944 -9.079 -12.211 178 HE1 MET 23 1HE MET 23 -4.472 -5.533 -13.910 179 HE2 MET 23 2HE MET 23 -4.764 -5.788 -12.190 180 HE3 MET 23 3HE MET 23 -5.648 -6.738 -13.388 181 H SER 24 H SER 24 -6.882 -7.948 -8.525 182 HA SER 24 HA SER 24 -6.034 -6.552 -6.160 183 HB2 SER 24 2HB SER 24 -8.111 -5.922 -7.393 184 HB3 SER 24 3HB SER 24 -8.817 -7.494 -7.017 185 HG SER 24 HG SER 24 -7.954 -5.611 -5.085 186 H VAL 25 H VAL 25 -5.071 -7.820 -4.646 187 HA VAL 25 HA VAL 25 -5.408 -10.576 -4.289 188 HB VAL 25 HB VAL 25 -4.281 -8.508 -2.349 189 HG11 VAL 25 1HG1 VAL 25 -4.056 -11.541 -2.172 190 HG12 VAL 25 2HG1 VAL 25 -4.911 -10.491 -1.041 191 HG13 VAL 25 3HG1 VAL 25 -3.154 -10.399 -1.171 192 HG21 VAL 25 1HG2 VAL 25 -3.052 -8.650 -4.481 193 HG22 VAL 25 2HG2 VAL 25 -2.870 -10.395 -4.279 194 HG23 VAL 25 3HG2 VAL 25 -2.069 -9.290 -3.159 195 H THR 26 H THR 26 -6.866 -7.841 -2.503 196 HA THR 26 HA THR 26 -8.195 -9.285 -0.499 197 HB THR 26 HB THR 26 -8.930 -6.615 -1.752 198 HG1 THR 26 HG1 THR 26 -7.785 -5.871 0.201 199 HG21 THR 26 1HG2 THR 26 -9.797 -7.757 0.935 200 HG22 THR 26 2HG2 THR 26 -10.849 -7.490 -0.457 201 HG23 THR 26 3HG2 THR 26 -10.111 -6.115 0.366 202 H ILE 27 H ILE 27 -9.461 -8.121 -3.669 203 HA ILE 27 HA ILE 27 -12.097 -9.143 -3.361 204 HB ILE 27 HB ILE 27 -10.565 -8.366 -5.878 205 HG12 ILE 27 2HG1 ILE 27 -12.669 -6.828 -4.282 206 HG13 ILE 27 3HG1 ILE 27 -10.935 -6.525 -4.233 207 HG21 ILE 27 1HG2 ILE 27 -13.554 -8.910 -5.630 208 HG22 ILE 27 2HG2 ILE 27 -12.392 -9.898 -6.515 209 HG23 ILE 27 3HG2 ILE 27 -12.745 -8.260 -7.061 210 HD11 ILE 27 1HD1 ILE 27 -12.032 -4.889 -5.605 211 HD12 ILE 27 2HD1 ILE 27 -12.755 -6.146 -6.605 212 HD13 ILE 27 3HD1 ILE 27 -11.006 -5.906 -6.617 213 H LYS 28 H LYS 28 -9.199 -10.418 -4.976 214 HA LYS 28 HA LYS 28 -10.228 -12.769 -6.101 215 HB2 LYS 28 2HB LYS 28 -7.976 -11.851 -6.596 216 HB3 LYS 28 3HB LYS 28 -7.445 -12.259 -4.969 217 HG2 LYS 28 2HG LYS 28 -7.871 -14.689 -5.524 218 HG3 LYS 28 3HG LYS 28 -8.213 -14.196 -7.183 219 HD2 LYS 28 2HD LYS 28 -5.911 -15.024 -6.980 220 HD3 LYS 28 3HD LYS 28 -5.917 -13.311 -7.400 221 HE2 LYS 28 2HE LYS 28 -4.204 -13.769 -5.698 222 HE3 LYS 28 3HE LYS 28 -5.463 -12.738 -5.018 223 HZ1 LYS 28 1HZ LYS 28 -4.904 -14.423 -3.451 224 HZ2 LYS 28 2HZ LYS 28 -5.123 -15.655 -4.588 225 HZ3 LYS 28 3HZ LYS 28 -6.454 -14.770 -4.037 226 H ASN 29 H ASN 29 -8.751 -12.200 -2.904 227 HA ASN 29 HA ASN 29 -8.957 -14.831 -1.900 228 HB2 ASN 29 2HB ASN 29 -8.565 -12.152 -0.522 229 HB3 ASN 29 3HB ASN 29 -8.682 -13.652 0.399 230 HD21 ASN 29 1HD2 ASN 29 -6.556 -13.316 1.167 231 HD22 ASN 29 2HD2 ASN 29 -5.174 -13.618 0.174 232 H MET 30 H MET 30 -11.222 -12.102 -1.877 233 HA MET 30 HA MET 30 -13.127 -13.209 -0.064 234 HB2 MET 30 2HB MET 30 -13.377 -11.081 -2.222 235 HB3 MET 30 3HB MET 30 -14.755 -11.575 -1.244 236 HG2 MET 30 2HG MET 30 -13.559 -10.879 0.787 237 HG3 MET 30 3HG MET 30 -12.189 -10.356 -0.197 238 HE1 MET 30 1HE MET 30 -13.905 -8.509 1.950 239 HE2 MET 30 2HE MET 30 -13.914 -6.992 1.050 240 HE3 MET 30 3HE MET 30 -12.446 -7.967 1.117 241 H ILE 31 H ILE 31 -12.795 -13.334 -3.606 242 HA ILE 31 HA ILE 31 -15.149 -14.788 -4.211 243 HB ILE 31 HB ILE 31 -12.497 -14.652 -5.724 244 HG12 ILE 31 2HG1 ILE 31 -15.104 -13.127 -6.206 245 HG13 ILE 31 3HG1 ILE 31 -13.674 -12.456 -5.430 246 HG21 ILE 31 1HG2 ILE 31 -13.728 -16.660 -6.448 247 HG22 ILE 31 2HG2 ILE 31 -13.728 -15.451 -7.731 248 HG23 ILE 31 3HG2 ILE 31 -15.172 -15.691 -6.748 249 HD11 ILE 31 1HD1 ILE 31 -13.879 -13.377 -8.300 250 HD12 ILE 31 2HD1 ILE 31 -12.418 -12.754 -7.528 251 HD13 ILE 31 3HD1 ILE 31 -13.826 -11.713 -7.718 252 H GLU 32 H GLU 32 -11.830 -15.800 -3.464 253 HA GLU 32 HA GLU 32 -12.266 -18.611 -3.860 254 HB2 GLU 32 2HB GLU 32 -9.952 -17.137 -2.542 255 HB3 GLU 32 3HB GLU 32 -9.951 -18.851 -2.962 256 HG2 GLU 32 2HG GLU 32 -10.185 -18.264 -5.350 257 HG3 GLU 32 3HG GLU 32 -10.186 -16.551 -4.937 258 H ASP 33 H ASP 33 -12.550 -16.428 -1.145 259 HA ASP 33 HA ASP 33 -12.541 -18.345 0.986 260 HB2 ASP 33 2HB ASP 33 -12.117 -15.975 1.449 261 HB3 ASP 33 3HB ASP 33 -13.685 -15.523 0.794 262 H ILE 34 H ILE 34 -15.061 -16.816 -0.976 263 HA ILE 34 HA ILE 34 -17.269 -18.351 0.082 264 HB ILE 34 HB ILE 34 -17.071 -16.790 -2.545 265 HG12 ILE 34 2HG1 ILE 34 -18.149 -15.832 0.156 266 HG13 ILE 34 3HG1 ILE 34 -16.603 -15.359 -0.538 267 HG21 ILE 34 1HG2 ILE 34 -19.542 -17.717 -1.022 268 HG22 ILE 34 2HG2 ILE 34 -18.963 -18.361 -2.559 269 HG23 ILE 34 3HG2 ILE 34 -19.554 -16.703 -2.469 270 HD11 ILE 34 1HD1 ILE 34 -18.252 -13.614 -0.826 271 HD12 ILE 34 2HD1 ILE 34 -19.328 -14.723 -1.673 272 HD13 ILE 34 3HD1 ILE 34 -17.782 -14.268 -2.394 273 H GLY 35 H GLY 35 -14.813 -18.799 -2.323 274 HA2 GLY 35 2HA GLY 35 -14.229 -20.808 -3.404 275 HA3 GLY 35 3HA GLY 35 -15.870 -21.411 -3.174 276 H GLU 36 H GLU 36 -17.592 -20.325 -4.388 277 HA GLU 36 HA GLU 36 -16.829 -18.796 -6.792 278 HB2 GLU 36 2HB GLU 36 -18.681 -21.235 -6.781 279 HB3 GLU 36 3HB GLU 36 -18.502 -20.130 -8.144 280 HG2 GLU 36 2HG GLU 36 -16.117 -20.760 -8.328 281 HG3 GLU 36 3HG GLU 36 -16.308 -21.888 -6.987 282 H SER 37 H SER 37 -18.298 -17.159 -7.266 283 HA SER 37 HA SER 37 -20.880 -16.980 -5.903 284 HB2 SER 37 2HB SER 37 -19.303 -16.041 -4.234 285 HB3 SER 37 3HB SER 37 -18.684 -14.909 -5.433 286 HG SER 37 HG SER 37 -21.292 -15.020 -4.327 287 H ASP 38 H ASP 38 -22.094 -16.668 -7.694 288 HA ASP 38 HA ASP 38 -21.323 -14.874 -9.859 289 HB2 ASP 38 2HB ASP 38 -23.405 -15.551 -10.942 290 HB3 ASP 38 3HB ASP 38 -22.565 -16.977 -10.353 291 H SER 39 H SER 39 -23.100 -14.735 -6.895 292 HA SER 39 HA SER 39 -24.752 -12.488 -7.363 293 HB2 SER 39 2HB SER 39 -24.762 -12.321 -4.834 294 HB3 SER 39 3HB SER 39 -25.155 -13.930 -5.441 295 HG SER 39 HG SER 39 -22.477 -13.342 -4.835 296 HA PRO 40 HA PRO 40 -21.766 -9.170 -7.723 297 HB2 PRO 40 2HB PRO 40 -23.228 -7.073 -6.572 298 HB3 PRO 40 3HB PRO 40 -23.444 -7.654 -8.238 299 HG2 PRO 40 2HG PRO 40 -25.022 -8.373 -5.777 300 HG3 PRO 40 3HG PRO 40 -25.607 -7.979 -7.409 301 HD2 PRO 40 2HD PRO 40 -25.474 -10.526 -6.621 302 HD3 PRO 40 3HD PRO 40 -25.009 -10.086 -8.283 303 H ILE 41 H ILE 41 -20.028 -8.674 -6.556 304 HA ILE 41 HA ILE 41 -19.964 -8.980 -3.648 305 HB ILE 41 HB ILE 41 -17.677 -8.314 -5.583 306 HG12 ILE 41 2HG1 ILE 41 -16.887 -10.721 -4.916 307 HG13 ILE 41 3HG1 ILE 41 -18.531 -10.974 -4.348 308 HG21 ILE 41 1HG2 ILE 41 -17.514 -8.983 -2.612 309 HG22 ILE 41 2HG2 ILE 41 -17.199 -7.409 -3.344 310 HG23 ILE 41 3HG2 ILE 41 -16.129 -8.769 -3.688 311 HD11 ILE 41 1HD1 ILE 41 -17.718 -10.316 -7.182 312 HD12 ILE 41 2HD1 ILE 41 -19.365 -10.611 -6.617 313 HD13 ILE 41 3HD1 ILE 41 -18.170 -11.906 -6.563 314 HA PRO 42 HA PRO 42 -20.351 -4.393 -3.555 315 HB2 PRO 42 2HB PRO 42 -21.769 -4.183 -1.250 316 HB3 PRO 42 3HB PRO 42 -22.526 -4.708 -2.766 317 HG2 PRO 42 2HG PRO 42 -21.855 -6.317 -0.366 318 HG3 PRO 42 3HG PRO 42 -23.077 -6.611 -1.617 319 HD2 PRO 42 2HD PRO 42 -20.439 -7.786 -1.426 320 HD3 PRO 42 3HD PRO 42 -21.668 -8.071 -2.674 321 H LEU 43 H LEU 43 -18.567 -3.300 -3.021 322 HA LEU 43 HA LEU 43 -17.087 -3.813 -0.531 323 HB2 LEU 43 2HB LEU 43 -16.333 -2.141 -2.968 324 HB3 LEU 43 3HB LEU 43 -15.338 -2.323 -1.538 325 HG LEU 43 HG LEU 43 -14.370 -3.730 -3.196 326 HD11 LEU 43 1HD1 LEU 43 -14.473 -5.968 -2.256 327 HD12 LEU 43 2HD1 LEU 43 -15.956 -5.567 -1.387 328 HD13 LEU 43 3HD1 LEU 43 -14.442 -4.751 -0.980 329 HD21 LEU 43 1HD2 LEU 43 -16.222 -3.835 -4.792 330 HD22 LEU 43 2HD2 LEU 43 -17.083 -4.973 -3.751 331 HD23 LEU 43 3HD2 LEU 43 -15.550 -5.439 -4.495 332 HA PRO 44 HA PRO 44 -19.515 -0.110 0.714 333 HB2 PRO 44 2HB PRO 44 -19.779 -0.683 3.344 334 HB3 PRO 44 3HB PRO 44 -20.643 -1.636 2.118 335 HG2 PRO 44 2HG PRO 44 -18.148 -2.332 3.639 336 HG3 PRO 44 3HG PRO 44 -19.531 -3.366 3.206 337 HD2 PRO 44 2HD PRO 44 -17.113 -3.250 1.787 338 HD3 PRO 44 3HD PRO 44 -18.641 -3.879 1.144 339 H ASN 45 H ASN 45 -16.906 0.392 0.109 340 HA ASN 45 HA ASN 45 -16.018 2.254 2.178 341 HB2 ASN 45 2HB ASN 45 -14.775 0.209 2.763 342 HB3 ASN 45 3HB ASN 45 -14.236 0.022 1.103 343 HD21 ASN 45 1HD2 ASN 45 -13.850 1.872 4.043 344 HD22 ASN 45 2HD2 ASN 45 -12.338 2.588 3.622 345 H VAL 46 H VAL 46 -15.066 0.764 -0.943 346 HA VAL 46 HA VAL 46 -14.024 3.272 -1.946 347 HB VAL 46 HB VAL 46 -12.842 1.196 -2.512 348 HG11 VAL 46 1HG1 VAL 46 -14.722 -0.394 -2.598 349 HG12 VAL 46 2HG1 VAL 46 -13.747 -0.495 -4.065 350 HG13 VAL 46 3HG1 VAL 46 -15.300 0.348 -4.093 351 HG21 VAL 46 1HG2 VAL 46 -12.626 3.080 -4.060 352 HG22 VAL 46 2HG2 VAL 46 -14.037 2.532 -4.969 353 HG23 VAL 46 3HG2 VAL 46 -12.565 1.558 -4.952 354 H THR 47 H THR 47 -15.212 4.784 -2.942 355 HA THR 47 HA THR 47 -18.016 4.427 -3.553 356 HB THR 47 HB THR 47 -17.962 6.816 -4.228 357 HG1 THR 47 HG1 THR 47 -15.532 7.589 -3.601 358 HG21 THR 47 1HG2 THR 47 -18.144 6.308 -1.813 359 HG22 THR 47 2HG2 THR 47 -17.243 7.803 -2.074 360 HG23 THR 47 3HG2 THR 47 -16.383 6.314 -1.672 361 H SER 48 H SER 48 -18.815 5.378 -5.757 362 HA SER 48 HA SER 48 -18.041 3.548 -7.775 363 HB2 SER 48 2HB SER 48 -19.700 4.789 -9.186 364 HB3 SER 48 3HB SER 48 -20.341 4.348 -7.604 365 HG SER 48 HG SER 48 -20.878 6.456 -7.948 366 H THR 49 H THR 49 -17.494 7.011 -7.320 367 HA THR 49 HA THR 49 -16.282 7.700 -9.733 368 HB THR 49 HB THR 49 -15.765 8.873 -6.958 369 HG1 THR 49 HG1 THR 49 -17.836 9.169 -8.849 370 HG21 THR 49 1HG2 THR 49 -15.220 10.984 -8.151 371 HG22 THR 49 2HG2 THR 49 -15.408 10.164 -9.701 372 HG23 THR 49 3HG2 THR 49 -14.099 9.702 -8.610 373 H ILE 50 H ILE 50 -14.898 6.364 -6.762 374 HA ILE 50 HA ILE 50 -12.158 6.589 -7.669 375 HB ILE 50 HB ILE 50 -13.310 5.250 -5.186 376 HG12 ILE 50 2HG1 ILE 50 -13.797 7.641 -5.162 377 HG13 ILE 50 3HG1 ILE 50 -12.502 7.340 -4.013 378 HG21 ILE 50 1HG2 ILE 50 -10.417 5.951 -5.809 379 HG22 ILE 50 2HG2 ILE 50 -11.091 4.326 -5.698 380 HG23 ILE 50 3HG2 ILE 50 -11.007 5.340 -4.259 381 HD11 ILE 50 1HD1 ILE 50 -12.230 8.533 -6.769 382 HD12 ILE 50 2HD1 ILE 50 -10.879 8.167 -5.692 383 HD13 ILE 50 3HD1 ILE 50 -12.083 9.365 -5.222 384 H LEU 51 H LEU 51 -14.493 3.951 -7.133 385 HA LEU 51 HA LEU 51 -12.824 1.765 -7.752 386 HB2 LEU 51 2HB LEU 51 -15.022 1.617 -6.532 387 HB3 LEU 51 3HB LEU 51 -15.847 1.902 -8.053 388 HG LEU 51 HG LEU 51 -14.915 -0.231 -8.962 389 HD11 LEU 51 1HD1 LEU 51 -13.789 -1.847 -7.500 390 HD12 LEU 51 2HD1 LEU 51 -13.753 -0.659 -6.194 391 HD13 LEU 51 3HD1 LEU 51 -12.846 -0.369 -7.681 392 HD21 LEU 51 1HD2 LEU 51 -16.285 -1.791 -7.665 393 HD22 LEU 51 2HD2 LEU 51 -17.131 -0.266 -7.921 394 HD23 LEU 51 3HD2 LEU 51 -16.408 -0.615 -6.350 395 H GLU 52 H GLU 52 -14.744 3.905 -9.746 396 HA GLU 52 HA GLU 52 -14.726 2.759 -12.262 397 HB2 GLU 52 2HB GLU 52 -15.780 4.946 -11.702 398 HB3 GLU 52 3HB GLU 52 -14.188 5.665 -11.510 399 HG2 GLU 52 2HG GLU 52 -13.793 5.091 -13.989 400 HG3 GLU 52 3HG GLU 52 -15.518 4.733 -14.067 401 H LYS 53 H LYS 53 -12.198 4.768 -10.738 402 HA LYS 53 HA LYS 53 -10.307 4.475 -12.896 403 HB2 LYS 53 2HB LYS 53 -10.337 5.906 -10.253 404 HB3 LYS 53 3HB LYS 53 -8.799 5.682 -11.077 405 HG2 LYS 53 2HG LYS 53 -9.532 6.923 -12.990 406 HG3 LYS 53 3HG LYS 53 -11.196 6.988 -12.399 407 HD2 LYS 53 2HD LYS 53 -8.850 8.230 -10.919 408 HD3 LYS 53 3HD LYS 53 -9.804 9.112 -12.116 409 HE2 LYS 53 2HE LYS 53 -10.926 7.851 -9.580 410 HE3 LYS 53 3HE LYS 53 -10.565 9.568 -9.798 411 HZ1 LYS 53 1HZ LYS 53 -12.193 9.669 -11.563 412 HZ2 LYS 53 2HZ LYS 53 -12.915 9.050 -10.163 413 HZ3 LYS 53 3HZ LYS 53 -12.505 8.014 -11.426 414 H VAL 54 H VAL 54 -10.749 2.989 -9.734 415 HA VAL 54 HA VAL 54 -8.240 1.746 -9.440 416 HB VAL 54 HB VAL 54 -11.006 0.969 -8.395 417 HG11 VAL 54 1HG1 VAL 54 -9.868 -0.543 -6.787 418 HG12 VAL 54 2HG1 VAL 54 -8.335 -0.259 -7.614 419 HG13 VAL 54 3HG1 VAL 54 -9.652 -1.080 -8.454 420 HG21 VAL 54 1HG2 VAL 54 -10.095 3.107 -7.527 421 HG22 VAL 54 2HG2 VAL 54 -8.630 2.280 -6.998 422 HG23 VAL 54 3HG2 VAL 54 -10.180 1.895 -6.247 423 H LEU 55 H LEU 55 -11.289 0.521 -10.826 424 HA LEU 55 HA LEU 55 -10.146 -1.893 -11.861 425 HB2 LEU 55 2HB LEU 55 -12.838 -0.600 -12.405 426 HB3 LEU 55 3HB LEU 55 -12.367 -2.203 -12.963 427 HG LEU 55 HG LEU 55 -12.704 -1.332 -10.064 428 HD11 LEU 55 1HD1 LEU 55 -14.569 -2.913 -10.003 429 HD12 LEU 55 2HD1 LEU 55 -14.351 -3.254 -11.723 430 HD13 LEU 55 3HD1 LEU 55 -14.831 -1.638 -11.194 431 HD21 LEU 55 1HD2 LEU 55 -11.859 -4.053 -11.132 432 HD22 LEU 55 2HD2 LEU 55 -12.254 -3.684 -9.451 433 HD23 LEU 55 3HD2 LEU 55 -10.855 -2.928 -10.209 434 H ASP 56 H ASP 56 -10.583 1.354 -13.116 435 HA ASP 56 HA ASP 56 -10.344 0.916 -15.889 436 HB2 ASP 56 2HB ASP 56 -10.938 3.119 -14.886 437 HB3 ASP 56 3HB ASP 56 -9.305 3.285 -14.266 438 H TYR 57 H TYR 57 -7.811 1.689 -13.479 439 HA TYR 57 HA TYR 57 -5.632 1.321 -15.255 440 HB2 TYR 57 2HB TYR 57 -5.305 2.710 -13.276 441 HB3 TYR 57 3HB TYR 57 -5.677 1.356 -12.211 442 HD1 TYR 57 HD1 TYR 57 -3.159 2.622 -14.674 443 HD2 TYR 57 HD2 TYR 57 -3.943 -0.243 -11.592 444 HE1 TYR 57 HE1 TYR 57 -0.804 1.916 -14.717 445 HE2 TYR 57 HE2 TYR 57 -1.597 -0.927 -11.642 446 HH TYR 57 HH TYR 57 0.832 0.803 -13.360 447 H CYS 58 H CYS 58 -7.323 -0.851 -12.981 448 HA CYS 58 HA CYS 58 -5.540 -3.022 -13.094 449 HB2 CYS 58 2HB CYS 58 -8.536 -2.970 -12.612 450 HB3 CYS 58 3HB CYS 58 -7.562 -4.433 -12.472 451 HG CYS 58 HG CYS 58 -8.183 -2.289 -10.188 452 H ARG 59 H ARG 59 -8.281 -2.172 -15.206 453 HA ARG 59 HA ARG 59 -8.176 -4.462 -16.882 454 HB2 ARG 59 2HB ARG 59 -10.152 -2.930 -16.759 455 HB3 ARG 59 3HB ARG 59 -9.209 -1.670 -17.557 456 HG2 ARG 59 2HG ARG 59 -9.016 -3.071 -19.577 457 HG3 ARG 59 3HG ARG 59 -9.897 -4.369 -18.775 458 HD2 ARG 59 2HD ARG 59 -11.892 -2.905 -18.639 459 HD3 ARG 59 3HD ARG 59 -11.002 -1.632 -19.485 460 HE ARG 59 HE ARG 59 -10.758 -3.707 -21.180 461 HH11 ARG 59 1HH1 ARG 59 -13.629 -2.324 -19.664 462 HH12 ARG 59 2HH1 ARG 59 -14.669 -2.776 -20.975 463 HH21 ARG 59 1HH2 ARG 59 -12.152 -4.327 -22.839 464 HH22 ARG 59 2HH2 ARG 59 -13.835 -3.906 -22.764 465 H HIS 60 H HIS 60 -6.826 -1.197 -17.117 466 HA HIS 60 HA HIS 60 -5.339 -1.346 -19.464 467 HB2 HIS 60 2HB HIS 60 -5.655 0.783 -18.405 468 HB3 HIS 60 3HB HIS 60 -4.960 0.227 -16.889 469 HD1 HIS 60 HD1 HIS 60 -3.893 1.052 -20.433 470 HD2 HIS 60 HD2 HIS 60 -2.292 0.779 -16.614 471 HE1 HIS 60 HE1 HIS 60 -1.543 1.903 -20.616 472 HE2 HIS 60 HE2 HIS 60 -0.735 2.024 -18.243 473 H HIS 61 H HIS 61 -4.552 -2.498 -16.216 474 HA HIS 61 HA HIS 61 -1.770 -3.000 -16.766 475 HB2 HIS 61 2HB HIS 61 -2.610 -2.295 -14.493 476 HB3 HIS 61 3HB HIS 61 -3.396 -3.863 -14.333 477 HD1 HIS 61 HD1 HIS 61 -1.917 -5.853 -13.693 478 HD2 HIS 61 HD2 HIS 61 0.240 -2.393 -14.453 479 HE1 HIS 61 HE1 HIS 61 0.428 -6.357 -12.972 480 HE2 HIS 61 HE2 HIS 61 1.750 -4.352 -13.717 481 H HIS 62 H HIS 62 -4.745 -4.755 -17.013 482 HA HIS 62 HA HIS 62 -3.514 -7.375 -17.212 483 HB2 HIS 62 2HB HIS 62 -5.863 -7.046 -16.371 484 HB3 HIS 62 3HB HIS 62 -6.338 -6.514 -17.982 485 HD1 HIS 62 HD1 HIS 62 -5.478 -9.572 -16.012 486 HD2 HIS 62 HD2 HIS 62 -6.530 -8.581 -19.903 487 HE1 HIS 62 HE1 HIS 62 -5.977 -11.744 -17.153 488 HE2 HIS 62 HE2 HIS 62 -6.744 -11.103 -19.458 489 H GLN 63 H GLN 63 -4.732 -4.858 -19.390 490 HA GLN 63 HA GLN 63 -4.287 -6.244 -21.858 491 HB2 GLN 63 2HB GLN 63 -4.588 -3.267 -21.258 492 HB3 GLN 63 3HB GLN 63 -4.561 -3.954 -22.882 493 HG2 GLN 63 2HG GLN 63 -6.607 -5.233 -22.375 494 HG3 GLN 63 3HG GLN 63 -6.631 -4.563 -20.749 495 HE21 GLN 63 1HE2 GLN 63 -5.857 -2.694 -23.655 496 HE22 GLN 63 2HE2 GLN 63 -7.269 -1.711 -23.599 497 H HIS 64 H HIS 64 -2.424 -4.056 -19.847 498 HA HIS 64 HA HIS 64 0.032 -4.552 -21.416 499 HB2 HIS 64 2HB HIS 64 -0.895 -1.930 -20.153 500 HB3 HIS 64 3HB HIS 64 0.769 -2.221 -20.651 501 HD1 HIS 64 HD1 HIS 64 1.334 -1.811 -23.039 502 HD2 HIS 64 HD2 HIS 64 -2.768 -1.927 -22.400 503 HE1 HIS 64 HE1 HIS 64 0.296 -1.166 -25.222 504 HE2 HIS 64 HE2 HIS 64 -2.172 -1.048 -24.750 505 HA PRO 65 HA PRO 65 0.621 -6.675 -17.388 506 HB2 PRO 65 2HB PRO 65 3.359 -6.985 -18.645 507 HB3 PRO 65 3HB PRO 65 2.351 -8.205 -17.832 508 HG2 PRO 65 2HG PRO 65 2.488 -8.209 -20.467 509 HG3 PRO 65 3HG PRO 65 0.915 -8.443 -19.666 510 HD2 PRO 65 2HD PRO 65 1.988 -5.976 -21.020 511 HD3 PRO 65 3HD PRO 65 0.339 -6.644 -21.039 512 H GLY 66 H GLY 66 2.690 -4.135 -18.660 513 HA2 GLY 66 2HA GLY 66 2.765 -2.351 -16.740 514 HA3 GLY 66 3HA GLY 66 3.854 -3.535 -16.019 515 H GLY 67 H GLY 67 5.112 -4.457 -18.347 516 HA2 GLY 67 2HA GLY 67 6.849 -4.032 -19.783 517 HA3 GLY 67 3HA GLY 67 6.326 -2.356 -19.871 518 H SER 68 H SER 68 6.937 -0.917 -18.175 519 HA SER 68 HA SER 68 8.206 0.064 -16.602 520 HB2 SER 68 2HB SER 68 8.657 -2.758 -15.546 521 HB3 SER 68 3HB SER 68 8.876 -1.264 -14.630 522 HG SER 68 HG SER 68 6.393 -1.492 -15.784 523 H GLY 69 H GLY 69 9.444 -0.807 -19.124 524 HA2 GLY 69 2HA GLY 69 12.116 -1.699 -18.776 525 HA3 GLY 69 3HA GLY 69 11.468 -0.871 -20.184 526 H LEU 70 H LEU 70 10.933 1.573 -19.666 527 HA LEU 70 HA LEU 70 12.524 2.998 -17.809 528 HB2 LEU 70 2HB LEU 70 14.381 2.366 -19.276 529 HB3 LEU 70 3HB LEU 70 13.495 2.916 -20.690 530 HG LEU 70 HG LEU 70 13.610 5.248 -19.822 531 HD11 LEU 70 1HD1 LEU 70 15.178 5.835 -18.005 532 HD12 LEU 70 2HD1 LEU 70 15.428 4.118 -17.672 533 HD13 LEU 70 3HD1 LEU 70 13.836 4.846 -17.436 534 HD21 LEU 70 1HD2 LEU 70 15.976 5.653 -20.380 535 HD22 LEU 70 2HD2 LEU 70 15.238 4.494 -21.484 536 HD23 LEU 70 3HD2 LEU 70 16.314 3.928 -20.204 537 H ASP 71 H ASP 71 11.124 3.207 -21.090 538 HA ASP 71 HA ASP 71 10.281 5.990 -20.661 539 HB2 ASP 71 2HB ASP 71 11.659 5.350 -22.667 540 HB3 ASP 71 3HB ASP 71 10.359 4.292 -23.204 541 H ASP 72 H ASP 72 8.874 3.866 -19.305 542 HA ASP 72 HA ASP 72 6.397 3.331 -20.771 543 HB2 ASP 72 2HB ASP 72 7.471 2.285 -18.115 544 HB3 ASP 72 3HB ASP 72 5.919 1.802 -18.807 545 H ILE 73 H ILE 73 6.380 5.902 -20.457 546 HA ILE 73 HA ILE 73 4.328 6.379 -18.366 547 HB ILE 73 HB ILE 73 6.028 8.534 -19.737 548 HG12 ILE 73 2HG1 ILE 73 6.905 8.926 -17.299 549 HG13 ILE 73 3HG1 ILE 73 6.302 7.313 -16.947 550 HG21 ILE 73 1HG2 ILE 73 4.974 10.118 -18.140 551 HG22 ILE 73 2HG2 ILE 73 3.976 8.810 -17.502 552 HG23 ILE 73 3HG2 ILE 73 3.772 9.336 -19.173 553 HD11 ILE 73 1HD1 ILE 73 8.690 7.313 -17.373 554 HD12 ILE 73 2HD1 ILE 73 8.432 8.022 -18.966 555 HD13 ILE 73 3HD1 ILE 73 7.850 6.392 -18.620 556 HA PRO 74 HA PRO 74 2.230 6.346 -22.531 557 HB2 PRO 74 2HB PRO 74 -0.013 5.099 -21.013 558 HB3 PRO 74 3HB PRO 74 0.815 4.507 -22.468 559 HG2 PRO 74 2HG PRO 74 1.171 3.281 -20.122 560 HG3 PRO 74 3HG PRO 74 2.527 3.490 -21.261 561 HD2 PRO 74 2HD PRO 74 1.846 5.175 -18.835 562 HD3 PRO 74 3HD PRO 74 3.412 4.459 -19.290 563 HA PRO 75 HA PRO 75 -0.111 10.199 -21.775 564 HB2 PRO 75 2HB PRO 75 -1.691 9.177 -24.140 565 HB3 PRO 75 3HB PRO 75 -0.988 10.787 -23.867 566 HG2 PRO 75 2HG PRO 75 0.204 9.126 -25.546 567 HG3 PRO 75 3HG PRO 75 1.178 10.089 -24.409 568 HD2 PRO 75 2HD PRO 75 0.436 7.174 -24.250 569 HD3 PRO 75 3HD PRO 75 1.979 7.965 -23.857 570 H TYR 76 H TYR 76 -1.630 7.051 -22.191 571 HA TYR 76 HA TYR 76 -4.251 7.493 -21.317 572 HB2 TYR 76 2HB TYR 76 -3.397 5.379 -22.360 573 HB3 TYR 76 3HB TYR 76 -2.513 5.018 -20.886 574 HD1 TYR 76 HD1 TYR 76 -3.777 4.320 -18.807 575 HD2 TYR 76 HD2 TYR 76 -5.791 4.973 -22.525 576 HE1 TYR 76 HE1 TYR 76 -5.729 3.094 -17.967 577 HE2 TYR 76 HE2 TYR 76 -7.745 3.748 -21.684 578 HH TYR 76 HH TYR 76 -8.116 2.899 -18.390 579 H ASP 77 H ASP 77 -1.381 6.482 -19.449 580 HA ASP 77 HA ASP 77 -2.629 6.560 -16.878 581 HB2 ASP 77 2HB ASP 77 0.318 6.461 -17.658 582 HB3 ASP 77 3HB ASP 77 -0.284 6.240 -16.012 583 H ARG 78 H ARG 78 -0.861 8.861 -18.810 584 HA ARG 78 HA ARG 78 -0.390 10.869 -16.863 585 HB2 ARG 78 2HB ARG 78 0.771 10.808 -19.022 586 HB3 ARG 78 3HB ARG 78 -0.746 11.033 -19.881 587 HG2 ARG 78 2HG ARG 78 -0.941 13.315 -19.086 588 HG3 ARG 78 3HG ARG 78 0.445 13.109 -18.009 589 HD2 ARG 78 2HD ARG 78 0.562 12.942 -21.047 590 HD3 ARG 78 3HD ARG 78 1.011 14.360 -20.094 591 HE ARG 78 HE ARG 78 2.621 12.616 -18.977 592 HH11 ARG 78 1HH1 ARG 78 1.981 12.949 -22.411 593 HH12 ARG 78 2HH1 ARG 78 3.541 12.353 -22.876 594 HH21 ARG 78 1HH2 ARG 78 4.638 11.832 -19.625 595 HH22 ARG 78 2HH2 ARG 78 5.037 11.725 -21.310 596 H ASP 79 H ASP 79 -3.149 10.216 -19.036 597 HA ASP 79 HA ASP 79 -4.772 12.421 -18.126 598 HB2 ASP 79 2HB ASP 79 -5.302 9.989 -19.855 599 HB3 ASP 79 3HB ASP 79 -6.658 10.948 -19.274 600 H PHE 80 H PHE 80 -4.274 9.111 -17.158 601 HA PHE 80 HA PHE 80 -6.515 8.708 -15.486 602 HB2 PHE 80 2HB PHE 80 -5.043 6.873 -16.305 603 HB3 PHE 80 3HB PHE 80 -3.711 7.500 -15.342 604 HD1 PHE 80 HD1 PHE 80 -3.510 6.939 -12.993 605 HD2 PHE 80 HD2 PHE 80 -7.067 5.930 -15.158 606 HE1 PHE 80 HE1 PHE 80 -4.295 5.599 -11.095 607 HE2 PHE 80 HE2 PHE 80 -7.830 4.596 -13.258 608 HZ PHE 80 HZ PHE 80 -6.455 4.428 -11.225 609 H CYS 81 H CYS 81 -3.307 10.083 -14.925 610 HA CYS 81 HA CYS 81 -3.524 10.431 -12.096 611 HB2 CYS 81 2HB CYS 81 -1.609 11.618 -14.130 612 HB3 CYS 81 3HB CYS 81 -1.426 11.761 -12.380 613 HG CYS 81 HG CYS 81 -1.702 8.637 -13.646 614 H LYS 82 H LYS 82 -5.038 12.108 -14.613 615 HA LYS 82 HA LYS 82 -4.957 14.781 -13.476 616 HB2 LYS 82 2HB LYS 82 -6.731 13.671 -15.699 617 HB3 LYS 82 3HB LYS 82 -6.593 15.368 -15.253 618 HG2 LYS 82 2HG LYS 82 -4.364 13.661 -16.421 619 HG3 LYS 82 3HG LYS 82 -5.348 14.814 -17.314 620 HD2 LYS 82 2HD LYS 82 -3.496 16.140 -16.926 621 HD3 LYS 82 3HD LYS 82 -4.413 16.525 -15.475 622 HE2 LYS 82 2HE LYS 82 -3.057 14.770 -14.257 623 HE3 LYS 82 3HE LYS 82 -2.084 14.592 -15.719 624 HZ1 LYS 82 1HZ LYS 82 -2.398 17.067 -14.121 625 HZ2 LYS 82 2HZ LYS 82 -1.493 16.929 -15.543 626 HZ3 LYS 82 3HZ LYS 82 -1.030 16.069 -14.168 627 H VAL 83 H VAL 83 -5.633 14.049 -11.346 628 HA VAL 83 HA VAL 83 -8.556 14.285 -11.018 629 HB VAL 83 HB VAL 83 -8.512 12.680 -9.102 630 HG11 VAL 83 1HG1 VAL 83 -7.601 11.411 -11.711 631 HG12 VAL 83 2HG1 VAL 83 -9.257 11.857 -11.290 632 HG13 VAL 83 3HG1 VAL 83 -8.436 10.581 -10.391 633 HG21 VAL 83 1HG2 VAL 83 -6.596 11.138 -8.778 634 HG22 VAL 83 2HG2 VAL 83 -6.131 12.813 -8.488 635 HG23 VAL 83 3HG2 VAL 83 -5.673 12.021 -9.998 636 H ASP 84 H ASP 84 -8.986 14.720 -8.558 637 HA ASP 84 HA ASP 84 -7.576 17.124 -7.841 638 HB2 ASP 84 2HB ASP 84 -9.771 15.577 -6.403 639 HB3 ASP 84 3HB ASP 84 -9.150 17.137 -5.866 640 H GLN 85 H GLN 85 -6.769 17.506 -5.636 641 HA GLN 85 HA GLN 85 -4.665 15.770 -4.949 642 HB2 GLN 85 2HB GLN 85 -4.600 18.219 -4.535 643 HB3 GLN 85 3HB GLN 85 -5.830 18.047 -3.295 644 HG2 GLN 85 2HG GLN 85 -3.649 18.308 -2.259 645 HG3 GLN 85 3HG GLN 85 -4.259 16.682 -1.937 646 HE21 GLN 85 1HE2 GLN 85 -2.159 15.921 -1.543 647 HE22 GLN 85 2HE2 GLN 85 -1.018 15.658 -2.808 648 HA PRO 86 HA PRO 86 -7.461 14.269 -1.129 649 HB2 PRO 86 2HB PRO 86 -10.220 14.758 -2.232 650 HB3 PRO 86 3HB PRO 86 -9.632 14.927 -0.562 651 HG2 PRO 86 2HG PRO 86 -10.134 17.091 -2.024 652 HG3 PRO 86 3HG PRO 86 -8.713 17.031 -0.951 653 HD2 PRO 86 2HD PRO 86 -8.822 16.651 -3.941 654 HD3 PRO 86 3HD PRO 86 -7.666 17.586 -2.973 655 H THR 87 H THR 87 -8.809 14.105 -4.430 656 HA THR 87 HA THR 87 -9.777 11.472 -4.408 657 HB THR 87 HB THR 87 -8.739 13.004 -6.836 658 HG1 THR 87 HG1 THR 87 -11.136 13.455 -6.954 659 HG21 THR 87 1HG2 THR 87 -10.364 11.649 -8.125 660 HG22 THR 87 2HG2 THR 87 -10.820 10.779 -6.660 661 HG23 THR 87 3HG2 THR 87 -9.193 10.604 -7.321 662 H LEU 88 H LEU 88 -6.530 12.742 -5.178 663 HA LEU 88 HA LEU 88 -5.235 10.452 -6.116 664 HB2 LEU 88 2HB LEU 88 -4.291 12.839 -4.515 665 HB3 LEU 88 3HB LEU 88 -3.169 11.550 -4.908 666 HG LEU 88 HG LEU 88 -4.693 13.135 -7.009 667 HD11 LEU 88 1HD1 LEU 88 -2.631 14.387 -7.415 668 HD12 LEU 88 2HD1 LEU 88 -1.851 13.577 -6.055 669 HD13 LEU 88 3HD1 LEU 88 -3.221 14.656 -5.774 670 HD21 LEU 88 1HD2 LEU 88 -3.041 12.180 -8.573 671 HD22 LEU 88 2HD2 LEU 88 -3.953 10.911 -7.763 672 HD23 LEU 88 3HD2 LEU 88 -2.301 11.267 -7.251 673 H PHE 89 H PHE 89 -5.744 11.560 -2.767 674 HA PHE 89 HA PHE 89 -4.430 9.356 -1.517 675 HB2 PHE 89 2HB PHE 89 -6.367 11.409 -0.378 676 HB3 PHE 89 3HB PHE 89 -5.480 10.231 0.598 677 HD1 PHE 89 HD1 PHE 89 -5.385 13.561 -0.562 678 HD2 PHE 89 HD2 PHE 89 -2.853 10.170 0.076 679 HE1 PHE 89 HE1 PHE 89 -3.423 15.033 -0.477 680 HE2 PHE 89 HE2 PHE 89 -0.911 11.651 0.159 681 HZ PHE 89 HZ PHE 89 -1.180 14.078 -0.105 682 H GLU 90 H GLU 90 -7.791 9.993 -2.453 683 HA GLU 90 HA GLU 90 -9.013 7.830 -1.086 684 HB2 GLU 90 2HB GLU 90 -9.856 9.193 -3.674 685 HB3 GLU 90 3HB GLU 90 -10.882 8.139 -2.704 686 HG2 GLU 90 2HG GLU 90 -9.748 10.812 -1.822 687 HG3 GLU 90 3HG GLU 90 -11.391 10.542 -2.395 688 H LEU 91 H LEU 91 -7.365 8.082 -4.214 689 HA LEU 91 HA LEU 91 -7.940 5.462 -5.183 690 HB2 LEU 91 2HB LEU 91 -5.677 7.379 -5.862 691 HB3 LEU 91 3HB LEU 91 -5.977 5.877 -6.725 692 HG LEU 91 HG LEU 91 -7.911 8.229 -6.604 693 HD11 LEU 91 1HD1 LEU 91 -7.311 8.665 -8.933 694 HD12 LEU 91 2HD1 LEU 91 -6.110 7.369 -8.886 695 HD13 LEU 91 3HD1 LEU 91 -5.903 8.805 -7.879 696 HD21 LEU 91 1HD2 LEU 91 -9.081 6.085 -6.889 697 HD22 LEU 91 2HD2 LEU 91 -8.054 5.686 -8.267 698 HD23 LEU 91 3HD2 LEU 91 -9.170 7.050 -8.359 699 H ILE 92 H ILE 92 -5.301 6.860 -3.234 700 HA ILE 92 HA ILE 92 -3.628 4.565 -3.049 701 HB ILE 92 HB ILE 92 -3.915 6.954 -1.165 702 HG12 ILE 92 2HG1 ILE 92 -1.812 6.385 -3.310 703 HG13 ILE 92 3HG1 ILE 92 -3.151 7.512 -3.480 704 HG21 ILE 92 1HG2 ILE 92 -2.911 5.089 0.092 705 HG22 ILE 92 2HG2 ILE 92 -1.710 6.346 -0.201 706 HG23 ILE 92 3HG2 ILE 92 -1.694 4.870 -1.169 707 HD11 ILE 92 1HD1 ILE 92 -1.095 8.688 -3.033 708 HD12 ILE 92 2HD1 ILE 92 -0.842 7.766 -1.553 709 HD13 ILE 92 3HD1 ILE 92 -2.201 8.889 -1.672 710 H LEU 93 H LEU 93 -6.308 5.757 -1.030 711 HA LEU 93 HA LEU 93 -6.065 3.857 1.074 712 HB2 LEU 93 2HB LEU 93 -8.435 5.582 0.261 713 HB3 LEU 93 3HB LEU 93 -8.368 4.632 1.739 714 HG LEU 93 HG LEU 93 -6.594 7.005 1.049 715 HD11 LEU 93 1HD1 LEU 93 -8.782 6.760 3.123 716 HD12 LEU 93 2HD1 LEU 93 -8.853 7.691 1.623 717 HD13 LEU 93 3HD1 LEU 93 -7.721 8.156 2.894 718 HD21 LEU 93 1HD2 LEU 93 -5.295 5.391 2.331 719 HD22 LEU 93 2HD2 LEU 93 -6.562 5.303 3.557 720 HD23 LEU 93 3HD2 LEU 93 -5.662 6.803 3.322 721 H ALA 94 H ALA 94 -8.015 4.012 -1.884 722 HA ALA 94 HA ALA 94 -9.535 1.631 -1.426 723 HB1 ALA 94 1HB ALA 94 -10.231 1.877 -3.778 724 HB2 ALA 94 2HB ALA 94 -8.999 3.121 -4.014 725 HB3 ALA 94 3HB ALA 94 -10.343 3.414 -2.913 726 H ALA 95 H ALA 95 -6.451 2.343 -2.976 727 HA ALA 95 HA ALA 95 -6.080 -0.184 -4.274 728 HB1 ALA 95 1HB ALA 95 -3.779 0.566 -4.635 729 HB2 ALA 95 2HB ALA 95 -4.002 1.880 -3.474 730 HB3 ALA 95 3HB ALA 95 -4.909 1.877 -4.984 731 H ASN 96 H ASN 96 -5.201 1.163 -1.135 732 HA ASN 96 HA ASN 96 -3.681 -1.080 -0.184 733 HB2 ASN 96 2HB ASN 96 -3.352 1.180 0.750 734 HB3 ASN 96 3HB ASN 96 -5.021 1.221 1.302 735 HD21 ASN 96 1HD2 ASN 96 -4.363 1.591 3.446 736 HD22 ASN 96 2HD2 ASN 96 -3.670 0.347 4.421 737 H TYR 97 H TYR 97 -7.057 -0.037 0.006 738 HA TYR 97 HA TYR 97 -8.033 -1.988 1.820 739 HB2 TYR 97 2HB TYR 97 -9.315 0.025 1.474 740 HB3 TYR 97 3HB TYR 97 -9.394 -0.237 -0.262 741 HD1 TYR 97 HD1 TYR 97 -11.440 -1.044 -1.131 742 HD2 TYR 97 HD2 TYR 97 -10.446 -1.970 2.932 743 HE1 TYR 97 HE1 TYR 97 -13.613 -2.151 -0.851 744 HE2 TYR 97 HE2 TYR 97 -12.625 -3.083 3.204 745 HH TYR 97 HH TYR 97 -14.869 -3.036 2.173 746 H LEU 98 H LEU 98 -7.764 -1.921 -1.719 747 HA LEU 98 HA LEU 98 -8.883 -4.635 -1.961 748 HB2 LEU 98 2HB LEU 98 -8.160 -2.594 -4.092 749 HB3 LEU 98 3HB LEU 98 -8.868 -4.172 -4.414 750 HG LEU 98 HG LEU 98 -10.202 -1.875 -2.909 751 HD11 LEU 98 1HD1 LEU 98 -11.780 -1.808 -4.783 752 HD12 LEU 98 2HD1 LEU 98 -10.858 -3.065 -5.615 753 HD13 LEU 98 3HD1 LEU 98 -10.129 -1.487 -5.312 754 HD21 LEU 98 1HD2 LEU 98 -12.222 -3.309 -2.840 755 HD22 LEU 98 2HD2 LEU 98 -10.891 -3.985 -1.906 756 HD23 LEU 98 3HD2 LEU 98 -11.281 -4.653 -3.492 757 H ASP 99 H ASP 99 -5.925 -3.251 -1.469 758 HA ASP 99 HA ASP 99 -3.803 -3.946 -1.413 759 HB2 ASP 99 2HB ASP 99 -5.111 -5.994 -0.427 760 HB3 ASP 99 3HB ASP 99 -4.670 -6.800 -1.926 761 H ILE 100 H ILE 100 -4.917 -3.155 -3.954 762 HA ILE 100 HA ILE 100 -3.563 -4.674 -6.027 763 HB ILE 100 HB ILE 100 -4.881 -1.926 -6.259 764 HG12 ILE 100 2HG1 ILE 100 -6.074 -4.688 -6.784 765 HG13 ILE 100 3HG1 ILE 100 -6.483 -3.641 -5.433 766 HG21 ILE 100 1HG2 ILE 100 -4.992 -2.420 -8.690 767 HG22 ILE 100 2HG2 ILE 100 -4.150 -3.951 -8.431 768 HG23 ILE 100 3HG2 ILE 100 -3.322 -2.422 -8.120 769 HD11 ILE 100 1HD1 ILE 100 -7.019 -3.081 -8.341 770 HD12 ILE 100 2HD1 ILE 100 -7.417 -2.013 -6.995 771 HD13 ILE 100 3HD1 ILE 100 -8.191 -3.590 -7.127 772 H LYS 101 H LYS 101 -1.456 -4.638 -5.492 773 HA LYS 101 HA LYS 101 0.083 -2.516 -4.520 774 HB2 LYS 101 2HB LYS 101 1.162 -4.860 -6.119 775 HB3 LYS 101 3HB LYS 101 2.021 -3.905 -4.906 776 HG2 LYS 101 2HG LYS 101 0.507 -4.782 -3.158 777 HG3 LYS 101 3HG LYS 101 -0.349 -5.734 -4.379 778 HD2 LYS 101 2HD LYS 101 1.860 -6.914 -4.849 779 HD3 LYS 101 3HD LYS 101 2.528 -6.068 -3.448 780 HE2 LYS 101 2HE LYS 101 0.272 -8.105 -3.468 781 HE3 LYS 101 3HE LYS 101 1.866 -8.271 -2.720 782 HZ1 LYS 101 1HZ LYS 101 -0.395 -6.564 -1.864 783 HZ2 LYS 101 2HZ LYS 101 1.188 -6.289 -1.321 784 HZ3 LYS 101 3HZ LYS 101 0.424 -7.752 -0.987 785 HA PRO 102 HA PRO 102 1.434 -1.748 -9.318 786 HB2 PRO 102 2HB PRO 102 -1.304 -2.342 -10.467 787 HB3 PRO 102 3HB PRO 102 0.299 -2.533 -11.216 788 HG2 PRO 102 2HG PRO 102 -0.981 -4.669 -10.344 789 HG3 PRO 102 3HG PRO 102 0.766 -4.504 -10.056 790 HD2 PRO 102 2HD PRO 102 -1.502 -4.073 -8.127 791 HD3 PRO 102 3HD PRO 102 0.076 -4.839 -7.858 792 H LEU 103 H LEU 103 -2.051 -1.164 -8.524 793 HA LEU 103 HA LEU 103 -2.063 1.502 -9.553 794 HB2 LEU 103 2HB LEU 103 -4.091 0.011 -9.369 795 HB3 LEU 103 3HB LEU 103 -4.074 0.249 -7.638 796 HG LEU 103 HG LEU 103 -5.752 1.626 -9.138 797 HD11 LEU 103 1HD1 LEU 103 -4.188 3.091 -7.003 798 HD12 LEU 103 2HD1 LEU 103 -5.575 2.031 -6.743 799 HD13 LEU 103 3HD1 LEU 103 -5.780 3.540 -7.628 800 HD21 LEU 103 1HD2 LEU 103 -4.081 2.437 -10.743 801 HD22 LEU 103 2HD2 LEU 103 -3.290 3.363 -9.467 802 HD23 LEU 103 3HD2 LEU 103 -4.934 3.765 -9.962 803 H LEU 104 H LEU 104 -1.690 0.120 -6.332 804 HA LEU 104 HA LEU 104 -1.736 2.418 -4.736 805 HB2 LEU 104 2HB LEU 104 -1.804 0.100 -3.894 806 HB3 LEU 104 3HB LEU 104 -0.146 -0.150 -4.412 807 HG LEU 104 HG LEU 104 0.606 1.559 -2.738 808 HD11 LEU 104 1HD1 LEU 104 -0.935 2.315 -0.973 809 HD12 LEU 104 2HD1 LEU 104 -2.287 1.556 -1.819 810 HD13 LEU 104 3HD1 LEU 104 -1.423 2.905 -2.561 811 HD21 LEU 104 1HD2 LEU 104 0.653 -0.840 -2.220 812 HD22 LEU 104 2HD2 LEU 104 -0.984 -0.741 -1.565 813 HD23 LEU 104 3HD2 LEU 104 0.341 0.128 -0.784 814 H ASP 105 H ASP 105 0.949 0.800 -6.398 815 HA ASP 105 HA ASP 105 3.025 2.453 -5.414 816 HB2 ASP 105 2HB ASP 105 3.321 0.111 -6.333 817 HB3 ASP 105 3HB ASP 105 3.082 0.763 -7.952 818 H VAL 106 H VAL 106 1.329 2.361 -8.561 819 HA VAL 106 HA VAL 106 2.694 4.443 -9.842 820 HB VAL 106 HB VAL 106 -0.139 3.399 -10.287 821 HG11 VAL 106 1HG1 VAL 106 -0.099 4.508 -12.520 822 HG12 VAL 106 2HG1 VAL 106 1.433 5.281 -12.100 823 HG13 VAL 106 3HG1 VAL 106 -0.034 5.691 -11.210 824 HG21 VAL 106 1HG2 VAL 106 1.664 1.755 -10.685 825 HG22 VAL 106 2HG2 VAL 106 2.458 2.875 -11.793 826 HG23 VAL 106 3HG2 VAL 106 0.881 2.198 -12.206 827 H THR 107 H THR 107 -0.327 4.580 -7.904 828 HA THR 107 HA THR 107 -0.797 7.351 -8.341 829 HB THR 107 HB THR 107 -1.913 5.605 -6.109 830 HG1 THR 107 HG1 THR 107 -2.930 4.696 -7.723 831 HG21 THR 107 1HG2 THR 107 -2.976 8.201 -7.299 832 HG22 THR 107 2HG2 THR 107 -2.248 8.040 -5.699 833 HG23 THR 107 3HG2 THR 107 -3.773 7.229 -6.059 834 H CYS 108 H CYS 108 0.763 5.544 -5.658 835 HA CYS 108 HA CYS 108 1.218 7.774 -3.950 836 HB2 CYS 108 2HB CYS 108 2.630 5.085 -4.100 837 HB3 CYS 108 3HB CYS 108 2.907 6.276 -2.830 838 HG CYS 108 HG CYS 108 -0.157 4.900 -3.441 839 H LYS 109 H LYS 109 3.057 6.365 -6.616 840 HA LYS 109 HA LYS 109 5.401 7.981 -6.337 841 HB2 LYS 109 2HB LYS 109 4.401 6.025 -8.379 842 HB3 LYS 109 3HB LYS 109 5.502 7.247 -8.989 843 HG2 LYS 109 2HG LYS 109 6.692 5.185 -8.390 844 HG3 LYS 109 3HG LYS 109 7.232 6.561 -7.426 845 HD2 LYS 109 2HD LYS 109 5.829 5.764 -5.526 846 HD3 LYS 109 3HD LYS 109 5.311 4.385 -6.498 847 HE2 LYS 109 2HE LYS 109 8.179 4.947 -5.665 848 HE3 LYS 109 3HE LYS 109 7.096 3.800 -4.874 849 HZ1 LYS 109 1HZ LYS 109 8.548 2.672 -6.395 850 HZ2 LYS 109 2HZ LYS 109 8.057 3.655 -7.679 851 HZ3 LYS 109 3HZ LYS 109 6.957 2.579 -6.974 852 H THR 110 H THR 110 2.347 8.291 -8.123 853 HA THR 110 HA THR 110 2.959 10.542 -9.696 854 HB THR 110 HB THR 110 0.267 9.611 -8.610 855 HG1 THR 110 HG1 THR 110 0.584 8.151 -10.100 856 HG21 THR 110 1HG2 THR 110 -0.777 10.954 -10.410 857 HG22 THR 110 2HG2 THR 110 0.802 11.613 -10.835 858 HG23 THR 110 3HG2 THR 110 0.083 11.990 -9.268 859 H VAL 111 H VAL 111 1.499 10.308 -6.446 860 HA VAL 111 HA VAL 111 1.228 13.089 -5.959 861 HB VAL 111 HB VAL 111 1.538 10.875 -3.868 862 HG11 VAL 111 1HG1 VAL 111 0.284 13.644 -3.640 863 HG12 VAL 111 2HG1 VAL 111 1.804 13.128 -2.903 864 HG13 VAL 111 3HG1 VAL 111 0.281 12.415 -2.370 865 HG21 VAL 111 1HG2 VAL 111 -1.020 11.939 -5.144 866 HG22 VAL 111 2HG2 VAL 111 -0.940 10.764 -3.828 867 HG23 VAL 111 3HG2 VAL 111 -0.312 10.345 -5.421 868 H ALA 112 H ALA 112 3.807 10.751 -5.377 869 HA ALA 112 HA ALA 112 5.597 12.419 -3.946 870 HB1 ALA 112 1HB ALA 112 7.310 10.726 -4.479 871 HB2 ALA 112 2HB ALA 112 6.228 9.988 -5.662 872 HB3 ALA 112 3HB ALA 112 5.810 9.955 -3.949 873 H ASN 113 H ASN 113 5.017 11.931 -7.421 874 HA ASN 113 HA ASN 113 7.375 13.123 -8.447 875 HB2 ASN 113 2HB ASN 113 4.644 12.769 -9.739 876 HB3 ASN 113 3HB ASN 113 6.049 13.375 -10.605 877 HD21 ASN 113 1HD2 ASN 113 4.512 11.050 -11.233 878 HD22 ASN 113 2HD2 ASN 113 5.584 9.699 -11.148 879 H MET 114 H MET 114 4.292 14.437 -7.414 880 HA MET 114 HA MET 114 4.519 17.040 -8.534 881 HB2 MET 114 2HB MET 114 2.960 16.179 -6.070 882 HB3 MET 114 3HB MET 114 2.707 17.662 -6.982 883 HG2 MET 114 2HG MET 114 2.055 16.278 -8.954 884 HG3 MET 114 3HG MET 114 2.189 14.835 -7.946 885 HE1 MET 114 1HE MET 114 0.832 14.770 -5.521 886 HE2 MET 114 2HE MET 114 -0.576 15.776 -5.199 887 HE3 MET 114 3HE MET 114 1.040 16.481 -5.150 888 H ILE 115 H ILE 115 5.552 15.631 -5.438 889 HA ILE 115 HA ILE 115 6.630 18.208 -4.490 890 HB ILE 115 HB ILE 115 7.076 17.109 -2.355 891 HG12 ILE 115 2HG1 ILE 115 6.016 14.503 -3.565 892 HG13 ILE 115 3HG1 ILE 115 7.720 14.844 -3.302 893 HG21 ILE 115 1HG2 ILE 115 4.281 16.416 -3.349 894 HG22 ILE 115 2HG2 ILE 115 4.802 17.979 -2.715 895 HG23 ILE 115 3HG2 ILE 115 4.768 16.569 -1.656 896 HD11 ILE 115 1HD1 ILE 115 6.837 13.419 -1.572 897 HD12 ILE 115 2HD1 ILE 115 5.615 14.620 -1.156 898 HD13 ILE 115 3HD1 ILE 115 7.326 14.970 -0.896 899 H ARG 116 H ARG 116 7.705 15.594 -6.350 900 HA ARG 116 HA ARG 116 10.424 15.418 -5.450 901 HB2 ARG 116 2HB ARG 116 8.852 14.243 -7.709 902 HB3 ARG 116 3HB ARG 116 10.581 14.384 -7.988 903 HG2 ARG 116 2HG ARG 116 9.611 13.099 -5.437 904 HG3 ARG 116 3HG ARG 116 9.557 12.174 -6.937 905 HD2 ARG 116 2HD ARG 116 11.657 11.870 -5.498 906 HD3 ARG 116 3HD ARG 116 11.919 12.243 -7.197 907 HE ARG 116 HE ARG 116 12.479 14.521 -6.559 908 HH11 ARG 116 1HH1 ARG 116 12.493 12.182 -3.933 909 HH12 ARG 116 2HH1 ARG 116 13.552 13.139 -2.944 910 HH21 ARG 116 1HH2 ARG 116 13.831 15.761 -5.259 911 HH22 ARG 116 2HH2 ARG 116 14.314 15.174 -3.695 912 H GLY 117 H GLY 117 11.185 17.508 -5.343 913 HA2 GLY 117 2HA GLY 117 11.553 19.153 -7.696 914 HA3 GLY 117 3HA GLY 117 12.287 19.379 -6.109 915 H1 SER 2 1H SER 2 14.728 -13.932 17.238 916 H2 SER 2 2H SER 2 15.421 -13.129 18.556 917 H3 SER 2 3H SER 2 15.639 -14.796 18.367 918 HA SER 2 HA SER 2 17.612 -13.549 17.757 919 HB2 SER 2 2HB SER 2 16.254 -14.909 15.393 920 HB3 SER 2 3HB SER 2 17.993 -14.708 15.624 921 HG SER 2 HG SER 2 17.183 -16.794 16.231 922 H LEU 3 H LEU 3 18.557 -11.862 16.614 923 HA LEU 3 HA LEU 3 16.789 -9.850 15.422 924 HB2 LEU 3 2HB LEU 3 19.772 -9.752 16.019 925 HB3 LEU 3 3HB LEU 3 18.783 -8.388 15.514 926 HG LEU 3 HG LEU 3 18.401 -9.884 18.143 927 HD11 LEU 3 1HD1 LEU 3 19.857 -7.272 17.658 928 HD12 LEU 3 2HD1 LEU 3 20.577 -8.808 18.149 929 HD13 LEU 3 3HD1 LEU 3 19.474 -7.969 19.238 930 HD21 LEU 3 1HD2 LEU 3 17.008 -7.948 18.777 931 HD22 LEU 3 2HD2 LEU 3 16.357 -8.771 17.364 932 HD23 LEU 3 3HD2 LEU 3 17.232 -7.249 17.169 933 H VAL 4 H VAL 4 16.483 -9.869 13.239 934 HA VAL 4 HA VAL 4 18.591 -10.776 11.414 935 HB VAL 4 HB VAL 4 16.975 -10.258 9.567 936 HG11 VAL 4 1HG1 VAL 4 15.447 -12.152 9.992 937 HG12 VAL 4 2HG1 VAL 4 15.868 -12.115 11.706 938 HG13 VAL 4 3HG1 VAL 4 17.094 -12.530 10.507 939 HG21 VAL 4 1HG2 VAL 4 14.589 -9.779 10.093 940 HG22 VAL 4 2HG2 VAL 4 15.644 -8.469 10.624 941 HG23 VAL 4 3HG2 VAL 4 15.002 -9.613 11.805 942 H LYS 5 H LYS 5 19.891 -9.437 10.337 943 HA LYS 5 HA LYS 5 20.076 -6.681 11.249 944 HB2 LYS 5 2HB LYS 5 21.935 -8.361 9.513 945 HB3 LYS 5 3HB LYS 5 22.299 -6.752 10.131 946 HG2 LYS 5 2HG LYS 5 22.139 -7.649 12.455 947 HG3 LYS 5 3HG LYS 5 21.874 -9.264 11.783 948 HD2 LYS 5 2HD LYS 5 24.093 -9.192 10.712 949 HD3 LYS 5 3HD LYS 5 24.350 -7.554 11.314 950 HE2 LYS 5 2HE LYS 5 24.274 -8.414 13.636 951 HE3 LYS 5 3HE LYS 5 24.043 -10.049 13.016 952 HZ1 LYS 5 1HZ LYS 5 26.187 -9.886 11.928 953 HZ2 LYS 5 2HZ LYS 5 26.333 -9.654 13.595 954 HZ3 LYS 5 3HZ LYS 5 26.410 -8.328 12.549 955 H LEU 6 H LEU 6 18.488 -5.517 10.155 956 HA LEU 6 HA LEU 6 18.319 -5.696 7.226 957 HB2 LEU 6 2HB LEU 6 16.603 -4.160 9.207 958 HB3 LEU 6 3HB LEU 6 16.323 -4.233 7.470 959 HG LEU 6 HG LEU 6 16.107 -6.549 9.443 960 HD11 LEU 6 1HD1 LEU 6 14.222 -5.007 9.546 961 HD12 LEU 6 2HD1 LEU 6 13.736 -6.556 8.862 962 HD13 LEU 6 3HD1 LEU 6 13.973 -5.162 7.804 963 HD21 LEU 6 1HD2 LEU 6 17.028 -7.387 7.328 964 HD22 LEU 6 2HD2 LEU 6 15.728 -6.607 6.422 965 HD23 LEU 6 3HD2 LEU 6 15.365 -7.931 7.534 966 H GLU 7 H GLU 7 20.204 -4.708 6.582 967 HA GLU 7 HA GLU 7 20.968 -2.064 7.424 968 HB2 GLU 7 2HB GLU 7 22.678 -3.657 6.669 969 HB3 GLU 7 3HB GLU 7 21.916 -3.766 5.083 970 HG2 GLU 7 2HG GLU 7 22.452 -1.416 4.635 971 HG3 GLU 7 3HG GLU 7 23.139 -1.242 6.252 972 H SER 8 H SER 8 20.465 -0.161 6.482 973 HA SER 8 HA SER 8 18.327 -0.010 4.528 974 HB2 SER 8 2HB SER 8 18.489 2.458 5.010 975 HB3 SER 8 3HB SER 8 18.271 1.491 6.471 976 HG SER 8 HG SER 8 20.292 1.906 7.082 977 H SER 9 H SER 9 18.605 1.758 2.768 978 HA SER 9 HA SER 9 20.780 1.284 1.029 979 HB2 SER 9 2HB SER 9 19.862 3.277 -0.230 980 HB3 SER 9 3HB SER 9 18.642 2.065 0.154 981 HG SER 9 HG SER 9 18.954 4.653 1.141 982 H ASP 10 H ASP 10 20.363 3.418 3.719 983 HA ASP 10 HA ASP 10 22.590 5.198 3.116 984 HB2 ASP 10 2HB ASP 10 20.435 5.930 4.264 985 HB3 ASP 10 3HB ASP 10 20.912 4.977 5.660 986 H GLU 11 H GLU 11 22.560 2.076 3.999 987 HA GLU 11 HA GLU 11 24.165 0.634 4.601 988 HB2 GLU 11 2HB GLU 11 25.900 3.106 4.898 989 HB3 GLU 11 3HB GLU 11 26.515 1.460 5.055 990 HG2 GLU 11 2HG GLU 11 25.959 0.985 2.732 991 HG3 GLU 11 3HG GLU 11 25.176 2.561 2.565 992 H LYS 12 H LYS 12 22.591 2.442 6.715 993 HA LYS 12 HA LYS 12 24.047 1.626 9.135 994 HB2 LYS 12 2HB LYS 12 21.510 3.284 8.782 995 HB3 LYS 12 3HB LYS 12 22.237 2.886 10.343 996 HG2 LYS 12 2HG LYS 12 24.321 4.066 9.632 997 HG3 LYS 12 3HG LYS 12 23.511 4.542 8.131 998 HD2 LYS 12 2HD LYS 12 21.846 5.827 9.431 999 HD3 LYS 12 3HD LYS 12 22.600 5.306 10.941 1000 HE2 LYS 12 2HE LYS 12 24.665 6.509 10.316 1001 HE3 LYS 12 3HE LYS 12 23.915 7.016 8.802 1002 HZ1 LYS 12 1HZ LYS 12 23.031 7.764 11.538 1003 HZ2 LYS 12 2HZ LYS 12 22.246 8.203 10.106 1004 HZ3 LYS 12 3HZ LYS 12 23.809 8.769 10.418 1005 H VAL 13 H VAL 13 23.600 -0.182 10.143 1006 HA VAL 13 HA VAL 13 21.528 -1.981 9.159 1007 HB VAL 13 HB VAL 13 23.706 -2.483 11.231 1008 HG11 VAL 13 1HG1 VAL 13 23.313 -4.891 10.765 1009 HG12 VAL 13 2HG1 VAL 13 21.987 -4.460 9.684 1010 HG13 VAL 13 3HG1 VAL 13 21.869 -4.103 11.407 1011 HG21 VAL 13 1HG2 VAL 13 25.013 -3.562 9.427 1012 HG22 VAL 13 2HG2 VAL 13 24.723 -1.860 9.065 1013 HG23 VAL 13 3HG2 VAL 13 23.778 -3.107 8.249 1014 H PHE 14 H PHE 14 19.621 -2.161 10.148 1015 HA PHE 14 HA PHE 14 19.289 -1.456 13.000 1016 HB2 PHE 14 2HB PHE 14 17.234 -1.549 10.748 1017 HB3 PHE 14 3HB PHE 14 16.845 -1.238 12.437 1018 HD1 PHE 14 HD1 PHE 14 17.243 0.937 13.434 1019 HD2 PHE 14 HD2 PHE 14 18.551 0.126 9.438 1020 HE1 PHE 14 HE1 PHE 14 17.683 3.333 13.086 1021 HE2 PHE 14 HE2 PHE 14 18.988 2.517 9.104 1022 HZ PHE 14 HZ PHE 14 18.553 4.122 10.922 1023 H GLU 15 H GLU 15 19.648 -3.294 14.088 1024 HA GLU 15 HA GLU 15 18.845 -5.910 13.122 1025 HB2 GLU 15 2HB GLU 15 20.059 -5.101 15.800 1026 HB3 GLU 15 3HB GLU 15 19.904 -6.749 15.182 1027 HG2 GLU 15 2HG GLU 15 21.411 -6.191 13.309 1028 HG3 GLU 15 3HG GLU 15 21.590 -4.547 13.930 1029 H ILE 16 H ILE 16 16.662 -5.972 13.065 1030 HA ILE 16 HA ILE 16 15.081 -5.509 15.528 1031 HB ILE 16 HB ILE 16 14.385 -4.271 13.423 1032 HG12 ILE 16 2HG1 ILE 16 11.933 -4.856 13.515 1033 HG13 ILE 16 3HG1 ILE 16 12.331 -6.289 14.462 1034 HG21 ILE 16 1HG2 ILE 16 13.342 -5.486 11.557 1035 HG22 ILE 16 2HG2 ILE 16 13.732 -7.027 12.320 1036 HG23 ILE 16 3HG2 ILE 16 15.029 -5.967 11.761 1037 HD11 ILE 16 1HD1 ILE 16 12.814 -3.433 15.305 1038 HD12 ILE 16 2HD1 ILE 16 13.149 -4.881 16.261 1039 HD13 ILE 16 3HD1 ILE 16 11.489 -4.470 15.834 1040 H GLU 17 H GLU 17 13.615 -7.243 16.196 1041 HA GLU 17 HA GLU 17 14.636 -9.880 15.885 1042 HB2 GLU 17 2HB GLU 17 11.917 -9.035 16.976 1043 HB3 GLU 17 3HB GLU 17 12.694 -10.599 17.228 1044 HG2 GLU 17 2HG GLU 17 14.528 -9.470 18.456 1045 HG3 GLU 17 3HG GLU 17 13.721 -7.917 18.228 1046 H LYS 18 H LYS 18 13.797 -11.640 14.754 1047 HA LYS 18 HA LYS 18 12.922 -11.088 12.121 1048 HB2 LYS 18 2HB LYS 18 14.391 -12.989 12.688 1049 HB3 LYS 18 3HB LYS 18 13.091 -13.743 13.605 1050 HG2 LYS 18 2HG LYS 18 11.774 -14.002 11.516 1051 HG3 LYS 18 3HG LYS 18 13.077 -13.246 10.598 1052 HD2 LYS 18 2HD LYS 18 13.113 -15.711 10.395 1053 HD3 LYS 18 3HD LYS 18 14.585 -15.096 11.151 1054 HE2 LYS 18 2HE LYS 18 13.726 -15.743 13.372 1055 HE3 LYS 18 3HE LYS 18 12.220 -16.298 12.637 1056 HZ1 LYS 18 1HZ LYS 18 14.907 -17.416 12.111 1057 HZ2 LYS 18 2HZ LYS 18 13.456 -17.965 11.441 1058 HZ3 LYS 18 3HZ LYS 18 13.728 -18.111 13.103 1059 H GLU 19 H GLU 19 11.294 -12.467 14.958 1060 HA GLU 19 HA GLU 19 8.791 -13.136 13.937 1061 HB2 GLU 19 2HB GLU 19 7.994 -12.829 16.318 1062 HB3 GLU 19 3HB GLU 19 9.436 -13.824 16.157 1063 HG2 GLU 19 2HG GLU 19 10.831 -11.840 16.812 1064 HG3 GLU 19 3HG GLU 19 9.343 -10.922 17.063 1065 H ILE 20 H ILE 20 10.093 -10.003 14.727 1066 HA ILE 20 HA ILE 20 7.615 -8.520 14.483 1067 HB ILE 20 HB ILE 20 10.522 -7.595 14.553 1068 HG12 ILE 20 2HG1 ILE 20 8.465 -7.742 16.808 1069 HG13 ILE 20 3HG1 ILE 20 9.860 -8.794 16.623 1070 HG21 ILE 20 1HG2 ILE 20 9.642 -5.358 15.102 1071 HG22 ILE 20 2HG2 ILE 20 7.993 -5.952 14.896 1072 HG23 ILE 20 3HG2 ILE 20 9.093 -5.900 13.517 1073 HD11 ILE 20 1HD1 ILE 20 9.908 -5.836 17.207 1074 HD12 ILE 20 2HD1 ILE 20 11.333 -6.850 16.952 1075 HD13 ILE 20 3HD1 ILE 20 10.268 -7.154 18.323 1076 H ALA 21 H ALA 21 10.530 -9.140 12.525 1077 HA ALA 21 HA ALA 21 9.844 -7.415 10.338 1078 HB1 ALA 21 1HB ALA 21 11.880 -8.315 9.282 1079 HB2 ALA 21 2HB ALA 21 11.982 -9.563 10.530 1080 HB3 ALA 21 3HB ALA 21 12.181 -7.863 10.965 1081 H CYS 22 H CYS 22 8.792 -10.548 11.174 1082 HA CYS 22 HA CYS 22 8.404 -11.708 8.594 1083 HB2 CYS 22 2HB CYS 22 7.093 -12.282 11.280 1084 HB3 CYS 22 3HB CYS 22 6.814 -13.244 9.827 1085 HG CYS 22 HG CYS 22 9.491 -14.024 9.577 1086 H MET 23 H MET 23 6.588 -9.413 10.510 1087 HA MET 23 HA MET 23 4.069 -9.617 9.196 1088 HB2 MET 23 2HB MET 23 5.247 -7.204 10.639 1089 HB3 MET 23 3HB MET 23 3.548 -7.451 10.250 1090 HG2 MET 23 2HG MET 23 3.544 -9.461 11.732 1091 HG3 MET 23 3HG MET 23 5.204 -9.082 12.201 1092 HE1 MET 23 1HE MET 23 4.635 -5.550 13.920 1093 HE2 MET 23 2HE MET 23 4.914 -5.790 12.196 1094 HE3 MET 23 3HE MET 23 5.847 -6.711 13.378 1095 H SER 24 H SER 24 7.035 -7.855 8.519 1096 HA SER 24 HA SER 24 6.143 -6.507 6.151 1097 HB2 SER 24 2HB SER 24 8.224 -5.852 7.365 1098 HB3 SER 24 3HB SER 24 8.951 -7.409 6.962 1099 HG SER 24 HG SER 24 8.027 -5.524 5.060 1100 H VAL 25 H VAL 25 5.185 -7.780 4.631 1101 HA VAL 25 HA VAL 25 5.565 -10.536 4.272 1102 HB VAL 25 HB VAL 25 4.369 -8.504 2.335 1103 HG11 VAL 25 1HG1 VAL 25 4.171 -11.543 2.208 1104 HG12 VAL 25 2HG1 VAL 25 4.999 -10.502 1.049 1105 HG13 VAL 25 3HG1 VAL 25 3.244 -10.423 1.202 1106 HG21 VAL 25 1HG2 VAL 25 3.182 -8.630 4.497 1107 HG22 VAL 25 2HG2 VAL 25 3.013 -10.378 4.315 1108 HG23 VAL 25 3HG2 VAL 25 2.182 -9.291 3.198 1109 H THR 26 H THR 26 6.946 -7.769 2.475 1110 HA THR 26 HA THR 26 8.277 -9.185 0.449 1111 HB THR 26 HB THR 26 8.978 -6.498 1.693 1112 HG1 THR 26 HG1 THR 26 7.774 -5.755 -0.199 1113 HG21 THR 26 1HG2 THR 26 9.820 -7.621 -1.013 1114 HG22 THR 26 2HG2 THR 26 10.891 -7.336 0.360 1115 HG23 THR 26 3HG2 THR 26 10.111 -5.974 -0.446 1116 H ILE 27 H ILE 27 9.556 -8.001 3.610 1117 HA ILE 27 HA ILE 27 12.207 -8.975 3.274 1118 HB ILE 27 HB ILE 27 10.687 -8.240 5.811 1119 HG12 ILE 27 2HG1 ILE 27 12.749 -6.655 4.205 1120 HG13 ILE 27 3HG1 ILE 27 11.010 -6.382 4.177 1121 HG21 ILE 27 1HG2 ILE 27 13.681 -8.731 5.533 1122 HG22 ILE 27 2HG2 ILE 27 12.544 -9.743 6.424 1123 HG23 ILE 27 3HG2 ILE 27 12.877 -8.102 6.975 1124 HD11 ILE 27 1HD1 ILE 27 12.093 -4.735 5.549 1125 HD12 ILE 27 2HD1 ILE 27 12.848 -5.987 6.532 1126 HD13 ILE 27 3HD1 ILE 27 11.096 -5.776 6.564 1127 H LYS 28 H LYS 28 9.357 -10.315 4.928 1128 HA LYS 28 HA LYS 28 10.441 -12.652 6.018 1129 HB2 LYS 28 2HB LYS 28 8.177 -11.784 6.548 1130 HB3 LYS 28 3HB LYS 28 7.634 -12.188 4.922 1131 HG2 LYS 28 2HG LYS 28 8.115 -14.618 5.453 1132 HG3 LYS 28 3HG LYS 28 8.458 -14.129 7.113 1133 HD2 LYS 28 2HD LYS 28 6.167 -15.002 6.904 1134 HD3 LYS 28 3HD LYS 28 6.150 -13.296 7.360 1135 HE2 LYS 28 2HE LYS 28 4.435 -13.735 5.660 1136 HE3 LYS 28 3HE LYS 28 5.680 -12.685 4.986 1137 HZ1 LYS 28 1HZ LYS 28 5.133 -14.351 3.402 1138 HZ2 LYS 28 2HZ LYS 28 5.352 -15.596 4.519 1139 HZ3 LYS 28 3HZ LYS 28 6.685 -14.705 3.978 1140 H ASN 29 H ASN 29 8.912 -12.101 2.840 1141 HA ASN 29 HA ASN 29 9.156 -14.726 1.826 1142 HB2 ASN 29 2HB ASN 29 8.709 -12.048 0.462 1143 HB3 ASN 29 3HB ASN 29 8.845 -13.539 -0.468 1144 HD21 ASN 29 1HD2 ASN 29 6.717 -13.262 -1.222 1145 HD22 ASN 29 2HD2 ASN 29 5.349 -13.593 -0.218 1146 H MET 30 H MET 30 11.372 -11.953 1.800 1147 HA MET 30 HA MET 30 13.275 -13.011 -0.048 1148 HB2 MET 30 2HB MET 30 13.512 -10.881 2.109 1149 HB3 MET 30 3HB MET 30 14.889 -11.351 1.122 1150 HG2 MET 30 2HG MET 30 13.671 -10.675 -0.902 1151 HG3 MET 30 3HG MET 30 12.295 -10.180 0.093 1152 HE1 MET 30 1HE MET 30 13.953 -8.279 -2.049 1153 HE2 MET 30 2HE MET 30 13.944 -6.772 -1.133 1154 HE3 MET 30 3HE MET 30 12.494 -7.773 -1.193 1155 H ILE 31 H ILE 31 12.987 -13.158 3.499 1156 HA ILE 31 HA ILE 31 15.376 -14.569 4.064 1157 HB ILE 31 HB ILE 31 12.742 -14.503 5.617 1158 HG12 ILE 31 2HG1 ILE 31 15.313 -12.908 6.072 1159 HG13 ILE 31 3HG1 ILE 31 13.859 -12.274 5.315 1160 HG21 ILE 31 1HG2 ILE 31 14.039 -16.479 6.314 1161 HG22 ILE 31 2HG2 ILE 31 14.027 -15.275 7.601 1162 HG23 ILE 31 3HG2 ILE 31 15.464 -15.473 6.594 1163 HD11 ILE 31 1HD1 ILE 31 14.116 -13.199 8.179 1164 HD12 ILE 31 2HD1 ILE 31 12.635 -12.602 7.427 1165 HD13 ILE 31 3HD1 ILE 31 14.025 -11.534 7.606 1166 H GLU 32 H GLU 32 12.056 -15.650 3.392 1167 HA GLU 32 HA GLU 32 12.541 -18.456 3.729 1168 HB2 GLU 32 2HB GLU 32 10.193 -17.011 2.431 1169 HB3 GLU 32 3HB GLU 32 10.225 -18.730 2.834 1170 HG2 GLU 32 2HG GLU 32 10.445 -18.162 5.230 1171 HG3 GLU 32 3HG GLU 32 10.429 -16.446 4.827 1172 H ASP 33 H ASP 33 12.744 -16.250 1.022 1173 HA ASP 33 HA ASP 33 12.766 -18.144 -1.112 1174 HB2 ASP 33 2HB ASP 33 12.312 -15.773 -1.552 1175 HB3 ASP 33 3HB ASP 33 13.894 -15.314 -0.932 1176 H ILE 34 H ILE 34 15.291 -16.577 0.819 1177 HA ILE 34 HA ILE 34 17.507 -18.070 -0.271 1178 HB ILE 34 HB ILE 34 17.310 -16.520 2.363 1179 HG12 ILE 34 2HG1 ILE 34 18.353 -15.546 -0.341 1180 HG13 ILE 34 3HG1 ILE 34 16.804 -15.100 0.361 1181 HG21 ILE 34 1HG2 ILE 34 19.787 -17.390 0.824 1182 HG22 ILE 34 2HG2 ILE 34 19.235 -18.053 2.363 1183 HG23 ILE 34 3HG2 ILE 34 19.787 -16.380 2.275 1184 HD11 ILE 34 1HD1 ILE 34 18.415 -13.324 0.639 1185 HD12 ILE 34 2HD1 ILE 34 19.525 -14.412 1.473 1186 HD13 ILE 34 3HD1 ILE 34 17.977 -13.990 2.212 1187 H GLY 35 H GLY 35 15.087 -18.598 2.150 1188 HA2 GLY 35 2HA GLY 35 14.568 -20.608 3.256 1189 HA3 GLY 35 3HA GLY 35 16.216 -21.180 3.002 1190 H GLU 36 H GLU 36 17.940 -20.064 4.203 1191 HA GLU 36 HA GLU 36 17.159 -18.545 6.606 1192 HB2 GLU 36 2HB GLU 36 19.032 -20.966 6.613 1193 HB3 GLU 36 3HB GLU 36 18.833 -19.857 7.970 1194 HG2 GLU 36 2HG GLU 36 16.465 -20.505 8.168 1195 HG3 GLU 36 3HG GLU 36 16.636 -21.592 6.788 1196 H SER 37 H SER 37 18.570 -16.892 7.066 1197 HA SER 37 HA SER 37 21.151 -16.670 5.717 1198 HB2 SER 37 2HB SER 37 19.513 -15.749 4.067 1199 HB3 SER 37 3HB SER 37 18.954 -14.593 5.273 1200 HG SER 37 HG SER 37 21.540 -14.779 4.120 1201 H ASP 38 H ASP 38 22.378 -16.331 7.472 1202 HA ASP 38 HA ASP 38 21.586 -14.571 9.661 1203 HB2 ASP 38 2HB ASP 38 23.753 -15.202 10.689 1204 HB3 ASP 38 3HB ASP 38 22.848 -16.626 10.184 1205 H SER 39 H SER 39 23.350 -14.390 6.686 1206 HA SER 39 HA SER 39 24.955 -12.108 7.129 1207 HB2 SER 39 2HB SER 39 24.886 -11.925 4.594 1208 HB3 SER 39 3HB SER 39 25.345 -13.522 5.184 1209 HG SER 39 HG SER 39 22.633 -13.003 4.668 1210 HA PRO 40 HA PRO 40 21.927 -8.835 7.549 1211 HB2 PRO 40 2HB PRO 40 23.343 -6.711 6.386 1212 HB3 PRO 40 3HB PRO 40 23.585 -7.288 8.047 1213 HG2 PRO 40 2HG PRO 40 25.154 -7.967 5.576 1214 HG3 PRO 40 3HG PRO 40 25.744 -7.587 7.210 1215 HD2 PRO 40 2HD PRO 40 25.636 -10.127 6.376 1216 HD3 PRO 40 3HD PRO 40 25.199 -9.720 8.053 1217 H ILE 41 H ILE 41 20.151 -8.399 6.400 1218 HA ILE 41 HA ILE 41 20.077 -8.678 3.494 1219 HB ILE 41 HB ILE 41 17.799 -8.060 5.448 1220 HG12 ILE 41 2HG1 ILE 41 17.044 -10.477 4.783 1221 HG13 ILE 41 3HG1 ILE 41 18.683 -10.701 4.193 1222 HG21 ILE 41 1HG2 ILE 41 17.617 -8.724 2.480 1223 HG22 ILE 41 2HG2 ILE 41 17.282 -7.157 3.219 1224 HG23 ILE 41 3HG2 ILE 41 16.241 -8.537 3.570 1225 HD11 ILE 41 1HD1 ILE 41 17.893 -10.074 7.041 1226 HD12 ILE 41 2HD1 ILE 41 19.540 -10.338 6.457 1227 HD13 ILE 41 3HD1 ILE 41 18.365 -11.651 6.409 1228 HA PRO 42 HA PRO 42 20.379 -4.086 3.422 1229 HB2 PRO 42 2HB PRO 42 21.776 -3.839 1.102 1230 HB3 PRO 42 3HB PRO 42 22.552 -4.347 2.614 1231 HG2 PRO 42 2HG PRO 42 21.924 -5.964 0.214 1232 HG3 PRO 42 3HG PRO 42 23.137 -6.245 1.476 1233 HD2 PRO 42 2HD PRO 42 20.507 -7.446 1.252 1234 HD3 PRO 42 3HD PRO 42 21.739 -7.745 2.493 1235 H LEU 43 H LEU 43 18.567 -3.016 2.902 1236 HA LEU 43 HA LEU 43 17.074 -3.553 0.427 1237 HB2 LEU 43 2HB LEU 43 16.315 -1.903 2.875 1238 HB3 LEU 43 3HB LEU 43 15.309 -2.095 1.455 1239 HG LEU 43 HG LEU 43 14.381 -3.523 3.118 1240 HD11 LEU 43 1HD1 LEU 43 14.512 -5.755 2.168 1241 HD12 LEU 43 2HD1 LEU 43 15.977 -5.324 1.283 1242 HD13 LEU 43 3HD1 LEU 43 14.445 -4.533 0.898 1243 HD21 LEU 43 1HD2 LEU 43 16.248 -3.604 4.695 1244 HD22 LEU 43 2HD2 LEU 43 17.120 -4.721 3.641 1245 HD23 LEU 43 3HD2 LEU 43 15.604 -5.219 4.399 1246 HA PRO 44 HA PRO 44 19.407 0.204 -0.837 1247 HB2 PRO 44 2HB PRO 44 19.665 -0.348 -3.463 1248 HB3 PRO 44 3HB PRO 44 20.535 -1.320 -2.256 1249 HG2 PRO 44 2HG PRO 44 18.016 -1.994 -3.757 1250 HG3 PRO 44 3HG PRO 44 19.409 -3.032 -3.372 1251 HD2 PRO 44 2HD PRO 44 17.028 -2.959 -1.895 1252 HD3 PRO 44 3HD PRO 44 18.578 -3.577 -1.292 1253 H ASN 45 H ASN 45 16.810 0.663 -0.193 1254 HA ASN 45 HA ASN 45 15.848 2.503 -2.241 1255 HB2 ASN 45 2HB ASN 45 14.655 0.425 -2.828 1256 HB3 ASN 45 3HB ASN 45 14.120 0.226 -1.167 1257 HD21 ASN 45 1HD2 ASN 45 13.679 2.054 -4.119 1258 HD22 ASN 45 2HD2 ASN 45 12.165 2.766 -3.685 1259 H VAL 46 H VAL 46 14.953 0.982 0.881 1260 HA VAL 46 HA VAL 46 13.892 3.475 1.908 1261 HB VAL 46 HB VAL 46 12.754 1.376 2.479 1262 HG11 VAL 46 1HG1 VAL 46 14.661 -0.182 2.536 1263 HG12 VAL 46 2HG1 VAL 46 13.704 -0.304 4.013 1264 HG13 VAL 46 3HG1 VAL 46 15.241 0.563 4.030 1265 HG21 VAL 46 1HG2 VAL 46 12.522 3.251 4.037 1266 HG22 VAL 46 2HG2 VAL 46 13.952 2.723 4.929 1267 HG23 VAL 46 3HG2 VAL 46 12.496 1.724 4.923 1268 H THR 47 H THR 47 15.064 4.993 2.891 1269 HA THR 47 HA THR 47 17.879 4.712 3.461 1270 HB THR 47 HB THR 47 17.743 7.098 4.161 1271 HG1 THR 47 HG1 THR 47 15.382 7.906 3.613 1272 HG21 THR 47 1HG2 THR 47 17.932 6.604 1.741 1273 HG22 THR 47 2HG2 THR 47 17.001 8.077 2.021 1274 HG23 THR 47 3HG2 THR 47 16.173 6.573 1.607 1275 H SER 48 H SER 48 18.684 5.671 5.688 1276 HA SER 48 HA SER 48 17.938 3.776 7.677 1277 HB2 SER 48 2HB SER 48 19.607 4.931 9.102 1278 HB3 SER 48 3HB SER 48 20.244 4.612 7.489 1279 HG SER 48 HG SER 48 20.748 6.652 7.725 1280 H THR 49 H THR 49 17.355 7.238 7.257 1281 HA THR 49 HA THR 49 16.164 7.889 9.700 1282 HB THR 49 HB THR 49 15.632 9.095 6.940 1283 HG1 THR 49 HG1 THR 49 17.645 9.490 8.893 1284 HG21 THR 49 1HG2 THR 49 15.028 11.169 8.141 1285 HG22 THR 49 2HG2 THR 49 15.231 10.350 9.690 1286 HG23 THR 49 3HG2 THR 49 13.938 9.858 8.593 1287 H ILE 50 H ILE 50 14.773 6.549 6.731 1288 HA ILE 50 HA ILE 50 12.034 6.735 7.664 1289 HB ILE 50 HB ILE 50 13.179 5.427 5.160 1290 HG12 ILE 50 2HG1 ILE 50 13.625 7.827 5.133 1291 HG13 ILE 50 3HG1 ILE 50 12.317 7.510 4.002 1292 HG21 ILE 50 1HG2 ILE 50 10.282 6.078 5.824 1293 HG22 ILE 50 2HG2 ILE 50 10.980 4.466 5.699 1294 HG23 ILE 50 3HG2 ILE 50 10.861 5.483 4.264 1295 HD11 ILE 50 1HD1 ILE 50 12.065 8.684 6.771 1296 HD12 ILE 50 2HD1 ILE 50 10.707 8.301 5.709 1297 HD13 ILE 50 3HD1 ILE 50 11.882 9.523 5.232 1298 H LEU 51 H LEU 51 14.411 4.139 7.091 1299 HA LEU 51 HA LEU 51 12.788 1.923 7.716 1300 HB2 LEU 51 2HB LEU 51 14.972 1.815 6.473 1301 HB3 LEU 51 3HB LEU 51 15.812 2.110 7.986 1302 HG LEU 51 HG LEU 51 14.923 -0.041 8.896 1303 HD11 LEU 51 1HD1 LEU 51 13.808 -1.671 7.439 1304 HD12 LEU 51 2HD1 LEU 51 13.737 -0.477 6.140 1305 HD13 LEU 51 3HD1 LEU 51 12.844 -0.210 7.639 1306 HD21 LEU 51 1HD2 LEU 51 16.306 -1.573 7.579 1307 HD22 LEU 51 2HD2 LEU 51 17.129 -0.036 7.836 1308 HD23 LEU 51 3HD2 LEU 51 16.396 -0.388 6.269 1309 H GLU 52 H GLU 52 14.677 4.094 9.709 1310 HA GLU 52 HA GLU 52 14.711 2.927 12.216 1311 HB2 GLU 52 2HB GLU 52 15.719 5.134 11.661 1312 HB3 GLU 52 3HB GLU 52 14.113 5.832 11.488 1313 HG2 GLU 52 2HG GLU 52 13.748 5.230 13.959 1314 HG3 GLU 52 3HG GLU 52 15.477 4.903 14.033 1315 H LYS 53 H LYS 53 12.128 4.904 10.740 1316 HA LYS 53 HA LYS 53 10.263 4.550 12.911 1317 HB2 LYS 53 2HB LYS 53 10.229 5.996 10.278 1318 HB3 LYS 53 3HB LYS 53 8.704 5.727 11.113 1319 HG2 LYS 53 2HG LYS 53 9.408 6.983 13.017 1320 HG3 LYS 53 3HG LYS 53 11.074 7.077 12.434 1321 HD2 LYS 53 2HD LYS 53 8.706 8.298 10.970 1322 HD3 LYS 53 3HD LYS 53 9.679 9.183 12.151 1323 HE2 LYS 53 2HE LYS 53 10.755 7.918 9.599 1324 HE3 LYS 53 3HE LYS 53 10.411 9.638 9.833 1325 HZ1 LYS 53 1HZ LYS 53 12.062 9.708 11.586 1326 HZ2 LYS 53 2HZ LYS 53 12.757 9.129 10.162 1327 HZ3 LYS 53 3HZ LYS 53 12.379 8.056 11.407 1328 H VAL 54 H VAL 54 10.697 3.097 9.730 1329 HA VAL 54 HA VAL 54 8.217 1.799 9.458 1330 HB VAL 54 HB VAL 54 10.984 1.084 8.376 1331 HG11 VAL 54 1HG1 VAL 54 9.859 -0.435 6.767 1332 HG12 VAL 54 2HG1 VAL 54 8.330 -0.187 7.611 1333 HG13 VAL 54 3HG1 VAL 54 9.669 -0.989 8.432 1334 HG21 VAL 54 1HG2 VAL 54 10.023 3.211 7.531 1335 HG22 VAL 54 2HG2 VAL 54 8.570 2.358 7.010 1336 HG23 VAL 54 3HG2 VAL 54 10.120 2.008 6.242 1337 H LEU 55 H LEU 55 11.304 0.630 10.807 1338 HA LEU 55 HA LEU 55 10.221 -1.814 11.832 1339 HB2 LEU 55 2HB LEU 55 12.891 -0.472 12.355 1340 HB3 LEU 55 3HB LEU 55 12.459 -2.087 12.909 1341 HG LEU 55 HG LEU 55 12.749 -1.196 10.010 1342 HD11 LEU 55 1HD1 LEU 55 14.644 -2.742 9.926 1343 HD12 LEU 55 2HD1 LEU 55 14.447 -3.093 11.646 1344 HD13 LEU 55 3HD1 LEU 55 14.894 -1.468 11.119 1345 HD21 LEU 55 1HD2 LEU 55 11.961 -3.934 11.080 1346 HD22 LEU 55 2HD2 LEU 55 12.331 -3.555 9.395 1347 HD23 LEU 55 3HD2 LEU 55 10.929 -2.825 10.169 1348 H ASP 56 H ASP 56 10.599 1.436 13.113 1349 HA ASP 56 HA ASP 56 10.413 0.930 15.887 1350 HB2 ASP 56 2HB ASP 56 11.021 3.156 14.940 1351 HB3 ASP 56 3HB ASP 56 9.383 3.349 14.334 1352 H TYR 57 H TYR 57 7.843 1.734 13.512 1353 HA TYR 57 HA TYR 57 5.676 1.310 15.295 1354 HB2 TYR 57 2HB TYR 57 5.306 2.698 13.322 1355 HB3 TYR 57 3HB TYR 57 5.700 1.355 12.250 1356 HD1 TYR 57 HD1 TYR 57 3.165 2.558 14.726 1357 HD2 TYR 57 HD2 TYR 57 3.992 -0.283 11.643 1358 HE1 TYR 57 HE1 TYR 57 0.828 1.815 14.784 1359 HE2 TYR 57 HE2 TYR 57 1.657 -1.011 11.702 1360 HH TYR 57 HH TYR 57 -0.790 0.673 13.459 1361 H CYS 58 H CYS 58 7.386 -0.824 12.991 1362 HA CYS 58 HA CYS 58 5.640 -3.029 13.116 1363 HB2 CYS 58 2HB CYS 58 8.629 -2.915 12.597 1364 HB3 CYS 58 3HB CYS 58 7.681 -4.396 12.459 1365 HG CYS 58 HG CYS 58 8.239 -2.227 10.183 1366 H ARG 59 H ARG 59 8.393 -2.142 15.185 1367 HA ARG 59 HA ARG 59 8.362 -4.425 16.864 1368 HB2 ARG 59 2HB ARG 59 10.300 -2.846 16.720 1369 HB3 ARG 59 3HB ARG 59 9.337 -1.608 17.526 1370 HG2 ARG 59 2HG ARG 59 9.194 -3.010 19.546 1371 HG3 ARG 59 3HG ARG 59 10.090 -4.291 18.732 1372 HD2 ARG 59 2HD ARG 59 12.056 -2.797 18.579 1373 HD3 ARG 59 3HD ARG 59 11.154 -1.540 19.438 1374 HE ARG 59 HE ARG 59 10.954 -3.611 21.133 1375 HH11 ARG 59 1HH1 ARG 59 13.785 -2.245 19.560 1376 HH12 ARG 59 2HH1 ARG 59 14.857 -2.700 20.843 1377 HH21 ARG 59 1HH2 ARG 59 12.390 -4.211 22.785 1378 HH22 ARG 59 2HH2 ARG 59 14.071 -3.808 22.658 1379 H HIS 60 H HIS 60 6.932 -1.193 17.122 1380 HA HIS 60 HA HIS 60 5.487 -1.391 19.497 1381 HB2 HIS 60 2HB HIS 60 5.740 0.758 18.454 1382 HB3 HIS 60 3HB HIS 60 5.040 0.198 16.942 1383 HD1 HIS 60 HD1 HIS 60 3.997 0.971 20.506 1384 HD2 HIS 60 HD2 HIS 60 2.357 0.688 16.700 1385 HE1 HIS 60 HE1 HIS 60 1.632 1.780 20.717 1386 HE2 HIS 60 HE2 HIS 60 0.790 1.882 18.355 1387 H HIS 61 H HIS 61 4.684 -2.536 16.249 1388 HA HIS 61 HA HIS 61 1.915 -3.094 16.822 1389 HB2 HIS 61 2HB HIS 61 2.727 -2.366 14.538 1390 HB3 HIS 61 3HB HIS 61 3.532 -3.924 14.374 1391 HD1 HIS 61 HD1 HIS 61 2.074 -5.924 13.712 1392 HD2 HIS 61 HD2 HIS 61 -0.121 -2.510 14.567 1393 HE1 HIS 61 HE1 HIS 61 -0.284 -6.462 13.062 1394 HE2 HIS 61 HE2 HIS 61 -1.620 -4.480 13.841 1395 H HIS 62 H HIS 62 4.927 -4.796 17.027 1396 HA HIS 62 HA HIS 62 3.754 -7.438 17.227 1397 HB2 HIS 62 2HB HIS 62 6.088 -7.056 16.376 1398 HB3 HIS 62 3HB HIS 62 6.560 -6.512 17.984 1399 HD1 HIS 62 HD1 HIS 62 5.704 -9.590 16.035 1400 HD2 HIS 62 HD2 HIS 62 6.862 -8.582 19.896 1401 HE1 HIS 62 HE1 HIS 62 6.278 -11.752 17.157 1402 HE2 HIS 62 HE2 HIS 62 7.088 -11.107 19.446 1403 H GLN 63 H GLN 63 4.938 -4.910 19.409 1404 HA GLN 63 HA GLN 63 4.548 -6.321 21.875 1405 HB2 GLN 63 2HB GLN 63 4.776 -3.330 21.312 1406 HB3 GLN 63 3HB GLN 63 4.834 -4.051 22.920 1407 HG2 GLN 63 2HG GLN 63 6.893 -5.260 22.303 1408 HG3 GLN 63 3HG GLN 63 6.838 -4.559 20.689 1409 HE21 GLN 63 1HE2 GLN 63 6.155 -2.825 23.706 1410 HE22 GLN 63 2HE2 GLN 63 7.520 -1.777 23.610 1411 H HIS 64 H HIS 64 2.625 -4.136 19.910 1412 HA HIS 64 HA HIS 64 0.188 -4.689 21.484 1413 HB2 HIS 64 2HB HIS 64 1.057 -2.050 20.220 1414 HB3 HIS 64 3HB HIS 64 -0.602 -2.371 20.714 1415 HD1 HIS 64 HD1 HIS 64 -1.177 -1.988 23.109 1416 HD2 HIS 64 HD2 HIS 64 2.924 -2.020 22.464 1417 HE1 HIS 64 HE1 HIS 64 -0.146 -1.306 25.289 1418 HE2 HIS 64 HE2 HIS 64 2.326 -1.180 24.823 1419 HA PRO 65 HA PRO 65 -0.392 -6.808 17.447 1420 HB2 PRO 65 2HB PRO 65 -3.105 -7.186 18.740 1421 HB3 PRO 65 3HB PRO 65 -2.084 -8.376 17.898 1422 HG2 PRO 65 2HG PRO 65 -2.175 -8.411 20.531 1423 HG3 PRO 65 3HG PRO 65 -0.610 -8.592 19.703 1424 HD2 PRO 65 2HD PRO 65 -1.735 -6.169 21.094 1425 HD3 PRO 65 3HD PRO 65 -0.069 -6.794 21.097 1426 H GLY 66 H GLY 66 -2.501 -4.328 18.764 1427 HA2 GLY 66 2HA GLY 66 -2.635 -2.530 16.859 1428 HA3 GLY 66 3HA GLY 66 -3.711 -3.731 16.146 1429 H GLY 67 H GLY 67 -4.929 -4.697 18.468 1430 HA2 GLY 67 2HA GLY 67 -6.642 -4.317 19.941 1431 HA3 GLY 67 3HA GLY 67 -6.155 -2.629 20.036 1432 H SER 68 H SER 68 -6.809 -1.195 18.334 1433 HA SER 68 HA SER 68 -8.131 -0.229 16.795 1434 HB2 SER 68 2HB SER 68 -8.527 -3.051 15.732 1435 HB3 SER 68 3HB SER 68 -8.798 -1.560 14.827 1436 HG SER 68 HG SER 68 -6.292 -1.736 15.959 1437 H GLY 69 H GLY 69 -9.319 -1.137 19.318 1438 HA2 GLY 69 2HA GLY 69 -11.984 -2.040 19.008 1439 HA3 GLY 69 3HA GLY 69 -11.325 -1.203 20.405 1440 H LEU 70 H LEU 70 -10.849 1.245 19.911 1441 HA LEU 70 HA LEU 70 -12.480 2.648 18.063 1442 HB2 LEU 70 2HB LEU 70 -14.305 1.974 19.559 1443 HB3 LEU 70 3HB LEU 70 -13.415 2.559 20.956 1444 HG LEU 70 HG LEU 70 -13.601 4.881 20.075 1445 HD11 LEU 70 1HD1 LEU 70 -15.190 5.419 18.265 1446 HD12 LEU 70 2HD1 LEU 70 -15.412 3.697 17.946 1447 HD13 LEU 70 3HD1 LEU 70 -13.837 4.449 17.687 1448 HD21 LEU 70 1HD2 LEU 70 -15.973 5.225 20.641 1449 HD22 LEU 70 2HD2 LEU 70 -15.207 4.084 21.745 1450 HD23 LEU 70 3HD2 LEU 70 -16.270 3.492 20.466 1451 H ASP 71 H ASP 71 -11.073 2.872 21.329 1452 HA ASP 71 HA ASP 71 -10.227 5.657 20.904 1453 HB2 ASP 71 2HB ASP 71 -11.596 4.983 22.918 1454 HB3 ASP 71 3HB ASP 71 -10.267 3.952 23.441 1455 H ASP 72 H ASP 72 -8.813 3.635 19.488 1456 HA ASP 72 HA ASP 72 -6.323 3.065 20.936 1457 HB2 ASP 72 2HB ASP 72 -7.420 2.045 18.279 1458 HB3 ASP 72 3HB ASP 72 -5.834 1.605 18.922 1459 H ILE 73 H ILE 73 -6.366 5.657 20.658 1460 HA ILE 73 HA ILE 73 -4.336 6.177 18.552 1461 HB ILE 73 HB ILE 73 -6.053 8.303 19.941 1462 HG12 ILE 73 2HG1 ILE 73 -6.958 8.683 17.508 1463 HG13 ILE 73 3HG1 ILE 73 -6.339 7.076 17.156 1464 HG21 ILE 73 1HG2 ILE 73 -5.039 9.908 18.342 1465 HG22 ILE 73 2HG2 ILE 73 -4.032 8.617 17.683 1466 HG23 ILE 73 3HG2 ILE 73 -3.814 9.139 19.354 1467 HD11 ILE 73 1HD1 ILE 73 -8.728 7.057 17.605 1468 HD12 ILE 73 2HD1 ILE 73 -8.457 7.758 19.200 1469 HD13 ILE 73 3HD1 ILE 73 -7.862 6.137 18.836 1470 HA PRO 74 HA PRO 74 -2.179 6.154 22.681 1471 HB2 PRO 74 2HB PRO 74 0.072 4.959 21.134 1472 HB3 PRO 74 3HB PRO 74 -0.729 4.342 22.596 1473 HG2 PRO 74 2HG PRO 74 -1.086 3.129 20.237 1474 HG3 PRO 74 3HG PRO 74 -2.427 3.290 21.401 1475 HD2 PRO 74 2HD PRO 74 -1.838 5.009 18.975 1476 HD3 PRO 74 3HD PRO 74 -3.377 4.258 19.462 1477 HA PRO 75 HA PRO 75 0.076 10.053 21.916 1478 HB2 PRO 75 2HB PRO 75 1.693 9.032 24.257 1479 HB3 PRO 75 3HB PRO 75 0.976 10.638 24.000 1480 HG2 PRO 75 2HG PRO 75 -0.184 8.960 25.685 1481 HG3 PRO 75 3HG PRO 75 -1.180 9.922 24.564 1482 HD2 PRO 75 2HD PRO 75 -0.413 7.017 24.380 1483 HD3 PRO 75 3HD PRO 75 -1.966 7.795 24.001 1484 H TYR 76 H TYR 76 1.641 6.917 22.299 1485 HA TYR 76 HA TYR 76 4.244 7.405 21.392 1486 HB2 TYR 76 2HB TYR 76 3.421 5.283 22.438 1487 HB3 TYR 76 3HB TYR 76 2.539 4.912 20.963 1488 HD1 TYR 76 HD1 TYR 76 3.795 4.227 18.897 1489 HD2 TYR 76 HD2 TYR 76 5.834 4.938 22.589 1490 HE1 TYR 76 HE1 TYR 76 5.754 3.031 18.048 1491 HE2 TYR 76 HE2 TYR 76 7.802 3.742 21.726 1492 HH TYR 76 HH TYR 76 8.154 2.903 18.451 1493 H ASP 77 H ASP 77 1.374 6.355 19.559 1494 HA ASP 77 HA ASP 77 2.585 6.482 16.972 1495 HB2 ASP 77 2HB ASP 77 -0.348 6.315 17.797 1496 HB3 ASP 77 3HB ASP 77 0.230 6.146 16.137 1497 H ARG 78 H ARG 78 0.807 8.742 18.944 1498 HA ARG 78 HA ARG 78 0.262 10.750 17.023 1499 HB2 ARG 78 2HB ARG 78 -0.863 10.657 19.189 1500 HB3 ARG 78 3HB ARG 78 0.660 10.886 20.034 1501 HG2 ARG 78 2HG ARG 78 0.824 13.181 19.281 1502 HG3 ARG 78 3HG ARG 78 -0.559 12.974 18.199 1503 HD2 ARG 78 2HD ARG 78 -0.682 12.772 21.237 1504 HD3 ARG 78 3HD ARG 78 -1.145 14.196 20.296 1505 HE ARG 78 HE ARG 78 -2.719 12.432 19.149 1506 HH11 ARG 78 1HH1 ARG 78 -2.117 12.747 22.601 1507 HH12 ARG 78 2HH1 ARG 78 -3.676 12.135 23.038 1508 HH21 ARG 78 1HH2 ARG 78 -4.741 11.649 19.752 1509 HH22 ARG 78 2HH2 ARG 78 -5.159 11.513 21.432 1510 H ASP 79 H ASP 79 3.067 10.165 19.158 1511 HA ASP 79 HA ASP 79 4.635 12.390 18.214 1512 HB2 ASP 79 2HB ASP 79 5.265 9.941 19.887 1513 HB3 ASP 79 3HB ASP 79 6.569 10.982 19.322 1514 H PHE 80 H PHE 80 4.198 9.053 17.255 1515 HA PHE 80 HA PHE 80 6.415 8.705 15.547 1516 HB2 PHE 80 2HB PHE 80 4.963 6.850 16.353 1517 HB3 PHE 80 3HB PHE 80 3.629 7.471 15.391 1518 HD1 PHE 80 HD1 PHE 80 3.427 6.903 13.053 1519 HD2 PHE 80 HD2 PHE 80 7.022 5.960 15.186 1520 HE1 PHE 80 HE1 PHE 80 4.218 5.569 11.153 1521 HE2 PHE 80 HE2 PHE 80 7.789 4.632 13.284 1522 HZ PHE 80 HZ PHE 80 6.398 4.434 11.268 1523 H CYS 81 H CYS 81 3.198 10.048 15.039 1524 HA CYS 81 HA CYS 81 3.373 10.404 12.209 1525 HB2 CYS 81 2HB CYS 81 1.456 11.539 14.269 1526 HB3 CYS 81 3HB CYS 81 1.249 11.687 12.524 1527 HG CYS 81 HG CYS 81 1.617 8.561 13.764 1528 H LYS 82 H LYS 82 4.883 12.096 14.722 1529 HA LYS 82 HA LYS 82 4.739 14.774 13.605 1530 HB2 LYS 82 2HB LYS 82 6.556 13.677 15.791 1531 HB3 LYS 82 3HB LYS 82 6.386 15.375 15.366 1532 HG2 LYS 82 2HG LYS 82 4.205 13.615 16.555 1533 HG3 LYS 82 3HG LYS 82 5.180 14.785 17.439 1534 HD2 LYS 82 2HD LYS 82 3.286 16.068 17.095 1535 HD3 LYS 82 3HD LYS 82 4.173 16.494 15.634 1536 HE2 LYS 82 2HE LYS 82 2.847 14.709 14.418 1537 HE3 LYS 82 3HE LYS 82 1.900 14.489 15.888 1538 HZ1 LYS 82 1HZ LYS 82 2.130 16.990 14.327 1539 HZ2 LYS 82 2HZ LYS 82 1.225 16.799 15.738 1540 HZ3 LYS 82 3HZ LYS 82 0.803 15.942 14.339 1541 H VAL 83 H VAL 83 5.405 14.052 11.461 1542 HA VAL 83 HA VAL 83 8.319 14.346 11.097 1543 HB VAL 83 HB VAL 83 8.283 12.739 9.179 1544 HG11 VAL 83 1HG1 VAL 83 7.426 11.451 11.797 1545 HG12 VAL 83 2HG1 VAL 83 9.067 11.926 11.358 1546 HG13 VAL 83 3HG1 VAL 83 8.257 10.637 10.467 1547 HG21 VAL 83 1HG2 VAL 83 6.399 11.165 8.870 1548 HG22 VAL 83 2HG2 VAL 83 5.894 12.829 8.587 1549 HG23 VAL 83 3HG2 VAL 83 5.467 12.023 10.100 1550 H ASP 84 H ASP 84 8.740 14.835 8.658 1551 HA ASP 84 HA ASP 84 7.266 17.198 7.947 1552 HB2 ASP 84 2HB ASP 84 9.459 15.679 6.471 1553 HB3 ASP 84 3HB ASP 84 8.800 17.216 5.921 1554 H GLN 85 H GLN 85 6.420 17.549 5.734 1555 HA GLN 85 HA GLN 85 4.346 15.760 5.074 1556 HB2 GLN 85 2HB GLN 85 4.215 18.204 4.677 1557 HB3 GLN 85 3HB GLN 85 5.435 18.073 3.422 1558 HG2 GLN 85 2HG GLN 85 3.219 18.296 2.434 1559 HG3 GLN 85 3HG GLN 85 3.888 16.703 2.060 1560 HE21 GLN 85 1HE2 GLN 85 1.772 15.932 1.667 1561 HE22 GLN 85 2HE2 GLN 85 0.679 15.575 2.952 1562 HA PRO 86 HA PRO 86 7.150 14.354 1.220 1563 HB2 PRO 86 2HB PRO 86 9.900 14.894 2.332 1564 HB3 PRO 86 3HB PRO 86 9.312 15.051 0.661 1565 HG2 PRO 86 2HG PRO 86 9.761 17.225 2.119 1566 HG3 PRO 86 3HG PRO 86 8.345 17.131 1.045 1567 HD2 PRO 86 2HD PRO 86 8.458 16.762 4.036 1568 HD3 PRO 86 3HD PRO 86 7.279 17.663 3.063 1569 H THR 87 H THR 87 8.502 14.193 4.509 1570 HA THR 87 HA THR 87 9.529 11.585 4.469 1571 HB THR 87 HB THR 87 8.489 13.104 6.903 1572 HG1 THR 87 HG1 THR 87 10.890 13.614 6.964 1573 HG21 THR 87 1HG2 THR 87 10.170 11.799 8.172 1574 HG22 THR 87 2HG2 THR 87 10.624 10.934 6.704 1575 HG23 THR 87 3HG2 THR 87 9.013 10.720 7.389 1576 H LEU 88 H LEU 88 6.266 12.793 5.276 1577 HA LEU 88 HA LEU 88 5.022 10.471 6.216 1578 HB2 LEU 88 2HB LEU 88 4.014 12.848 4.637 1579 HB3 LEU 88 3HB LEU 88 2.922 11.534 5.032 1580 HG LEU 88 HG LEU 88 4.429 13.143 7.127 1581 HD11 LEU 88 1HD1 LEU 88 2.334 14.329 7.558 1582 HD12 LEU 88 2HD1 LEU 88 1.565 13.502 6.200 1583 HD13 LEU 88 3HD1 LEU 88 2.900 14.622 5.914 1584 HD21 LEU 88 1HD2 LEU 88 2.821 12.138 8.704 1585 HD22 LEU 88 2HD2 LEU 88 3.756 10.893 7.878 1586 HD23 LEU 88 3HD2 LEU 88 2.090 11.213 7.388 1587 H PHE 89 H PHE 89 5.476 11.605 2.867 1588 HA PHE 89 HA PHE 89 4.179 9.386 1.621 1589 HB2 PHE 89 2HB PHE 89 6.071 11.476 0.469 1590 HB3 PHE 89 3HB PHE 89 5.195 10.289 -0.502 1591 HD1 PHE 89 HD1 PHE 89 5.053 13.609 0.675 1592 HD2 PHE 89 HD2 PHE 89 2.575 10.178 0.050 1593 HE1 PHE 89 HE1 PHE 89 3.066 15.047 0.624 1594 HE2 PHE 89 HE2 PHE 89 0.604 11.623 -0.000 1595 HZ PHE 89 HZ PHE 89 0.837 14.057 0.276 1596 H GLU 90 H GLU 90 7.534 10.079 2.511 1597 HA GLU 90 HA GLU 90 8.792 7.949 1.137 1598 HB2 GLU 90 2HB GLU 90 9.589 9.343 3.724 1599 HB3 GLU 90 3HB GLU 90 10.645 8.287 2.788 1600 HG2 GLU 90 2HG GLU 90 9.474 10.910 1.797 1601 HG3 GLU 90 3HG GLU 90 11.100 10.706 2.445 1602 H LEU 91 H LEU 91 7.173 8.155 4.286 1603 HA LEU 91 HA LEU 91 7.799 5.534 5.231 1604 HB2 LEU 91 2HB LEU 91 5.509 7.406 5.945 1605 HB3 LEU 91 3HB LEU 91 5.848 5.907 6.797 1606 HG LEU 91 HG LEU 91 7.738 8.295 6.663 1607 HD11 LEU 91 1HD1 LEU 91 7.159 8.710 9.000 1608 HD12 LEU 91 2HD1 LEU 91 5.982 7.393 8.961 1609 HD13 LEU 91 3HD1 LEU 91 5.736 8.830 7.966 1610 HD21 LEU 91 1HD2 LEU 91 8.949 6.172 6.923 1611 HD22 LEU 91 2HD2 LEU 91 7.944 5.747 8.310 1612 HD23 LEU 91 3HD2 LEU 91 9.037 7.131 8.396 1613 H ILE 92 H ILE 92 5.122 6.897 3.307 1614 HA ILE 92 HA ILE 92 3.485 4.573 3.130 1615 HB ILE 92 HB ILE 92 3.711 6.976 1.257 1616 HG12 ILE 92 2HG1 ILE 92 1.642 6.361 3.422 1617 HG13 ILE 92 3HG1 ILE 92 2.963 7.511 3.583 1618 HG21 ILE 92 1HG2 ILE 92 2.727 5.103 0.001 1619 HG22 ILE 92 2HG2 ILE 92 1.506 6.335 0.314 1620 HG23 ILE 92 3HG2 ILE 92 1.526 4.854 1.272 1621 HD11 ILE 92 1HD1 ILE 92 0.880 8.651 3.163 1622 HD12 ILE 92 2HD1 ILE 92 0.627 7.731 1.682 1623 HD13 ILE 92 3HD1 ILE 92 1.967 8.879 1.792 1624 H LEU 93 H LEU 93 6.127 5.823 1.095 1625 HA LEU 93 HA LEU 93 5.895 3.933 -1.021 1626 HB2 LEU 93 2HB LEU 93 8.247 5.689 -0.215 1627 HB3 LEU 93 3HB LEU 93 8.177 4.752 -1.702 1628 HG LEU 93 HG LEU 93 6.381 7.094 -0.968 1629 HD11 LEU 93 1HD1 LEU 93 8.541 6.889 -3.075 1630 HD12 LEU 93 2HD1 LEU 93 8.619 7.817 -1.574 1631 HD13 LEU 93 3HD1 LEU 93 7.465 8.268 -2.827 1632 HD21 LEU 93 1HD2 LEU 93 5.081 5.476 -2.236 1633 HD22 LEU 93 2HD2 LEU 93 6.329 5.403 -3.480 1634 HD23 LEU 93 3HD2 LEU 93 5.417 6.893 -3.226 1635 H ALA 94 H ALA 94 7.875 4.104 1.915 1636 HA ALA 94 HA ALA 94 9.429 1.753 1.432 1637 HB1 ALA 94 1HB ALA 94 10.144 2.003 3.779 1638 HB2 ALA 94 2HB ALA 94 8.890 3.221 4.033 1639 HB3 ALA 94 3HB ALA 94 10.219 3.543 2.919 1640 H ALA 95 H ALA 95 6.346 2.401 3.011 1641 HA ALA 95 HA ALA 95 6.033 -0.140 4.298 1642 HB1 ALA 95 1HB ALA 95 3.727 0.567 4.689 1643 HB2 ALA 95 2HB ALA 95 3.913 1.891 3.533 1644 HB3 ALA 95 3HB ALA 95 4.836 1.896 5.032 1645 H ASN 96 H ASN 96 5.117 1.201 1.168 1646 HA ASN 96 HA ASN 96 3.612 -1.055 0.226 1647 HB2 ASN 96 2HB ASN 96 3.247 1.192 -0.710 1648 HB3 ASN 96 3HB ASN 96 4.918 1.266 -1.257 1649 HD21 ASN 96 1HD2 ASN 96 4.280 1.621 -3.401 1650 HD22 ASN 96 2HD2 ASN 96 3.597 0.374 -4.379 1651 H TYR 97 H TYR 97 6.965 0.041 -0.022 1652 HA TYR 97 HA TYR 97 7.968 -1.882 -1.843 1653 HB2 TYR 97 2HB TYR 97 9.214 0.154 -1.483 1654 HB3 TYR 97 3HB TYR 97 9.298 -0.117 0.252 1655 HD1 TYR 97 HD1 TYR 97 11.374 -0.874 1.103 1656 HD2 TYR 97 HD2 TYR 97 10.372 -1.817 -2.949 1657 HE1 TYR 97 HE1 TYR 97 13.566 -1.939 0.807 1658 HE2 TYR 97 HE2 TYR 97 12.568 -2.884 -3.241 1659 HH TYR 97 HH TYR 97 14.827 -2.782 -2.218 1660 H LEU 98 H LEU 98 7.738 -1.834 1.702 1661 HA LEU 98 HA LEU 98 8.910 -4.526 1.935 1662 HB2 LEU 98 2HB LEU 98 8.162 -2.501 4.073 1663 HB3 LEU 98 3HB LEU 98 8.901 -4.065 4.389 1664 HG LEU 98 HG LEU 98 10.181 -1.742 2.883 1665 HD11 LEU 98 1HD1 LEU 98 11.772 -1.658 4.744 1666 HD12 LEU 98 2HD1 LEU 98 10.880 -2.935 5.576 1667 HD13 LEU 98 3HD1 LEU 98 10.120 -1.369 5.288 1668 HD21 LEU 98 1HD2 LEU 98 12.226 -3.138 2.791 1669 HD22 LEU 98 2HD2 LEU 98 10.900 -3.834 1.864 1670 HD23 LEU 98 3HD2 LEU 98 11.315 -4.503 3.445 1671 H ASP 99 H ASP 99 5.916 -3.179 1.507 1672 HA ASP 99 HA ASP 99 3.814 -3.936 1.435 1673 HB2 ASP 99 2HB ASP 99 5.204 -5.970 0.490 1674 HB3 ASP 99 3HB ASP 99 4.709 -6.774 1.970 1675 H ILE 100 H ILE 100 4.935 -3.126 3.983 1676 HA ILE 100 HA ILE 100 3.620 -4.681 6.056 1677 HB ILE 100 HB ILE 100 4.888 -1.909 6.292 1678 HG12 ILE 100 2HG1 ILE 100 6.138 -4.652 6.789 1679 HG13 ILE 100 3HG1 ILE 100 6.514 -3.590 5.438 1680 HG21 ILE 100 1HG2 ILE 100 5.032 -2.415 8.719 1681 HG22 ILE 100 2HG2 ILE 100 4.216 -3.959 8.459 1682 HG23 ILE 100 3HG2 ILE 100 3.358 -2.445 8.163 1683 HD11 ILE 100 1HD1 ILE 100 7.072 -3.034 8.342 1684 HD12 ILE 100 2HD1 ILE 100 7.437 -1.954 6.997 1685 HD13 ILE 100 3HD1 ILE 100 8.240 -3.519 7.113 1686 H LYS 101 H LYS 101 1.501 -4.681 5.574 1687 HA LYS 101 HA LYS 101 -0.076 -2.577 4.609 1688 HB2 LYS 101 2HB LYS 101 -1.099 -4.952 6.199 1689 HB3 LYS 101 3HB LYS 101 -1.989 -4.000 5.008 1690 HG2 LYS 101 2HG LYS 101 -0.479 -4.830 3.232 1691 HG3 LYS 101 3HG LYS 101 0.408 -5.779 4.431 1692 HD2 LYS 101 2HD LYS 101 -1.786 -6.995 4.912 1693 HD3 LYS 101 3HD LYS 101 -2.468 -6.158 3.514 1694 HE2 LYS 101 2HE LYS 101 -0.187 -8.166 3.534 1695 HE3 LYS 101 3HE LYS 101 -1.773 -8.342 2.771 1696 HZ1 LYS 101 1HZ LYS 101 0.455 -6.567 1.957 1697 HZ2 LYS 101 2HZ LYS 101 -1.125 -6.384 1.363 1698 HZ3 LYS 101 3HZ LYS 101 -0.273 -7.807 1.075 1699 HA PRO 102 HA PRO 102 -1.398 -1.848 9.417 1700 HB2 PRO 102 2HB PRO 102 1.355 -2.403 10.547 1701 HB3 PRO 102 3HB PRO 102 -0.239 -2.625 11.304 1702 HG2 PRO 102 2HG PRO 102 1.076 -4.732 10.412 1703 HG3 PRO 102 3HG PRO 102 -0.678 -4.596 10.135 1704 HD2 PRO 102 2HD PRO 102 1.572 -4.110 8.199 1705 HD3 PRO 102 3HD PRO 102 0.009 -4.906 7.934 1706 H LEU 103 H LEU 103 2.068 -1.209 8.588 1707 HA LEU 103 HA LEU 103 2.049 1.453 9.631 1708 HB2 LEU 103 2HB LEU 103 4.103 -0.002 9.421 1709 HB3 LEU 103 3HB LEU 103 4.063 0.242 7.691 1710 HG LEU 103 HG LEU 103 5.731 1.645 9.180 1711 HD11 LEU 103 1HD1 LEU 103 4.116 3.090 7.070 1712 HD12 LEU 103 2HD1 LEU 103 5.519 2.059 6.788 1713 HD13 LEU 103 3HD1 LEU 103 5.706 3.565 7.680 1714 HD21 LEU 103 1HD2 LEU 103 4.061 2.414 10.805 1715 HD22 LEU 103 2HD2 LEU 103 3.239 3.330 9.542 1716 HD23 LEU 103 3HD2 LEU 103 4.880 3.762 10.024 1717 H LEU 104 H LEU 104 1.684 0.082 6.403 1718 HA LEU 104 HA LEU 104 1.657 2.387 4.819 1719 HB2 LEU 104 2HB LEU 104 1.757 0.074 3.966 1720 HB3 LEU 104 3HB LEU 104 0.111 -0.212 4.504 1721 HG LEU 104 HG LEU 104 -0.695 1.487 2.847 1722 HD11 LEU 104 1HD1 LEU 104 0.813 2.283 1.068 1723 HD12 LEU 104 2HD1 LEU 104 2.189 1.545 1.897 1724 HD13 LEU 104 3HD1 LEU 104 1.305 2.874 2.654 1725 HD21 LEU 104 1HD2 LEU 104 -0.701 -0.911 2.318 1726 HD22 LEU 104 2HD2 LEU 104 0.928 -0.777 1.644 1727 HD23 LEU 104 3HD2 LEU 104 -0.422 0.068 0.881 1728 H ASP 105 H ASP 105 -0.971 0.707 6.507 1729 HA ASP 105 HA ASP 105 -3.096 2.315 5.554 1730 HB2 ASP 105 2HB ASP 105 -3.323 -0.043 6.459 1731 HB3 ASP 105 3HB ASP 105 -3.090 0.607 8.080 1732 H VAL 106 H VAL 106 -1.357 2.248 8.682 1733 HA VAL 106 HA VAL 106 -2.761 4.293 9.992 1734 HB VAL 106 HB VAL 106 0.101 3.311 10.401 1735 HG11 VAL 106 1HG1 VAL 106 0.064 4.418 12.635 1736 HG12 VAL 106 2HG1 VAL 106 -1.486 5.161 12.233 1737 HG13 VAL 106 3HG1 VAL 106 -0.039 5.599 11.327 1738 HG21 VAL 106 1HG2 VAL 106 -1.660 1.630 10.825 1739 HG22 VAL 106 2HG2 VAL 106 -2.462 2.733 11.942 1740 HG23 VAL 106 3HG2 VAL 106 -0.867 2.091 12.333 1741 H THR 107 H THR 107 0.239 4.504 8.024 1742 HA THR 107 HA THR 107 0.658 7.280 8.471 1743 HB THR 107 HB THR 107 1.784 5.568 6.217 1744 HG1 THR 107 HG1 THR 107 2.845 4.673 7.808 1745 HG21 THR 107 1HG2 THR 107 2.810 8.176 7.410 1746 HG22 THR 107 2HG2 THR 107 2.068 8.010 5.816 1747 HG23 THR 107 3HG2 THR 107 3.612 7.227 6.156 1748 H CYS 108 H CYS 108 -0.892 5.460 5.787 1749 HA CYS 108 HA CYS 108 -1.413 7.691 4.103 1750 HB2 CYS 108 2HB CYS 108 -2.775 4.976 4.252 1751 HB3 CYS 108 3HB CYS 108 -3.090 6.171 2.994 1752 HG CYS 108 HG CYS 108 0.008 4.849 3.558 1753 H LYS 109 H LYS 109 -3.202 6.225 6.774 1754 HA LYS 109 HA LYS 109 -5.573 7.806 6.537 1755 HB2 LYS 109 2HB LYS 109 -4.514 5.858 8.558 1756 HB3 LYS 109 3HB LYS 109 -5.643 7.049 9.180 1757 HG2 LYS 109 2HG LYS 109 -6.783 4.961 8.571 1758 HG3 LYS 109 3HG LYS 109 -7.360 6.330 7.619 1759 HD2 LYS 109 2HD LYS 109 -5.943 5.583 5.706 1760 HD3 LYS 109 3HD LYS 109 -5.389 4.211 6.666 1761 HE2 LYS 109 2HE LYS 109 -8.268 4.705 5.837 1762 HE3 LYS 109 3HE LYS 109 -7.160 3.585 5.043 1763 HZ1 LYS 109 1HZ LYS 109 -8.594 2.427 6.564 1764 HZ2 LYS 109 2HZ LYS 109 -8.111 3.410 7.853 1765 HZ3 LYS 109 3HZ LYS 109 -7.003 2.355 7.132 1766 H THR 110 H THR 110 -2.500 8.169 8.272 1767 HA THR 110 HA THR 110 -3.145 10.393 9.877 1768 HB THR 110 HB THR 110 -0.441 9.535 8.759 1769 HG1 THR 110 HG1 THR 110 -0.720 8.036 10.220 1770 HG21 THR 110 1HG2 THR 110 0.580 10.876 10.576 1771 HG22 THR 110 2HG2 THR 110 -1.014 11.490 11.018 1772 HG23 THR 110 3HG2 THR 110 -0.311 11.905 9.452 1773 H VAL 111 H VAL 111 -1.709 10.204 6.611 1774 HA VAL 111 HA VAL 111 -1.495 12.992 6.135 1775 HB VAL 111 HB VAL 111 -1.787 10.782 4.036 1776 HG11 VAL 111 1HG1 VAL 111 -0.592 13.578 3.806 1777 HG12 VAL 111 2HG1 VAL 111 -2.109 13.034 3.087 1778 HG13 VAL 111 3HG1 VAL 111 -0.580 12.353 2.531 1779 HG21 VAL 111 1HG2 VAL 111 0.762 11.889 5.288 1780 HG22 VAL 111 2HG2 VAL 111 0.689 10.723 3.963 1781 HG23 VAL 111 3HG2 VAL 111 0.091 10.280 5.561 1782 H ALA 112 H ALA 112 -4.045 10.614 5.588 1783 HA ALA 112 HA ALA 112 -5.877 12.254 4.174 1784 HB1 ALA 112 1HB ALA 112 -7.557 10.534 4.726 1785 HB2 ALA 112 2HB ALA 112 -6.447 9.810 5.893 1786 HB3 ALA 112 3HB ALA 112 -6.053 9.789 4.173 1787 H ASN 113 H ASN 113 -5.253 11.757 7.642 1788 HA ASN 113 HA ASN 113 -7.622 12.917 8.692 1789 HB2 ASN 113 2HB ASN 113 -4.874 12.583 9.966 1790 HB3 ASN 113 3HB ASN 113 -6.274 13.183 10.848 1791 HD21 ASN 113 1HD2 ASN 113 -4.682 10.852 11.408 1792 HD22 ASN 113 2HD2 ASN 113 -5.751 9.497 11.355 1793 H MET 114 H MET 114 -4.573 14.278 7.626 1794 HA MET 114 HA MET 114 -4.829 16.864 8.779 1795 HB2 MET 114 2HB MET 114 -3.269 16.059 6.295 1796 HB3 MET 114 3HB MET 114 -3.039 17.534 7.227 1797 HG2 MET 114 2HG MET 114 -2.335 16.142 9.173 1798 HG3 MET 114 3HG MET 114 -2.462 14.705 8.153 1799 HE1 MET 114 1HE MET 114 -1.150 14.687 5.707 1800 HE2 MET 114 2HE MET 114 0.235 15.718 5.367 1801 HE3 MET 114 3HE MET 114 -1.391 16.399 5.357 1802 H ILE 115 H ILE 115 -5.837 15.464 5.668 1803 HA ILE 115 HA ILE 115 -6.985 18.017 4.751 1804 HB ILE 115 HB ILE 115 -7.448 16.923 2.619 1805 HG12 ILE 115 2HG1 ILE 115 -6.335 14.325 3.794 1806 HG13 ILE 115 3HG1 ILE 115 -8.047 14.641 3.547 1807 HG21 ILE 115 1HG2 ILE 115 -4.633 16.261 3.575 1808 HG22 ILE 115 2HG2 ILE 115 -5.182 17.820 2.955 1809 HG23 ILE 115 3HG2 ILE 115 -5.139 16.416 1.887 1810 HD11 ILE 115 1HD1 ILE 115 -7.152 13.246 1.795 1811 HD12 ILE 115 2HD1 ILE 115 -5.955 14.473 1.383 1812 HD13 ILE 115 3HD1 ILE 115 -7.674 14.796 1.137 1813 H ARG 116 H ARG 116 -7.998 15.362 6.602 1814 HA ARG 116 HA ARG 116 -10.720 15.159 5.736 1815 HB2 ARG 116 2HB ARG 116 -9.118 14.003 7.983 1816 HB3 ARG 116 3HB ARG 116 -10.847 14.113 8.267 1817 HG2 ARG 116 2HG ARG 116 -9.861 12.862 5.706 1818 HG3 ARG 116 3HG ARG 116 -9.789 11.927 7.199 1819 HD2 ARG 116 2HD ARG 116 -11.890 11.613 5.756 1820 HD3 ARG 116 3HD ARG 116 -12.142 11.943 7.463 1821 HE ARG 116 HE ARG 116 -12.746 14.229 6.876 1822 HH11 ARG 116 1HH1 ARG 116 -12.764 11.929 4.218 1823 HH12 ARG 116 2HH1 ARG 116 -13.851 12.878 3.257 1824 HH21 ARG 116 1HH2 ARG 116 -14.137 15.465 5.617 1825 HH22 ARG 116 2HH2 ARG 116 -14.635 14.894 4.053 1826 H GLY 117 H GLY 117 -11.544 17.202 5.646 1827 HA2 GLY 117 2HA GLY 117 -11.910 18.870 7.969 1828 HA3 GLY 117 3HA GLY 117 -12.693 19.042 6.400 Start of MODEL 15 1 H1 SER 2 1H SER 2 -16.076 -16.165 -16.525 2 H2 SER 2 2H SER 2 -14.740 -15.316 -15.938 3 H3 SER 2 3H SER 2 -15.920 -14.511 -16.842 4 HA SER 2 HA SER 2 -17.549 -14.891 -15.156 5 HB2 SER 2 2HB SER 2 -15.287 -16.130 -13.542 6 HB3 SER 2 3HB SER 2 -16.962 -15.926 -13.022 7 HG SER 2 HG SER 2 -17.405 -17.740 -13.982 8 H LEU 3 H LEU 3 -17.947 -13.019 -14.222 9 HA LEU 3 HA LEU 3 -15.757 -11.078 -13.841 10 HB2 LEU 3 2HB LEU 3 -18.749 -10.639 -14.204 11 HB3 LEU 3 3HB LEU 3 -17.528 -9.377 -14.149 12 HG LEU 3 HG LEU 3 -17.626 -11.516 -16.310 13 HD11 LEU 3 1HD1 LEU 3 -18.612 -9.830 -17.778 14 HD12 LEU 3 2HD1 LEU 3 -18.726 -8.695 -16.429 15 HD13 LEU 3 3HD1 LEU 3 -19.661 -10.193 -16.413 16 HD21 LEU 3 1HD2 LEU 3 -15.413 -10.528 -16.023 17 HD22 LEU 3 2HD2 LEU 3 -16.089 -8.903 -16.175 18 HD23 LEU 3 3HD2 LEU 3 -16.130 -10.013 -17.549 19 H VAL 4 H VAL 4 -15.168 -10.791 -11.696 20 HA VAL 4 HA VAL 4 -16.966 -11.168 -9.492 21 HB VAL 4 HB VAL 4 -15.231 -9.842 -8.122 22 HG11 VAL 4 1HG1 VAL 4 -13.640 -11.725 -8.046 23 HG12 VAL 4 2HG1 VAL 4 -14.276 -12.336 -9.575 24 HG13 VAL 4 3HG1 VAL 4 -15.307 -12.297 -8.144 25 HG21 VAL 4 1HG2 VAL 4 -14.208 -8.551 -9.957 26 HG22 VAL 4 2HG2 VAL 4 -13.606 -10.039 -10.691 27 HG23 VAL 4 3HG2 VAL 4 -12.990 -9.517 -9.120 28 H LYS 5 H LYS 5 -18.632 -9.960 -9.146 29 HA LYS 5 HA LYS 5 -19.001 -7.404 -10.440 30 HB2 LYS 5 2HB LYS 5 -20.878 -9.006 -8.660 31 HB3 LYS 5 3HB LYS 5 -21.331 -7.646 -9.676 32 HG2 LYS 5 2HG LYS 5 -20.689 -8.963 -11.690 33 HG3 LYS 5 3HG LYS 5 -20.310 -10.338 -10.651 34 HD2 LYS 5 2HD LYS 5 -22.667 -10.442 -9.915 35 HD3 LYS 5 3HD LYS 5 -23.050 -9.036 -10.918 36 HE2 LYS 5 2HE LYS 5 -22.390 -10.324 -12.936 37 HE3 LYS 5 3HE LYS 5 -22.082 -11.735 -11.918 38 HZ1 LYS 5 1HZ LYS 5 -24.264 -11.816 -12.948 39 HZ2 LYS 5 2HZ LYS 5 -24.693 -10.359 -12.208 40 HZ3 LYS 5 3HZ LYS 5 -24.397 -11.732 -11.267 41 H LEU 6 H LEU 6 -17.435 -6.219 -9.329 42 HA LEU 6 HA LEU 6 -17.463 -5.869 -6.462 43 HB2 LEU 6 2HB LEU 6 -15.900 -4.398 -8.617 44 HB3 LEU 6 3HB LEU 6 -15.603 -4.285 -6.890 45 HG LEU 6 HG LEU 6 -15.257 -6.792 -8.582 46 HD11 LEU 6 1HD1 LEU 6 -13.543 -5.125 -9.063 47 HD12 LEU 6 2HD1 LEU 6 -12.863 -6.509 -8.213 48 HD13 LEU 6 3HD1 LEU 6 -13.151 -4.997 -7.344 49 HD21 LEU 6 1HD2 LEU 6 -15.937 -7.393 -6.316 50 HD22 LEU 6 2HD2 LEU 6 -14.664 -6.379 -5.632 51 HD23 LEU 6 3HD2 LEU 6 -14.244 -7.810 -6.579 52 H GLU 7 H GLU 7 -19.557 -5.115 -6.134 53 HA GLU 7 HA GLU 7 -20.535 -2.662 -7.270 54 HB2 GLU 7 2HB GLU 7 -22.071 -4.454 -6.524 55 HB3 GLU 7 3HB GLU 7 -21.491 -4.289 -4.870 56 HG2 GLU 7 2HG GLU 7 -22.383 -1.973 -4.804 57 HG3 GLU 7 3HG GLU 7 -23.000 -2.173 -6.444 58 H SER 8 H SER 8 -19.808 -0.702 -6.650 59 HA SER 8 HA SER 8 -18.065 -0.203 -4.456 60 HB2 SER 8 2HB SER 8 -18.369 2.216 -5.192 61 HB3 SER 8 3HB SER 8 -17.916 1.120 -6.496 62 HG SER 8 HG SER 8 -19.959 1.171 -7.276 63 H SER 9 H SER 9 -18.550 1.690 -2.913 64 HA SER 9 HA SER 9 -20.775 1.219 -1.225 65 HB2 SER 9 2HB SER 9 -20.042 3.339 -0.083 66 HB3 SER 9 3HB SER 9 -18.709 2.219 -0.361 67 HG SER 9 HG SER 9 -18.651 4.662 -0.989 68 H ASP 10 H ASP 10 -20.311 3.233 -4.015 69 HA ASP 10 HA ASP 10 -22.715 4.820 -3.751 70 HB2 ASP 10 2HB ASP 10 -20.683 5.656 -4.918 71 HB3 ASP 10 3HB ASP 10 -20.839 4.382 -6.118 72 H GLU 11 H GLU 11 -22.258 1.611 -4.387 73 HA GLU 11 HA GLU 11 -23.663 -0.072 -4.868 74 HB2 GLU 11 2HB GLU 11 -25.761 2.067 -5.390 75 HB3 GLU 11 3HB GLU 11 -26.085 0.339 -5.314 76 HG2 GLU 11 2HG GLU 11 -25.342 0.315 -2.948 77 HG3 GLU 11 3HG GLU 11 -25.053 2.051 -3.035 78 H LYS 12 H LYS 12 -22.275 1.750 -7.087 79 HA LYS 12 HA LYS 12 -23.550 0.637 -9.463 80 HB2 LYS 12 2HB LYS 12 -21.078 2.366 -9.089 81 HB3 LYS 12 3HB LYS 12 -21.499 1.671 -10.650 82 HG2 LYS 12 2HG LYS 12 -23.725 2.827 -10.509 83 HG3 LYS 12 3HG LYS 12 -23.170 3.617 -9.030 84 HD2 LYS 12 2HD LYS 12 -21.369 4.734 -10.268 85 HD3 LYS 12 3HD LYS 12 -21.820 3.881 -11.746 86 HE2 LYS 12 2HE LYS 12 -22.640 6.206 -11.733 87 HE3 LYS 12 3HE LYS 12 -23.974 5.057 -11.793 88 HZ1 LYS 12 1HZ LYS 12 -24.326 5.385 -9.442 89 HZ2 LYS 12 2HZ LYS 12 -24.383 6.873 -10.235 90 HZ3 LYS 12 3HZ LYS 12 -23.016 6.443 -9.344 91 H VAL 13 H VAL 13 -23.084 -1.266 -10.333 92 HA VAL 13 HA VAL 13 -21.205 -3.020 -8.958 93 HB VAL 13 HB VAL 13 -23.233 -3.706 -11.138 94 HG11 VAL 13 1HG1 VAL 13 -21.806 -5.510 -9.157 95 HG12 VAL 13 2HG1 VAL 13 -21.480 -5.398 -10.888 96 HG13 VAL 13 3HG1 VAL 13 -23.031 -6.017 -10.325 97 HG21 VAL 13 1HG2 VAL 13 -24.755 -4.440 -9.346 98 HG22 VAL 13 2HG2 VAL 13 -24.391 -2.721 -9.199 99 HG23 VAL 13 3HG2 VAL 13 -23.611 -3.878 -8.121 100 H PHE 14 H PHE 14 -19.156 -2.948 -9.703 101 HA PHE 14 HA PHE 14 -18.533 -2.614 -12.555 102 HB2 PHE 14 2HB PHE 14 -16.729 -2.742 -10.095 103 HB3 PHE 14 3HB PHE 14 -16.155 -2.484 -11.740 104 HD1 PHE 14 HD1 PHE 14 -17.833 -0.931 -8.857 105 HD2 PHE 14 HD2 PHE 14 -16.621 -0.357 -12.919 106 HE1 PHE 14 HE1 PHE 14 -18.209 1.490 -8.632 107 HE2 PHE 14 HE2 PHE 14 -16.996 2.063 -12.678 108 HZ PHE 14 HZ PHE 14 -17.794 2.986 -10.542 109 H GLU 15 H GLU 15 -19.224 -4.534 -13.376 110 HA GLU 15 HA GLU 15 -18.336 -7.114 -12.448 111 HB2 GLU 15 2HB GLU 15 -19.683 -6.317 -15.061 112 HB3 GLU 15 3HB GLU 15 -19.520 -7.961 -14.448 113 HG2 GLU 15 2HG GLU 15 -20.963 -7.427 -12.546 114 HG3 GLU 15 3HG GLU 15 -21.059 -5.749 -13.063 115 H ILE 16 H ILE 16 -16.105 -6.902 -12.433 116 HA ILE 16 HA ILE 16 -14.675 -6.602 -15.016 117 HB ILE 16 HB ILE 16 -14.128 -4.868 -13.296 118 HG12 ILE 16 2HG1 ILE 16 -11.784 -6.758 -13.806 119 HG13 ILE 16 3HG1 ILE 16 -12.402 -5.584 -14.961 120 HG21 ILE 16 1HG2 ILE 16 -14.544 -6.190 -11.262 121 HG22 ILE 16 2HG2 ILE 16 -12.952 -5.433 -11.211 122 HG23 ILE 16 3HG2 ILE 16 -13.099 -7.154 -11.580 123 HD11 ILE 16 1HD1 ILE 16 -10.406 -4.765 -13.908 124 HD12 ILE 16 2HD1 ILE 16 -11.118 -4.961 -12.308 125 HD13 ILE 16 3HD1 ILE 16 -11.781 -3.770 -13.431 126 H GLU 17 H GLU 17 -12.906 -8.113 -15.415 127 HA GLU 17 HA GLU 17 -13.493 -10.810 -14.816 128 HB2 GLU 17 2HB GLU 17 -10.807 -9.736 -15.774 129 HB3 GLU 17 3HB GLU 17 -11.409 -11.376 -15.959 130 HG2 GLU 17 2HG GLU 17 -13.187 -10.498 -17.488 131 HG3 GLU 17 3HG GLU 17 -12.453 -8.899 -17.359 132 H LYS 18 H LYS 18 -12.715 -12.220 -13.296 133 HA LYS 18 HA LYS 18 -11.627 -11.223 -10.872 134 HB2 LYS 18 2HB LYS 18 -13.122 -13.214 -10.977 135 HB3 LYS 18 3HB LYS 18 -11.847 -14.122 -11.781 136 HG2 LYS 18 2HG LYS 18 -10.424 -13.915 -9.759 137 HG3 LYS 18 3HG LYS 18 -11.693 -12.979 -8.970 138 HD2 LYS 18 2HD LYS 18 -11.904 -15.173 -8.081 139 HD3 LYS 18 3HD LYS 18 -13.208 -15.036 -9.257 140 HE2 LYS 18 2HE LYS 18 -10.544 -16.401 -9.793 141 HE3 LYS 18 3HE LYS 18 -12.018 -17.232 -9.302 142 HZ1 LYS 18 1HZ LYS 18 -11.600 -15.740 -11.836 143 HZ2 LYS 18 2HZ LYS 18 -13.076 -16.387 -11.338 144 HZ3 LYS 18 3HZ LYS 18 -11.775 -17.411 -11.643 145 H GLU 19 H GLU 19 -10.189 -12.743 -13.700 146 HA GLU 19 HA GLU 19 -7.592 -13.251 -12.720 147 HB2 GLU 19 2HB GLU 19 -6.888 -13.210 -15.138 148 HB3 GLU 19 3HB GLU 19 -8.266 -14.252 -14.805 149 HG2 GLU 19 2HG GLU 19 -9.787 -12.471 -15.664 150 HG3 GLU 19 3HG GLU 19 -8.374 -11.490 -16.054 151 H ILE 20 H ILE 20 -9.095 -10.250 -13.695 152 HA ILE 20 HA ILE 20 -6.652 -8.676 -13.691 153 HB ILE 20 HB ILE 20 -9.562 -7.740 -13.509 154 HG12 ILE 20 2HG1 ILE 20 -7.763 -8.036 -15.960 155 HG13 ILE 20 3HG1 ILE 20 -9.187 -8.995 -15.604 156 HG21 ILE 20 1HG2 ILE 20 -8.712 -5.547 -14.224 157 HG22 ILE 20 2HG2 ILE 20 -7.062 -6.169 -14.220 158 HG23 ILE 20 3HG2 ILE 20 -7.964 -6.049 -12.708 159 HD11 ILE 20 1HD1 ILE 20 -9.672 -7.377 -17.311 160 HD12 ILE 20 2HD1 ILE 20 -9.138 -6.057 -16.272 161 HD13 ILE 20 3HD1 ILE 20 -10.581 -6.984 -15.853 162 H ALA 21 H ALA 21 -9.367 -9.333 -11.502 163 HA ALA 21 HA ALA 21 -8.458 -7.655 -9.336 164 HB1 ALA 21 1HB ALA 21 -10.418 -8.529 -8.139 165 HB2 ALA 21 2HB ALA 21 -10.659 -9.743 -9.399 166 HB3 ALA 21 3HB ALA 21 -10.853 -8.031 -9.776 167 H CYS 22 H CYS 22 -7.158 -10.494 -10.366 168 HA CYS 22 HA CYS 22 -6.511 -11.729 -7.862 169 HB2 CYS 22 2HB CYS 22 -5.128 -11.886 -10.567 170 HB3 CYS 22 3HB CYS 22 -4.766 -12.927 -9.190 171 HG CYS 22 HG CYS 22 -7.939 -13.230 -9.570 172 H MET 23 H MET 23 -5.164 -9.066 -9.753 173 HA MET 23 HA MET 23 -2.725 -8.718 -8.301 174 HB2 MET 23 2HB MET 23 -4.356 -6.677 -9.869 175 HB3 MET 23 3HB MET 23 -2.736 -6.388 -9.252 176 HG2 MET 23 2HG MET 23 -1.941 -8.303 -10.688 177 HG3 MET 23 3HG MET 23 -3.549 -8.343 -11.411 178 HE1 MET 23 1HE MET 23 -4.269 -5.175 -11.472 179 HE2 MET 23 2HE MET 23 -4.587 -6.277 -12.814 180 HE3 MET 23 3HE MET 23 -3.720 -4.769 -13.100 181 H SER 24 H SER 24 -6.041 -7.747 -7.734 182 HA SER 24 HA SER 24 -5.567 -6.374 -5.268 183 HB2 SER 24 2HB SER 24 -8.011 -7.869 -6.283 184 HB3 SER 24 3HB SER 24 -7.975 -6.901 -4.813 185 HG SER 24 HG SER 24 -7.958 -5.140 -5.937 186 H VAL 25 H VAL 25 -4.268 -7.518 -3.903 187 HA VAL 25 HA VAL 25 -4.428 -10.318 -3.419 188 HB VAL 25 HB VAL 25 -3.206 -8.110 -1.712 189 HG11 VAL 25 1HG1 VAL 25 -2.815 -11.114 -1.462 190 HG12 VAL 25 2HG1 VAL 25 -3.612 -10.063 -0.292 191 HG13 VAL 25 3HG1 VAL 25 -1.882 -9.889 -0.594 192 HG21 VAL 25 1HG2 VAL 25 -2.199 -8.267 -3.948 193 HG22 VAL 25 2HG2 VAL 25 -1.918 -9.996 -3.725 194 HG23 VAL 25 3HG2 VAL 25 -1.056 -8.823 -2.722 195 H THR 26 H THR 26 -6.039 -7.505 -1.966 196 HA THR 26 HA THR 26 -7.123 -8.794 0.327 197 HB THR 26 HB THR 26 -8.176 -6.375 -1.206 198 HG1 THR 26 HG1 THR 26 -7.079 -5.225 0.465 199 HG21 THR 26 1HG2 THR 26 -9.384 -5.764 0.861 200 HG22 THR 26 2HG2 THR 26 -8.887 -7.282 1.611 201 HG23 THR 26 3HG2 THR 26 -9.973 -7.299 0.219 202 H ILE 27 H ILE 27 -8.450 -8.234 -2.952 203 HA ILE 27 HA ILE 27 -11.018 -9.329 -2.487 204 HB ILE 27 HB ILE 27 -9.518 -8.930 -5.105 205 HG12 ILE 27 2HG1 ILE 27 -11.774 -7.340 -3.803 206 HG13 ILE 27 3HG1 ILE 27 -10.084 -6.851 -3.876 207 HG21 ILE 27 1HG2 ILE 27 -11.673 -9.257 -6.290 208 HG22 ILE 27 2HG2 ILE 27 -12.437 -9.707 -4.765 209 HG23 ILE 27 3HG2 ILE 27 -11.170 -10.725 -5.445 210 HD11 ILE 27 1HD1 ILE 27 -11.384 -5.654 -5.504 211 HD12 ILE 27 2HD1 ILE 27 -11.953 -7.163 -6.219 212 HD13 ILE 27 3HD1 ILE 27 -10.245 -6.723 -6.320 213 H LYS 28 H LYS 28 -8.046 -10.769 -3.942 214 HA LYS 28 HA LYS 28 -9.186 -13.276 -4.501 215 HB2 LYS 28 2HB LYS 28 -7.023 -14.122 -4.947 216 HB3 LYS 28 3HB LYS 28 -6.893 -12.413 -5.330 217 HG2 LYS 28 2HG LYS 28 -5.770 -12.017 -3.184 218 HG3 LYS 28 3HG LYS 28 -5.941 -13.713 -2.766 219 HD2 LYS 28 2HD LYS 28 -4.488 -14.334 -4.682 220 HD3 LYS 28 3HD LYS 28 -4.293 -12.620 -5.083 221 HE2 LYS 28 2HE LYS 28 -2.372 -13.534 -3.777 222 HE3 LYS 28 3HE LYS 28 -3.181 -12.199 -2.957 223 HZ1 LYS 28 1HZ LYS 28 -4.310 -13.768 -1.529 224 HZ2 LYS 28 2HZ LYS 28 -2.646 -14.066 -1.466 225 HZ3 LYS 28 3HZ LYS 28 -3.653 -15.081 -2.364 226 H ASN 29 H ASN 29 -7.568 -12.050 -1.547 227 HA ASN 29 HA ASN 29 -7.369 -14.445 -0.087 228 HB2 ASN 29 2HB ASN 29 -7.607 -11.559 0.898 229 HB3 ASN 29 3HB ASN 29 -7.382 -12.914 2.003 230 HD21 ASN 29 1HD2 ASN 29 -5.642 -10.666 1.622 231 HD22 ASN 29 2HD2 ASN 29 -4.119 -11.295 1.101 232 H MET 30 H MET 30 -9.949 -12.008 -0.176 233 HA MET 30 HA MET 30 -11.670 -13.145 1.732 234 HB2 MET 30 2HB MET 30 -12.370 -11.413 -0.682 235 HB3 MET 30 3HB MET 30 -13.495 -11.818 0.607 236 HG2 MET 30 2HG MET 30 -11.958 -10.685 2.224 237 HG3 MET 30 3HG MET 30 -10.980 -10.162 0.856 238 HE1 MET 30 1HE MET 30 -13.546 -7.791 -1.048 239 HE2 MET 30 2HE MET 30 -13.324 -9.511 -1.359 240 HE3 MET 30 3HE MET 30 -11.921 -8.478 -1.080 241 H ILE 31 H ILE 31 -11.427 -13.634 -1.771 242 HA ILE 31 HA ILE 31 -13.596 -15.442 -2.082 243 HB ILE 31 HB ILE 31 -11.107 -15.098 -3.826 244 HG12 ILE 31 2HG1 ILE 31 -13.880 -13.856 -4.132 245 HG13 ILE 31 3HG1 ILE 31 -12.447 -13.007 -3.577 246 HG21 ILE 31 1HG2 ILE 31 -12.187 -17.259 -4.302 247 HG22 ILE 31 2HG2 ILE 31 -12.413 -16.143 -5.650 248 HG23 ILE 31 3HG2 ILE 31 -13.740 -16.449 -4.528 249 HD11 ILE 31 1HD1 ILE 31 -12.850 -14.187 -6.319 250 HD12 ILE 31 2HD1 ILE 31 -11.400 -13.351 -5.756 251 HD13 ILE 31 3HD1 ILE 31 -12.927 -12.480 -5.881 252 H GLU 32 H GLU 32 -10.212 -15.867 -1.155 253 HA GLU 32 HA GLU 32 -10.148 -18.743 -1.483 254 HB2 GLU 32 2HB GLU 32 -8.195 -16.902 -0.011 255 HB3 GLU 32 3HB GLU 32 -7.922 -18.606 -0.370 256 HG2 GLU 32 2HG GLU 32 -8.010 -18.108 -2.796 257 HG3 GLU 32 3HG GLU 32 -8.271 -16.421 -2.428 258 H ASP 33 H ASP 33 -10.789 -16.514 1.201 259 HA ASP 33 HA ASP 33 -10.782 -18.483 3.300 260 HB2 ASP 33 2HB ASP 33 -12.099 -15.723 3.213 261 HB3 ASP 33 3HB ASP 33 -11.996 -16.728 4.657 262 H ILE 34 H ILE 34 -13.289 -16.936 1.354 263 HA ILE 34 HA ILE 34 -15.525 -18.386 2.415 264 HB ILE 34 HB ILE 34 -15.211 -16.777 -0.172 265 HG12 ILE 34 2HG1 ILE 34 -16.492 -15.993 2.495 266 HG13 ILE 34 3HG1 ILE 34 -14.915 -15.456 1.929 267 HG21 ILE 34 1HG2 ILE 34 -17.068 -18.383 -0.423 268 HG22 ILE 34 2HG2 ILE 34 -17.678 -16.732 -0.327 269 HG23 ILE 34 3HG2 ILE 34 -17.798 -17.796 1.076 270 HD11 ILE 34 1HD1 ILE 34 -16.538 -13.717 1.633 271 HD12 ILE 34 2HD1 ILE 34 -17.580 -14.783 0.693 272 HD13 ILE 34 3HD1 ILE 34 -16.007 -14.294 0.053 273 H GLY 35 H GLY 35 -13.166 -18.916 -0.099 274 HA2 GLY 35 2HA GLY 35 -12.600 -20.976 -1.060 275 HA3 GLY 35 3HA GLY 35 -14.194 -21.613 -0.660 276 H GLU 36 H GLU 36 -15.992 -20.090 -1.710 277 HA GLU 36 HA GLU 36 -15.382 -19.520 -4.542 278 HB2 GLU 36 2HB GLU 36 -17.702 -21.237 -3.538 279 HB3 GLU 36 3HB GLU 36 -17.489 -20.709 -5.202 280 HG2 GLU 36 2HG GLU 36 -15.450 -22.039 -5.405 281 HG3 GLU 36 3HG GLU 36 -15.550 -22.495 -3.710 282 H SER 37 H SER 37 -15.641 -17.317 -4.302 283 HA SER 37 HA SER 37 -18.099 -16.202 -3.139 284 HB2 SER 37 2HB SER 37 -15.595 -14.809 -4.166 285 HB3 SER 37 3HB SER 37 -16.936 -14.024 -3.333 286 HG SER 37 HG SER 37 -16.462 -15.395 -1.544 287 H ASP 38 H ASP 38 -19.197 -17.346 -5.005 288 HA ASP 38 HA ASP 38 -18.992 -16.302 -7.669 289 HB2 ASP 38 2HB ASP 38 -19.767 -18.604 -7.210 290 HB3 ASP 38 3HB ASP 38 -21.155 -17.993 -6.323 291 H SER 39 H SER 39 -20.858 -15.517 -4.819 292 HA SER 39 HA SER 39 -22.857 -13.845 -5.916 293 HB2 SER 39 2HB SER 39 -21.578 -13.784 -3.148 294 HB3 SER 39 3HB SER 39 -23.106 -13.017 -3.586 295 HG SER 39 HG SER 39 -23.886 -14.876 -2.965 296 HA PRO 40 HA PRO 40 -20.682 -9.989 -6.931 297 HB2 PRO 40 2HB PRO 40 -22.597 -8.126 -6.064 298 HB3 PRO 40 3HB PRO 40 -22.652 -8.970 -7.622 299 HG2 PRO 40 2HG PRO 40 -24.094 -9.630 -5.083 300 HG3 PRO 40 3HG PRO 40 -24.693 -9.649 -6.758 301 HD2 PRO 40 2HD PRO 40 -24.017 -11.937 -5.536 302 HD3 PRO 40 3HD PRO 40 -23.641 -11.688 -7.256 303 H ILE 41 H ILE 41 -19.105 -8.928 -5.836 304 HA ILE 41 HA ILE 41 -19.053 -9.045 -2.912 305 HB ILE 41 HB ILE 41 -16.838 -8.317 -4.887 306 HG12 ILE 41 2HG1 ILE 41 -17.489 -10.699 -5.069 307 HG13 ILE 41 3HG1 ILE 41 -15.889 -10.560 -4.354 308 HG21 ILE 41 1HG2 ILE 41 -16.664 -8.773 -1.884 309 HG22 ILE 41 2HG2 ILE 41 -16.448 -7.234 -2.719 310 HG23 ILE 41 3HG2 ILE 41 -15.287 -8.538 -2.967 311 HD11 ILE 41 1HD1 ILE 41 -18.460 -11.132 -2.866 312 HD12 ILE 41 2HD1 ILE 41 -16.866 -10.975 -2.124 313 HD13 ILE 41 3HD1 ILE 41 -17.188 -12.288 -3.253 314 HA PRO 42 HA PRO 42 -20.021 -4.571 -3.077 315 HB2 PRO 42 2HB PRO 42 -21.002 -4.330 -0.543 316 HB3 PRO 42 3HB PRO 42 -21.970 -5.020 -1.862 317 HG2 PRO 42 2HG PRO 42 -20.523 -6.426 0.338 318 HG3 PRO 42 3HG PRO 42 -22.103 -6.793 -0.386 319 HD2 PRO 42 2HD PRO 42 -19.743 -8.113 -1.029 320 HD3 PRO 42 3HD PRO 42 -21.172 -8.041 -2.081 321 H LEU 43 H LEU 43 -18.780 -2.896 -2.415 322 HA LEU 43 HA LEU 43 -16.585 -3.306 -0.484 323 HB2 LEU 43 2HB LEU 43 -16.449 -1.776 -3.129 324 HB3 LEU 43 3HB LEU 43 -15.153 -1.887 -1.956 325 HG LEU 43 HG LEU 43 -16.257 -4.200 -3.599 326 HD11 LEU 43 1HD1 LEU 43 -13.603 -2.753 -3.849 327 HD12 LEU 43 2HD1 LEU 43 -14.967 -2.644 -4.963 328 HD13 LEU 43 3HD1 LEU 43 -14.107 -4.169 -4.781 329 HD21 LEU 43 1HD2 LEU 43 -15.508 -5.044 -1.442 330 HD22 LEU 43 2HD2 LEU 43 -13.961 -4.212 -1.607 331 HD23 LEU 43 3HD2 LEU 43 -14.374 -5.538 -2.699 332 HA PRO 44 HA PRO 44 -19.402 0.174 0.688 333 HB2 PRO 44 2HB PRO 44 -19.776 -0.451 3.283 334 HB3 PRO 44 3HB PRO 44 -20.481 -1.459 2.004 335 HG2 PRO 44 2HG PRO 44 -18.038 -1.959 3.650 336 HG3 PRO 44 3HG PRO 44 -19.304 -3.097 3.142 337 HD2 PRO 44 2HD PRO 44 -16.832 -2.777 1.864 338 HD3 PRO 44 3HD PRO 44 -18.274 -3.521 1.135 339 H ASN 45 H ASN 45 -16.863 0.899 0.202 340 HA ASN 45 HA ASN 45 -16.160 2.782 2.314 341 HB2 ASN 45 2HB ASN 45 -14.757 0.850 2.917 342 HB3 ASN 45 3HB ASN 45 -14.217 0.665 1.253 343 HD21 ASN 45 1HD2 ASN 45 -13.940 2.622 4.158 344 HD22 ASN 45 2HD2 ASN 45 -12.476 3.418 3.708 345 H VAL 46 H VAL 46 -15.026 1.359 -0.765 346 HA VAL 46 HA VAL 46 -14.113 3.935 -1.746 347 HB VAL 46 HB VAL 46 -12.687 2.008 -2.150 348 HG11 VAL 46 1HG1 VAL 46 -14.352 0.216 -2.240 349 HG12 VAL 46 2HG1 VAL 46 -13.281 0.153 -3.641 350 HG13 VAL 46 3HG1 VAL 46 -14.917 0.796 -3.811 351 HG21 VAL 46 1HG2 VAL 46 -12.275 2.285 -4.571 352 HG22 VAL 46 2HG2 VAL 46 -12.594 3.831 -3.781 353 HG23 VAL 46 3HG2 VAL 46 -13.850 3.062 -4.752 354 H THR 47 H THR 47 -15.144 5.208 -3.131 355 HA THR 47 HA THR 47 -17.932 4.783 -3.768 356 HB THR 47 HB THR 47 -17.794 7.099 -4.687 357 HG1 THR 47 HG1 THR 47 -15.049 7.069 -3.903 358 HG21 THR 47 1HG2 THR 47 -16.402 6.827 -1.989 359 HG22 THR 47 2HG2 THR 47 -18.151 6.830 -2.243 360 HG23 THR 47 3HG2 THR 47 -17.206 8.276 -2.599 361 H SER 48 H SER 48 -18.635 5.514 -6.118 362 HA SER 48 HA SER 48 -17.675 3.450 -7.854 363 HB2 SER 48 2HB SER 48 -19.343 4.309 -9.482 364 HB3 SER 48 3HB SER 48 -20.046 4.103 -7.877 365 HG SER 48 HG SER 48 -20.713 6.081 -8.528 366 H THR 49 H THR 49 -17.356 6.995 -7.868 367 HA THR 49 HA THR 49 -16.091 7.416 -10.326 368 HB THR 49 HB THR 49 -15.677 8.944 -7.704 369 HG1 THR 49 HG1 THR 49 -17.745 8.854 -9.559 370 HG21 THR 49 1HG2 THR 49 -13.977 9.604 -9.382 371 HG22 THR 49 2HG2 THR 49 -15.142 10.901 -9.123 372 HG23 THR 49 3HG2 THR 49 -15.253 9.899 -10.569 373 H ILE 50 H ILE 50 -14.743 6.583 -7.164 374 HA ILE 50 HA ILE 50 -11.984 6.871 -7.980 375 HB ILE 50 HB ILE 50 -13.207 5.815 -5.394 376 HG12 ILE 50 2HG1 ILE 50 -13.815 8.141 -5.753 377 HG13 ILE 50 3HG1 ILE 50 -12.593 8.085 -4.492 378 HG21 ILE 50 1HG2 ILE 50 -10.926 4.960 -5.644 379 HG22 ILE 50 2HG2 ILE 50 -10.992 6.175 -4.368 380 HG23 ILE 50 3HG2 ILE 50 -10.324 6.592 -5.947 381 HD11 ILE 50 1HD1 ILE 50 -12.161 8.895 -7.379 382 HD12 ILE 50 2HD1 ILE 50 -10.889 8.783 -6.156 383 HD13 ILE 50 3HD1 ILE 50 -12.196 9.949 -5.967 384 H LEU 51 H LEU 51 -14.185 4.186 -7.156 385 HA LEU 51 HA LEU 51 -12.323 2.067 -7.435 386 HB2 LEU 51 2HB LEU 51 -14.541 1.914 -6.220 387 HB3 LEU 51 3HB LEU 51 -15.353 1.912 -7.775 388 HG LEU 51 HG LEU 51 -14.270 -0.239 -8.360 389 HD11 LEU 51 1HD1 LEU 51 -13.014 -0.154 -5.596 390 HD12 LEU 51 2HD1 LEU 51 -12.165 -0.010 -7.138 391 HD13 LEU 51 3HD1 LEU 51 -12.968 -1.519 -6.719 392 HD21 LEU 51 1HD2 LEU 51 -15.659 -0.366 -5.661 393 HD22 LEU 51 2HD2 LEU 51 -15.491 -1.692 -6.816 394 HD23 LEU 51 3HD2 LEU 51 -16.459 -0.281 -7.234 395 H GLU 52 H GLU 52 -14.366 3.791 -9.713 396 HA GLU 52 HA GLU 52 -14.214 2.127 -11.974 397 HB2 GLU 52 2HB GLU 52 -15.704 4.146 -11.817 398 HB3 GLU 52 3HB GLU 52 -14.286 5.189 -11.907 399 HG2 GLU 52 2HG GLU 52 -13.781 4.226 -14.166 400 HG3 GLU 52 3HG GLU 52 -15.278 3.303 -14.069 401 H LYS 53 H LYS 53 -12.132 4.808 -10.872 402 HA LYS 53 HA LYS 53 -10.280 4.782 -12.993 403 HB2 LYS 53 2HB LYS 53 -9.757 5.601 -10.102 404 HB3 LYS 53 3HB LYS 53 -8.761 6.023 -11.489 405 HG2 LYS 53 2HG LYS 53 -10.749 7.295 -12.412 406 HG3 LYS 53 3HG LYS 53 -11.555 7.002 -10.865 407 HD2 LYS 53 2HD LYS 53 -9.484 8.067 -9.758 408 HD3 LYS 53 3HD LYS 53 -9.018 8.601 -11.372 409 HE2 LYS 53 2HE LYS 53 -11.566 9.326 -9.911 410 HE3 LYS 53 3HE LYS 53 -10.162 10.365 -10.142 411 HZ1 LYS 53 1HZ LYS 53 -10.554 10.261 -12.540 412 HZ2 LYS 53 2HZ LYS 53 -11.887 10.902 -11.720 413 HZ3 LYS 53 3HZ LYS 53 -11.927 9.309 -12.288 414 H VAL 54 H VAL 54 -10.143 3.248 -9.771 415 HA VAL 54 HA VAL 54 -7.504 2.282 -9.954 416 HB VAL 54 HB VAL 54 -9.764 1.190 -8.199 417 HG11 VAL 54 1HG1 VAL 54 -7.840 -0.339 -8.297 418 HG12 VAL 54 2HG1 VAL 54 -7.948 0.411 -6.704 419 HG13 VAL 54 3HG1 VAL 54 -6.748 0.978 -7.867 420 HG21 VAL 54 1HG2 VAL 54 -7.729 3.371 -7.578 421 HG22 VAL 54 2HG2 VAL 54 -8.912 2.715 -6.441 422 HG23 VAL 54 3HG2 VAL 54 -9.452 3.617 -7.856 423 H LEU 55 H LEU 55 -10.636 0.700 -10.612 424 HA LEU 55 HA LEU 55 -9.519 -1.846 -11.346 425 HB2 LEU 55 2HB LEU 55 -12.307 -0.698 -11.744 426 HB3 LEU 55 3HB LEU 55 -11.865 -2.345 -12.161 427 HG LEU 55 HG LEU 55 -11.917 -1.141 -9.370 428 HD11 LEU 55 1HD1 LEU 55 -13.719 -2.748 -8.956 429 HD12 LEU 55 2HD1 LEU 55 -13.618 -3.320 -10.623 430 HD13 LEU 55 3HD1 LEU 55 -14.125 -1.662 -10.285 431 HD21 LEU 55 1HD2 LEU 55 -11.051 -3.944 -10.183 432 HD22 LEU 55 2HD2 LEU 55 -11.300 -3.381 -8.528 433 HD23 LEU 55 3HD2 LEU 55 -10.017 -2.678 -9.507 434 H ASP 56 H ASP 56 -10.323 1.078 -13.152 435 HA ASP 56 HA ASP 56 -10.266 -0.118 -15.769 436 HB2 ASP 56 2HB ASP 56 -11.438 2.035 -15.329 437 HB3 ASP 56 3HB ASP 56 -9.898 2.816 -15.008 438 H TYR 57 H TYR 57 -7.889 1.484 -13.697 439 HA TYR 57 HA TYR 57 -5.709 1.383 -15.554 440 HB2 TYR 57 2HB TYR 57 -5.709 2.929 -13.593 441 HB3 TYR 57 3HB TYR 57 -5.614 1.551 -12.500 442 HD1 TYR 57 HD1 TYR 57 -3.771 3.437 -15.137 443 HD2 TYR 57 HD2 TYR 57 -3.473 0.488 -12.060 444 HE1 TYR 57 HE1 TYR 57 -1.320 3.462 -15.341 445 HE2 TYR 57 HE2 TYR 57 -1.028 0.514 -12.254 446 HH TYR 57 HH TYR 57 0.664 2.895 -14.001 447 H CYS 58 H CYS 58 -6.927 -0.761 -12.988 448 HA CYS 58 HA CYS 58 -4.935 -2.739 -13.058 449 HB2 CYS 58 2HB CYS 58 -7.907 -2.971 -12.430 450 HB3 CYS 58 3HB CYS 58 -6.746 -4.275 -12.172 451 HG CYS 58 HG CYS 58 -7.579 -1.953 -10.139 452 H ARG 59 H ARG 59 -7.876 -2.294 -14.993 453 HA ARG 59 HA ARG 59 -7.753 -4.633 -16.563 454 HB2 ARG 59 2HB ARG 59 -9.800 -3.324 -16.517 455 HB3 ARG 59 3HB ARG 59 -8.982 -1.900 -17.152 456 HG2 ARG 59 2HG ARG 59 -8.780 -2.875 -19.334 457 HG3 ARG 59 3HG ARG 59 -9.244 -4.471 -18.740 458 HD2 ARG 59 2HD ARG 59 -11.067 -3.385 -20.002 459 HD3 ARG 59 3HD ARG 59 -11.523 -3.704 -18.329 460 HE ARG 59 HE ARG 59 -10.534 -1.043 -18.607 461 HH11 ARG 59 1HH1 ARG 59 -13.393 -2.996 -19.315 462 HH12 ARG 59 2HH1 ARG 59 -14.472 -1.637 -19.262 463 HH21 ARG 59 1HH2 ARG 59 -12.011 0.733 -18.588 464 HH22 ARG 59 2HH2 ARG 59 -13.678 0.456 -18.851 465 H HIS 60 H HIS 60 -6.482 -1.363 -17.139 466 HA HIS 60 HA HIS 60 -5.209 -1.747 -19.608 467 HB2 HIS 60 2HB HIS 60 -5.559 0.485 -18.688 468 HB3 HIS 60 3HB HIS 60 -4.544 0.127 -17.294 469 HD1 HIS 60 HD1 HIS 60 -4.277 0.681 -21.040 470 HD2 HIS 60 HD2 HIS 60 -1.885 0.728 -17.645 471 HE1 HIS 60 HE1 HIS 60 -2.066 1.621 -21.779 472 HE2 HIS 60 HE2 HIS 60 -0.756 1.878 -19.651 473 H HIS 61 H HIS 61 -3.997 -2.241 -16.326 474 HA HIS 61 HA HIS 61 -1.299 -2.894 -17.063 475 HB2 HIS 61 2HB HIS 61 -1.968 -1.883 -14.853 476 HB3 HIS 61 3HB HIS 61 -2.754 -3.401 -14.424 477 HD1 HIS 61 HD1 HIS 61 -1.192 -5.405 -13.808 478 HD2 HIS 61 HD2 HIS 61 0.819 -1.882 -14.693 479 HE1 HIS 61 HE1 HIS 61 1.169 -5.771 -13.040 480 HE2 HIS 61 HE2 HIS 61 2.400 -3.699 -13.754 481 H HIS 62 H HIS 62 -4.275 -4.681 -16.744 482 HA HIS 62 HA HIS 62 -3.039 -7.293 -16.684 483 HB2 HIS 62 2HB HIS 62 -5.293 -6.904 -15.706 484 HB3 HIS 62 3HB HIS 62 -5.926 -6.508 -17.301 485 HD1 HIS 62 HD1 HIS 62 -4.541 -9.408 -15.305 486 HD2 HIS 62 HD2 HIS 62 -6.745 -8.731 -18.762 487 HE1 HIS 62 HE1 HIS 62 -5.323 -11.668 -16.073 488 HE2 HIS 62 HE2 HIS 62 -6.578 -11.227 -18.203 489 H GLN 63 H GLN 63 -4.359 -5.098 -19.106 490 HA GLN 63 HA GLN 63 -4.230 -6.861 -21.364 491 HB2 GLN 63 2HB GLN 63 -4.339 -3.802 -21.193 492 HB3 GLN 63 3HB GLN 63 -4.501 -4.716 -22.690 493 HG2 GLN 63 2HG GLN 63 -6.572 -5.725 -21.914 494 HG3 GLN 63 3HG GLN 63 -6.393 -4.982 -20.330 495 HE21 GLN 63 1HE2 GLN 63 -7.676 -4.610 -23.450 496 HE22 GLN 63 2HE2 GLN 63 -8.207 -2.972 -23.305 497 H HIS 64 H HIS 64 -2.028 -4.565 -19.853 498 HA HIS 64 HA HIS 64 0.236 -5.615 -21.411 499 HB2 HIS 64 2HB HIS 64 -0.337 -2.641 -20.966 500 HB3 HIS 64 3HB HIS 64 1.211 -3.269 -21.522 501 HD1 HIS 64 HD1 HIS 64 1.311 -4.214 -23.940 502 HD2 HIS 64 HD2 HIS 64 -2.348 -2.525 -22.923 503 HE1 HIS 64 HE1 HIS 64 0.057 -3.958 -26.099 504 HE2 HIS 64 HE2 HIS 64 -2.144 -2.919 -25.466 505 HA PRO 65 HA PRO 65 1.313 -5.654 -16.877 506 HB2 PRO 65 2HB PRO 65 2.562 -8.276 -17.546 507 HB3 PRO 65 3HB PRO 65 1.354 -7.895 -16.302 508 HG2 PRO 65 2HG PRO 65 0.698 -9.325 -18.491 509 HG3 PRO 65 3HG PRO 65 -0.448 -8.183 -17.747 510 HD2 PRO 65 2HD PRO 65 1.303 -7.774 -20.178 511 HD3 PRO 65 3HD PRO 65 -0.420 -7.384 -19.943 512 H GLY 66 H GLY 66 3.623 -7.506 -18.874 513 HA2 GLY 66 2HA GLY 66 5.852 -7.305 -19.281 514 HA3 GLY 66 3HA GLY 66 5.447 -5.657 -19.732 515 H GLY 67 H GLY 67 7.000 -4.410 -18.868 516 HA2 GLY 67 2HA GLY 67 7.806 -4.667 -16.035 517 HA3 GLY 67 3HA GLY 67 8.557 -3.655 -17.268 518 H SER 68 H SER 68 5.335 -3.294 -17.739 519 HA SER 68 HA SER 68 3.813 -1.663 -17.464 520 HB2 SER 68 2HB SER 68 5.088 -1.191 -14.730 521 HB3 SER 68 3HB SER 68 3.467 -0.694 -15.225 522 HG SER 68 HG SER 68 3.958 -3.373 -15.608 523 H GLY 69 H GLY 69 4.354 0.948 -15.975 524 HA2 GLY 69 2HA GLY 69 5.146 2.481 -18.207 525 HA3 GLY 69 3HA GLY 69 4.980 3.068 -16.558 526 H LEU 70 H LEU 70 7.043 1.175 -15.526 527 HA LEU 70 HA LEU 70 9.206 1.203 -14.891 528 HB2 LEU 70 2HB LEU 70 9.654 1.676 -17.867 529 HB3 LEU 70 3HB LEU 70 10.962 1.354 -16.743 530 HG LEU 70 HG LEU 70 8.676 -0.587 -17.299 531 HD11 LEU 70 1HD1 LEU 70 10.075 -0.298 -19.297 532 HD12 LEU 70 2HD1 LEU 70 10.302 -1.896 -18.593 533 HD13 LEU 70 3HD1 LEU 70 11.526 -0.644 -18.352 534 HD21 LEU 70 1HD2 LEU 70 11.260 -0.947 -15.734 535 HD22 LEU 70 2HD2 LEU 70 10.093 -2.224 -16.095 536 HD23 LEU 70 3HD2 LEU 70 9.630 -0.874 -15.060 537 H ASP 71 H ASP 71 9.877 3.582 -17.365 538 HA ASP 71 HA ASP 71 9.809 5.867 -15.514 539 HB2 ASP 71 2HB ASP 71 12.151 4.977 -15.532 540 HB3 ASP 71 3HB ASP 71 12.214 5.188 -17.279 541 H ASP 72 H ASP 72 9.353 4.471 -18.607 542 HA ASP 72 HA ASP 72 9.323 6.626 -20.393 543 HB2 ASP 72 2HB ASP 72 9.294 4.363 -21.246 544 HB3 ASP 72 3HB ASP 72 7.853 3.948 -20.329 545 H ILE 73 H ILE 73 6.653 5.060 -18.643 546 HA ILE 73 HA ILE 73 4.570 5.606 -18.058 547 HB ILE 73 HB ILE 73 5.542 8.497 -17.999 548 HG12 ILE 73 2HG1 ILE 73 6.927 7.047 -16.538 549 HG13 ILE 73 3HG1 ILE 73 5.946 8.139 -15.571 550 HG21 ILE 73 1HG2 ILE 73 3.086 8.380 -17.999 551 HG22 ILE 73 2HG2 ILE 73 3.672 8.901 -16.420 552 HG23 ILE 73 3HG2 ILE 73 3.119 7.241 -16.648 553 HD11 ILE 73 1HD1 ILE 73 5.389 5.202 -16.048 554 HD12 ILE 73 2HD1 ILE 73 4.389 6.291 -15.082 555 HD13 ILE 73 3HD1 ILE 73 6.037 5.926 -14.578 556 HA PRO 74 HA PRO 74 3.078 6.316 -22.384 557 HB2 PRO 74 2HB PRO 74 0.752 4.832 -21.155 558 HB3 PRO 74 3HB PRO 74 1.580 4.543 -22.701 559 HG2 PRO 74 2HG PRO 74 1.994 2.904 -20.663 560 HG3 PRO 74 3HG PRO 74 3.362 3.403 -21.688 561 HD2 PRO 74 2HD PRO 74 2.579 4.416 -18.958 562 HD3 PRO 74 3HD PRO 74 4.193 4.016 -19.593 563 HA PRO 75 HA PRO 75 0.724 10.067 -21.837 564 HB2 PRO 75 2HB PRO 75 -1.283 9.718 -23.828 565 HB3 PRO 75 3HB PRO 75 0.340 10.384 -24.085 566 HG2 PRO 75 2HG PRO 75 -0.629 7.588 -24.535 567 HG3 PRO 75 3HG PRO 75 0.489 8.571 -25.512 568 HD2 PRO 75 2HD PRO 75 1.436 6.654 -23.928 569 HD3 PRO 75 3HD PRO 75 2.295 8.207 -24.052 570 H TYR 76 H TYR 76 -1.498 7.274 -22.345 571 HA TYR 76 HA TYR 76 -3.737 8.221 -20.997 572 HB2 TYR 76 2HB TYR 76 -4.062 6.213 -22.235 573 HB3 TYR 76 3HB TYR 76 -2.713 5.395 -21.457 574 HD1 TYR 76 HD1 TYR 76 -6.135 6.797 -20.685 575 HD2 TYR 76 HD2 TYR 76 -3.167 3.883 -19.665 576 HE1 TYR 76 HE1 TYR 76 -7.671 5.789 -19.042 577 HE2 TYR 76 HE2 TYR 76 -4.708 2.888 -18.035 578 HH TYR 76 HH TYR 76 -8.009 3.661 -17.863 579 H ASP 77 H ASP 77 -1.016 6.345 -19.692 580 HA ASP 77 HA ASP 77 -2.048 5.928 -17.105 581 HB2 ASP 77 2HB ASP 77 0.844 5.911 -18.082 582 HB3 ASP 77 3HB ASP 77 0.318 5.303 -16.517 583 H ARG 78 H ARG 78 -0.150 8.570 -18.475 584 HA ARG 78 HA ARG 78 0.465 9.818 -15.960 585 HB2 ARG 78 2HB ARG 78 1.821 10.128 -18.089 586 HB3 ARG 78 3HB ARG 78 0.513 11.127 -18.719 587 HG2 ARG 78 2HG ARG 78 0.815 12.708 -16.843 588 HG3 ARG 78 3HG ARG 78 2.115 11.699 -16.203 589 HD2 ARG 78 2HD ARG 78 3.120 13.534 -17.369 590 HD3 ARG 78 3HD ARG 78 3.374 12.086 -18.345 591 HE ARG 78 HE ARG 78 1.039 13.326 -19.259 592 HH11 ARG 78 1HH1 ARG 78 4.499 14.003 -19.175 593 HH12 ARG 78 2HH1 ARG 78 4.457 15.002 -20.592 594 HH21 ARG 78 1HH2 ARG 78 1.002 14.682 -21.097 595 HH22 ARG 78 2HH2 ARG 78 2.479 15.386 -21.676 596 H ASP 79 H ASP 79 -1.795 10.659 -18.629 597 HA ASP 79 HA ASP 79 -3.119 12.830 -17.439 598 HB2 ASP 79 2HB ASP 79 -4.064 10.838 -19.533 599 HB3 ASP 79 3HB ASP 79 -5.075 12.178 -19.020 600 H PHE 80 H PHE 80 -3.647 9.407 -17.117 601 HA PHE 80 HA PHE 80 -6.141 9.314 -15.834 602 HB2 PHE 80 2HB PHE 80 -5.235 7.260 -16.732 603 HB3 PHE 80 3HB PHE 80 -3.726 7.439 -15.848 604 HD1 PHE 80 HD1 PHE 80 -7.323 6.588 -15.514 605 HD2 PHE 80 HD2 PHE 80 -3.503 6.650 -13.596 606 HE1 PHE 80 HE1 PHE 80 -8.216 5.254 -13.659 607 HE2 PHE 80 HE2 PHE 80 -4.406 5.331 -11.747 608 HZ PHE 80 HZ PHE 80 -6.762 4.633 -11.769 609 H CYS 81 H CYS 81 -2.834 9.398 -14.517 610 HA CYS 81 HA CYS 81 -3.673 9.376 -11.763 611 HB2 CYS 81 2HB CYS 81 -0.931 9.816 -13.016 612 HB3 CYS 81 3HB CYS 81 -1.230 9.582 -11.293 613 HG CYS 81 HG CYS 81 -1.884 7.263 -13.729 614 H LYS 82 H LYS 82 -3.269 11.865 -14.124 615 HA LYS 82 HA LYS 82 -2.836 14.046 -12.281 616 HB2 LYS 82 2HB LYS 82 -3.958 14.127 -15.114 617 HB3 LYS 82 3HB LYS 82 -3.451 15.530 -14.182 618 HG2 LYS 82 2HG LYS 82 -1.702 13.318 -15.269 619 HG3 LYS 82 3HG LYS 82 -1.756 14.990 -15.811 620 HD2 LYS 82 2HD LYS 82 -0.803 14.053 -13.083 621 HD3 LYS 82 3HD LYS 82 0.237 14.501 -14.434 622 HE2 LYS 82 2HE LYS 82 -0.671 16.804 -14.365 623 HE3 LYS 82 3HE LYS 82 -1.685 16.355 -12.988 624 HZ1 LYS 82 1HZ LYS 82 0.323 17.444 -12.258 625 HZ2 LYS 82 2HZ LYS 82 1.284 16.308 -13.053 626 HZ3 LYS 82 3HZ LYS 82 0.331 15.838 -11.740 627 H VAL 83 H VAL 83 -4.353 13.566 -10.688 628 HA VAL 83 HA VAL 83 -7.146 14.371 -11.257 629 HB VAL 83 HB VAL 83 -7.887 12.864 -9.400 630 HG11 VAL 83 1HG1 VAL 83 -7.721 10.717 -10.610 631 HG12 VAL 83 2HG1 VAL 83 -6.430 11.376 -11.617 632 HG13 VAL 83 3HG1 VAL 83 -8.057 12.052 -11.716 633 HG21 VAL 83 1HG2 VAL 83 -6.382 11.095 -8.519 634 HG22 VAL 83 2HG2 VAL 83 -5.801 12.708 -8.106 635 HG23 VAL 83 3HG2 VAL 83 -5.032 11.803 -9.412 636 H ASP 84 H ASP 84 -8.203 15.042 -9.057 637 HA ASP 84 HA ASP 84 -6.771 17.385 -8.235 638 HB2 ASP 84 2HB ASP 84 -9.338 17.075 -8.650 639 HB3 ASP 84 3HB ASP 84 -9.389 16.419 -7.021 640 H GLN 85 H GLN 85 -6.803 17.960 -5.763 641 HA GLN 85 HA GLN 85 -4.739 16.407 -4.682 642 HB2 GLN 85 2HB GLN 85 -4.896 18.830 -4.280 643 HB3 GLN 85 3HB GLN 85 -6.358 18.604 -3.329 644 HG2 GLN 85 2HG GLN 85 -4.440 19.004 -1.871 645 HG3 GLN 85 3HG GLN 85 -5.071 17.378 -1.623 646 HE21 GLN 85 1HE2 GLN 85 -3.108 16.741 -0.711 647 HE22 GLN 85 2HE2 GLN 85 -1.702 16.435 -1.661 648 HA PRO 86 HA PRO 86 -7.801 14.605 -1.285 649 HB2 PRO 86 2HB PRO 86 -10.521 14.904 -2.526 650 HB3 PRO 86 3HB PRO 86 -10.004 15.186 -0.849 651 HG2 PRO 86 2HG PRO 86 -10.594 17.241 -2.442 652 HG3 PRO 86 3HG PRO 86 -9.254 17.341 -1.274 653 HD2 PRO 86 2HD PRO 86 -9.124 16.822 -4.250 654 HD3 PRO 86 3HD PRO 86 -8.132 17.910 -3.249 655 H THR 87 H THR 87 -8.641 14.453 -4.722 656 HA THR 87 HA THR 87 -9.617 11.796 -4.839 657 HB THR 87 HB THR 87 -8.319 13.333 -7.140 658 HG1 THR 87 HG1 THR 87 -10.869 13.607 -5.933 659 HG21 THR 87 1HG2 THR 87 -10.546 11.254 -7.133 660 HG22 THR 87 2HG2 THR 87 -8.883 10.971 -7.656 661 HG23 THR 87 3HG2 THR 87 -9.910 12.090 -8.553 662 H LEU 88 H LEU 88 -6.372 13.185 -5.135 663 HA LEU 88 HA LEU 88 -4.838 10.990 -5.932 664 HB2 LEU 88 2HB LEU 88 -4.203 13.280 -4.023 665 HB3 LEU 88 3HB LEU 88 -2.985 12.116 -4.516 666 HG LEU 88 HG LEU 88 -4.481 13.897 -6.484 667 HD11 LEU 88 1HD1 LEU 88 -2.469 15.300 -6.575 668 HD12 LEU 88 2HD1 LEU 88 -1.727 14.350 -5.285 669 HD13 LEU 88 3HD1 LEU 88 -3.175 15.305 -4.961 670 HD21 LEU 88 1HD2 LEU 88 -2.697 13.268 -8.052 671 HD22 LEU 88 2HD2 LEU 88 -3.563 11.846 -7.479 672 HD23 LEU 88 3HD2 LEU 88 -1.966 12.224 -6.828 673 H PHE 89 H PHE 89 -5.823 12.022 -2.675 674 HA PHE 89 HA PHE 89 -4.642 9.843 -1.264 675 HB2 PHE 89 2HB PHE 89 -6.821 11.786 -0.363 676 HB3 PHE 89 3HB PHE 89 -5.958 10.671 0.697 677 HD1 PHE 89 HD1 PHE 89 -3.215 10.844 0.239 678 HD2 PHE 89 HD2 PHE 89 -6.072 14.004 -0.159 679 HE1 PHE 89 HE1 PHE 89 -1.437 12.507 0.598 680 HE2 PHE 89 HE2 PHE 89 -4.286 15.655 0.203 681 HZ PHE 89 HZ PHE 89 -1.969 14.912 0.578 682 H GLU 90 H GLU 90 -7.862 10.410 -2.614 683 HA GLU 90 HA GLU 90 -9.252 8.239 -1.479 684 HB2 GLU 90 2HB GLU 90 -9.607 9.654 -4.154 685 HB3 GLU 90 3HB GLU 90 -10.698 8.403 -3.579 686 HG2 GLU 90 2HG GLU 90 -10.160 10.958 -2.073 687 HG3 GLU 90 3HG GLU 90 -11.481 10.758 -3.218 688 H LEU 91 H LEU 91 -7.247 8.471 -4.387 689 HA LEU 91 HA LEU 91 -7.676 5.783 -5.288 690 HB2 LEU 91 2HB LEU 91 -5.615 7.892 -6.044 691 HB3 LEU 91 3HB LEU 91 -5.693 6.321 -6.818 692 HG LEU 91 HG LEU 91 -7.875 8.440 -6.902 693 HD11 LEU 91 1HD1 LEU 91 -5.982 7.506 -9.095 694 HD12 LEU 91 2HD1 LEU 91 -5.920 9.060 -8.261 695 HD13 LEU 91 3HD1 LEU 91 -7.298 8.672 -9.284 696 HD21 LEU 91 1HD2 LEU 91 -8.790 6.149 -6.928 697 HD22 LEU 91 2HD2 LEU 91 -7.769 5.757 -8.313 698 HD23 LEU 91 3HD2 LEU 91 -9.034 6.976 -8.461 699 H ILE 92 H ILE 92 -5.223 7.349 -3.249 700 HA ILE 92 HA ILE 92 -3.443 5.140 -2.981 701 HB ILE 92 HB ILE 92 -3.956 7.499 -1.088 702 HG12 ILE 92 2HG1 ILE 92 -1.669 7.029 -3.064 703 HG13 ILE 92 3HG1 ILE 92 -3.038 8.092 -3.346 704 HG21 ILE 92 1HG2 ILE 92 -2.987 5.653 0.217 705 HG22 ILE 92 2HG2 ILE 92 -1.800 6.940 0.012 706 HG23 ILE 92 3HG2 ILE 92 -1.686 5.473 -0.962 707 HD11 ILE 92 1HD1 ILE 92 -1.074 9.352 -2.720 708 HD12 ILE 92 2HD1 ILE 92 -0.935 8.450 -1.211 709 HD13 ILE 92 3HD1 ILE 92 -2.322 9.510 -1.485 710 H LEU 93 H LEU 93 -6.294 6.211 -1.128 711 HA LEU 93 HA LEU 93 -6.171 4.221 0.922 712 HB2 LEU 93 2HB LEU 93 -8.459 6.014 0.001 713 HB3 LEU 93 3HB LEU 93 -8.558 4.971 1.408 714 HG LEU 93 HG LEU 93 -6.647 7.322 1.081 715 HD11 LEU 93 1HD1 LEU 93 -8.959 8.061 1.381 716 HD12 LEU 93 2HD1 LEU 93 -7.995 8.438 2.806 717 HD13 LEU 93 3HD1 LEU 93 -9.114 7.072 2.837 718 HD21 LEU 93 1HD2 LEU 93 -5.620 5.565 2.439 719 HD22 LEU 93 2HD2 LEU 93 -7.038 5.514 3.490 720 HD23 LEU 93 3HD2 LEU 93 -6.030 6.963 3.429 721 H ALA 94 H ALA 94 -7.917 4.468 -2.164 722 HA ALA 94 HA ALA 94 -9.532 2.122 -1.900 723 HB1 ALA 94 1HB ALA 94 -8.659 3.610 -4.408 724 HB2 ALA 94 2HB ALA 94 -10.092 3.962 -3.440 725 HB3 ALA 94 3HB ALA 94 -9.974 2.431 -4.303 726 H ALA 95 H ALA 95 -6.386 2.773 -3.385 727 HA ALA 95 HA ALA 95 -5.956 0.210 -4.537 728 HB1 ALA 95 1HB ALA 95 -3.655 0.908 -4.817 729 HB2 ALA 95 2HB ALA 95 -3.876 2.230 -3.664 730 HB3 ALA 95 3HB ALA 95 -4.728 2.252 -5.205 731 H ASN 96 H ASN 96 -5.053 1.659 -1.399 732 HA ASN 96 HA ASN 96 -3.634 -0.612 -0.375 733 HB2 ASN 96 2HB ASN 96 -3.304 1.691 0.520 734 HB3 ASN 96 3HB ASN 96 -4.962 1.717 1.119 735 HD21 ASN 96 1HD2 ASN 96 -4.242 2.072 3.254 736 HD22 ASN 96 2HD2 ASN 96 -3.502 0.833 4.198 737 H TYR 97 H TYR 97 -6.974 0.407 -0.377 738 HA TYR 97 HA TYR 97 -8.109 -1.312 1.544 739 HB2 TYR 97 2HB TYR 97 -9.319 0.639 0.697 740 HB3 TYR 97 3HB TYR 97 -9.310 -0.005 -0.937 741 HD1 TYR 97 HD1 TYR 97 -11.334 -0.925 -1.689 742 HD2 TYR 97 HD2 TYR 97 -10.485 -1.048 2.498 743 HE1 TYR 97 HE1 TYR 97 -13.521 -1.955 -1.275 744 HE2 TYR 97 HE2 TYR 97 -12.677 -2.079 2.904 745 HH TYR 97 HH TYR 97 -14.587 -3.390 0.464 746 H LEU 98 H LEU 98 -7.628 -1.737 -1.975 747 HA LEU 98 HA LEU 98 -8.551 -4.533 -1.816 748 HB2 LEU 98 2HB LEU 98 -7.935 -2.806 -4.240 749 HB3 LEU 98 3HB LEU 98 -8.516 -4.461 -4.308 750 HG LEU 98 HG LEU 98 -10.051 -2.054 -3.253 751 HD11 LEU 98 1HD1 LEU 98 -11.584 -2.487 -5.135 752 HD12 LEU 98 2HD1 LEU 98 -10.538 -3.792 -5.698 753 HD13 LEU 98 3HD1 LEU 98 -9.952 -2.128 -5.696 754 HD21 LEU 98 1HD2 LEU 98 -10.907 -4.967 -3.305 755 HD22 LEU 98 2HD2 LEU 98 -11.947 -3.599 -2.901 756 HD23 LEU 98 3HD2 LEU 98 -10.575 -3.995 -1.869 757 H ASP 99 H ASP 99 -5.730 -2.937 -1.438 758 HA ASP 99 HA ASP 99 -3.529 -3.187 -1.772 759 HB2 ASP 99 2HB ASP 99 -4.034 -5.088 -0.193 760 HB3 ASP 99 3HB ASP 99 -4.062 -6.172 -1.577 761 H ILE 100 H ILE 100 -4.664 -2.640 -4.066 762 HA ILE 100 HA ILE 100 -3.489 -4.240 -6.212 763 HB ILE 100 HB ILE 100 -4.940 -1.552 -6.347 764 HG12 ILE 100 2HG1 ILE 100 -5.929 -4.386 -6.883 765 HG13 ILE 100 3HG1 ILE 100 -6.373 -3.376 -5.517 766 HG21 ILE 100 1HG2 ILE 100 -3.395 -1.889 -8.261 767 HG22 ILE 100 2HG2 ILE 100 -5.077 -1.940 -8.784 768 HG23 ILE 100 3HG2 ILE 100 -4.164 -3.440 -8.613 769 HD11 ILE 100 1HD1 ILE 100 -8.131 -3.508 -7.167 770 HD12 ILE 100 2HD1 ILE 100 -7.067 -2.812 -8.388 771 HD13 ILE 100 3HD1 ILE 100 -7.543 -1.860 -6.981 772 H LYS 101 H LYS 101 -1.374 -4.163 -5.781 773 HA LYS 101 HA LYS 101 0.190 -1.982 -4.977 774 HB2 LYS 101 2HB LYS 101 1.181 -4.441 -6.489 775 HB3 LYS 101 3HB LYS 101 2.117 -3.410 -5.406 776 HG2 LYS 101 2HG LYS 101 0.668 -4.109 -3.514 777 HG3 LYS 101 3HG LYS 101 -0.212 -5.176 -4.611 778 HD2 LYS 101 2HD LYS 101 1.910 -6.436 -5.038 779 HD3 LYS 101 3HD LYS 101 2.737 -5.400 -3.870 780 HE2 LYS 101 2HE LYS 101 0.461 -7.328 -3.302 781 HE3 LYS 101 3HE LYS 101 2.141 -7.469 -2.779 782 HZ1 LYS 101 1HZ LYS 101 0.876 -6.649 -0.972 783 HZ2 LYS 101 2HZ LYS 101 0.163 -5.444 -1.914 784 HZ3 LYS 101 3HZ LYS 101 1.809 -5.362 -1.546 785 HA PRO 102 HA PRO 102 1.405 -1.515 -9.860 786 HB2 PRO 102 2HB PRO 102 -0.984 -1.801 -11.385 787 HB3 PRO 102 3HB PRO 102 0.382 -2.926 -11.361 788 HG2 PRO 102 2HG PRO 102 -2.186 -3.066 -9.834 789 HG3 PRO 102 3HG PRO 102 -1.253 -4.372 -10.603 790 HD2 PRO 102 2HD PRO 102 -1.162 -4.046 -7.963 791 HD3 PRO 102 3HD PRO 102 0.322 -4.442 -8.859 792 H LEU 103 H LEU 103 -1.877 -0.737 -8.609 793 HA LEU 103 HA LEU 103 -1.870 1.900 -9.840 794 HB2 LEU 103 2HB LEU 103 -3.947 0.492 -9.591 795 HB3 LEU 103 3HB LEU 103 -3.877 0.729 -7.858 796 HG LEU 103 HG LEU 103 -5.538 2.177 -9.287 797 HD11 LEU 103 1HD1 LEU 103 -5.355 4.146 -7.822 798 HD12 LEU 103 2HD1 LEU 103 -3.796 3.559 -7.233 799 HD13 LEU 103 3HD1 LEU 103 -5.263 2.627 -6.935 800 HD21 LEU 103 1HD2 LEU 103 -4.662 4.268 -10.190 801 HD22 LEU 103 2HD2 LEU 103 -3.928 2.888 -10.998 802 HD23 LEU 103 3HD2 LEU 103 -3.012 3.784 -9.783 803 H LEU 104 H LEU 104 -1.484 0.501 -6.615 804 HA LEU 104 HA LEU 104 -1.601 2.808 -5.034 805 HB2 LEU 104 2HB LEU 104 -1.720 0.494 -4.141 806 HB3 LEU 104 3HB LEU 104 -0.033 0.240 -4.554 807 HG LEU 104 HG LEU 104 0.645 1.933 -2.865 808 HD11 LEU 104 1HD1 LEU 104 -0.976 2.869 -1.273 809 HD12 LEU 104 2HD1 LEU 104 -2.309 2.147 -2.178 810 HD13 LEU 104 3HD1 LEU 104 -1.314 3.406 -2.916 811 HD21 LEU 104 1HD2 LEU 104 0.509 -0.437 -2.224 812 HD22 LEU 104 2HD2 LEU 104 -1.173 -0.221 -1.728 813 HD23 LEU 104 3HD2 LEU 104 0.118 0.618 -0.867 814 H ASP 105 H ASP 105 1.179 1.141 -6.470 815 HA ASP 105 HA ASP 105 3.257 2.737 -5.448 816 HB2 ASP 105 2HB ASP 105 3.601 0.494 -6.487 817 HB3 ASP 105 3HB ASP 105 3.186 1.150 -8.070 818 H VAL 106 H VAL 106 1.563 2.856 -8.592 819 HA VAL 106 HA VAL 106 3.028 5.000 -9.691 820 HB VAL 106 HB VAL 106 0.266 3.927 -10.416 821 HG11 VAL 106 1HG1 VAL 106 0.505 5.069 -12.598 822 HG12 VAL 106 2HG1 VAL 106 1.989 5.846 -12.042 823 HG13 VAL 106 3HG1 VAL 106 0.449 6.233 -11.274 824 HG21 VAL 106 1HG2 VAL 106 2.109 2.310 -10.652 825 HG22 VAL 106 2HG2 VAL 106 2.994 3.445 -11.671 826 HG23 VAL 106 3HG2 VAL 106 1.466 2.763 -12.231 827 H THR 107 H THR 107 -0.046 4.994 -7.852 828 HA THR 107 HA THR 107 -0.580 7.792 -8.162 829 HB THR 107 HB THR 107 -1.639 5.927 -5.976 830 HG1 THR 107 HG1 THR 107 -2.001 5.345 -8.305 831 HG21 THR 107 1HG2 THR 107 -2.786 8.512 -7.113 832 HG22 THR 107 2HG2 THR 107 -2.072 8.331 -5.509 833 HG23 THR 107 3HG2 THR 107 -3.564 7.482 -5.908 834 H CYS 108 H CYS 108 1.119 5.873 -5.709 835 HA CYS 108 HA CYS 108 1.708 8.004 -3.899 836 HB2 CYS 108 2HB CYS 108 3.093 5.321 -4.293 837 HB3 CYS 108 3HB CYS 108 3.419 6.428 -2.956 838 HG CYS 108 HG CYS 108 0.285 5.212 -3.517 839 H LYS 109 H LYS 109 3.230 6.784 -6.824 840 HA LYS 109 HA LYS 109 5.593 8.426 -6.636 841 HB2 LYS 109 2HB LYS 109 4.478 6.504 -8.656 842 HB3 LYS 109 3HB LYS 109 5.486 7.789 -9.313 843 HG2 LYS 109 2HG LYS 109 6.736 5.677 -8.826 844 HG3 LYS 109 3HG LYS 109 7.385 7.088 -7.986 845 HD2 LYS 109 2HD LYS 109 6.261 6.365 -5.901 846 HD3 LYS 109 3HD LYS 109 5.570 4.978 -6.747 847 HE2 LYS 109 2HE LYS 109 8.539 5.472 -6.350 848 HE3 LYS 109 3HE LYS 109 7.555 4.373 -5.383 849 HZ1 LYS 109 1HZ LYS 109 7.058 3.137 -7.428 850 HZ2 LYS 109 2HZ LYS 109 8.707 3.151 -7.069 851 HZ3 LYS 109 3HZ LYS 109 8.101 4.150 -8.284 852 H THR 110 H THR 110 2.344 8.828 -7.950 853 HA THR 110 HA THR 110 2.794 11.127 -9.559 854 HB THR 110 HB THR 110 0.235 10.210 -8.154 855 HG1 THR 110 HG1 THR 110 1.506 8.980 -9.986 856 HG21 THR 110 1HG2 THR 110 0.049 12.589 -8.832 857 HG22 THR 110 2HG2 THR 110 -0.971 11.566 -9.844 858 HG23 THR 110 3HG2 THR 110 0.563 12.169 -10.471 859 H VAL 111 H VAL 111 1.695 10.764 -6.161 860 HA VAL 111 HA VAL 111 1.653 13.566 -5.594 861 HB VAL 111 HB VAL 111 1.484 12.945 -3.199 862 HG11 VAL 111 1HG1 VAL 111 -0.317 11.269 -4.994 863 HG12 VAL 111 2HG1 VAL 111 -0.563 12.959 -4.545 864 HG13 VAL 111 3HG1 VAL 111 -0.655 11.701 -3.312 865 HG21 VAL 111 1HG2 VAL 111 1.896 10.078 -4.123 866 HG22 VAL 111 2HG2 VAL 111 1.411 10.568 -2.497 867 HG23 VAL 111 3HG2 VAL 111 2.997 11.025 -3.120 868 H ALA 112 H ALA 112 4.153 11.070 -5.406 869 HA ALA 112 HA ALA 112 6.190 12.662 -4.189 870 HB1 ALA 112 1HB ALA 112 6.481 10.220 -5.967 871 HB2 ALA 112 2HB ALA 112 6.299 10.209 -4.213 872 HB3 ALA 112 3HB ALA 112 7.742 10.914 -4.941 873 H ASN 113 H ASN 113 4.977 12.424 -7.477 874 HA ASN 113 HA ASN 113 7.192 13.628 -8.806 875 HB2 ASN 113 2HB ASN 113 4.343 13.048 -9.603 876 HB3 ASN 113 3HB ASN 113 5.175 14.290 -10.523 877 HD21 ASN 113 1HD2 ASN 113 4.825 10.898 -10.068 878 HD22 ASN 113 2HD2 ASN 113 6.020 10.402 -11.207 879 H MET 114 H MET 114 4.569 14.927 -6.930 880 HA MET 114 HA MET 114 4.739 17.638 -7.865 881 HB2 MET 114 2HB MET 114 3.553 16.533 -5.282 882 HB3 MET 114 3HB MET 114 3.324 18.174 -5.877 883 HG2 MET 114 2HG MET 114 2.282 17.148 -7.957 884 HG3 MET 114 3HG MET 114 2.307 15.608 -7.105 885 HE1 MET 114 1HE MET 114 -0.144 16.327 -4.094 886 HE2 MET 114 2HE MET 114 1.620 16.425 -4.094 887 HE3 MET 114 3HE MET 114 0.805 15.091 -4.914 888 H ILE 115 H ILE 115 6.401 15.767 -5.398 889 HA ILE 115 HA ILE 115 7.935 18.131 -4.496 890 HB ILE 115 HB ILE 115 8.800 16.682 -2.659 891 HG12 ILE 115 2HG1 ILE 115 6.869 14.565 -3.722 892 HG13 ILE 115 3HG1 ILE 115 8.620 14.480 -3.829 893 HG21 ILE 115 1HG2 ILE 115 5.770 16.745 -2.815 894 HG22 ILE 115 2HG2 ILE 115 6.808 18.065 -2.277 895 HG23 ILE 115 3HG2 ILE 115 6.722 16.575 -1.337 896 HD11 ILE 115 1HD1 ILE 115 7.012 14.458 -1.277 897 HD12 ILE 115 2HD1 ILE 115 8.769 14.347 -1.396 898 HD13 ILE 115 3HD1 ILE 115 7.757 13.063 -2.058 899 H ARG 116 H ARG 116 8.164 15.899 -6.886 900 HA ARG 116 HA ARG 116 10.704 14.724 -6.714 901 HB2 ARG 116 2HB ARG 116 8.930 13.999 -8.294 902 HB3 ARG 116 3HB ARG 116 9.124 15.487 -9.207 903 HG2 ARG 116 2HG ARG 116 10.205 13.692 -10.402 904 HG3 ARG 116 3HG ARG 116 11.458 14.773 -9.790 905 HD2 ARG 116 2HD ARG 116 11.927 13.213 -7.952 906 HD3 ARG 116 3HD ARG 116 10.621 12.153 -8.493 907 HE ARG 116 HE ARG 116 12.188 12.296 -10.670 908 HH11 ARG 116 1HH1 ARG 116 12.951 11.527 -7.318 909 HH12 ARG 116 2HH1 ARG 116 14.276 10.489 -7.734 910 HH21 ARG 116 1HH2 ARG 116 13.897 10.927 -11.199 911 HH22 ARG 116 2HH2 ARG 116 14.812 10.149 -9.944 912 H GLY 117 H GLY 117 12.361 16.055 -6.181 913 HA2 GLY 117 2HA GLY 117 13.202 18.097 -8.172 914 HA3 GLY 117 3HA GLY 117 13.400 18.322 -6.438 915 H1 SER 2 1H SER 2 16.321 -16.038 16.377 916 H2 SER 2 2H SER 2 14.984 -15.185 15.800 917 H3 SER 2 3H SER 2 16.169 -14.384 16.705 918 HA SER 2 HA SER 2 17.794 -14.752 15.012 919 HB2 SER 2 2HB SER 2 15.529 -15.996 13.412 920 HB3 SER 2 3HB SER 2 17.194 -15.758 12.868 921 HG SER 2 HG SER 2 17.702 -17.552 13.819 922 H LEU 3 H LEU 3 18.166 -12.828 14.197 923 HA LEU 3 HA LEU 3 15.949 -10.933 13.785 924 HB2 LEU 3 2HB LEU 3 18.934 -10.465 14.167 925 HB3 LEU 3 3HB LEU 3 17.706 -9.209 14.106 926 HG LEU 3 HG LEU 3 17.782 -11.358 16.259 927 HD11 LEU 3 1HD1 LEU 3 18.778 -9.690 17.740 928 HD12 LEU 3 2HD1 LEU 3 18.890 -8.541 16.403 929 HD13 LEU 3 3HD1 LEU 3 19.830 -10.036 16.368 930 HD21 LEU 3 1HD2 LEU 3 15.580 -10.350 15.949 931 HD22 LEU 3 2HD2 LEU 3 16.265 -8.732 16.117 932 HD23 LEU 3 3HD2 LEU 3 16.280 -9.848 17.486 933 H VAL 4 H VAL 4 15.355 -10.650 11.639 934 HA VAL 4 HA VAL 4 17.160 -10.965 9.434 935 HB VAL 4 HB VAL 4 15.406 -9.653 8.077 936 HG11 VAL 4 1HG1 VAL 4 13.849 -11.558 7.970 937 HG12 VAL 4 2HG1 VAL 4 14.489 -12.183 9.491 938 HG13 VAL 4 3HG1 VAL 4 15.524 -12.105 8.064 939 HG21 VAL 4 1HG2 VAL 4 14.352 -8.401 9.922 940 HG22 VAL 4 2HG2 VAL 4 13.775 -9.908 10.637 941 HG23 VAL 4 3HG2 VAL 4 13.157 -9.382 9.070 942 H LYS 5 H LYS 5 18.813 -9.730 9.112 943 HA LYS 5 HA LYS 5 19.132 -7.173 10.422 944 HB2 LYS 5 2HB LYS 5 21.047 -8.712 8.627 945 HB3 LYS 5 3HB LYS 5 21.466 -7.361 9.667 946 HG2 LYS 5 2HG LYS 5 20.851 -8.730 11.654 947 HG3 LYS 5 3HG LYS 5 20.507 -10.092 10.588 948 HD2 LYS 5 2HD LYS 5 22.873 -10.132 9.864 949 HD3 LYS 5 3HD LYS 5 23.217 -8.733 10.888 950 HE2 LYS 5 2HE LYS 5 22.569 -10.067 12.884 951 HE3 LYS 5 3HE LYS 5 22.316 -11.471 11.841 952 HZ1 LYS 5 1HZ LYS 5 24.479 -11.517 12.903 953 HZ2 LYS 5 2HZ LYS 5 24.887 -10.032 12.212 954 HZ3 LYS 5 3HZ LYS 5 24.651 -11.384 11.227 955 H LEU 6 H LEU 6 17.545 -6.005 9.318 956 HA LEU 6 HA LEU 6 17.562 -5.643 6.450 957 HB2 LEU 6 2HB LEU 6 15.980 -4.223 8.625 958 HB3 LEU 6 3HB LEU 6 15.679 -4.081 6.898 959 HG LEU 6 HG LEU 6 15.367 -6.615 8.554 960 HD11 LEU 6 1HD1 LEU 6 13.624 -4.981 9.043 961 HD12 LEU 6 2HD1 LEU 6 12.971 -6.367 8.177 962 HD13 LEU 6 3HD1 LEU 6 13.236 -4.844 7.324 963 HD21 LEU 6 1HD2 LEU 6 16.068 -7.183 6.287 964 HD22 LEU 6 2HD2 LEU 6 14.781 -6.184 5.606 965 HD23 LEU 6 3HD2 LEU 6 14.381 -7.631 6.538 966 H GLU 7 H GLU 7 19.647 -4.835 6.121 967 HA GLU 7 HA GLU 7 20.560 -2.374 7.294 968 HB2 GLU 7 2HB GLU 7 22.149 -4.122 6.534 969 HB3 GLU 7 3HB GLU 7 21.582 -3.930 4.879 970 HG2 GLU 7 2HG GLU 7 22.404 -1.587 4.884 971 HG3 GLU 7 3HG GLU 7 23.017 -1.813 6.520 972 H SER 8 H SER 8 19.806 -0.427 6.695 973 HA SER 8 HA SER 8 18.058 0.069 4.504 974 HB2 SER 8 2HB SER 8 18.321 2.478 5.265 975 HB3 SER 8 3HB SER 8 17.890 1.363 6.562 976 HG SER 8 HG SER 8 19.922 1.465 7.356 977 H SER 9 H SER 9 18.525 1.981 2.964 978 HA SER 9 HA SER 9 20.773 1.553 1.295 979 HB2 SER 9 2HB SER 9 20.008 3.675 0.153 980 HB3 SER 9 3HB SER 9 18.705 2.514 0.407 981 HG SER 9 HG SER 9 18.727 5.006 1.145 982 H ASP 10 H ASP 10 20.262 3.567 4.078 983 HA ASP 10 HA ASP 10 22.636 5.200 3.843 984 HB2 ASP 10 2HB ASP 10 20.570 5.944 5.010 985 HB3 ASP 10 3HB ASP 10 20.772 4.665 6.199 986 H GLU 11 H GLU 11 22.228 1.977 4.488 987 HA GLU 11 HA GLU 11 23.662 0.314 4.930 988 HB2 GLU 11 2HB GLU 11 25.738 2.472 5.453 989 HB3 GLU 11 3HB GLU 11 26.083 0.749 5.361 990 HG2 GLU 11 2HG GLU 11 25.354 0.716 3.007 991 HG3 GLU 11 3HG GLU 11 24.986 2.437 3.092 992 H LYS 12 H LYS 12 22.246 2.066 7.163 993 HA LYS 12 HA LYS 12 23.547 0.957 9.531 994 HB2 LYS 12 2HB LYS 12 21.046 2.656 9.153 995 HB3 LYS 12 3HB LYS 12 21.467 1.961 10.715 996 HG2 LYS 12 2HG LYS 12 23.671 3.162 10.595 997 HG3 LYS 12 3HG LYS 12 23.113 3.943 9.113 998 HD2 LYS 12 2HD LYS 12 21.283 5.028 10.338 999 HD3 LYS 12 3HD LYS 12 21.735 4.181 11.820 1000 HE2 LYS 12 2HE LYS 12 22.532 6.505 11.838 1001 HE3 LYS 12 3HE LYS 12 23.887 5.381 11.856 1002 HZ1 LYS 12 1HZ LYS 12 24.201 5.755 9.507 1003 HZ2 LYS 12 2HZ LYS 12 24.239 7.232 10.321 1004 HZ3 LYS 12 3HZ LYS 12 22.866 6.783 9.443 1005 H VAL 13 H VAL 13 23.084 -0.952 10.393 1006 HA VAL 13 HA VAL 13 21.264 -2.740 8.979 1007 HB VAL 13 HB VAL 13 23.278 -3.392 11.185 1008 HG11 VAL 13 1HG1 VAL 13 21.919 -5.203 9.163 1009 HG12 VAL 13 2HG1 VAL 13 21.569 -5.121 10.890 1010 HG13 VAL 13 3HG1 VAL 13 23.141 -5.701 10.339 1011 HG21 VAL 13 1HG2 VAL 13 24.843 -4.075 9.404 1012 HG22 VAL 13 2HG2 VAL 13 24.448 -2.361 9.279 1013 HG23 VAL 13 3HG2 VAL 13 23.705 -3.519 8.173 1014 H PHE 14 H PHE 14 19.198 -2.716 9.716 1015 HA PHE 14 HA PHE 14 18.564 -2.408 12.570 1016 HB2 PHE 14 2HB PHE 14 16.764 -2.556 10.103 1017 HB3 PHE 14 3HB PHE 14 16.185 -2.321 11.749 1018 HD1 PHE 14 HD1 PHE 14 17.849 -0.719 8.882 1019 HD2 PHE 14 HD2 PHE 14 16.586 -0.190 12.936 1020 HE1 PHE 14 HE1 PHE 14 18.169 1.711 8.670 1021 HE2 PHE 14 HE2 PHE 14 16.904 2.237 12.706 1022 HZ PHE 14 HZ PHE 14 17.698 3.186 10.579 1023 H GLU 15 H GLU 15 19.268 -4.320 13.403 1024 HA GLU 15 HA GLU 15 18.458 -6.908 12.416 1025 HB2 GLU 15 2HB GLU 15 19.787 -6.133 15.045 1026 HB3 GLU 15 3HB GLU 15 19.650 -7.769 14.403 1027 HG2 GLU 15 2HG GLU 15 21.084 -7.183 12.513 1028 HG3 GLU 15 3HG GLU 15 21.146 -5.510 13.045 1029 H ILE 16 H ILE 16 16.215 -6.752 12.394 1030 HA ILE 16 HA ILE 16 14.772 -6.501 14.979 1031 HB ILE 16 HB ILE 16 14.199 -4.757 13.281 1032 HG12 ILE 16 2HG1 ILE 16 11.884 -6.692 13.751 1033 HG13 ILE 16 3HG1 ILE 16 12.476 -5.525 14.925 1034 HG21 ILE 16 1HG2 ILE 16 14.650 -6.042 11.233 1035 HG22 ILE 16 2HG2 ILE 16 13.045 -5.310 11.184 1036 HG23 ILE 16 3HG2 ILE 16 13.219 -7.033 11.529 1037 HD11 ILE 16 1HD1 ILE 16 10.478 -4.717 13.869 1038 HD12 ILE 16 2HD1 ILE 16 11.203 -4.886 12.271 1039 HD13 ILE 16 3HD1 ILE 16 11.844 -3.702 13.412 1040 H GLU 17 H GLU 17 13.028 -8.037 15.361 1041 HA GLU 17 HA GLU 17 13.665 -10.723 14.755 1042 HB2 GLU 17 2HB GLU 17 10.954 -9.699 15.711 1043 HB3 GLU 17 3HB GLU 17 11.590 -11.325 15.908 1044 HG2 GLU 17 2HG GLU 17 13.328 -10.433 17.447 1045 HG3 GLU 17 3HG GLU 17 12.625 -8.823 17.282 1046 H LYS 18 H LYS 18 12.926 -12.128 13.218 1047 HA LYS 18 HA LYS 18 11.830 -11.132 10.801 1048 HB2 LYS 18 2HB LYS 18 13.355 -13.106 10.916 1049 HB3 LYS 18 3HB LYS 18 12.075 -14.037 11.688 1050 HG2 LYS 18 2HG LYS 18 10.684 -13.829 9.650 1051 HG3 LYS 18 3HG LYS 18 11.941 -12.852 8.894 1052 HD2 LYS 18 2HD LYS 18 12.213 -15.016 7.963 1053 HD3 LYS 18 3HD LYS 18 13.495 -14.887 9.164 1054 HE2 LYS 18 2HE LYS 18 10.844 -16.310 9.602 1055 HE3 LYS 18 3HE LYS 18 12.351 -17.099 9.148 1056 HZ1 LYS 18 1HZ LYS 18 11.834 -15.642 11.686 1057 HZ2 LYS 18 2HZ LYS 18 13.328 -16.287 11.230 1058 HZ3 LYS 18 3HZ LYS 18 12.011 -17.312 11.487 1059 H GLU 19 H GLU 19 10.399 -12.676 13.619 1060 HA GLU 19 HA GLU 19 7.825 -13.230 12.598 1061 HB2 GLU 19 2HB GLU 19 7.091 -13.255 14.998 1062 HB3 GLU 19 3HB GLU 19 8.495 -14.260 14.661 1063 HG2 GLU 19 2HG GLU 19 9.962 -12.485 15.618 1064 HG3 GLU 19 3HG GLU 19 8.523 -11.535 15.992 1065 H ILE 20 H ILE 20 9.255 -10.214 13.616 1066 HA ILE 20 HA ILE 20 6.790 -8.681 13.605 1067 HB ILE 20 HB ILE 20 9.685 -7.700 13.445 1068 HG12 ILE 20 2HG1 ILE 20 7.885 -8.033 15.889 1069 HG13 ILE 20 3HG1 ILE 20 9.322 -8.974 15.531 1070 HG21 ILE 20 1HG2 ILE 20 8.798 -5.522 14.171 1071 HG22 ILE 20 2HG2 ILE 20 7.157 -6.172 14.151 1072 HG23 ILE 20 3HG2 ILE 20 8.068 -6.029 12.646 1073 HD11 ILE 20 1HD1 ILE 20 9.782 -7.359 17.245 1074 HD12 ILE 20 2HD1 ILE 20 9.229 -6.039 16.216 1075 HD13 ILE 20 3HD1 ILE 20 10.686 -6.942 15.791 1076 H ALA 21 H ALA 21 9.521 -9.287 11.422 1077 HA ALA 21 HA ALA 21 8.594 -7.601 9.266 1078 HB1 ALA 21 1HB ALA 21 10.574 -8.432 8.067 1079 HB2 ALA 21 2HB ALA 21 10.836 -9.647 9.321 1080 HB3 ALA 21 3HB ALA 21 10.994 -7.933 9.707 1081 H CYS 22 H CYS 22 7.348 -10.460 10.281 1082 HA CYS 22 HA CYS 22 6.738 -11.702 7.774 1083 HB2 CYS 22 2HB CYS 22 5.372 -11.890 10.486 1084 HB3 CYS 22 3HB CYS 22 4.997 -12.921 9.106 1085 HG CYS 22 HG CYS 22 8.194 -13.146 9.465 1086 H MET 23 H MET 23 5.301 -9.093 9.688 1087 HA MET 23 HA MET 23 2.881 -8.771 8.214 1088 HB2 MET 23 2HB MET 23 4.472 -6.703 9.793 1089 HB3 MET 23 3HB MET 23 2.850 -6.442 9.167 1090 HG2 MET 23 2HG MET 23 2.082 -8.373 10.597 1091 HG3 MET 23 3HG MET 23 3.686 -8.385 11.328 1092 HE1 MET 23 1HE MET 23 4.357 -5.209 11.411 1093 HE2 MET 23 2HE MET 23 4.681 -6.323 12.743 1094 HE3 MET 23 3HE MET 23 3.792 -4.829 13.039 1095 H SER 24 H SER 24 6.181 -7.726 7.660 1096 HA SER 24 HA SER 24 5.687 -6.343 5.204 1097 HB2 SER 24 2HB SER 24 8.154 -7.803 6.215 1098 HB3 SER 24 3HB SER 24 8.106 -6.823 4.752 1099 HG SER 24 HG SER 24 8.054 -5.072 5.891 1100 H VAL 25 H VAL 25 4.414 -7.496 3.820 1101 HA VAL 25 HA VAL 25 4.628 -10.292 3.321 1102 HB VAL 25 HB VAL 25 3.358 -8.112 1.613 1103 HG11 VAL 25 1HG1 VAL 25 3.018 -11.126 1.382 1104 HG12 VAL 25 2HG1 VAL 25 3.799 -10.068 0.207 1105 HG13 VAL 25 3HG1 VAL 25 2.065 -9.921 0.503 1106 HG21 VAL 25 1HG2 VAL 25 2.356 -8.279 3.854 1107 HG22 VAL 25 2HG2 VAL 25 2.101 -10.012 3.632 1108 HG23 VAL 25 3HG2 VAL 25 1.223 -8.854 2.629 1109 H THR 26 H THR 26 6.190 -7.435 1.907 1110 HA THR 26 HA THR 26 7.298 -8.676 -0.401 1111 HB THR 26 HB THR 26 8.326 -6.267 1.167 1112 HG1 THR 26 HG1 THR 26 7.227 -5.106 -0.518 1113 HG21 THR 26 1HG2 THR 26 9.498 -5.612 -0.915 1114 HG22 THR 26 2HG2 THR 26 9.029 -7.139 -1.665 1115 HG23 THR 26 3HG2 THR 26 10.123 -7.135 -0.279 1116 H ILE 27 H ILE 27 8.611 -8.132 2.887 1117 HA ILE 27 HA ILE 27 11.198 -9.174 2.417 1118 HB ILE 27 HB ILE 27 9.684 -8.823 5.034 1119 HG12 ILE 27 2HG1 ILE 27 11.911 -7.178 3.749 1120 HG13 ILE 27 3HG1 ILE 27 10.214 -6.722 3.824 1121 HG21 ILE 27 1HG2 ILE 27 11.841 -9.114 6.226 1122 HG22 ILE 27 2HG2 ILE 27 12.618 -9.542 4.702 1123 HG23 ILE 27 3HG2 ILE 27 11.367 -10.586 5.372 1124 HD11 ILE 27 1HD1 ILE 27 11.492 -5.512 5.463 1125 HD12 ILE 27 2HD1 ILE 27 12.083 -7.015 6.170 1126 HD13 ILE 27 3HD1 ILE 27 10.368 -6.607 6.269 1127 H LYS 28 H LYS 28 8.251 -10.677 3.855 1128 HA LYS 28 HA LYS 28 9.433 -13.165 4.401 1129 HB2 LYS 28 2HB LYS 28 7.287 -14.048 4.839 1130 HB3 LYS 28 3HB LYS 28 7.125 -12.342 5.225 1131 HG2 LYS 28 2HG LYS 28 5.994 -11.960 3.085 1132 HG3 LYS 28 3HG LYS 28 6.208 -13.645 2.650 1133 HD2 LYS 28 2HD LYS 28 4.769 -14.318 4.565 1134 HD3 LYS 28 3HD LYS 28 4.523 -12.611 4.969 1135 HE2 LYS 28 2HE LYS 28 2.635 -13.595 3.648 1136 HE3 LYS 28 3HE LYS 28 3.401 -12.219 2.844 1137 HZ1 LYS 28 1HZ LYS 28 4.595 -13.725 1.408 1138 HZ2 LYS 28 2HZ LYS 28 2.951 -14.094 1.334 1139 HZ3 LYS 28 3HZ LYS 28 3.996 -15.075 2.230 1140 H ASN 29 H ASN 29 7.805 -11.958 1.441 1141 HA ASN 29 HA ASN 29 7.667 -14.359 -0.023 1142 HB2 ASN 29 2HB ASN 29 7.838 -11.468 -0.997 1143 HB3 ASN 29 3HB ASN 29 7.641 -12.822 -2.105 1144 HD21 ASN 29 1HD2 ASN 29 5.900 -10.603 -1.712 1145 HD22 ASN 29 2HD2 ASN 29 4.367 -11.239 -1.224 1146 H MET 30 H MET 30 10.189 -11.853 0.085 1147 HA MET 30 HA MET 30 11.942 -12.926 -1.836 1148 HB2 MET 30 2HB MET 30 12.593 -11.223 0.613 1149 HB3 MET 30 3HB MET 30 13.729 -11.574 -0.683 1150 HG2 MET 30 2HG MET 30 12.157 -10.446 -2.276 1151 HG3 MET 30 3HG MET 30 11.180 -9.967 -0.889 1152 HE1 MET 30 1HE MET 30 13.707 -7.564 1.023 1153 HE2 MET 30 2HE MET 30 13.523 -9.293 1.321 1154 HE3 MET 30 3HE MET 30 12.098 -8.287 1.057 1155 H ILE 31 H ILE 31 11.679 -13.466 1.659 1156 HA ILE 31 HA ILE 31 13.901 -15.218 1.959 1157 HB ILE 31 HB ILE 31 11.408 -14.967 3.714 1158 HG12 ILE 31 2HG1 ILE 31 14.145 -13.650 4.026 1159 HG13 ILE 31 3HG1 ILE 31 12.691 -12.834 3.474 1160 HG21 ILE 31 1HG2 ILE 31 12.567 -17.097 4.159 1161 HG22 ILE 31 2HG2 ILE 31 12.764 -15.993 5.519 1162 HG23 ILE 31 3HG2 ILE 31 14.093 -16.236 4.384 1163 HD11 ILE 31 1HD1 ILE 31 13.116 -14.030 6.206 1164 HD12 ILE 31 2HD1 ILE 31 11.649 -13.221 5.646 1165 HD13 ILE 31 3HD1 ILE 31 13.157 -12.318 5.783 1166 H GLU 32 H GLU 32 10.514 -15.716 1.065 1167 HA GLU 32 HA GLU 32 10.512 -18.591 1.339 1168 HB2 GLU 32 2HB GLU 32 8.539 -16.773 -0.137 1169 HB3 GLU 32 3HB GLU 32 8.295 -18.486 0.190 1170 HG2 GLU 32 2HG GLU 32 8.305 -18.029 2.619 1171 HG3 GLU 32 3HG GLU 32 8.561 -16.329 2.291 1172 H ASP 33 H ASP 33 11.146 -16.321 -1.306 1173 HA ASP 33 HA ASP 33 11.188 -18.253 -3.438 1174 HB2 ASP 33 2HB ASP 33 12.425 -15.460 -3.299 1175 HB3 ASP 33 3HB ASP 33 12.344 -16.440 -4.761 1176 H ILE 34 H ILE 34 13.654 -16.677 -1.468 1177 HA ILE 34 HA ILE 34 15.915 -18.090 -2.544 1178 HB ILE 34 HB ILE 34 15.559 -16.502 0.049 1179 HG12 ILE 34 2HG1 ILE 34 16.843 -15.678 -2.602 1180 HG13 ILE 34 3HG1 ILE 34 15.259 -15.167 -2.037 1181 HG21 ILE 34 1HG2 ILE 34 17.439 -18.076 0.301 1182 HG22 ILE 34 2HG2 ILE 34 18.013 -16.412 0.221 1183 HG23 ILE 34 3HG2 ILE 34 18.168 -17.462 -1.188 1184 HD11 ILE 34 1HD1 ILE 34 16.856 -13.412 -1.713 1185 HD12 ILE 34 2HD1 ILE 34 17.910 -14.471 -0.781 1186 HD13 ILE 34 3HD1 ILE 34 16.327 -14.012 -0.142 1187 H GLY 35 H GLY 35 13.525 -18.684 -0.070 1188 HA2 GLY 35 2HA GLY 35 13.000 -20.739 0.910 1189 HA3 GLY 35 3HA GLY 35 14.590 -21.370 0.501 1190 H GLU 36 H GLU 36 16.378 -19.812 1.568 1191 HA GLU 36 HA GLU 36 15.753 -19.313 4.417 1192 HB2 GLU 36 2HB GLU 36 18.117 -20.952 3.378 1193 HB3 GLU 36 3HB GLU 36 17.894 -20.463 5.054 1194 HG2 GLU 36 2HG GLU 36 15.899 -21.848 5.243 1195 HG3 GLU 36 3HG GLU 36 15.979 -22.255 3.533 1196 H SER 37 H SER 37 15.940 -17.085 4.167 1197 HA SER 37 HA SER 37 18.415 -15.922 3.092 1198 HB2 SER 37 2HB SER 37 15.886 -14.539 4.081 1199 HB3 SER 37 3HB SER 37 17.241 -13.765 3.259 1200 HG SER 37 HG SER 37 16.776 -15.104 1.460 1201 H ASP 38 H ASP 38 19.560 -17.001 4.892 1202 HA ASP 38 HA ASP 38 19.315 -16.021 7.588 1203 HB2 ASP 38 2HB ASP 38 20.147 -18.310 7.085 1204 HB3 ASP 38 3HB ASP 38 21.536 -17.639 6.241 1205 H SER 39 H SER 39 21.142 -15.176 4.735 1206 HA SER 39 HA SER 39 23.114 -13.489 5.857 1207 HB2 SER 39 2HB SER 39 21.882 -13.456 3.071 1208 HB3 SER 39 3HB SER 39 23.384 -12.660 3.533 1209 HG SER 39 HG SER 39 24.121 -14.527 2.803 1210 HA PRO 40 HA PRO 40 20.855 -9.699 6.889 1211 HB2 PRO 40 2HB PRO 40 22.742 -7.791 6.040 1212 HB3 PRO 40 3HB PRO 40 22.796 -8.639 7.596 1213 HG2 PRO 40 2HG PRO 40 24.284 -9.251 5.077 1214 HG3 PRO 40 3HG PRO 40 24.856 -9.282 6.761 1215 HD2 PRO 40 2HD PRO 40 24.234 -11.561 5.491 1216 HD3 PRO 40 3HD PRO 40 23.842 -11.344 7.211 1217 H ILE 41 H ILE 41 19.270 -8.645 5.794 1218 HA ILE 41 HA ILE 41 19.231 -8.755 2.868 1219 HB ILE 41 HB ILE 41 17.003 -8.076 4.845 1220 HG12 ILE 41 2HG1 ILE 41 17.707 -10.446 5.009 1221 HG13 ILE 41 3HG1 ILE 41 16.100 -10.335 4.304 1222 HG21 ILE 41 1HG2 ILE 41 16.835 -8.511 1.838 1223 HG22 ILE 41 2HG2 ILE 41 16.592 -6.982 2.687 1224 HG23 ILE 41 3HG2 ILE 41 15.455 -8.309 2.922 1225 HD11 ILE 41 1HD1 ILE 41 18.678 -10.849 2.806 1226 HD12 ILE 41 2HD1 ILE 41 17.083 -10.706 2.063 1227 HD13 ILE 41 3HD1 ILE 41 17.422 -12.027 3.180 1228 HA PRO 42 HA PRO 42 20.149 -4.273 3.071 1229 HB2 PRO 42 2HB PRO 42 21.114 -4.010 0.527 1230 HB3 PRO 42 3HB PRO 42 22.097 -4.689 1.841 1231 HG2 PRO 42 2HG PRO 42 20.660 -6.106 -0.356 1232 HG3 PRO 42 3HG PRO 42 22.251 -6.451 0.359 1233 HD2 PRO 42 2HD PRO 42 19.925 -7.813 1.009 1234 HD3 PRO 42 3HD PRO 42 21.350 -7.707 2.062 1235 H LEU 43 H LEU 43 18.864 -2.607 2.435 1236 HA LEU 43 HA LEU 43 16.693 -3.030 0.478 1237 HB2 LEU 43 2HB LEU 43 16.511 -1.525 3.135 1238 HB3 LEU 43 3HB LEU 43 15.225 -1.650 1.952 1239 HG LEU 43 HG LEU 43 16.357 -3.957 3.584 1240 HD11 LEU 43 1HD1 LEU 43 13.680 -2.556 3.846 1241 HD12 LEU 43 2HD1 LEU 43 15.040 -2.438 4.963 1242 HD13 LEU 43 3HD1 LEU 43 14.206 -3.975 4.762 1243 HD21 LEU 43 1HD2 LEU 43 15.626 -4.792 1.419 1244 HD22 LEU 43 2HD2 LEU 43 14.065 -3.986 1.588 1245 HD23 LEU 43 3HD2 LEU 43 14.497 -5.315 2.668 1246 HA PRO 44 HA PRO 44 19.458 0.517 -0.636 1247 HB2 PRO 44 2HB PRO 44 19.830 -0.054 -3.245 1248 HB3 PRO 44 3HB PRO 44 20.551 -1.079 -1.986 1249 HG2 PRO 44 2HG PRO 44 18.113 -1.576 -3.642 1250 HG3 PRO 44 3HG PRO 44 19.389 -2.710 -3.147 1251 HD2 PRO 44 2HD PRO 44 16.910 -2.427 -1.868 1252 HD3 PRO 44 3HD PRO 44 18.354 -3.179 -1.156 1253 H ASN 45 H ASN 45 16.863 1.165 -0.159 1254 HA ASN 45 HA ASN 45 16.140 3.065 -2.257 1255 HB2 ASN 45 2HB ASN 45 14.787 1.108 -2.883 1256 HB3 ASN 45 3HB ASN 45 14.232 0.902 -1.226 1257 HD21 ASN 45 1HD2 ASN 45 13.960 2.895 -4.112 1258 HD22 ASN 45 2HD2 ASN 45 12.474 3.657 -3.673 1259 H VAL 46 H VAL 46 15.001 1.607 0.798 1260 HA VAL 46 HA VAL 46 14.046 4.158 1.798 1261 HB VAL 46 HB VAL 46 12.661 2.197 2.183 1262 HG11 VAL 46 1HG1 VAL 46 14.363 0.438 2.260 1263 HG12 VAL 46 2HG1 VAL 46 13.291 0.340 3.658 1264 HG13 VAL 46 3HG1 VAL 46 14.914 1.013 3.836 1265 HG21 VAL 46 1HG2 VAL 46 12.239 2.441 4.605 1266 HG22 VAL 46 2HG2 VAL 46 12.529 4.001 3.834 1267 HG23 VAL 46 3HG2 VAL 46 13.798 3.247 4.798 1268 H THR 47 H THR 47 15.066 5.447 3.182 1269 HA THR 47 HA THR 47 17.853 5.052 3.831 1270 HB THR 47 HB THR 47 17.678 7.352 4.779 1271 HG1 THR 47 HG1 THR 47 14.966 7.428 3.953 1272 HG21 THR 47 1HG2 THR 47 16.290 7.099 2.074 1273 HG22 THR 47 2HG2 THR 47 18.038 7.127 2.328 1274 HG23 THR 47 3HG2 THR 47 17.069 8.552 2.705 1275 H SER 48 H SER 48 18.523 5.771 6.185 1276 HA SER 48 HA SER 48 17.615 3.682 7.912 1277 HB2 SER 48 2HB SER 48 19.250 4.641 9.542 1278 HB3 SER 48 3HB SER 48 19.957 4.395 7.943 1279 HG SER 48 HG SER 48 20.546 6.431 8.578 1280 H THR 49 H THR 49 17.240 7.229 7.973 1281 HA THR 49 HA THR 49 15.955 7.594 10.423 1282 HB THR 49 HB THR 49 15.562 9.148 7.819 1283 HG1 THR 49 HG1 THR 49 17.586 9.078 9.724 1284 HG21 THR 49 1HG2 THR 49 13.792 9.743 9.463 1285 HG22 THR 49 2HG2 THR 49 14.920 11.079 9.217 1286 HG23 THR 49 3HG2 THR 49 15.036 10.087 10.670 1287 H ILE 50 H ILE 50 14.630 6.764 7.252 1288 HA ILE 50 HA ILE 50 11.860 7.011 8.058 1289 HB ILE 50 HB ILE 50 13.111 5.992 5.471 1290 HG12 ILE 50 2HG1 ILE 50 13.679 8.328 5.839 1291 HG13 ILE 50 3HG1 ILE 50 12.462 8.256 4.574 1292 HG21 ILE 50 1HG2 ILE 50 10.848 5.095 5.701 1293 HG22 ILE 50 2HG2 ILE 50 10.895 6.321 4.435 1294 HG23 ILE 50 3HG2 ILE 50 10.215 6.713 6.014 1295 HD11 ILE 50 1HD1 ILE 50 12.005 9.049 7.461 1296 HD12 ILE 50 2HD1 ILE 50 10.741 8.925 6.232 1297 HD13 ILE 50 3HD1 ILE 50 12.032 10.113 6.056 1298 H LEU 51 H LEU 51 14.105 4.364 7.214 1299 HA LEU 51 HA LEU 51 12.280 2.213 7.471 1300 HB2 LEU 51 2HB LEU 51 14.501 2.104 6.263 1301 HB3 LEU 51 3HB LEU 51 15.310 2.108 7.822 1302 HG LEU 51 HG LEU 51 14.262 -0.068 8.389 1303 HD11 LEU 51 1HD1 LEU 51 13.018 0.017 5.620 1304 HD12 LEU 51 2HD1 LEU 51 12.160 0.133 7.159 1305 HD13 LEU 51 3HD1 LEU 51 12.994 -1.357 6.729 1306 HD21 LEU 51 1HD2 LEU 51 15.670 -0.148 5.696 1307 HD22 LEU 51 2HD2 LEU 51 15.516 -1.488 6.837 1308 HD23 LEU 51 3HD2 LEU 51 16.458 -0.065 7.274 1309 H GLU 52 H GLU 52 14.288 3.943 9.771 1310 HA GLU 52 HA GLU 52 14.154 2.263 12.020 1311 HB2 GLU 52 2HB GLU 52 15.615 4.300 11.877 1312 HB3 GLU 52 3HB GLU 52 14.184 5.324 11.967 1313 HG2 GLU 52 2HG GLU 52 13.689 4.388 14.223 1314 HG3 GLU 52 3HG GLU 52 15.170 3.436 14.131 1315 H LYS 53 H LYS 53 12.026 4.902 10.926 1316 HA LYS 53 HA LYS 53 10.167 4.832 13.038 1317 HB2 LYS 53 2HB LYS 53 9.640 5.659 10.152 1318 HB3 LYS 53 3HB LYS 53 8.628 6.053 11.536 1319 HG2 LYS 53 2HG LYS 53 10.588 7.353 12.476 1320 HG3 LYS 53 3HG LYS 53 11.403 7.088 10.931 1321 HD2 LYS 53 2HD LYS 53 9.309 8.139 9.836 1322 HD3 LYS 53 3HD LYS 53 8.858 8.655 11.459 1323 HE2 LYS 53 2HE LYS 53 11.392 9.400 9.990 1324 HE3 LYS 53 3HE LYS 53 9.981 10.431 10.216 1325 HZ1 LYS 53 1HZ LYS 53 10.371 10.409 12.585 1326 HZ2 LYS 53 2HZ LYS 53 11.763 10.942 11.789 1327 HZ3 LYS 53 3HZ LYS 53 11.686 9.368 12.403 1328 H VAL 54 H VAL 54 10.074 3.325 9.812 1329 HA VAL 54 HA VAL 54 7.454 2.310 9.973 1330 HB VAL 54 HB VAL 54 9.741 1.274 8.219 1331 HG11 VAL 54 1HG1 VAL 54 7.844 -0.293 8.295 1332 HG12 VAL 54 2HG1 VAL 54 7.949 0.472 6.709 1333 HG13 VAL 54 3HG1 VAL 54 6.730 1.007 7.869 1334 HG21 VAL 54 1HG2 VAL 54 7.670 3.423 7.609 1335 HG22 VAL 54 2HG2 VAL 54 8.869 2.800 6.473 1336 HG23 VAL 54 3HG2 VAL 54 9.387 3.697 7.899 1337 H LEU 55 H LEU 55 10.611 0.793 10.649 1338 HA LEU 55 HA LEU 55 9.539 -1.788 11.333 1339 HB2 LEU 55 2HB LEU 55 12.301 -0.589 11.758 1340 HB3 LEU 55 3HB LEU 55 11.892 -2.247 12.162 1341 HG LEU 55 HG LEU 55 11.933 -1.023 9.379 1342 HD11 LEU 55 1HD1 LEU 55 13.763 -2.596 8.959 1343 HD12 LEU 55 2HD1 LEU 55 13.661 -3.185 10.622 1344 HD13 LEU 55 3HD1 LEU 55 14.147 -1.518 10.301 1345 HD21 LEU 55 1HD2 LEU 55 11.113 -3.846 10.167 1346 HD22 LEU 55 2HD2 LEU 55 11.356 -3.267 8.516 1347 HD23 LEU 55 3HD2 LEU 55 10.058 -2.596 9.499 1348 H ASP 56 H ASP 56 10.282 1.120 13.180 1349 HA ASP 56 HA ASP 56 10.230 -0.124 15.776 1350 HB2 ASP 56 2HB ASP 56 11.387 2.045 15.365 1351 HB3 ASP 56 3HB ASP 56 9.835 2.818 15.060 1352 H TYR 57 H TYR 57 7.846 1.493 13.722 1353 HA TYR 57 HA TYR 57 5.652 1.334 15.556 1354 HB2 TYR 57 2HB TYR 57 5.635 2.897 13.606 1355 HB3 TYR 57 3HB TYR 57 5.563 1.526 12.500 1356 HD1 TYR 57 HD1 TYR 57 3.682 3.362 15.152 1357 HD2 TYR 57 HD2 TYR 57 3.427 0.424 12.053 1358 HE1 TYR 57 HE1 TYR 57 1.237 3.336 15.370 1359 HE2 TYR 57 HE2 TYR 57 0.980 0.404 12.265 1360 HH TYR 57 HH TYR 57 -0.740 2.744 14.019 1361 H CYS 58 H CYS 58 6.928 -0.763 12.982 1362 HA CYS 58 HA CYS 58 4.971 -2.779 13.030 1363 HB2 CYS 58 2HB CYS 58 7.948 -2.955 12.401 1364 HB3 CYS 58 3HB CYS 58 6.807 -4.277 12.132 1365 HG CYS 58 HG CYS 58 7.599 -1.921 10.119 1366 H ARG 59 H ARG 59 7.894 -2.297 14.983 1367 HA ARG 59 HA ARG 59 7.807 -4.653 16.530 1368 HB2 ARG 59 2HB ARG 59 9.832 -3.306 16.503 1369 HB3 ARG 59 3HB ARG 59 8.987 -1.904 17.152 1370 HG2 ARG 59 2HG ARG 59 8.799 -2.899 19.320 1371 HG3 ARG 59 3HG ARG 59 9.266 -4.490 18.714 1372 HD2 ARG 59 2HD ARG 59 11.083 -3.422 19.988 1373 HD3 ARG 59 3HD ARG 59 11.545 -3.704 18.311 1374 HE ARG 59 HE ARG 59 10.541 -1.057 18.635 1375 HH11 ARG 59 1HH1 ARG 59 13.411 -3.015 19.308 1376 HH12 ARG 59 2HH1 ARG 59 14.484 -1.651 19.284 1377 HH21 ARG 59 1HH2 ARG 59 12.001 0.711 18.638 1378 HH22 ARG 59 2HH2 ARG 59 13.681 0.447 18.905 1379 H HIS 60 H HIS 60 6.465 -1.414 17.128 1380 HA HIS 60 HA HIS 60 5.188 -1.841 19.588 1381 HB2 HIS 60 2HB HIS 60 5.501 0.407 18.698 1382 HB3 HIS 60 3HB HIS 60 4.510 0.044 17.289 1383 HD1 HIS 60 HD1 HIS 60 4.184 0.580 21.033 1384 HD2 HIS 60 HD2 HIS 60 1.826 0.577 17.610 1385 HE1 HIS 60 HE1 HIS 60 1.938 1.443 21.755 1386 HE2 HIS 60 HE2 HIS 60 0.654 1.696 19.607 1387 H HIS 61 H HIS 61 4.023 -2.348 16.291 1388 HA HIS 61 HA HIS 61 1.324 -3.042 17.010 1389 HB2 HIS 61 2HB HIS 61 1.996 -1.997 14.814 1390 HB3 HIS 61 3HB HIS 61 2.793 -3.502 14.370 1391 HD1 HIS 61 HD1 HIS 61 1.243 -5.527 13.757 1392 HD2 HIS 61 HD2 HIS 61 -0.791 -2.012 14.636 1393 HE1 HIS 61 HE1 HIS 61 -1.104 -5.890 12.959 1394 HE2 HIS 61 HE2 HIS 61 -2.351 -3.832 13.683 1395 H HIS 62 H HIS 62 4.326 -4.779 16.681 1396 HA HIS 62 HA HIS 62 3.138 -7.419 16.587 1397 HB2 HIS 62 2HB HIS 62 5.386 -6.978 15.618 1398 HB3 HIS 62 3HB HIS 62 6.006 -6.568 17.213 1399 HD1 HIS 62 HD1 HIS 62 4.738 -9.494 15.199 1400 HD2 HIS 62 HD2 HIS 62 6.850 -8.770 18.700 1401 HE1 HIS 62 HE1 HIS 62 5.553 -11.733 15.976 1402 HE2 HIS 62 HE2 HIS 62 6.877 -11.249 18.057 1403 H GLN 63 H GLN 63 4.394 -5.214 19.013 1404 HA GLN 63 HA GLN 63 4.298 -6.954 21.278 1405 HB2 GLN 63 2HB GLN 63 4.387 -3.919 20.990 1406 HB3 GLN 63 3HB GLN 63 4.377 -4.720 22.558 1407 HG2 GLN 63 2HG GLN 63 6.496 -5.803 22.094 1408 HG3 GLN 63 3HG GLN 63 6.494 -5.181 20.444 1409 HE21 GLN 63 1HE2 GLN 63 8.115 -4.777 23.117 1410 HE22 GLN 63 2HE2 GLN 63 8.413 -3.074 23.099 1411 H HIS 64 H HIS 64 2.049 -4.695 19.790 1412 HA HIS 64 HA HIS 64 -0.192 -5.826 21.323 1413 HB2 HIS 64 2HB HIS 64 0.324 -2.834 20.928 1414 HB3 HIS 64 3HB HIS 64 -1.213 -3.501 21.464 1415 HD1 HIS 64 HD1 HIS 64 -1.326 -4.450 23.878 1416 HD2 HIS 64 HD2 HIS 64 2.332 -2.746 22.902 1417 HE1 HIS 64 HE1 HIS 64 -0.101 -4.191 26.052 1418 HE2 HIS 64 HE2 HIS 64 2.074 -3.078 25.453 1419 HA PRO 65 HA PRO 65 -1.234 -5.841 16.783 1420 HB2 PRO 65 2HB PRO 65 -2.454 -8.481 17.452 1421 HB3 PRO 65 3HB PRO 65 -1.265 -8.079 16.197 1422 HG2 PRO 65 2HG PRO 65 -0.568 -9.508 18.372 1423 HG3 PRO 65 3HG PRO 65 0.556 -8.350 17.619 1424 HD2 PRO 65 2HD PRO 65 -1.164 -7.980 20.076 1425 HD3 PRO 65 3HD PRO 65 0.545 -7.549 19.815 1426 H GLY 66 H GLY 66 -3.514 -7.713 18.810 1427 HA2 GLY 66 2HA GLY 66 -5.756 -7.550 19.197 1428 HA3 GLY 66 3HA GLY 66 -5.371 -5.896 19.649 1429 H GLY 67 H GLY 67 -7.008 -4.725 18.796 1430 HA2 GLY 67 2HA GLY 67 -7.737 -4.963 15.945 1431 HA3 GLY 67 3HA GLY 67 -8.531 -3.975 17.169 1432 H SER 68 H SER 68 -5.314 -3.555 17.691 1433 HA SER 68 HA SER 68 -3.803 -1.907 17.417 1434 HB2 SER 68 2HB SER 68 -5.077 -1.444 14.675 1435 HB3 SER 68 3HB SER 68 -3.458 -0.948 15.176 1436 HG SER 68 HG SER 68 -3.931 -3.623 15.568 1437 H GLY 69 H GLY 69 -4.361 0.699 15.928 1438 HA2 GLY 69 2HA GLY 69 -5.188 2.220 18.146 1439 HA3 GLY 69 3HA GLY 69 -5.028 2.813 16.498 1440 H LEU 70 H LEU 70 -7.090 0.867 15.494 1441 HA LEU 70 HA LEU 70 -9.250 0.882 14.855 1442 HB2 LEU 70 2HB LEU 70 -9.690 1.338 17.831 1443 HB3 LEU 70 3HB LEU 70 -11.004 1.007 16.714 1444 HG LEU 70 HG LEU 70 -8.685 -0.904 17.233 1445 HD11 LEU 70 1HD1 LEU 70 -10.057 -0.641 19.247 1446 HD12 LEU 70 2HD1 LEU 70 -10.266 -2.241 18.541 1447 HD13 LEU 70 3HD1 LEU 70 -11.516 -1.011 18.324 1448 HD21 LEU 70 1HD2 LEU 70 -11.286 -1.311 15.697 1449 HD22 LEU 70 2HD2 LEU 70 -10.096 -2.567 16.049 1450 HD23 LEU 70 3HD2 LEU 70 -9.666 -1.216 15.005 1451 H ASP 71 H ASP 71 -10.000 3.237 17.322 1452 HA ASP 71 HA ASP 71 -9.917 5.543 15.502 1453 HB2 ASP 71 2HB ASP 71 -12.253 4.608 15.447 1454 HB3 ASP 71 3HB ASP 71 -12.366 4.831 17.189 1455 H ASP 72 H ASP 72 -9.483 4.126 18.580 1456 HA ASP 72 HA ASP 72 -9.500 6.265 20.381 1457 HB2 ASP 72 2HB ASP 72 -9.439 4.012 21.221 1458 HB3 ASP 72 3HB ASP 72 -8.009 3.604 20.281 1459 H ILE 73 H ILE 73 -6.787 4.767 18.658 1460 HA ILE 73 HA ILE 73 -4.722 5.353 18.062 1461 HB ILE 73 HB ILE 73 -5.739 8.225 18.028 1462 HG12 ILE 73 2HG1 ILE 73 -7.093 6.758 16.553 1463 HG13 ILE 73 3HG1 ILE 73 -6.137 7.882 15.597 1464 HG21 ILE 73 1HG2 ILE 73 -3.284 8.151 18.040 1465 HG22 ILE 73 2HG2 ILE 73 -3.869 8.676 16.462 1466 HG23 ILE 73 3HG2 ILE 73 -3.289 7.024 16.679 1467 HD11 ILE 73 1HD1 ILE 73 -5.521 4.955 16.050 1468 HD12 ILE 73 2HD1 ILE 73 -4.539 6.074 15.100 1469 HD13 ILE 73 3HD1 ILE 73 -6.177 5.683 14.584 1470 HA PRO 74 HA PRO 74 -3.227 6.039 22.387 1471 HB2 PRO 74 2HB PRO 74 -0.879 4.603 21.146 1472 HB3 PRO 74 3HB PRO 74 -1.703 4.289 22.690 1473 HG2 PRO 74 2HG PRO 74 -2.094 2.662 20.639 1474 HG3 PRO 74 3HG PRO 74 -3.471 3.134 21.667 1475 HD2 PRO 74 2HD PRO 74 -2.697 4.186 18.948 1476 HD3 PRO 74 3HD PRO 74 -4.307 3.756 19.574 1477 HA PRO 75 HA PRO 75 -0.969 9.838 21.886 1478 HB2 PRO 75 2HB PRO 75 1.027 9.524 23.890 1479 HB3 PRO 75 3HB PRO 75 -0.614 10.144 24.139 1480 HG2 PRO 75 2HG PRO 75 0.422 7.369 24.572 1481 HG3 PRO 75 3HG PRO 75 -0.723 8.315 25.552 1482 HD2 PRO 75 2HD PRO 75 -1.624 6.395 23.949 1483 HD3 PRO 75 3HD PRO 75 -2.510 7.932 24.074 1484 H TYR 76 H TYR 76 1.303 7.091 22.381 1485 HA TYR 76 HA TYR 76 3.531 8.092 21.053 1486 HB2 TYR 76 2HB TYR 76 3.892 6.075 22.267 1487 HB3 TYR 76 3HB TYR 76 2.555 5.244 21.482 1488 HD1 TYR 76 HD1 TYR 76 5.944 6.713 20.729 1489 HD2 TYR 76 HD2 TYR 76 3.030 3.763 19.673 1490 HE1 TYR 76 HE1 TYR 76 7.496 5.753 19.078 1491 HE2 TYR 76 HE2 TYR 76 4.587 2.811 18.034 1492 HH TYR 76 HH TYR 76 7.853 3.556 17.904 1493 H ASP 77 H ASP 77 0.855 6.162 19.717 1494 HA ASP 77 HA ASP 77 1.908 5.792 17.134 1495 HB2 ASP 77 2HB ASP 77 -0.993 5.721 18.078 1496 HB3 ASP 77 3HB ASP 77 -0.443 5.143 16.511 1497 H ARG 78 H ARG 78 -0.051 8.385 18.511 1498 HA ARG 78 HA ARG 78 -0.682 9.641 16.001 1499 HB2 ARG 78 2HB ARG 78 -2.050 9.908 18.129 1500 HB3 ARG 78 3HB ARG 78 -0.761 10.926 18.771 1501 HG2 ARG 78 2HG ARG 78 -1.098 12.521 16.910 1502 HG3 ARG 78 3HG ARG 78 -2.377 11.490 16.261 1503 HD2 ARG 78 2HD ARG 78 -3.412 13.301 17.451 1504 HD3 ARG 78 3HD ARG 78 -3.648 11.837 18.412 1505 HE ARG 78 HE ARG 78 -1.316 13.091 19.318 1506 HH11 ARG 78 1HH1 ARG 78 -4.788 13.757 19.279 1507 HH12 ARG 78 2HH1 ARG 78 -4.727 14.737 20.711 1508 HH21 ARG 78 1HH2 ARG 78 -1.262 14.444 21.154 1509 HH22 ARG 78 2HH2 ARG 78 -2.737 15.127 21.766 1510 H ASP 79 H ASP 79 1.547 10.501 18.678 1511 HA ASP 79 HA ASP 79 2.816 12.704 17.484 1512 HB2 ASP 79 2HB ASP 79 3.744 10.770 19.640 1513 HB3 ASP 79 3HB ASP 79 4.748 12.120 19.125 1514 H PHE 80 H PHE 80 3.435 9.295 17.184 1515 HA PHE 80 HA PHE 80 5.932 9.273 15.900 1516 HB2 PHE 80 2HB PHE 80 5.076 7.189 16.779 1517 HB3 PHE 80 3HB PHE 80 3.562 7.341 15.893 1518 HD1 PHE 80 HD1 PHE 80 7.174 6.565 15.569 1519 HD2 PHE 80 HD2 PHE 80 3.371 6.591 13.626 1520 HE1 PHE 80 HE1 PHE 80 8.098 5.252 13.716 1521 HE2 PHE 80 HE2 PHE 80 4.305 5.295 11.775 1522 HZ PHE 80 HZ PHE 80 6.666 4.623 11.814 1523 H CYS 81 H CYS 81 2.620 9.305 14.581 1524 HA CYS 81 HA CYS 81 3.488 9.326 11.834 1525 HB2 CYS 81 2HB CYS 81 0.717 9.675 13.051 1526 HB3 CYS 81 3HB CYS 81 1.051 9.467 11.331 1527 HG CYS 81 HG CYS 81 1.712 7.149 13.764 1528 H LYS 82 H LYS 82 3.004 11.778 14.212 1529 HA LYS 82 HA LYS 82 2.568 13.965 12.382 1530 HB2 LYS 82 2HB LYS 82 3.666 14.038 15.221 1531 HB3 LYS 82 3HB LYS 82 3.148 15.442 14.297 1532 HG2 LYS 82 2HG LYS 82 1.419 13.193 15.341 1533 HG3 LYS 82 3HG LYS 82 1.442 14.858 15.905 1534 HD2 LYS 82 2HD LYS 82 0.538 13.950 13.149 1535 HD3 LYS 82 3HD LYS 82 -0.526 14.348 14.493 1536 HE2 LYS 82 2HE LYS 82 0.310 16.669 14.477 1537 HE3 LYS 82 3HE LYS 82 1.378 16.275 13.124 1538 HZ1 LYS 82 1HZ LYS 82 -0.649 17.332 12.357 1539 HZ2 LYS 82 2HZ LYS 82 -1.594 16.136 13.091 1540 HZ3 LYS 82 3HZ LYS 82 -0.580 15.739 11.796 1541 H VAL 83 H VAL 83 4.095 13.541 10.778 1542 HA VAL 83 HA VAL 83 6.877 14.375 11.365 1543 HB VAL 83 HB VAL 83 7.645 12.895 9.502 1544 HG11 VAL 83 1HG1 VAL 83 7.503 10.730 10.672 1545 HG12 VAL 83 2HG1 VAL 83 6.198 11.352 11.685 1546 HG13 VAL 83 3HG1 VAL 83 7.815 12.049 11.801 1547 HG21 VAL 83 1HG2 VAL 83 6.173 11.126 8.581 1548 HG22 VAL 83 2HG2 VAL 83 5.569 12.736 8.195 1549 HG23 VAL 83 3HG2 VAL 83 4.806 11.796 9.478 1550 H ASP 84 H ASP 84 7.950 15.140 9.236 1551 HA ASP 84 HA ASP 84 6.460 17.428 8.378 1552 HB2 ASP 84 2HB ASP 84 9.029 17.179 8.810 1553 HB3 ASP 84 3HB ASP 84 9.109 16.512 7.186 1554 H GLN 85 H GLN 85 6.475 18.032 5.925 1555 HA GLN 85 HA GLN 85 4.456 16.451 4.814 1556 HB2 GLN 85 2HB GLN 85 4.584 18.874 4.411 1557 HB3 GLN 85 3HB GLN 85 6.051 18.667 3.464 1558 HG2 GLN 85 2HG GLN 85 4.084 19.043 2.024 1559 HG3 GLN 85 3HG GLN 85 4.797 17.453 1.739 1560 HE21 GLN 85 1HE2 GLN 85 2.814 16.795 0.816 1561 HE22 GLN 85 2HE2 GLN 85 1.447 16.399 1.790 1562 HA PRO 86 HA PRO 86 7.523 14.715 1.408 1563 HB2 PRO 86 2HB PRO 86 10.248 15.068 2.612 1564 HB3 PRO 86 3HB PRO 86 9.701 15.358 0.947 1565 HG2 PRO 86 2HG PRO 86 10.274 17.402 2.565 1566 HG3 PRO 86 3HG PRO 86 8.924 17.492 1.407 1567 HD2 PRO 86 2HD PRO 86 8.827 16.944 4.377 1568 HD3 PRO 86 3HD PRO 86 7.803 18.017 3.391 1569 H THR 87 H THR 87 8.393 14.564 4.840 1570 HA THR 87 HA THR 87 9.415 11.926 4.943 1571 HB THR 87 HB THR 87 8.066 13.401 7.254 1572 HG1 THR 87 HG1 THR 87 10.612 13.750 6.069 1573 HG21 THR 87 1HG2 THR 87 10.348 11.380 7.233 1574 HG22 THR 87 2HG2 THR 87 8.692 11.048 7.750 1575 HG23 THR 87 3HG2 THR 87 9.689 12.184 8.659 1576 H LEU 88 H LEU 88 6.141 13.241 5.239 1577 HA LEU 88 HA LEU 88 4.647 11.011 6.015 1578 HB2 LEU 88 2HB LEU 88 3.970 13.302 4.122 1579 HB3 LEU 88 3HB LEU 88 2.775 12.110 4.601 1580 HG LEU 88 HG LEU 88 4.234 13.899 6.592 1581 HD11 LEU 88 1HD1 LEU 88 2.200 15.269 6.686 1582 HD12 LEU 88 2HD1 LEU 88 1.480 14.318 5.384 1583 HD13 LEU 88 3HD1 LEU 88 2.914 15.299 5.074 1584 HD21 LEU 88 1HD2 LEU 88 2.450 13.225 8.143 1585 HD22 LEU 88 2HD2 LEU 88 3.343 11.822 7.561 1586 HD23 LEU 88 3HD2 LEU 88 1.743 12.182 6.904 1587 H PHE 89 H PHE 89 5.628 12.079 2.771 1588 HA PHE 89 HA PHE 89 4.494 9.887 1.339 1589 HB2 PHE 89 2HB PHE 89 6.641 11.876 0.462 1590 HB3 PHE 89 3HB PHE 89 5.801 10.755 -0.609 1591 HD1 PHE 89 HD1 PHE 89 3.056 10.874 -0.167 1592 HD2 PHE 89 HD2 PHE 89 5.854 14.078 0.286 1593 HE1 PHE 89 HE1 PHE 89 1.250 12.509 -0.507 1594 HE2 PHE 89 HE2 PHE 89 4.041 15.700 -0.058 1595 HZ PHE 89 HZ PHE 89 1.741 14.919 -0.448 1596 H GLU 90 H GLU 90 7.699 10.509 2.688 1597 HA GLU 90 HA GLU 90 9.133 8.376 1.547 1598 HB2 GLU 90 2HB GLU 90 9.445 9.773 4.238 1599 HB3 GLU 90 3HB GLU 90 10.581 8.573 3.643 1600 HG2 GLU 90 2HG GLU 90 9.955 11.166 2.223 1601 HG3 GLU 90 3HG GLU 90 11.316 10.928 3.315 1602 H LEU 91 H LEU 91 7.111 8.546 4.459 1603 HA LEU 91 HA LEU 91 7.587 5.862 5.338 1604 HB2 LEU 91 2HB LEU 91 5.479 7.919 6.102 1605 HB3 LEU 91 3HB LEU 91 5.583 6.344 6.862 1606 HG LEU 91 HG LEU 91 7.726 8.504 6.971 1607 HD11 LEU 91 1HD1 LEU 91 5.839 7.516 9.146 1608 HD12 LEU 91 2HD1 LEU 91 5.754 9.076 8.324 1609 HD13 LEU 91 3HD1 LEU 91 7.133 8.704 9.352 1610 HD21 LEU 91 1HD2 LEU 91 8.686 6.232 6.984 1611 HD22 LEU 91 2HD2 LEU 91 7.662 5.806 8.357 1612 HD23 LEU 91 3HD2 LEU 91 8.902 7.048 8.528 1613 H ILE 92 H ILE 92 5.111 7.395 3.299 1614 HA ILE 92 HA ILE 92 3.374 5.155 3.005 1615 HB ILE 92 HB ILE 92 3.850 7.536 1.134 1616 HG12 ILE 92 2HG1 ILE 92 1.568 7.012 3.102 1617 HG13 ILE 92 3HG1 ILE 92 2.918 8.099 3.393 1618 HG21 ILE 92 1HG2 ILE 92 2.916 5.687 -0.189 1619 HG22 ILE 92 2HG2 ILE 92 1.705 6.949 0.026 1620 HG23 ILE 92 3HG2 ILE 92 1.616 5.473 0.986 1621 HD11 ILE 92 1HD1 ILE 92 0.932 9.327 2.772 1622 HD12 ILE 92 2HD1 ILE 92 0.813 8.431 1.257 1623 HD13 ILE 92 3HD1 ILE 92 2.179 9.515 1.541 1624 H LEU 93 H LEU 93 6.209 6.292 1.169 1625 HA LEU 93 HA LEU 93 6.130 4.323 -0.903 1626 HB2 LEU 93 2HB LEU 93 8.387 6.140 0.049 1627 HB3 LEU 93 3HB LEU 93 8.499 5.123 -1.377 1628 HG LEU 93 HG LEU 93 6.565 7.449 -1.009 1629 HD11 LEU 93 1HD1 LEU 93 8.867 8.218 -1.302 1630 HD12 LEU 93 2HD1 LEU 93 7.898 8.602 -2.721 1631 HD13 LEU 93 3HD1 LEU 93 9.033 7.249 -2.770 1632 HD21 LEU 93 1HD2 LEU 93 5.550 5.710 -2.395 1633 HD22 LEU 93 2HD2 LEU 93 6.968 5.688 -3.448 1634 HD23 LEU 93 3HD2 LEU 93 5.949 7.128 -3.362 1635 H ALA 94 H ALA 94 7.859 4.575 2.192 1636 HA ALA 94 HA ALA 94 9.519 2.263 1.920 1637 HB1 ALA 94 1HB ALA 94 8.598 3.709 4.436 1638 HB2 ALA 94 2HB ALA 94 10.030 4.100 3.482 1639 HB3 ALA 94 3HB ALA 94 9.937 2.558 4.330 1640 H ALA 95 H ALA 95 6.354 2.842 3.399 1641 HA ALA 95 HA ALA 95 5.970 0.260 4.524 1642 HB1 ALA 95 1HB ALA 95 3.654 0.913 4.801 1643 HB2 ALA 95 2HB ALA 95 3.858 2.253 3.664 1644 HB3 ALA 95 3HB ALA 95 4.703 2.269 5.210 1645 H ASN 96 H ASN 96 5.038 1.724 1.396 1646 HA ASN 96 HA ASN 96 3.685 -0.574 0.345 1647 HB2 ASN 96 2HB ASN 96 3.294 1.731 -0.535 1648 HB3 ASN 96 3HB ASN 96 4.951 1.797 -1.140 1649 HD21 ASN 96 1HD2 ASN 96 4.142 2.165 -3.259 1650 HD22 ASN 96 2HD2 ASN 96 3.456 0.895 -4.206 1651 H TYR 97 H TYR 97 7.008 0.512 0.384 1652 HA TYR 97 HA TYR 97 8.172 -1.171 -1.556 1653 HB2 TYR 97 2HB TYR 97 9.354 0.788 -0.694 1654 HB3 TYR 97 3HB TYR 97 9.352 0.136 0.937 1655 HD1 TYR 97 HD1 TYR 97 11.385 -0.776 1.687 1656 HD2 TYR 97 HD2 TYR 97 10.557 -0.851 -2.506 1657 HE1 TYR 97 HE1 TYR 97 13.593 -1.758 1.266 1658 HE2 TYR 97 HE2 TYR 97 12.771 -1.836 -2.919 1659 HH TYR 97 HH TYR 97 14.691 -3.145 -0.481 1660 H LEU 98 H LEU 98 7.691 -1.634 1.957 1661 HA LEU 98 HA LEU 98 8.657 -4.412 1.775 1662 HB2 LEU 98 2HB LEU 98 7.998 -2.720 4.212 1663 HB3 LEU 98 3HB LEU 98 8.611 -4.366 4.267 1664 HG LEU 98 HG LEU 98 10.104 -1.921 3.243 1665 HD11 LEU 98 1HD1 LEU 98 11.636 -2.342 5.125 1666 HD12 LEU 98 2HD1 LEU 98 10.610 -3.672 5.672 1667 HD13 LEU 98 3HD1 LEU 98 9.995 -2.016 5.681 1668 HD21 LEU 98 1HD2 LEU 98 11.013 -4.818 3.270 1669 HD22 LEU 98 2HD2 LEU 98 12.030 -3.427 2.885 1670 HD23 LEU 98 3HD2 LEU 98 10.670 -3.839 1.843 1671 H ASP 99 H ASP 99 5.809 -2.859 1.406 1672 HA ASP 99 HA ASP 99 3.611 -3.161 1.719 1673 HB2 ASP 99 2HB ASP 99 4.170 -5.042 0.128 1674 HB3 ASP 99 3HB ASP 99 4.207 -6.135 1.506 1675 H ILE 100 H ILE 100 4.724 -2.606 4.024 1676 HA ILE 100 HA ILE 100 3.575 -4.251 6.154 1677 HB ILE 100 HB ILE 100 4.975 -1.537 6.320 1678 HG12 ILE 100 2HG1 ILE 100 6.014 -4.357 6.834 1679 HG13 ILE 100 3HG1 ILE 100 6.445 -3.325 5.481 1680 HG21 ILE 100 1HG2 ILE 100 3.425 -1.919 8.223 1681 HG22 ILE 100 2HG2 ILE 100 5.104 -1.944 8.755 1682 HG23 ILE 100 3HG2 ILE 100 4.220 -3.459 8.566 1683 HD11 ILE 100 1HD1 ILE 100 8.199 -3.439 7.139 1684 HD12 ILE 100 2HD1 ILE 100 7.114 -2.777 8.360 1685 HD13 ILE 100 3HD1 ILE 100 7.578 -1.801 6.967 1686 H LYS 101 H LYS 101 1.465 -4.206 5.713 1687 HA LYS 101 HA LYS 101 -0.137 -2.052 4.922 1688 HB2 LYS 101 2HB LYS 101 -1.086 -4.537 6.417 1689 HB3 LYS 101 3HB LYS 101 -2.041 -3.519 5.341 1690 HG2 LYS 101 2HG LYS 101 -0.569 -4.176 3.446 1691 HG3 LYS 101 3HG LYS 101 0.322 -5.239 4.538 1692 HD2 LYS 101 2HD LYS 101 -1.779 -6.541 4.941 1693 HD3 LYS 101 3HD LYS 101 -2.620 -5.502 3.785 1694 HE2 LYS 101 2HE LYS 101 -0.318 -7.392 3.195 1695 HE3 LYS 101 3HE LYS 101 -1.996 -7.549 2.661 1696 HZ1 LYS 101 1HZ LYS 101 -0.726 -6.681 0.872 1697 HZ2 LYS 101 2HZ LYS 101 -0.038 -5.481 1.835 1698 HZ3 LYS 101 3HZ LYS 101 -1.683 -5.417 1.457 1699 HA PRO 102 HA PRO 102 -1.382 -1.628 9.807 1700 HB2 PRO 102 2HB PRO 102 1.003 -1.890 11.344 1701 HB3 PRO 102 3HB PRO 102 -0.344 -3.038 11.300 1702 HG2 PRO 102 2HG PRO 102 2.238 -3.120 9.790 1703 HG3 PRO 102 3HG PRO 102 1.324 -4.448 10.544 1704 HD2 PRO 102 2HD PRO 102 1.246 -4.101 7.904 1705 HD3 PRO 102 3HD PRO 102 -0.236 -4.536 8.786 1706 H LEU 103 H LEU 103 1.900 -0.796 8.586 1707 HA LEU 103 HA LEU 103 1.840 1.834 9.827 1708 HB2 LEU 103 2HB LEU 103 3.944 0.465 9.575 1709 HB3 LEU 103 3HB LEU 103 3.873 0.716 7.844 1710 HG LEU 103 HG LEU 103 5.502 2.184 9.289 1711 HD11 LEU 103 1HD1 LEU 103 5.286 4.159 7.838 1712 HD12 LEU 103 2HD1 LEU 103 3.740 3.549 7.241 1713 HD13 LEU 103 3HD1 LEU 103 5.223 2.645 6.938 1714 HD21 LEU 103 1HD2 LEU 103 4.585 4.247 10.208 1715 HD22 LEU 103 2HD2 LEU 103 3.871 2.846 11.001 1716 HD23 LEU 103 3HD2 LEU 103 2.946 3.737 9.790 1717 H LEU 104 H LEU 104 1.479 0.448 6.592 1718 HA LEU 104 HA LEU 104 1.576 2.769 5.028 1719 HB2 LEU 104 2HB LEU 104 1.730 0.467 4.116 1720 HB3 LEU 104 3HB LEU 104 0.048 0.181 4.522 1721 HG LEU 104 HG LEU 104 -0.656 1.873 2.842 1722 HD11 LEU 104 1HD1 LEU 104 0.950 2.853 1.263 1723 HD12 LEU 104 2HD1 LEU 104 2.295 2.151 2.163 1724 HD13 LEU 104 3HD1 LEU 104 1.275 3.384 2.912 1725 HD21 LEU 104 1HD2 LEU 104 -0.472 -0.488 2.183 1726 HD22 LEU 104 2HD2 LEU 104 1.207 -0.237 1.695 1727 HD23 LEU 104 3HD2 LEU 104 -0.098 0.583 0.836 1728 H ASP 105 H ASP 105 -1.176 1.063 6.460 1729 HA ASP 105 HA ASP 105 -3.272 2.625 5.418 1730 HB2 ASP 105 2HB ASP 105 -3.593 0.356 6.414 1731 HB3 ASP 105 3HB ASP 105 -3.214 0.998 8.013 1732 H VAL 106 H VAL 106 -1.621 2.736 8.583 1733 HA VAL 106 HA VAL 106 -3.120 4.847 9.690 1734 HB VAL 106 HB VAL 106 -0.340 3.816 10.413 1735 HG11 VAL 106 1HG1 VAL 106 -0.607 4.932 12.603 1736 HG12 VAL 106 2HG1 VAL 106 -2.104 5.685 12.051 1737 HG13 VAL 106 3HG1 VAL 106 -0.571 6.109 11.290 1738 HG21 VAL 106 1HG2 VAL 106 -2.150 2.158 10.623 1739 HG22 VAL 106 2HG2 VAL 106 -3.066 3.266 11.650 1740 HG23 VAL 106 3HG2 VAL 106 -1.526 2.609 12.211 1741 H THR 107 H THR 107 -0.034 4.910 7.863 1742 HA THR 107 HA THR 107 0.445 7.717 8.194 1743 HB THR 107 HB THR 107 1.547 5.889 6.000 1744 HG1 THR 107 HG1 THR 107 1.920 5.290 8.314 1745 HG21 THR 107 1HG2 THR 107 2.643 8.489 7.153 1746 HG22 THR 107 2HG2 THR 107 1.937 8.302 5.546 1747 HG23 THR 107 3HG2 THR 107 3.443 7.478 5.945 1748 H CYS 108 H CYS 108 -1.213 5.788 5.725 1749 HA CYS 108 HA CYS 108 -1.834 7.924 3.927 1750 HB2 CYS 108 2HB CYS 108 -3.175 5.217 4.304 1751 HB3 CYS 108 3HB CYS 108 -3.520 6.326 2.976 1752 HG CYS 108 HG CYS 108 -0.363 5.162 3.517 1753 H LYS 109 H LYS 109 -3.341 6.659 6.842 1754 HA LYS 109 HA LYS 109 -5.737 8.253 6.652 1755 HB2 LYS 109 2HB LYS 109 -4.594 6.340 8.663 1756 HB3 LYS 109 3HB LYS 109 -5.632 7.599 9.324 1757 HG2 LYS 109 2HG LYS 109 -6.832 5.460 8.812 1758 HG3 LYS 109 3HG LYS 109 -7.509 6.868 7.987 1759 HD2 LYS 109 2HD LYS 109 -6.358 6.196 5.899 1760 HD3 LYS 109 3HD LYS 109 -5.645 4.813 6.730 1761 HE2 LYS 109 2HE LYS 109 -8.617 5.256 6.312 1762 HE3 LYS 109 3HE LYS 109 -7.602 4.179 5.351 1763 HZ1 LYS 109 1HZ LYS 109 -7.121 2.919 7.372 1764 HZ2 LYS 109 2HZ LYS 109 -8.774 2.936 7.022 1765 HZ3 LYS 109 3HZ LYS 109 -8.158 3.924 8.249 1766 H THR 110 H THR 110 -2.515 8.699 8.002 1767 HA THR 110 HA THR 110 -3.014 10.980 9.614 1768 HB THR 110 HB THR 110 -0.441 10.087 8.225 1769 HG1 THR 110 HG1 THR 110 -1.696 8.836 10.042 1770 HG21 THR 110 1HG2 THR 110 -0.280 12.463 8.894 1771 HG22 THR 110 2HG2 THR 110 0.746 11.451 9.910 1772 HG23 THR 110 3HG2 THR 110 -0.794 12.044 10.533 1773 H VAL 111 H VAL 111 -1.875 10.661 6.221 1774 HA VAL 111 HA VAL 111 -1.888 13.464 5.670 1775 HB VAL 111 HB VAL 111 -1.702 12.862 3.272 1776 HG11 VAL 111 1HG1 VAL 111 0.122 11.208 5.062 1777 HG12 VAL 111 2HG1 VAL 111 0.338 12.905 4.629 1778 HG13 VAL 111 3HG1 VAL 111 0.460 11.660 3.386 1779 HG21 VAL 111 1HG2 VAL 111 -2.059 9.980 4.175 1780 HG22 VAL 111 2HG2 VAL 111 -1.581 10.493 2.554 1781 HG23 VAL 111 3HG2 VAL 111 -3.177 10.912 3.175 1782 H ALA 112 H ALA 112 -4.343 10.929 5.470 1783 HA ALA 112 HA ALA 112 -6.403 12.492 4.247 1784 HB1 ALA 112 1HB ALA 112 -6.662 10.025 5.993 1785 HB2 ALA 112 2HB ALA 112 -6.469 10.037 4.240 1786 HB3 ALA 112 3HB ALA 112 -7.928 10.710 4.968 1787 H ASN 113 H ASN 113 -5.195 12.242 7.536 1788 HA ASN 113 HA ASN 113 -7.429 13.401 8.878 1789 HB2 ASN 113 2HB ASN 113 -4.571 12.857 9.672 1790 HB3 ASN 113 3HB ASN 113 -5.418 14.085 10.595 1791 HD21 ASN 113 1HD2 ASN 113 -5.052 10.698 10.105 1792 HD22 ASN 113 2HD2 ASN 113 -6.233 10.191 11.257 1793 H MET 114 H MET 114 -4.850 14.758 7.002 1794 HA MET 114 HA MET 114 -5.049 17.454 7.970 1795 HB2 MET 114 2HB MET 114 -3.873 16.377 5.365 1796 HB3 MET 114 3HB MET 114 -3.670 18.020 5.961 1797 HG2 MET 114 2HG MET 114 -2.592 17.015 8.032 1798 HG3 MET 114 3HG MET 114 -2.584 15.477 7.173 1799 HE1 MET 114 1HE MET 114 -0.161 16.260 4.161 1800 HE2 MET 114 2HE MET 114 -1.925 16.304 4.165 1801 HE3 MET 114 3HE MET 114 -1.071 14.996 4.988 1802 H ILE 115 H ILE 115 -6.676 15.581 5.481 1803 HA ILE 115 HA ILE 115 -8.256 17.920 4.592 1804 HB ILE 115 HB ILE 115 -9.066 16.474 2.730 1805 HG12 ILE 115 2HG1 ILE 115 -7.118 14.383 3.809 1806 HG13 ILE 115 3HG1 ILE 115 -8.870 14.270 3.883 1807 HG21 ILE 115 1HG2 ILE 115 -6.041 16.577 2.931 1808 HG22 ILE 115 2HG2 ILE 115 -7.089 17.887 2.385 1809 HG23 ILE 115 3HG2 ILE 115 -6.972 16.403 1.439 1810 HD11 ILE 115 1HD1 ILE 115 -7.219 14.300 1.359 1811 HD12 ILE 115 2HD1 ILE 115 -8.977 14.156 1.454 1812 HD13 ILE 115 3HD1 ILE 115 -7.951 12.886 2.118 1813 H ARG 116 H ARG 116 -8.458 15.660 6.951 1814 HA ARG 116 HA ARG 116 -10.980 14.445 6.763 1815 HB2 ARG 116 2HB ARG 116 -9.202 13.732 8.338 1816 HB3 ARG 116 3HB ARG 116 -9.406 15.212 9.263 1817 HG2 ARG 116 2HG ARG 116 -10.473 13.406 10.450 1818 HG3 ARG 116 3HG ARG 116 -11.736 14.471 9.835 1819 HD2 ARG 116 2HD ARG 116 -12.188 12.914 8.008 1820 HD3 ARG 116 3HD ARG 116 -10.863 11.872 8.533 1821 HE ARG 116 HE ARG 116 -12.430 11.981 10.727 1822 HH11 ARG 116 1HH1 ARG 116 -13.206 11.251 7.372 1823 HH12 ARG 116 2HH1 ARG 116 -14.511 10.184 7.776 1824 HH21 ARG 116 1HH2 ARG 116 -14.122 10.538 11.248 1825 HH22 ARG 116 2HH2 ARG 116 -15.030 9.783 9.976 1826 H GLY 117 H GLY 117 -12.648 15.773 6.230 1827 HA2 GLY 117 2HA GLY 117 -13.561 17.742 8.264 1828 HA3 GLY 117 3HA GLY 117 -13.703 18.038 6.535 Start of MODEL 16 1 H1 SER 2 1H SER 2 -14.938 -13.253 -20.221 2 H2 SER 2 2H SER 2 -14.127 -12.162 -19.219 3 H3 SER 2 3H SER 2 -15.574 -11.709 -19.957 4 HA SER 2 HA SER 2 -16.805 -13.324 -18.703 5 HB2 SER 2 2HB SER 2 -14.113 -13.946 -17.403 6 HB3 SER 2 3HB SER 2 -15.672 -14.606 -16.896 7 HG SER 2 HG SER 2 -15.800 -15.378 -19.168 8 H LEU 3 H LEU 3 -17.976 -12.030 -17.372 9 HA LEU 3 HA LEU 3 -16.570 -9.830 -15.957 10 HB2 LEU 3 2HB LEU 3 -19.385 -9.918 -17.107 11 HB3 LEU 3 3HB LEU 3 -18.683 -8.550 -16.255 12 HG LEU 3 HG LEU 3 -17.559 -9.640 -18.864 13 HD11 LEU 3 1HD1 LEU 3 -19.815 -8.871 -19.275 14 HD12 LEU 3 2HD1 LEU 3 -18.653 -7.755 -19.985 15 HD13 LEU 3 3HD1 LEU 3 -19.479 -7.328 -18.482 16 HD21 LEU 3 1HD2 LEU 3 -15.930 -8.389 -17.556 17 HD22 LEU 3 2HD2 LEU 3 -17.045 -7.028 -17.407 18 HD23 LEU 3 3HD2 LEU 3 -16.398 -7.476 -18.988 19 H VAL 4 H VAL 4 -16.532 -10.145 -13.812 20 HA VAL 4 HA VAL 4 -18.895 -11.225 -12.393 21 HB VAL 4 HB VAL 4 -17.496 -11.186 -10.344 22 HG11 VAL 4 1HG1 VAL 4 -15.964 -13.026 -10.922 23 HG12 VAL 4 2HG1 VAL 4 -16.138 -12.648 -12.639 24 HG13 VAL 4 3HG1 VAL 4 -17.529 -13.224 -11.715 25 HG21 VAL 4 1HG2 VAL 4 -15.063 -10.712 -10.442 26 HG22 VAL 4 2HG2 VAL 4 -16.019 -9.287 -10.854 27 HG23 VAL 4 3HG2 VAL 4 -15.227 -10.213 -12.131 28 H LYS 5 H LYS 5 -19.865 -9.920 -10.713 29 HA LYS 5 HA LYS 5 -19.991 -7.109 -11.577 30 HB2 LYS 5 2HB LYS 5 -21.919 -8.774 -9.902 31 HB3 LYS 5 3HB LYS 5 -22.205 -7.121 -10.445 32 HG2 LYS 5 2HG LYS 5 -22.148 -7.900 -12.801 33 HG3 LYS 5 3HG LYS 5 -21.903 -9.558 -12.245 34 HD2 LYS 5 2HD LYS 5 -24.099 -9.492 -11.095 35 HD3 LYS 5 3HD LYS 5 -24.334 -7.824 -11.629 36 HE2 LYS 5 2HE LYS 5 -24.336 -8.578 -13.979 37 HE3 LYS 5 3HE LYS 5 -24.096 -10.248 -13.450 38 HZ1 LYS 5 1HZ LYS 5 -26.415 -9.834 -13.920 39 HZ2 LYS 5 2HZ LYS 5 -26.451 -8.535 -12.838 40 HZ3 LYS 5 3HZ LYS 5 -26.220 -10.106 -12.264 41 H LEU 6 H LEU 6 -19.367 -5.462 -10.299 42 HA LEU 6 HA LEU 6 -18.921 -5.884 -7.387 43 HB2 LEU 6 2HB LEU 6 -17.371 -4.027 -9.257 44 HB3 LEU 6 3HB LEU 6 -17.151 -4.125 -7.516 45 HG LEU 6 HG LEU 6 -16.522 -6.337 -9.508 46 HD11 LEU 6 1HD1 LEU 6 -14.675 -4.537 -7.910 47 HD12 LEU 6 2HD1 LEU 6 -14.959 -4.476 -9.653 48 HD13 LEU 6 3HD1 LEU 6 -14.182 -5.885 -8.944 49 HD21 LEU 6 1HD2 LEU 6 -16.092 -6.286 -6.499 50 HD22 LEU 6 2HD2 LEU 6 -15.502 -7.529 -7.606 51 HD23 LEU 6 3HD2 LEU 6 -17.234 -7.307 -7.379 52 H GLU 7 H GLU 7 -20.663 -4.940 -6.444 53 HA GLU 7 HA GLU 7 -21.801 -2.459 -7.468 54 HB2 GLU 7 2HB GLU 7 -22.668 -4.552 -5.562 55 HB3 GLU 7 3HB GLU 7 -23.002 -2.935 -4.956 56 HG2 GLU 7 2HG GLU 7 -24.183 -2.415 -7.095 57 HG3 GLU 7 3HG GLU 7 -23.930 -4.078 -7.605 58 H SER 8 H SER 8 -20.948 -0.557 -6.962 59 HA SER 8 HA SER 8 -19.042 -0.112 -4.852 60 HB2 SER 8 2HB SER 8 -19.234 2.291 -5.648 61 HB3 SER 8 3HB SER 8 -18.869 1.138 -6.933 62 HG SER 8 HG SER 8 -20.817 1.392 -7.762 63 H SER 9 H SER 9 -19.493 2.057 -3.499 64 HA SER 9 HA SER 9 -21.528 1.660 -1.608 65 HB2 SER 9 2HB SER 9 -19.473 2.988 -1.170 66 HB3 SER 9 3HB SER 9 -20.047 4.246 -2.264 67 HG SER 9 HG SER 9 -21.811 4.566 -0.851 68 H ASP 10 H ASP 10 -21.655 3.188 -4.712 69 HA ASP 10 HA ASP 10 -24.201 4.571 -4.221 70 HB2 ASP 10 2HB ASP 10 -22.375 4.484 -6.668 71 HB3 ASP 10 3HB ASP 10 -23.841 5.450 -6.550 72 H GLU 11 H GLU 11 -23.546 1.459 -4.652 73 HA GLU 11 HA GLU 11 -24.706 -0.361 -5.297 74 HB2 GLU 11 2HB GLU 11 -26.936 1.629 -5.905 75 HB3 GLU 11 3HB GLU 11 -27.143 -0.122 -5.885 76 HG2 GLU 11 2HG GLU 11 -26.659 -0.211 -3.505 77 HG3 GLU 11 3HG GLU 11 -26.259 1.506 -3.476 78 H LYS 12 H LYS 12 -23.195 1.420 -7.302 79 HA LYS 12 HA LYS 12 -24.419 0.830 -9.872 80 HB2 LYS 12 2HB LYS 12 -21.723 2.062 -9.145 81 HB3 LYS 12 3HB LYS 12 -22.324 1.901 -10.793 82 HG2 LYS 12 2HG LYS 12 -23.623 3.546 -8.595 83 HG3 LYS 12 3HG LYS 12 -22.620 4.183 -9.903 84 HD2 LYS 12 2HD LYS 12 -24.290 3.348 -11.562 85 HD3 LYS 12 3HD LYS 12 -25.296 2.763 -10.232 86 HE2 LYS 12 2HE LYS 12 -25.557 5.075 -9.407 87 HE3 LYS 12 3HE LYS 12 -24.537 5.663 -10.725 88 HZ1 LYS 12 1HZ LYS 12 -26.881 5.936 -11.237 89 HZ2 LYS 12 2HZ LYS 12 -27.155 4.284 -11.048 90 HZ3 LYS 12 3HZ LYS 12 -26.178 4.836 -12.311 91 H VAL 13 H VAL 13 -24.152 -1.010 -10.919 92 HA VAL 13 HA VAL 13 -22.379 -3.092 -9.966 93 HB VAL 13 HB VAL 13 -24.411 -3.121 -12.254 94 HG11 VAL 13 1HG1 VAL 13 -22.727 -4.880 -12.566 95 HG12 VAL 13 2HG1 VAL 13 -24.283 -5.586 -12.129 96 HG13 VAL 13 3HG1 VAL 13 -23.000 -5.461 -10.924 97 HG21 VAL 13 1HG2 VAL 13 -25.465 -2.698 -10.065 98 HG22 VAL 13 2HG2 VAL 13 -24.705 -4.148 -9.406 99 HG23 VAL 13 3HG2 VAL 13 -25.912 -4.287 -10.687 100 H PHE 14 H PHE 14 -20.310 -2.388 -10.522 101 HA PHE 14 HA PHE 14 -19.539 -1.964 -13.292 102 HB2 PHE 14 2HB PHE 14 -17.895 -2.225 -10.732 103 HB3 PHE 14 3HB PHE 14 -17.199 -1.910 -12.321 104 HD1 PHE 14 HD1 PHE 14 -17.770 0.216 -13.532 105 HD2 PHE 14 HD2 PHE 14 -18.886 -0.434 -9.452 106 HE1 PHE 14 HE1 PHE 14 -18.155 2.625 -13.247 107 HE2 PHE 14 HE2 PHE 14 -19.266 1.976 -9.179 108 HZ PHE 14 HZ PHE 14 -18.907 3.506 -11.075 109 H GLU 15 H GLU 15 -20.124 -3.852 -14.327 110 HA GLU 15 HA GLU 15 -19.229 -6.463 -13.552 111 HB2 GLU 15 2HB GLU 15 -20.094 -5.462 -16.298 112 HB3 GLU 15 3HB GLU 15 -19.924 -7.152 -15.822 113 HG2 GLU 15 2HG GLU 15 -21.744 -6.861 -14.173 114 HG3 GLU 15 3HG GLU 15 -21.909 -5.176 -14.654 115 H ILE 16 H ILE 16 -17.073 -6.432 -13.202 116 HA ILE 16 HA ILE 16 -15.197 -5.378 -15.217 117 HB ILE 16 HB ILE 16 -15.020 -4.698 -12.764 118 HG12 ILE 16 2HG1 ILE 16 -12.543 -4.928 -12.629 119 HG13 ILE 16 3HG1 ILE 16 -12.586 -6.137 -13.908 120 HG21 ILE 16 1HG2 ILE 16 -15.603 -6.848 -11.718 121 HG22 ILE 16 2HG2 ILE 16 -14.034 -6.279 -11.142 122 HG23 ILE 16 3HG2 ILE 16 -14.117 -7.569 -12.342 123 HD11 ILE 16 1HD1 ILE 16 -11.867 -3.953 -14.699 124 HD12 ILE 16 2HD1 ILE 16 -13.405 -3.248 -14.203 125 HD13 ILE 16 3HD1 ILE 16 -13.359 -4.460 -15.487 126 H GLU 17 H GLU 17 -13.473 -6.724 -16.004 127 HA GLU 17 HA GLU 17 -14.040 -9.434 -16.508 128 HB2 GLU 17 2HB GLU 17 -11.573 -7.722 -16.841 129 HB3 GLU 17 3HB GLU 17 -11.471 -9.453 -17.134 130 HG2 GLU 17 2HG GLU 17 -13.399 -7.588 -18.554 131 HG3 GLU 17 3HG GLU 17 -11.836 -8.095 -19.193 132 H LYS 18 H LYS 18 -13.275 -11.293 -15.681 133 HA LYS 18 HA LYS 18 -13.045 -11.502 -12.897 134 HB2 LYS 18 2HB LYS 18 -14.054 -13.274 -14.254 135 HB3 LYS 18 3HB LYS 18 -12.542 -13.534 -15.117 136 HG2 LYS 18 2HG LYS 18 -12.919 -15.317 -13.500 137 HG3 LYS 18 3HG LYS 18 -11.491 -14.378 -13.057 138 HD2 LYS 18 2HD LYS 18 -12.876 -13.152 -11.365 139 HD3 LYS 18 3HD LYS 18 -14.250 -14.183 -11.783 140 HE2 LYS 18 2HE LYS 18 -11.606 -15.091 -10.597 141 HE3 LYS 18 3HE LYS 18 -13.164 -15.032 -9.771 142 HZ1 LYS 18 1HZ LYS 18 -12.674 -17.261 -10.464 143 HZ2 LYS 18 2HZ LYS 18 -12.465 -16.784 -12.065 144 HZ3 LYS 18 3HZ LYS 18 -13.992 -16.690 -11.348 145 H GLU 19 H GLU 19 -10.630 -11.656 -15.483 146 HA GLU 19 HA GLU 19 -8.407 -12.515 -13.999 147 HB2 GLU 19 2HB GLU 19 -8.243 -10.601 -16.362 148 HB3 GLU 19 3HB GLU 19 -7.050 -11.790 -15.848 149 HG2 GLU 19 2HG GLU 19 -9.725 -12.314 -17.166 150 HG3 GLU 19 3HG GLU 19 -8.125 -12.595 -17.841 151 H ILE 20 H ILE 20 -9.724 -9.312 -14.587 152 HA ILE 20 HA ILE 20 -7.695 -7.735 -13.361 153 HB ILE 20 HB ILE 20 -10.635 -7.145 -13.927 154 HG12 ILE 20 2HG1 ILE 20 -8.131 -6.374 -15.497 155 HG13 ILE 20 3HG1 ILE 20 -9.288 -7.616 -15.960 156 HG21 ILE 20 1HG2 ILE 20 -8.448 -5.210 -13.120 157 HG22 ILE 20 2HG2 ILE 20 -9.881 -5.632 -12.181 158 HG23 ILE 20 3HG2 ILE 20 -10.047 -4.739 -13.694 159 HD11 ILE 20 1HD1 ILE 20 -9.645 -5.626 -17.251 160 HD12 ILE 20 2HD1 ILE 20 -9.818 -4.650 -15.792 161 HD13 ILE 20 3HD1 ILE 20 -11.025 -5.881 -16.183 162 H ALA 21 H ALA 21 -10.799 -9.043 -12.264 163 HA ALA 21 HA ALA 21 -10.820 -7.943 -9.656 164 HB1 ALA 21 1HB ALA 21 -12.658 -9.525 -9.249 165 HB2 ALA 21 2HB ALA 21 -12.244 -10.396 -10.730 166 HB3 ALA 21 3HB ALA 21 -12.834 -8.732 -10.819 167 H CYS 22 H CYS 22 -9.335 -10.811 -11.013 168 HA CYS 22 HA CYS 22 -8.555 -12.027 -8.533 169 HB2 CYS 22 2HB CYS 22 -7.518 -12.419 -11.361 170 HB3 CYS 22 3HB CYS 22 -7.064 -13.418 -9.981 171 HG CYS 22 HG CYS 22 -10.358 -13.123 -10.726 172 H MET 23 H MET 23 -7.037 -9.713 -10.813 173 HA MET 23 HA MET 23 -4.469 -9.558 -9.612 174 HB2 MET 23 2HB MET 23 -5.944 -7.309 -11.057 175 HB3 MET 23 3HB MET 23 -4.230 -7.316 -10.671 176 HG2 MET 23 2HG MET 23 -4.036 -9.371 -12.155 177 HG3 MET 23 3HG MET 23 -5.682 -9.029 -12.687 178 HE1 MET 23 1HE MET 23 -5.024 -5.299 -14.172 179 HE2 MET 23 2HE MET 23 -5.354 -5.633 -12.473 180 HE3 MET 23 3HE MET 23 -6.299 -6.436 -13.730 181 H SER 24 H SER 24 -7.492 -7.930 -8.935 182 HA SER 24 HA SER 24 -6.603 -6.426 -6.667 183 HB2 SER 24 2HB SER 24 -8.693 -5.866 -7.920 184 HB3 SER 24 3HB SER 24 -9.407 -7.394 -7.403 185 HG SER 24 HG SER 24 -8.404 -5.525 -5.549 186 H VAL 25 H VAL 25 -5.687 -7.529 -5.003 187 HA VAL 25 HA VAL 25 -5.950 -10.313 -4.630 188 HB VAL 25 HB VAL 25 -4.780 -8.284 -2.673 189 HG11 VAL 25 1HG1 VAL 25 -5.205 -10.442 -1.565 190 HG12 VAL 25 2HG1 VAL 25 -3.471 -10.169 -1.746 191 HG13 VAL 25 3HG1 VAL 25 -4.306 -11.288 -2.828 192 HG21 VAL 25 1HG2 VAL 25 -2.583 -8.830 -3.697 193 HG22 VAL 25 2HG2 VAL 25 -3.693 -8.117 -4.869 194 HG23 VAL 25 3HG2 VAL 25 -3.398 -9.856 -4.885 195 H THR 26 H THR 26 -7.430 -7.579 -2.886 196 HA THR 26 HA THR 26 -8.658 -9.022 -0.790 197 HB THR 26 HB THR 26 -9.405 -6.354 -2.052 198 HG1 THR 26 HG1 THR 26 -8.242 -5.531 -0.295 199 HG21 THR 26 1HG2 THR 26 -10.670 -5.840 0.013 200 HG22 THR 26 2HG2 THR 26 -10.406 -7.483 0.593 201 HG23 THR 26 3HG2 THR 26 -11.392 -7.210 -0.842 202 H ILE 27 H ILE 27 -9.972 -8.019 -3.980 203 HA ILE 27 HA ILE 27 -12.584 -9.094 -3.613 204 HB ILE 27 HB ILE 27 -11.064 -8.522 -6.200 205 HG12 ILE 27 2HG1 ILE 27 -13.165 -6.836 -4.750 206 HG13 ILE 27 3HG1 ILE 27 -11.431 -6.532 -4.716 207 HG21 ILE 27 1HG2 ILE 27 -14.044 -9.037 -5.836 208 HG22 ILE 27 2HG2 ILE 27 -12.899 -10.108 -6.645 209 HG23 ILE 27 3HG2 ILE 27 -13.269 -8.529 -7.338 210 HD11 ILE 27 1HD1 ILE 27 -12.553 -5.050 -6.259 211 HD12 ILE 27 2HD1 ILE 27 -13.191 -6.424 -7.161 212 HD13 ILE 27 3HD1 ILE 27 -11.452 -6.123 -7.120 213 H LYS 28 H LYS 28 -9.631 -10.378 -5.128 214 HA LYS 28 HA LYS 28 -10.425 -12.932 -5.883 215 HB2 LYS 28 2HB LYS 28 -8.223 -11.981 -6.435 216 HB3 LYS 28 3HB LYS 28 -7.774 -11.973 -4.734 217 HG2 LYS 28 2HG LYS 28 -8.030 -14.538 -4.812 218 HG3 LYS 28 3HG LYS 28 -8.103 -14.361 -6.567 219 HD2 LYS 28 2HD LYS 28 -5.829 -14.935 -5.794 220 HD3 LYS 28 3HD LYS 28 -5.862 -13.358 -6.588 221 HE2 LYS 28 2HE LYS 28 -4.458 -13.421 -4.518 222 HE3 LYS 28 3HE LYS 28 -5.743 -12.218 -4.446 223 HZ1 LYS 28 1HZ LYS 28 -5.544 -13.427 -2.372 224 HZ2 LYS 28 2HZ LYS 28 -5.788 -14.900 -3.160 225 HZ3 LYS 28 3HZ LYS 28 -7.035 -13.769 -3.088 226 H ASN 29 H ASN 29 -9.313 -11.760 -2.695 227 HA ASN 29 HA ASN 29 -9.306 -14.253 -1.329 228 HB2 ASN 29 2HB ASN 29 -9.522 -11.398 -0.263 229 HB3 ASN 29 3HB ASN 29 -9.386 -12.806 0.785 230 HD21 ASN 29 1HD2 ASN 29 -7.621 -10.509 0.488 231 HD22 ASN 29 2HD2 ASN 29 -6.062 -11.146 0.099 232 H MET 30 H MET 30 -11.798 -11.742 -1.743 233 HA MET 30 HA MET 30 -13.783 -12.799 -0.041 234 HB2 MET 30 2HB MET 30 -13.794 -10.875 -2.359 235 HB3 MET 30 3HB MET 30 -15.340 -11.600 -1.947 236 HG2 MET 30 2HG MET 30 -15.091 -9.436 -0.876 237 HG3 MET 30 3HG MET 30 -15.174 -10.718 0.330 238 HE1 MET 30 1HE MET 30 -14.288 -8.945 2.180 239 HE2 MET 30 2HE MET 30 -14.201 -7.699 0.931 240 HE3 MET 30 3HE MET 30 -12.808 -8.007 1.970 241 H ILE 31 H ILE 31 -13.133 -13.337 -3.495 242 HA ILE 31 HA ILE 31 -15.248 -15.092 -4.091 243 HB ILE 31 HB ILE 31 -12.474 -14.873 -5.364 244 HG12 ILE 31 2HG1 ILE 31 -15.149 -13.716 -6.293 245 HG13 ILE 31 3HG1 ILE 31 -13.913 -12.804 -5.436 246 HG21 ILE 31 1HG2 ILE 31 -13.413 -16.029 -7.347 247 HG22 ILE 31 2HG2 ILE 31 -14.924 -16.298 -6.475 248 HG23 ILE 31 3HG2 ILE 31 -13.439 -17.072 -5.921 249 HD11 ILE 31 1HD1 ILE 31 -12.368 -13.164 -7.306 250 HD12 ILE 31 2HD1 ILE 31 -13.839 -12.321 -7.787 251 HD13 ILE 31 3HD1 ILE 31 -13.641 -14.030 -8.176 252 H GLU 32 H GLU 32 -11.884 -15.768 -3.077 253 HA GLU 32 HA GLU 32 -12.043 -18.602 -3.092 254 HB2 GLU 32 2HB GLU 32 -10.136 -16.750 -1.599 255 HB3 GLU 32 3HB GLU 32 -9.914 -18.492 -1.747 256 HG2 GLU 32 2HG GLU 32 -9.645 -18.306 -4.161 257 HG3 GLU 32 3HG GLU 32 -10.020 -16.582 -4.105 258 H ASP 33 H ASP 33 -12.747 -16.204 -0.600 259 HA ASP 33 HA ASP 33 -12.794 -18.016 1.639 260 HB2 ASP 33 2HB ASP 33 -12.293 -15.575 1.858 261 HB3 ASP 33 3HB ASP 33 -13.946 -15.195 1.388 262 H ILE 34 H ILE 34 -15.234 -16.599 -0.487 263 HA ILE 34 HA ILE 34 -17.468 -18.000 0.768 264 HB ILE 34 HB ILE 34 -17.421 -16.405 -1.857 265 HG12 ILE 34 2HG1 ILE 34 -18.245 -15.419 0.925 266 HG13 ILE 34 3HG1 ILE 34 -16.723 -15.021 0.137 267 HG21 ILE 34 1HG2 ILE 34 -19.874 -16.205 -1.559 268 HG22 ILE 34 2HG2 ILE 34 -19.785 -17.206 -0.107 269 HG23 ILE 34 3HG2 ILE 34 -19.383 -17.898 -1.680 270 HD11 ILE 34 1HD1 ILE 34 -17.950 -13.870 -1.647 271 HD12 ILE 34 2HD1 ILE 34 -18.283 -13.193 -0.055 272 HD13 ILE 34 3HD1 ILE 34 -19.474 -14.236 -0.831 273 H GLY 35 H GLY 35 -14.964 -18.915 -1.242 274 HA2 GLY 35 2HA GLY 35 -14.664 -21.082 -2.123 275 HA3 GLY 35 3HA GLY 35 -16.403 -21.263 -2.321 276 H GLU 36 H GLU 36 -17.300 -19.344 -3.748 277 HA GLU 36 HA GLU 36 -15.682 -18.233 -5.805 278 HB2 GLU 36 2HB GLU 36 -15.763 -20.516 -6.726 279 HB3 GLU 36 3HB GLU 36 -17.517 -20.566 -6.563 280 HG2 GLU 36 2HG GLU 36 -17.779 -18.875 -8.282 281 HG3 GLU 36 3HG GLU 36 -16.043 -18.622 -8.363 282 H SER 37 H SER 37 -16.784 -16.477 -6.717 283 HA SER 37 HA SER 37 -19.684 -16.224 -6.409 284 HB2 SER 37 2HB SER 37 -17.736 -14.238 -5.142 285 HB3 SER 37 3HB SER 37 -19.485 -14.014 -5.259 286 HG SER 37 HG SER 37 -19.439 -16.213 -4.128 287 H ASP 38 H ASP 38 -20.261 -15.747 -8.433 288 HA ASP 38 HA ASP 38 -18.870 -13.692 -10.025 289 HB2 ASP 38 2HB ASP 38 -20.344 -14.366 -11.852 290 HB3 ASP 38 3HB ASP 38 -19.676 -15.818 -11.124 291 H SER 39 H SER 39 -21.304 -13.999 -7.740 292 HA SER 39 HA SER 39 -23.384 -12.310 -8.441 293 HB2 SER 39 2HB SER 39 -23.708 -12.240 -5.889 294 HB3 SER 39 3HB SER 39 -23.588 -13.850 -6.601 295 HG SER 39 HG SER 39 -22.191 -13.964 -4.963 296 HA PRO 40 HA PRO 40 -21.905 -8.067 -7.940 297 HB2 PRO 40 2HB PRO 40 -24.334 -7.415 -6.305 298 HB3 PRO 40 3HB PRO 40 -23.779 -6.709 -7.837 299 HG2 PRO 40 2HG PRO 40 -25.890 -8.343 -7.775 300 HG3 PRO 40 3HG PRO 40 -24.740 -8.384 -9.131 301 HD2 PRO 40 2HD PRO 40 -24.963 -10.274 -6.791 302 HD3 PRO 40 3HD PRO 40 -24.667 -10.633 -8.509 303 H ILE 41 H ILE 41 -20.127 -8.503 -6.615 304 HA ILE 41 HA ILE 41 -20.217 -8.776 -3.778 305 HB ILE 41 HB ILE 41 -17.870 -8.033 -5.588 306 HG12 ILE 41 2HG1 ILE 41 -18.799 -10.248 -6.147 307 HG13 ILE 41 3HG1 ILE 41 -17.216 -10.431 -5.403 308 HG21 ILE 41 1HG2 ILE 41 -17.382 -7.348 -3.287 309 HG22 ILE 41 2HG2 ILE 41 -16.394 -8.744 -3.722 310 HG23 ILE 41 3HG2 ILE 41 -17.812 -8.954 -2.689 311 HD11 ILE 41 1HD1 ILE 41 -19.889 -10.890 -4.072 312 HD12 ILE 41 2HD1 ILE 41 -18.317 -11.045 -3.278 313 HD13 ILE 41 3HD1 ILE 41 -18.745 -12.117 -4.608 314 HA PRO 42 HA PRO 42 -20.867 -4.291 -3.309 315 HB2 PRO 42 2HB PRO 42 -21.671 -4.274 -0.707 316 HB3 PRO 42 3HB PRO 42 -22.718 -4.867 -2.014 317 HG2 PRO 42 2HG PRO 42 -21.097 -6.437 -0.048 318 HG3 PRO 42 3HG PRO 42 -22.730 -6.755 -0.668 319 HD2 PRO 42 2HD PRO 42 -20.436 -8.002 -1.613 320 HD3 PRO 42 3HD PRO 42 -21.942 -7.841 -2.544 321 H LEU 43 H LEU 43 -19.328 -2.855 -3.005 322 HA LEU 43 HA LEU 43 -17.132 -3.224 -1.079 323 HB2 LEU 43 2HB LEU 43 -17.043 -1.872 -3.817 324 HB3 LEU 43 3HB LEU 43 -15.689 -2.015 -2.708 325 HG LEU 43 HG LEU 43 -17.065 -4.378 -4.059 326 HD11 LEU 43 1HD1 LEU 43 -14.438 -3.049 -4.787 327 HD12 LEU 43 2HD1 LEU 43 -15.929 -3.017 -5.728 328 HD13 LEU 43 3HD1 LEU 43 -15.073 -4.537 -5.493 329 HD21 LEU 43 1HD2 LEU 43 -15.126 -5.697 -3.281 330 HD22 LEU 43 2HD2 LEU 43 -16.048 -5.032 -1.937 331 HD23 LEU 43 3HD2 LEU 43 -14.516 -4.288 -2.404 332 HA PRO 44 HA PRO 44 -19.725 0.442 0.089 333 HB2 PRO 44 2HB PRO 44 -19.375 0.298 2.799 334 HB3 PRO 44 3HB PRO 44 -20.463 -0.799 1.921 335 HG2 PRO 44 2HG PRO 44 -17.633 -1.296 2.818 336 HG3 PRO 44 3HG PRO 44 -19.067 -2.332 3.015 337 HD2 PRO 44 2HD PRO 44 -17.280 -2.756 1.028 338 HD3 PRO 44 3HD PRO 44 -19.016 -3.061 0.796 339 H ASN 45 H ASN 45 -16.345 -0.136 0.897 340 HA ASN 45 HA ASN 45 -15.911 2.536 2.001 341 HB2 ASN 45 2HB ASN 45 -14.018 0.186 1.588 342 HB3 ASN 45 3HB ASN 45 -13.530 1.724 2.293 343 HD21 ASN 45 1HD2 ASN 45 -12.940 0.730 4.245 344 HD22 ASN 45 2HD2 ASN 45 -14.120 0.153 5.372 345 H VAL 46 H VAL 46 -16.434 1.834 -1.023 346 HA VAL 46 HA VAL 46 -14.646 3.922 -1.999 347 HB VAL 46 HB VAL 46 -13.454 1.799 -2.527 348 HG11 VAL 46 1HG1 VAL 46 -15.362 0.276 -2.737 349 HG12 VAL 46 2HG1 VAL 46 -14.316 0.186 -4.155 350 HG13 VAL 46 3HG1 VAL 46 -15.846 1.067 -4.240 351 HG21 VAL 46 1HG2 VAL 46 -13.128 3.732 -3.986 352 HG22 VAL 46 2HG2 VAL 46 -14.496 3.242 -4.989 353 HG23 VAL 46 3HG2 VAL 46 -13.046 2.238 -4.924 354 H THR 47 H THR 47 -15.728 5.325 -3.258 355 HA THR 47 HA THR 47 -18.536 4.988 -3.848 356 HB THR 47 HB THR 47 -18.318 7.257 -4.934 357 HG1 THR 47 HG1 THR 47 -16.363 8.190 -5.163 358 HG21 THR 47 1HG2 THR 47 -17.056 7.084 -2.171 359 HG22 THR 47 2HG2 THR 47 -18.789 7.134 -2.508 360 HG23 THR 47 3HG2 THR 47 -17.777 8.529 -2.889 361 H SER 48 H SER 48 -19.348 5.491 -6.102 362 HA SER 48 HA SER 48 -18.483 3.510 -7.921 363 HB2 SER 48 2HB SER 48 -20.160 4.570 -9.482 364 HB3 SER 48 3HB SER 48 -20.805 4.195 -7.883 365 HG SER 48 HG SER 48 -20.634 6.358 -7.335 366 H THR 49 H THR 49 -17.914 6.995 -7.776 367 HA THR 49 HA THR 49 -16.769 7.374 -10.329 368 HB THR 49 HB THR 49 -15.807 9.485 -9.243 369 HG1 THR 49 HG1 THR 49 -15.929 9.690 -7.120 370 HG21 THR 49 1HG2 THR 49 -18.009 10.543 -8.861 371 HG22 THR 49 2HG2 THR 49 -18.770 8.953 -8.776 372 HG23 THR 49 3HG2 THR 49 -18.057 9.510 -10.293 373 H ILE 50 H ILE 50 -15.246 6.782 -7.137 374 HA ILE 50 HA ILE 50 -12.550 6.856 -8.105 375 HB ILE 50 HB ILE 50 -13.670 5.738 -5.493 376 HG12 ILE 50 2HG1 ILE 50 -14.072 8.170 -5.738 377 HG13 ILE 50 3HG1 ILE 50 -12.911 7.856 -4.459 378 HG21 ILE 50 1HG2 ILE 50 -11.361 5.884 -4.593 379 HG22 ILE 50 2HG2 ILE 50 -10.769 6.304 -6.203 380 HG23 ILE 50 3HG2 ILE 50 -11.492 4.721 -5.917 381 HD11 ILE 50 1HD1 ILE 50 -12.319 9.803 -5.780 382 HD12 ILE 50 2HD1 ILE 50 -12.241 8.822 -7.241 383 HD13 ILE 50 3HD1 ILE 50 -11.088 8.550 -5.930 384 H LEU 51 H LEU 51 -14.834 4.225 -7.251 385 HA LEU 51 HA LEU 51 -13.145 2.016 -7.651 386 HB2 LEU 51 2HB LEU 51 -15.349 1.863 -6.484 387 HB3 LEU 51 3HB LEU 51 -16.172 2.122 -8.013 388 HG LEU 51 HG LEU 51 -15.264 -0.041 -8.872 389 HD11 LEU 51 1HD1 LEU 51 -14.085 -0.403 -6.104 390 HD12 LEU 51 2HD1 LEU 51 -13.185 -0.161 -7.605 391 HD13 LEU 51 3HD1 LEU 51 -14.142 -1.623 -7.381 392 HD21 LEU 51 1HD2 LEU 51 -17.470 -0.030 -7.806 393 HD22 LEU 51 2HD2 LEU 51 -16.729 -0.345 -6.234 394 HD23 LEU 51 3HD2 LEU 51 -16.629 -1.555 -7.518 395 H GLU 52 H GLU 52 -15.177 3.831 -9.907 396 HA GLU 52 HA GLU 52 -15.043 2.241 -12.194 397 HB2 GLU 52 2HB GLU 52 -16.459 4.277 -11.989 398 HB3 GLU 52 3HB GLU 52 -15.016 5.286 -12.011 399 HG2 GLU 52 2HG GLU 52 -14.512 4.474 -14.311 400 HG3 GLU 52 3HG GLU 52 -15.999 3.527 -14.285 401 H LYS 53 H LYS 53 -12.862 4.801 -11.050 402 HA LYS 53 HA LYS 53 -11.055 4.671 -13.257 403 HB2 LYS 53 2HB LYS 53 -10.725 5.963 -10.518 404 HB3 LYS 53 3HB LYS 53 -9.630 6.187 -11.881 405 HG2 LYS 53 2HG LYS 53 -11.573 7.107 -13.200 406 HG3 LYS 53 3HG LYS 53 -12.535 7.034 -11.721 407 HD2 LYS 53 2HD LYS 53 -11.658 9.303 -12.095 408 HD3 LYS 53 3HD LYS 53 -10.996 8.605 -10.617 409 HE2 LYS 53 2HE LYS 53 -8.856 8.304 -11.579 410 HE3 LYS 53 3HE LYS 53 -9.473 8.463 -13.225 411 HZ1 LYS 53 1HZ LYS 53 -8.273 10.442 -12.476 412 HZ2 LYS 53 2HZ LYS 53 -9.411 10.669 -11.245 413 HZ3 LYS 53 3HZ LYS 53 -9.882 10.777 -12.857 414 H VAL 54 H VAL 54 -11.052 3.229 -10.025 415 HA VAL 54 HA VAL 54 -8.378 2.295 -10.006 416 HB VAL 54 HB VAL 54 -10.834 1.290 -8.484 417 HG11 VAL 54 1HG1 VAL 54 -7.909 0.609 -7.987 418 HG12 VAL 54 2HG1 VAL 54 -9.148 -0.506 -8.567 419 HG13 VAL 54 3HG1 VAL 54 -9.258 0.163 -6.938 420 HG21 VAL 54 1HG2 VAL 54 -9.902 2.574 -6.591 421 HG22 VAL 54 2HG2 VAL 54 -10.183 3.625 -7.979 422 HG23 VAL 54 3HG2 VAL 54 -8.547 3.094 -7.597 423 H LEU 55 H LEU 55 -11.443 0.818 -11.016 424 HA LEU 55 HA LEU 55 -10.296 -1.653 -11.917 425 HB2 LEU 55 2HB LEU 55 -12.990 -0.372 -12.522 426 HB3 LEU 55 3HB LEU 55 -12.545 -2.008 -12.976 427 HG LEU 55 HG LEU 55 -12.825 -0.975 -10.125 428 HD11 LEU 55 1HD1 LEU 55 -14.597 -2.883 -11.681 429 HD12 LEU 55 2HD1 LEU 55 -14.981 -1.215 -11.244 430 HD13 LEU 55 3HD1 LEU 55 -14.787 -2.430 -9.983 431 HD21 LEU 55 1HD2 LEU 55 -12.156 -3.785 -11.074 432 HD22 LEU 55 2HD2 LEU 55 -12.509 -3.312 -9.410 433 HD23 LEU 55 3HD2 LEU 55 -11.077 -2.678 -10.215 434 H ASP 56 H ASP 56 -10.921 1.474 -13.365 435 HA ASP 56 HA ASP 56 -10.832 0.797 -16.122 436 HB2 ASP 56 2HB ASP 56 -11.869 2.877 -15.279 437 HB3 ASP 56 3HB ASP 56 -10.309 3.464 -14.721 438 H TYR 57 H TYR 57 -8.343 2.072 -13.912 439 HA TYR 57 HA TYR 57 -6.156 2.144 -15.677 440 HB2 TYR 57 2HB TYR 57 -6.030 3.213 -13.480 441 HB3 TYR 57 3HB TYR 57 -6.273 1.674 -12.662 442 HD1 TYR 57 HD1 TYR 57 -3.855 3.657 -14.680 443 HD2 TYR 57 HD2 TYR 57 -4.396 0.177 -12.257 444 HE1 TYR 57 HE1 TYR 57 -1.431 3.287 -14.658 445 HE2 TYR 57 HE2 TYR 57 -1.971 -0.194 -12.236 446 HH TYR 57 HH TYR 57 0.263 2.142 -13.396 447 H CYS 58 H CYS 58 -7.440 -0.432 -13.622 448 HA CYS 58 HA CYS 58 -5.475 -2.387 -14.186 449 HB2 CYS 58 2HB CYS 58 -8.289 -2.633 -13.089 450 HB3 CYS 58 3HB CYS 58 -7.112 -3.943 -13.115 451 HG CYS 58 HG CYS 58 -7.583 -1.812 -10.782 452 H ARG 59 H ARG 59 -8.469 -1.468 -15.839 453 HA ARG 59 HA ARG 59 -8.740 -3.599 -17.664 454 HB2 ARG 59 2HB ARG 59 -9.350 -0.643 -18.100 455 HB3 ARG 59 3HB ARG 59 -9.816 -1.914 -19.224 456 HG2 ARG 59 2HG ARG 59 -11.268 -2.917 -17.517 457 HG3 ARG 59 3HG ARG 59 -10.778 -1.678 -16.360 458 HD2 ARG 59 2HD ARG 59 -11.714 0.058 -17.912 459 HD3 ARG 59 3HD ARG 59 -12.309 -1.245 -18.948 460 HE ARG 59 HE ARG 59 -13.170 -0.863 -16.141 461 HH11 ARG 59 1HH1 ARG 59 -13.968 -1.558 -19.492 462 HH12 ARG 59 2HH1 ARG 59 -15.654 -1.802 -19.166 463 HH21 ARG 59 1HH2 ARG 59 -15.391 -1.184 -15.725 464 HH22 ARG 59 2HH2 ARG 59 -16.455 -1.587 -17.033 465 H HIS 60 H HIS 60 -6.734 -0.683 -17.775 466 HA HIS 60 HA HIS 60 -5.565 -0.973 -20.307 467 HB2 HIS 60 2HB HIS 60 -5.350 1.091 -18.999 468 HB3 HIS 60 3HB HIS 60 -4.409 0.262 -17.768 469 HD1 HIS 60 HD1 HIS 60 -4.159 1.567 -21.295 470 HD2 HIS 60 HD2 HIS 60 -1.686 0.149 -18.271 471 HE1 HIS 60 HE1 HIS 60 -1.820 2.041 -22.065 472 HE2 HIS 60 HE2 HIS 60 -0.401 1.492 -20.062 473 H HIS 61 H HIS 61 -4.730 -2.467 -17.219 474 HA HIS 61 HA HIS 61 -2.293 -3.710 -18.178 475 HB2 HIS 61 2HB HIS 61 -3.839 -3.852 -15.573 476 HB3 HIS 61 3HB HIS 61 -2.489 -4.943 -15.879 477 HD1 HIS 61 HD1 HIS 61 -0.421 -4.099 -14.839 478 HD2 HIS 61 HD2 HIS 61 -2.811 -0.974 -16.186 479 HE1 HIS 61 HE1 HIS 61 0.871 -2.003 -14.353 480 HE2 HIS 61 HE2 HIS 61 -0.618 -0.128 -15.117 481 H HIS 62 H HIS 62 -5.650 -4.555 -18.175 482 HA HIS 62 HA HIS 62 -5.227 -7.393 -18.646 483 HB2 HIS 62 2HB HIS 62 -7.268 -6.656 -17.521 484 HB3 HIS 62 3HB HIS 62 -7.705 -5.634 -18.883 485 HD1 HIS 62 HD1 HIS 62 -6.686 -9.321 -18.962 486 HD2 HIS 62 HD2 HIS 62 -9.941 -6.889 -19.793 487 HE1 HIS 62 HE1 HIS 62 -8.431 -10.845 -19.933 488 HE2 HIS 62 HE2 HIS 62 -10.375 -9.337 -20.463 489 H GLN 63 H GLN 63 -6.103 -4.546 -20.575 490 HA GLN 63 HA GLN 63 -6.313 -5.958 -23.081 491 HB2 GLN 63 2HB GLN 63 -6.201 -2.959 -22.506 492 HB3 GLN 63 3HB GLN 63 -6.628 -3.682 -24.056 493 HG2 GLN 63 2HG GLN 63 -8.614 -4.726 -23.024 494 HG3 GLN 63 3HG GLN 63 -8.182 -4.016 -21.471 495 HE21 GLN 63 1HE2 GLN 63 -10.130 -2.886 -21.321 496 HE22 GLN 63 2HE2 GLN 63 -10.496 -1.516 -22.311 497 H HIS 64 H HIS 64 -3.865 -4.120 -21.396 498 HA HIS 64 HA HIS 64 -1.830 -4.986 -23.360 499 HB2 HIS 64 2HB HIS 64 -1.851 -2.277 -21.927 500 HB3 HIS 64 3HB HIS 64 -0.579 -2.864 -22.991 501 HD1 HIS 64 HD1 HIS 64 -0.944 -2.628 -25.512 502 HD2 HIS 64 HD2 HIS 64 -4.227 -1.446 -23.251 503 HE1 HIS 64 HE1 HIS 64 -2.502 -1.491 -27.116 504 HE2 HIS 64 HE2 HIS 64 -4.473 -0.779 -25.728 505 HA PRO 65 HA PRO 65 -0.922 -6.829 -19.159 506 HB2 PRO 65 2HB PRO 65 0.914 -8.675 -20.260 507 HB3 PRO 65 3HB PRO 65 -0.811 -8.981 -19.985 508 HG2 PRO 65 2HG PRO 65 0.573 -8.143 -22.506 509 HG3 PRO 65 3HG PRO 65 -0.746 -9.314 -22.287 510 HD2 PRO 65 2HD PRO 65 -1.259 -6.868 -23.233 511 HD3 PRO 65 3HD PRO 65 -2.380 -7.629 -22.079 512 H GLY 66 H GLY 66 0.117 -5.057 -18.343 513 HA2 GLY 66 2HA GLY 66 1.996 -4.057 -17.392 514 HA3 GLY 66 3HA GLY 66 3.036 -4.901 -18.528 515 H GLY 67 H GLY 67 1.870 -4.155 -20.963 516 HA2 GLY 67 2HA GLY 67 1.866 -2.459 -22.534 517 HA3 GLY 67 3HA GLY 67 1.804 -1.269 -21.233 518 H SER 68 H SER 68 3.681 -0.368 -20.485 519 HA SER 68 HA SER 68 5.823 0.220 -20.200 520 HB2 SER 68 2HB SER 68 6.365 -2.712 -20.803 521 HB3 SER 68 3HB SER 68 7.520 -1.602 -20.054 522 HG SER 68 HG SER 68 5.739 -1.276 -18.445 523 H GLY 69 H GLY 69 8.185 0.041 -21.218 524 HA2 GLY 69 2HA GLY 69 8.846 -0.666 -23.763 525 HA3 GLY 69 3HA GLY 69 8.027 0.884 -23.985 526 H LEU 70 H LEU 70 9.829 2.015 -24.632 527 HA LEU 70 HA LEU 70 12.181 2.283 -22.954 528 HB2 LEU 70 2HB LEU 70 12.381 2.444 -25.409 529 HB3 LEU 70 3HB LEU 70 11.252 3.788 -25.440 530 HG LEU 70 HG LEU 70 12.910 5.168 -24.167 531 HD11 LEU 70 1HD1 LEU 70 15.235 4.407 -23.928 532 HD12 LEU 70 2HD1 LEU 70 14.783 2.813 -24.534 533 HD13 LEU 70 3HD1 LEU 70 14.126 3.396 -23.003 534 HD21 LEU 70 1HD2 LEU 70 12.807 5.314 -26.621 535 HD22 LEU 70 2HD2 LEU 70 13.998 4.019 -26.756 536 HD23 LEU 70 3HD2 LEU 70 14.452 5.564 -26.034 537 H ASP 71 H ASP 71 9.279 4.100 -23.798 538 HA ASP 71 HA ASP 71 9.626 5.865 -21.453 539 HB2 ASP 71 2HB ASP 71 9.430 7.097 -23.606 540 HB3 ASP 71 3HB ASP 71 7.904 6.292 -23.939 541 H ASP 72 H ASP 72 8.634 4.951 -19.820 542 HA ASP 72 HA ASP 72 6.240 3.292 -20.110 543 HB2 ASP 72 2HB ASP 72 8.296 3.711 -17.934 544 HB3 ASP 72 3HB ASP 72 6.709 3.104 -17.467 545 H ILE 73 H ILE 73 6.138 6.290 -20.440 546 HA ILE 73 HA ILE 73 3.876 6.706 -18.559 547 HB ILE 73 HB ILE 73 5.467 8.914 -19.957 548 HG12 ILE 73 2HG1 ILE 73 6.878 7.798 -18.233 549 HG13 ILE 73 3HG1 ILE 73 6.491 9.451 -17.779 550 HG21 ILE 73 1HG2 ILE 73 3.140 9.556 -19.494 551 HG22 ILE 73 2HG2 ILE 73 4.236 10.459 -18.452 552 HG23 ILE 73 3HG2 ILE 73 3.319 9.100 -17.797 553 HD11 ILE 73 1HD1 ILE 73 6.391 7.972 -15.870 554 HD12 ILE 73 2HD1 ILE 73 5.203 6.951 -16.677 555 HD13 ILE 73 3HD1 ILE 73 4.783 8.606 -16.221 556 HA PRO 74 HA PRO 74 1.975 6.405 -22.818 557 HB2 PRO 74 2HB PRO 74 -0.173 4.893 -21.408 558 HB3 PRO 74 3HB PRO 74 0.811 4.393 -22.799 559 HG2 PRO 74 2HG PRO 74 1.124 3.257 -20.383 560 HG3 PRO 74 3HG PRO 74 2.513 3.528 -21.464 561 HD2 PRO 74 2HD PRO 74 1.604 5.202 -19.110 562 HD3 PRO 74 3HD PRO 74 3.239 4.623 -19.521 563 HA PRO 75 HA PRO 75 -0.644 10.031 -22.148 564 HB2 PRO 75 2HB PRO 75 -2.409 8.683 -24.212 565 HB3 PRO 75 3HB PRO 75 -1.844 10.368 -24.135 566 HG2 PRO 75 2HG PRO 75 -0.678 8.681 -25.813 567 HG3 PRO 75 3HG PRO 75 0.305 9.838 -24.887 568 HD2 PRO 75 2HD PRO 75 -0.031 6.885 -24.463 569 HD3 PRO 75 3HD PRO 75 1.402 7.912 -24.214 570 H TYR 76 H TYR 76 -2.206 6.852 -22.315 571 HA TYR 76 HA TYR 76 -4.689 7.371 -21.166 572 HB2 TYR 76 2HB TYR 76 -3.981 5.241 -22.317 573 HB3 TYR 76 3HB TYR 76 -3.011 4.830 -20.913 574 HD1 TYR 76 HD1 TYR 76 -4.236 4.379 -18.674 575 HD2 TYR 76 HD2 TYR 76 -6.288 4.676 -22.414 576 HE1 TYR 76 HE1 TYR 76 -6.163 3.199 -17.710 577 HE2 TYR 76 HE2 TYR 76 -8.205 3.494 -21.452 578 HH TYR 76 HH TYR 76 -8.506 2.874 -18.097 579 H ASP 77 H ASP 77 -1.745 6.157 -19.585 580 HA ASP 77 HA ASP 77 -2.840 6.111 -16.938 581 HB2 ASP 77 2HB ASP 77 0.069 5.863 -17.842 582 HB3 ASP 77 3HB ASP 77 -0.582 5.360 -16.281 583 H ARG 78 H ARG 78 -0.962 8.354 -18.819 584 HA ARG 78 HA ARG 78 -0.112 10.148 -16.800 585 HB2 ARG 78 2HB ARG 78 0.799 10.015 -19.141 586 HB3 ARG 78 3HB ARG 78 -0.702 10.702 -19.746 587 HG2 ARG 78 2HG ARG 78 -0.223 12.791 -18.467 588 HG3 ARG 78 3HG ARG 78 1.301 12.081 -17.926 589 HD2 ARG 78 2HD ARG 78 2.024 11.887 -20.297 590 HD3 ARG 78 3HD ARG 78 0.521 12.662 -20.805 591 HE ARG 78 HE ARG 78 2.161 14.169 -18.937 592 HH11 ARG 78 1HH1 ARG 78 1.401 13.632 -22.345 593 HH12 ARG 78 2HH1 ARG 78 2.045 15.159 -22.844 594 HH21 ARG 78 1HH2 ARG 78 3.033 16.142 -19.627 595 HH22 ARG 78 2HH2 ARG 78 2.974 16.585 -21.301 596 H ASP 79 H ASP 79 -3.025 10.003 -18.848 597 HA ASP 79 HA ASP 79 -4.239 12.359 -17.695 598 HB2 ASP 79 2HB ASP 79 -5.316 10.233 -19.581 599 HB3 ASP 79 3HB ASP 79 -6.319 11.547 -18.972 600 H PHE 80 H PHE 80 -4.256 8.929 -16.974 601 HA PHE 80 HA PHE 80 -6.467 8.822 -15.210 602 HB2 PHE 80 2HB PHE 80 -5.397 6.751 -15.958 603 HB3 PHE 80 3HB PHE 80 -3.865 7.218 -15.229 604 HD1 PHE 80 HD1 PHE 80 -7.417 6.407 -14.362 605 HD2 PHE 80 HD2 PHE 80 -3.357 6.508 -13.017 606 HE1 PHE 80 HE1 PHE 80 -8.068 5.294 -12.271 607 HE2 PHE 80 HE2 PHE 80 -4.020 5.386 -10.929 608 HZ PHE 80 HZ PHE 80 -6.385 4.783 -10.555 609 H CYS 81 H CYS 81 -3.142 9.886 -14.801 610 HA CYS 81 HA CYS 81 -3.157 10.233 -11.977 611 HB2 CYS 81 2HB CYS 81 -1.358 11.407 -14.119 612 HB3 CYS 81 3HB CYS 81 -1.050 11.518 -12.387 613 HG CYS 81 HG CYS 81 -1.483 8.443 -13.738 614 H LYS 82 H LYS 82 -4.681 12.082 -14.441 615 HA LYS 82 HA LYS 82 -4.745 14.598 -13.077 616 HB2 LYS 82 2HB LYS 82 -6.451 13.397 -15.283 617 HB3 LYS 82 3HB LYS 82 -6.912 14.918 -14.533 618 HG2 LYS 82 2HG LYS 82 -4.290 14.395 -15.978 619 HG3 LYS 82 3HG LYS 82 -5.682 15.269 -16.633 620 HD2 LYS 82 2HD LYS 82 -5.445 16.949 -14.781 621 HD3 LYS 82 3HD LYS 82 -4.000 16.094 -14.234 622 HE2 LYS 82 2HE LYS 82 -4.363 17.502 -16.901 623 HE3 LYS 82 3HE LYS 82 -3.356 18.030 -15.551 624 HZ1 LYS 82 1HZ LYS 82 -2.956 15.610 -17.216 625 HZ2 LYS 82 2HZ LYS 82 -2.052 15.967 -15.838 626 HZ3 LYS 82 3HZ LYS 82 -1.980 16.986 -17.181 627 H VAL 83 H VAL 83 -5.121 14.063 -10.965 628 HA VAL 83 HA VAL 83 -7.959 13.843 -10.229 629 HB VAL 83 HB VAL 83 -7.163 12.513 -8.128 630 HG11 VAL 83 1HG1 VAL 83 -8.556 11.495 -9.890 631 HG12 VAL 83 2HG1 VAL 83 -7.410 10.336 -9.219 632 HG13 VAL 83 3HG1 VAL 83 -7.105 11.064 -10.799 633 HG21 VAL 83 1HG2 VAL 83 -4.734 12.811 -8.455 634 HG22 VAL 83 2HG2 VAL 83 -4.805 11.872 -9.944 635 HG23 VAL 83 3HG2 VAL 83 -5.158 11.099 -8.393 636 H ASP 84 H ASP 84 -8.498 15.103 -8.462 637 HA ASP 84 HA ASP 84 -6.929 17.394 -7.833 638 HB2 ASP 84 2HB ASP 84 -9.417 17.369 -7.835 639 HB3 ASP 84 3HB ASP 84 -9.416 16.252 -6.477 640 H GLN 85 H GLN 85 -6.287 17.977 -5.498 641 HA GLN 85 HA GLN 85 -4.239 16.245 -4.794 642 HB2 GLN 85 2HB GLN 85 -4.408 18.766 -4.363 643 HB3 GLN 85 3HB GLN 85 -5.308 18.381 -2.904 644 HG2 GLN 85 2HG GLN 85 -2.515 17.324 -3.434 645 HG3 GLN 85 3HG GLN 85 -2.804 18.868 -2.646 646 HE21 GLN 85 1HE2 GLN 85 -1.468 16.442 -1.635 647 HE22 GLN 85 2HE2 GLN 85 -2.297 16.035 -0.180 648 HA PRO 86 HA PRO 86 -6.847 14.460 -0.983 649 HB2 PRO 86 2HB PRO 86 -9.625 14.635 -1.307 650 HB3 PRO 86 3HB PRO 86 -8.660 15.729 -0.292 651 HG2 PRO 86 2HG PRO 86 -9.621 16.147 -3.108 652 HG3 PRO 86 3HG PRO 86 -9.646 17.275 -1.731 653 HD2 PRO 86 2HD PRO 86 -7.759 17.492 -3.607 654 HD3 PRO 86 3HD PRO 86 -7.348 17.735 -1.895 655 H THR 87 H THR 87 -8.059 14.468 -4.322 656 HA THR 87 HA THR 87 -9.270 11.900 -4.290 657 HB THR 87 HB THR 87 -8.315 13.405 -6.754 658 HG1 THR 87 HG1 THR 87 -10.923 13.646 -5.706 659 HG21 THR 87 1HG2 THR 87 -9.111 11.107 -7.237 660 HG22 THR 87 2HG2 THR 87 -10.225 12.313 -7.881 661 HG23 THR 87 3HG2 THR 87 -10.628 11.452 -6.395 662 H LEU 88 H LEU 88 -5.924 12.949 -5.010 663 HA LEU 88 HA LEU 88 -4.850 10.556 -6.002 664 HB2 LEU 88 2HB LEU 88 -3.587 12.604 -4.145 665 HB3 LEU 88 3HB LEU 88 -2.718 11.169 -4.641 666 HG LEU 88 HG LEU 88 -3.219 12.041 -7.093 667 HD11 LEU 88 1HD1 LEU 88 -3.246 14.475 -7.294 668 HD12 LEU 88 2HD1 LEU 88 -3.415 14.624 -5.543 669 HD13 LEU 88 3HD1 LEU 88 -4.694 13.868 -6.493 670 HD21 LEU 88 1HD2 LEU 88 -0.975 11.779 -6.172 671 HD22 LEU 88 2HD2 LEU 88 -1.104 13.336 -5.350 672 HD23 LEU 88 3HD2 LEU 88 -1.091 13.266 -7.116 673 H PHE 89 H PHE 89 -5.473 11.541 -2.643 674 HA PHE 89 HA PHE 89 -4.483 9.173 -1.402 675 HB2 PHE 89 2HB PHE 89 -6.400 11.273 -0.310 676 HB3 PHE 89 3HB PHE 89 -5.581 10.049 0.656 677 HD1 PHE 89 HD1 PHE 89 -2.863 10.027 0.026 678 HD2 PHE 89 HD2 PHE 89 -5.480 13.407 -0.051 679 HE1 PHE 89 HE1 PHE 89 -0.954 11.526 0.360 680 HE2 PHE 89 HE2 PHE 89 -3.558 14.897 0.279 681 HZ PHE 89 HZ PHE 89 -1.292 13.962 0.483 682 H GLU 90 H GLU 90 -7.650 10.136 -2.619 683 HA GLU 90 HA GLU 90 -9.193 8.052 -1.479 684 HB2 GLU 90 2HB GLU 90 -9.642 9.514 -4.116 685 HB3 GLU 90 3HB GLU 90 -10.845 8.538 -3.276 686 HG2 GLU 90 2HG GLU 90 -9.607 11.108 -2.269 687 HG3 GLU 90 3HG GLU 90 -11.224 10.929 -2.930 688 H LEU 91 H LEU 91 -7.267 8.241 -4.454 689 HA LEU 91 HA LEU 91 -7.900 5.637 -5.452 690 HB2 LEU 91 2HB LEU 91 -5.488 7.404 -6.018 691 HB3 LEU 91 3HB LEU 91 -5.860 5.928 -6.893 692 HG LEU 91 HG LEU 91 -7.446 8.526 -6.937 693 HD11 LEU 91 1HD1 LEU 91 -5.897 7.078 -9.111 694 HD12 LEU 91 2HD1 LEU 91 -5.406 8.559 -8.287 695 HD13 LEU 91 3HD1 LEU 91 -6.832 8.561 -9.320 696 HD21 LEU 91 1HD2 LEU 91 -8.141 5.910 -8.319 697 HD22 LEU 91 2HD2 LEU 91 -8.964 7.455 -8.544 698 HD23 LEU 91 3HD2 LEU 91 -9.028 6.647 -6.981 699 H ILE 92 H ILE 92 -5.280 6.911 -3.377 700 HA ILE 92 HA ILE 92 -3.775 4.537 -3.050 701 HB ILE 92 HB ILE 92 -4.134 6.868 -1.100 702 HG12 ILE 92 2HG1 ILE 92 -1.912 6.313 -3.123 703 HG13 ILE 92 3HG1 ILE 92 -3.175 7.522 -3.297 704 HG21 ILE 92 1HG2 ILE 92 -2.029 6.121 -0.009 705 HG22 ILE 92 2HG2 ILE 92 -2.005 4.691 -1.043 706 HG23 ILE 92 3HG2 ILE 92 -3.301 4.904 0.133 707 HD11 ILE 92 1HD1 ILE 92 -1.001 7.523 -1.208 708 HD12 ILE 92 2HD1 ILE 92 -2.285 8.725 -1.357 709 HD13 ILE 92 3HD1 ILE 92 -1.093 8.542 -2.644 710 H LEU 93 H LEU 93 -6.561 5.821 -1.254 711 HA LEU 93 HA LEU 93 -6.665 3.862 0.796 712 HB2 LEU 93 2HB LEU 93 -8.756 5.795 -0.275 713 HB3 LEU 93 3HB LEU 93 -9.082 4.725 1.077 714 HG LEU 93 HG LEU 93 -6.945 6.899 1.044 715 HD11 LEU 93 1HD1 LEU 93 -8.383 8.120 2.607 716 HD12 LEU 93 2HD1 LEU 93 -9.625 6.871 2.467 717 HD13 LEU 93 3HD1 LEU 93 -9.199 7.855 1.063 718 HD21 LEU 93 1HD2 LEU 93 -6.295 5.035 2.487 719 HD22 LEU 93 2HD2 LEU 93 -7.847 5.111 3.325 720 HD23 LEU 93 3HD2 LEU 93 -6.708 6.455 3.447 721 H ALA 94 H ALA 94 -8.265 4.153 -2.362 722 HA ALA 94 HA ALA 94 -9.898 1.799 -2.097 723 HB1 ALA 94 1HB ALA 94 -10.437 2.181 -4.464 724 HB2 ALA 94 2HB ALA 94 -9.151 3.386 -4.577 725 HB3 ALA 94 3HB ALA 94 -10.550 3.677 -3.539 726 H ALA 95 H ALA 95 -6.694 2.469 -3.431 727 HA ALA 95 HA ALA 95 -6.336 -0.064 -4.739 728 HB1 ALA 95 1HB ALA 95 -3.992 0.600 -4.977 729 HB2 ALA 95 2HB ALA 95 -4.231 1.935 -3.843 730 HB3 ALA 95 3HB ALA 95 -5.059 1.940 -5.402 731 H ASN 96 H ASN 96 -5.561 1.225 -1.524 732 HA ASN 96 HA ASN 96 -4.229 -1.148 -0.576 733 HB2 ASN 96 2HB ASN 96 -3.804 1.149 0.359 734 HB3 ASN 96 3HB ASN 96 -5.434 1.168 1.021 735 HD21 ASN 96 1HD2 ASN 96 -4.480 1.495 3.109 736 HD22 ASN 96 2HD2 ASN 96 -3.770 0.194 3.989 737 H TYR 97 H TYR 97 -7.536 0.113 -0.506 738 HA TYR 97 HA TYR 97 -8.707 -1.757 1.285 739 HB2 TYR 97 2HB TYR 97 -9.905 0.297 0.780 740 HB3 TYR 97 3HB TYR 97 -9.922 -0.058 -0.944 741 HD1 TYR 97 HD1 TYR 97 -12.038 -0.720 -1.783 742 HD2 TYR 97 HD2 TYR 97 -11.040 -1.755 2.244 743 HE1 TYR 97 HE1 TYR 97 -14.226 -1.813 -1.520 744 HE2 TYR 97 HE2 TYR 97 -13.222 -2.843 2.502 745 HH TYR 97 HH TYR 97 -15.228 -3.587 -0.108 746 H LEU 98 H LEU 98 -8.420 -1.713 -2.257 747 HA LEU 98 HA LEU 98 -9.589 -4.378 -2.549 748 HB2 LEU 98 2HB LEU 98 -8.504 -2.402 -4.591 749 HB3 LEU 98 3HB LEU 98 -9.239 -3.944 -5.001 750 HG LEU 98 HG LEU 98 -10.632 -1.578 -3.687 751 HD11 LEU 98 1HD1 LEU 98 -11.002 -2.786 -6.444 752 HD12 LEU 98 2HD1 LEU 98 -10.221 -1.248 -6.071 753 HD13 LEU 98 3HD1 LEU 98 -11.939 -1.460 -5.751 754 HD21 LEU 98 1HD2 LEU 98 -12.709 -2.890 -3.845 755 HD22 LEU 98 2HD2 LEU 98 -11.540 -3.653 -2.773 756 HD23 LEU 98 3HD2 LEU 98 -11.789 -4.293 -4.399 757 H ASP 99 H ASP 99 -6.580 -3.069 -1.924 758 HA ASP 99 HA ASP 99 -4.478 -3.807 -1.772 759 HB2 ASP 99 2HB ASP 99 -5.760 -5.697 -0.618 760 HB3 ASP 99 3HB ASP 99 -5.559 -6.625 -2.098 761 H ILE 100 H ILE 100 -5.534 -3.117 -4.377 762 HA ILE 100 HA ILE 100 -4.024 -4.663 -6.320 763 HB ILE 100 HB ILE 100 -5.244 -1.891 -6.749 764 HG12 ILE 100 2HG1 ILE 100 -6.514 -4.630 -7.183 765 HG13 ILE 100 3HG1 ILE 100 -7.014 -3.425 -6.006 766 HG21 ILE 100 1HG2 ILE 100 -4.455 -4.051 -8.753 767 HG22 ILE 100 2HG2 ILE 100 -3.559 -2.562 -8.439 768 HG23 ILE 100 3HG2 ILE 100 -5.170 -2.485 -9.152 769 HD11 ILE 100 1HD1 ILE 100 -8.535 -3.491 -7.867 770 HD12 ILE 100 2HD1 ILE 100 -7.225 -3.177 -9.005 771 HD13 ILE 100 3HD1 ILE 100 -7.694 -1.944 -7.833 772 H LYS 101 H LYS 101 -2.055 -4.606 -5.228 773 HA LYS 101 HA LYS 101 -0.589 -2.333 -4.502 774 HB2 LYS 101 2HB LYS 101 0.388 -5.111 -5.212 775 HB3 LYS 101 3HB LYS 101 1.363 -3.871 -4.428 776 HG2 LYS 101 2HG LYS 101 -0.225 -3.862 -2.507 777 HG3 LYS 101 3HG LYS 101 -1.148 -5.152 -3.289 778 HD2 LYS 101 2HD LYS 101 0.355 -6.101 -1.592 779 HD3 LYS 101 3HD LYS 101 0.853 -6.623 -3.206 780 HE2 LYS 101 2HE LYS 101 2.557 -4.748 -3.187 781 HE3 LYS 101 3HE LYS 101 2.137 -4.468 -1.495 782 HZ1 LYS 101 1HZ LYS 101 2.826 -6.719 -0.994 783 HZ2 LYS 101 2HZ LYS 101 4.086 -5.855 -1.713 784 HZ3 LYS 101 3HZ LYS 101 3.223 -6.993 -2.613 785 HA PRO 102 HA PRO 102 1.364 -2.615 -9.203 786 HB2 PRO 102 2HB PRO 102 -1.465 -3.017 -10.257 787 HB3 PRO 102 3HB PRO 102 0.091 -3.396 -11.035 788 HG2 PRO 102 2HG PRO 102 -1.306 -5.347 -9.927 789 HG3 PRO 102 3HG PRO 102 0.461 -5.288 -9.716 790 HD2 PRO 102 2HD PRO 102 -1.695 -4.622 -7.743 791 HD3 PRO 102 3HD PRO 102 -0.089 -5.329 -7.464 792 H LEU 103 H LEU 103 -2.031 -1.513 -8.613 793 HA LEU 103 HA LEU 103 -1.676 1.055 -9.802 794 HB2 LEU 103 2HB LEU 103 -3.860 -0.216 -9.485 795 HB3 LEU 103 3HB LEU 103 -3.834 0.268 -7.805 796 HG LEU 103 HG LEU 103 -3.801 2.370 -10.010 797 HD11 LEU 103 1HD1 LEU 103 -6.295 1.081 -8.872 798 HD12 LEU 103 2HD1 LEU 103 -5.690 0.915 -10.522 799 HD13 LEU 103 3HD1 LEU 103 -6.244 2.484 -9.948 800 HD21 LEU 103 1HD2 LEU 103 -3.367 3.188 -7.731 801 HD22 LEU 103 2HD2 LEU 103 -4.880 2.478 -7.171 802 HD23 LEU 103 3HD2 LEU 103 -4.902 3.802 -8.340 803 H LEU 104 H LEU 104 -1.609 -0.127 -6.455 804 HA LEU 104 HA LEU 104 -1.526 2.240 -5.014 805 HB2 LEU 104 2HB LEU 104 -1.818 0.079 -3.931 806 HB3 LEU 104 3HB LEU 104 -0.230 -0.451 -4.452 807 HG LEU 104 HG LEU 104 0.794 1.286 -2.923 808 HD11 LEU 104 1HD1 LEU 104 -2.037 1.667 -1.912 809 HD12 LEU 104 2HD1 LEU 104 -1.066 2.857 -2.783 810 HD13 LEU 104 3HD1 LEU 104 -0.565 2.320 -1.180 811 HD21 LEU 104 1HD2 LEU 104 0.622 -1.054 -2.226 812 HD22 LEU 104 2HD2 LEU 104 -0.988 -0.759 -1.562 813 HD23 LEU 104 3HD2 LEU 104 0.420 0.032 -0.852 814 H ASP 105 H ASP 105 1.195 0.351 -6.321 815 HA ASP 105 HA ASP 105 3.293 1.961 -5.307 816 HB2 ASP 105 2HB ASP 105 3.587 -0.418 -6.002 817 HB3 ASP 105 3HB ASP 105 3.340 0.041 -7.686 818 H VAL 106 H VAL 106 1.580 1.970 -8.423 819 HA VAL 106 HA VAL 106 3.197 3.914 -9.725 820 HB VAL 106 HB VAL 106 0.331 3.005 -10.240 821 HG11 VAL 106 1HG1 VAL 106 2.051 4.753 -12.047 822 HG12 VAL 106 2HG1 VAL 106 0.585 5.258 -11.205 823 HG13 VAL 106 3HG1 VAL 106 0.491 4.044 -12.481 824 HG21 VAL 106 1HG2 VAL 106 2.942 2.307 -11.637 825 HG22 VAL 106 2HG2 VAL 106 1.344 1.703 -12.077 826 HG23 VAL 106 3HG2 VAL 106 2.052 1.269 -10.522 827 H THR 107 H THR 107 0.196 4.208 -7.795 828 HA THR 107 HA THR 107 -0.027 7.052 -8.029 829 HB THR 107 HB THR 107 -1.232 5.290 -5.841 830 HG1 THR 107 HG1 THR 107 -1.957 4.421 -7.722 831 HG21 THR 107 1HG2 THR 107 -2.175 7.943 -7.010 832 HG22 THR 107 2HG2 THR 107 -1.469 7.728 -5.407 833 HG23 THR 107 3HG2 THR 107 -3.030 6.997 -5.791 834 H CYS 108 H CYS 108 1.673 4.889 -5.845 835 HA CYS 108 HA CYS 108 2.524 6.809 -3.920 836 HB2 CYS 108 2HB CYS 108 3.675 4.103 -4.694 837 HB3 CYS 108 3HB CYS 108 4.308 5.086 -3.376 838 HG CYS 108 HG CYS 108 1.012 4.315 -3.336 839 H LYS 109 H LYS 109 3.787 5.747 -7.065 840 HA LYS 109 HA LYS 109 6.182 7.308 -7.004 841 HB2 LYS 109 2HB LYS 109 4.714 5.730 -9.079 842 HB3 LYS 109 3HB LYS 109 5.623 7.088 -9.717 843 HG2 LYS 109 2HG LYS 109 6.954 5.068 -9.840 844 HG3 LYS 109 3HG LYS 109 7.689 6.205 -8.705 845 HD2 LYS 109 2HD LYS 109 6.789 4.902 -6.808 846 HD3 LYS 109 3HD LYS 109 5.994 3.795 -7.932 847 HE2 LYS 109 2HE LYS 109 8.225 3.143 -8.828 848 HE3 LYS 109 3HE LYS 109 8.985 4.213 -7.647 849 HZ1 LYS 109 1HZ LYS 109 8.026 2.874 -5.876 850 HZ2 LYS 109 2HZ LYS 109 8.982 1.926 -6.894 851 HZ3 LYS 109 3HZ LYS 109 7.296 1.852 -7.007 852 H THR 110 H THR 110 2.861 7.922 -8.123 853 HA THR 110 HA THR 110 3.240 10.409 -9.363 854 HB THR 110 HB THR 110 0.738 9.412 -7.913 855 HG1 THR 110 HG1 THR 110 0.280 8.928 -10.300 856 HG21 THR 110 1HG2 THR 110 0.555 11.827 -8.465 857 HG22 THR 110 2HG2 THR 110 -0.516 10.867 -9.489 858 HG23 THR 110 3HG2 THR 110 1.003 11.484 -10.139 859 H VAL 111 H VAL 111 2.345 9.688 -5.957 860 HA VAL 111 HA VAL 111 2.280 12.418 -5.116 861 HB VAL 111 HB VAL 111 2.205 11.566 -2.794 862 HG11 VAL 111 1HG1 VAL 111 0.110 11.664 -4.057 863 HG12 VAL 111 2HG1 VAL 111 0.089 10.300 -2.940 864 HG13 VAL 111 3HG1 VAL 111 0.365 10.025 -4.663 865 HG21 VAL 111 1HG2 VAL 111 3.757 9.675 -2.963 866 HG22 VAL 111 2HG2 VAL 111 2.618 8.803 -3.988 867 HG23 VAL 111 3HG2 VAL 111 2.207 9.144 -2.305 868 H ALA 112 H ALA 112 4.800 9.942 -5.211 869 HA ALA 112 HA ALA 112 6.802 11.345 -3.752 870 HB1 ALA 112 1HB ALA 112 8.372 9.720 -4.726 871 HB2 ALA 112 2HB ALA 112 7.131 9.189 -5.866 872 HB3 ALA 112 3HB ALA 112 6.914 8.919 -4.135 873 H ASN 113 H ASN 113 5.756 11.412 -7.115 874 HA ASN 113 HA ASN 113 7.980 12.807 -8.229 875 HB2 ASN 113 2HB ASN 113 5.107 12.431 -9.172 876 HB3 ASN 113 3HB ASN 113 6.253 13.406 -10.088 877 HD21 ASN 113 1HD2 ASN 113 4.862 10.903 -10.778 878 HD22 ASN 113 2HD2 ASN 113 6.107 9.798 -11.235 879 H MET 114 H MET 114 4.963 13.844 -6.703 880 HA MET 114 HA MET 114 5.044 16.592 -7.368 881 HB2 MET 114 2HB MET 114 3.834 15.326 -4.868 882 HB3 MET 114 3HB MET 114 3.490 16.944 -5.462 883 HG2 MET 114 2HG MET 114 2.567 15.884 -7.551 884 HG3 MET 114 3HG MET 114 2.732 14.319 -6.751 885 HE1 MET 114 1HE MET 114 1.990 15.373 -3.640 886 HE2 MET 114 2HE MET 114 1.424 13.830 -4.287 887 HE3 MET 114 3HE MET 114 0.272 14.977 -3.608 888 H ILE 115 H ILE 115 6.354 14.796 -4.607 889 HA ILE 115 HA ILE 115 7.417 17.198 -3.317 890 HB ILE 115 HB ILE 115 8.104 15.684 -1.496 891 HG12 ILE 115 2HG1 ILE 115 7.059 13.416 -3.265 892 HG13 ILE 115 3HG1 ILE 115 8.751 13.726 -2.906 893 HG21 ILE 115 1HG2 ILE 115 5.790 16.525 -1.505 894 HG22 ILE 115 2HG2 ILE 115 5.867 14.918 -0.786 895 HG23 ILE 115 3HG2 ILE 115 5.263 15.117 -2.433 896 HD11 ILE 115 1HD1 ILE 115 6.654 12.913 -0.901 897 HD12 ILE 115 2HD1 ILE 115 8.361 13.210 -0.561 898 HD13 ILE 115 3HD1 ILE 115 7.892 11.877 -1.612 899 H ARG 116 H ARG 116 8.507 15.046 -5.680 900 HA ARG 116 HA ARG 116 11.218 14.622 -4.961 901 HB2 ARG 116 2HB ARG 116 9.972 13.231 -6.610 902 HB3 ARG 116 3HB ARG 116 9.941 14.585 -7.733 903 HG2 ARG 116 2HG ARG 116 12.335 14.472 -8.043 904 HG3 ARG 116 3HG ARG 116 12.506 13.303 -6.730 905 HD2 ARG 116 2HD ARG 116 12.686 12.171 -8.874 906 HD3 ARG 116 3HD ARG 116 11.217 11.646 -8.053 907 HE ARG 116 HE ARG 116 10.351 13.659 -9.682 908 HH11 ARG 116 1HH1 ARG 116 12.204 10.714 -10.290 909 HH12 ARG 116 2HH1 ARG 116 11.602 10.526 -11.909 910 HH21 ARG 116 1HH2 ARG 116 9.570 13.372 -11.818 911 HH22 ARG 116 2HH2 ARG 116 10.109 12.035 -12.771 912 H GLY 117 H GLY 117 9.622 17.111 -6.953 913 HA2 GLY 117 2HA GLY 117 10.279 19.327 -7.209 914 HA3 GLY 117 3HA GLY 117 11.829 18.963 -6.466 915 H1 SER 2 1H SER 2 15.398 -13.086 20.103 916 H2 SER 2 2H SER 2 14.548 -12.024 19.097 917 H3 SER 2 3H SER 2 15.977 -11.523 19.834 918 HA SER 2 HA SER 2 17.260 -13.093 18.572 919 HB2 SER 2 2HB SER 2 14.579 -13.802 17.294 920 HB3 SER 2 3HB SER 2 16.146 -14.418 16.774 921 HG SER 2 HG SER 2 16.319 -15.174 19.049 922 H LEU 3 H LEU 3 18.398 -11.816 17.157 923 HA LEU 3 HA LEU 3 16.924 -9.630 15.777 924 HB2 LEU 3 2HB LEU 3 19.763 -9.648 16.864 925 HB3 LEU 3 3HB LEU 3 19.011 -8.300 16.021 926 HG LEU 3 HG LEU 3 17.959 -9.400 18.658 927 HD11 LEU 3 1HD1 LEU 3 20.214 -8.609 19.020 928 HD12 LEU 3 2HD1 LEU 3 19.056 -7.510 19.761 929 HD13 LEU 3 3HD1 LEU 3 19.844 -7.069 18.241 930 HD21 LEU 3 1HD2 LEU 3 16.293 -8.158 17.386 931 HD22 LEU 3 2HD2 LEU 3 17.396 -6.789 17.219 932 HD23 LEU 3 3HD2 LEU 3 16.784 -7.247 18.812 933 H VAL 4 H VAL 4 16.854 -9.937 13.642 934 HA VAL 4 HA VAL 4 19.196 -10.966 12.162 935 HB VAL 4 HB VAL 4 17.747 -10.954 10.151 936 HG11 VAL 4 1HG1 VAL 4 16.259 -12.819 10.760 937 HG12 VAL 4 2HG1 VAL 4 16.462 -12.436 12.472 938 HG13 VAL 4 3HG1 VAL 4 17.843 -12.989 11.521 939 HG21 VAL 4 1HG2 VAL 4 15.306 -10.520 10.305 940 HG22 VAL 4 2HG2 VAL 4 16.245 -9.079 10.697 941 HG23 VAL 4 3HG2 VAL 4 15.499 -10.022 11.990 942 H LYS 5 H LYS 5 20.127 -9.644 10.492 943 HA LYS 5 HA LYS 5 20.196 -6.828 11.332 944 HB2 LYS 5 2HB LYS 5 22.112 -8.449 9.607 945 HB3 LYS 5 3HB LYS 5 22.377 -6.791 10.145 946 HG2 LYS 5 2HG LYS 5 22.396 -7.577 12.498 947 HG3 LYS 5 3HG LYS 5 22.173 -9.238 11.943 948 HD2 LYS 5 2HD LYS 5 24.339 -9.125 10.749 949 HD3 LYS 5 3HD LYS 5 24.546 -7.450 11.264 950 HE2 LYS 5 2HE LYS 5 24.641 -8.174 13.616 951 HE3 LYS 5 3HE LYS 5 24.400 -9.852 13.116 952 HZ1 LYS 5 1HZ LYS 5 26.727 -9.430 13.496 953 HZ2 LYS 5 2HZ LYS 5 26.719 -8.127 12.421 954 HZ3 LYS 5 3HZ LYS 5 26.481 -9.696 11.844 955 H LEU 6 H LEU 6 19.507 -5.193 10.070 956 HA LEU 6 HA LEU 6 18.997 -5.623 7.169 957 HB2 LEU 6 2HB LEU 6 17.460 -3.803 9.085 958 HB3 LEU 6 3HB LEU 6 17.197 -3.896 7.349 959 HG LEU 6 HG LEU 6 16.657 -6.127 9.348 960 HD11 LEU 6 1HD1 LEU 6 14.742 -4.363 7.792 961 HD12 LEU 6 2HD1 LEU 6 15.061 -4.299 9.529 962 HD13 LEU 6 3HD1 LEU 6 14.298 -5.723 8.831 963 HD21 LEU 6 1HD2 LEU 6 16.166 -6.081 6.347 964 HD22 LEU 6 2HD2 LEU 6 15.622 -7.336 7.465 965 HD23 LEU 6 3HD2 LEU 6 17.345 -7.081 7.204 966 H GLU 7 H GLU 7 20.685 -4.635 6.174 967 HA GLU 7 HA GLU 7 21.803 -2.138 7.184 968 HB2 GLU 7 2HB GLU 7 22.673 -4.213 5.258 969 HB3 GLU 7 3HB GLU 7 22.967 -2.587 4.655 970 HG2 GLU 7 2HG GLU 7 24.178 -2.052 6.767 971 HG3 GLU 7 3HG GLU 7 23.955 -3.715 7.285 972 H SER 8 H SER 8 20.908 -0.253 6.696 973 HA SER 8 HA SER 8 18.954 0.153 4.619 974 HB2 SER 8 2HB SER 8 19.110 2.558 5.413 975 HB3 SER 8 3HB SER 8 18.791 1.399 6.703 976 HG SER 8 HG SER 8 20.759 1.680 7.493 977 H SER 9 H SER 9 19.339 2.343 3.278 978 HA SER 9 HA SER 9 21.329 1.975 1.331 979 HB2 SER 9 2HB SER 9 19.217 3.249 0.969 980 HB3 SER 9 3HB SER 9 19.810 4.526 2.029 981 HG SER 9 HG SER 9 21.531 4.824 0.544 982 H ASP 10 H ASP 10 21.479 3.524 4.427 983 HA ASP 10 HA ASP 10 23.999 4.929 3.904 984 HB2 ASP 10 2HB ASP 10 22.230 4.812 6.390 985 HB3 ASP 10 3HB ASP 10 23.683 5.794 6.241 986 H GLU 11 H GLU 11 23.442 1.804 4.298 987 HA GLU 11 HA GLU 11 24.643 0.004 4.939 988 HB2 GLU 11 2HB GLU 11 26.829 2.039 5.554 989 HB3 GLU 11 3HB GLU 11 27.075 0.296 5.541 990 HG2 GLU 11 2HG GLU 11 26.607 0.191 3.158 991 HG3 GLU 11 3HG GLU 11 26.185 1.902 3.121 992 H LYS 12 H LYS 12 23.140 1.787 7.000 993 HA LYS 12 HA LYS 12 24.429 1.197 9.529 994 HB2 LYS 12 2HB LYS 12 21.690 2.374 8.889 995 HB3 LYS 12 3HB LYS 12 22.343 2.222 10.517 996 HG2 LYS 12 2HG LYS 12 23.543 3.899 8.285 997 HG3 LYS 12 3HG LYS 12 22.562 4.512 9.621 998 HD2 LYS 12 2HD LYS 12 24.296 3.728 11.231 999 HD3 LYS 12 3HD LYS 12 25.277 3.155 9.878 1000 HE2 LYS 12 2HE LYS 12 25.451 5.472 9.029 1001 HE3 LYS 12 3HE LYS 12 24.474 6.042 10.387 1002 HZ1 LYS 12 1HZ LYS 12 26.840 6.356 10.790 1003 HZ2 LYS 12 2HZ LYS 12 27.123 4.702 10.608 1004 HZ3 LYS 12 3HZ LYS 12 26.191 5.260 11.904 1005 H VAL 13 H VAL 13 24.220 -0.642 10.595 1006 HA VAL 13 HA VAL 13 22.471 -2.761 9.681 1007 HB VAL 13 HB VAL 13 24.555 -2.745 11.920 1008 HG11 VAL 13 1HG1 VAL 13 22.912 -4.534 12.274 1009 HG12 VAL 13 2HG1 VAL 13 24.469 -5.213 11.800 1010 HG13 VAL 13 3HG1 VAL 13 23.158 -5.114 10.625 1011 HG21 VAL 13 1HG2 VAL 13 25.550 -2.299 9.704 1012 HG22 VAL 13 2HG2 VAL 13 24.805 -3.766 9.064 1013 HG23 VAL 13 3HG2 VAL 13 26.045 -3.880 10.317 1014 H PHE 14 H PHE 14 20.395 -2.082 10.280 1015 HA PHE 14 HA PHE 14 19.668 -1.704 13.067 1016 HB2 PHE 14 2HB PHE 14 17.969 -1.988 10.543 1017 HB3 PHE 14 3HB PHE 14 17.311 -1.682 12.150 1018 HD1 PHE 14 HD1 PHE 14 17.868 0.460 13.340 1019 HD2 PHE 14 HD2 PHE 14 18.902 -0.178 9.238 1020 HE1 PHE 14 HE1 PHE 14 18.209 2.876 13.044 1021 HE2 PHE 14 HE2 PHE 14 19.238 2.238 8.953 1022 HZ PHE 14 HZ PHE 14 18.899 3.764 10.855 1023 H GLU 15 H GLU 15 20.317 -3.576 14.070 1024 HA GLU 15 HA GLU 15 19.473 -6.212 13.329 1025 HB2 GLU 15 2HB GLU 15 20.386 -5.154 16.040 1026 HB3 GLU 15 3HB GLU 15 20.227 -6.855 15.604 1027 HG2 GLU 15 2HG GLU 15 21.979 -6.531 13.859 1028 HG3 GLU 15 3HG GLU 15 22.167 -4.862 14.392 1029 H ILE 16 H ILE 16 17.302 -6.207 13.010 1030 HA ILE 16 HA ILE 16 15.449 -5.201 15.078 1031 HB ILE 16 HB ILE 16 15.197 -4.526 12.630 1032 HG12 ILE 16 2HG1 ILE 16 12.721 -4.802 12.551 1033 HG13 ILE 16 3HG1 ILE 16 12.815 -6.005 13.835 1034 HG21 ILE 16 1HG2 ILE 16 15.798 -6.663 11.568 1035 HG22 ILE 16 2HG2 ILE 16 14.208 -6.119 11.027 1036 HG23 ILE 16 3HG2 ILE 16 14.339 -7.414 12.218 1037 HD11 ILE 16 1HD1 ILE 16 12.077 -3.827 14.633 1038 HD12 ILE 16 2HD1 ILE 16 13.591 -3.102 14.099 1039 HD13 ILE 16 3HD1 ILE 16 13.594 -4.307 15.390 1040 H GLU 17 H GLU 17 13.764 -6.583 15.913 1041 HA GLU 17 HA GLU 17 14.391 -9.285 16.417 1042 HB2 GLU 17 2HB GLU 17 11.869 -7.647 16.758 1043 HB3 GLU 17 3HB GLU 17 11.861 -9.370 17.113 1044 HG2 GLU 17 2HG GLU 17 13.758 -7.395 18.423 1045 HG3 GLU 17 3HG GLU 17 12.201 -7.875 19.101 1046 H LYS 18 H LYS 18 13.657 -11.171 15.586 1047 HA LYS 18 HA LYS 18 13.357 -11.361 12.805 1048 HB2 LYS 18 2HB LYS 18 14.431 -13.124 14.116 1049 HB3 LYS 18 3HB LYS 18 12.953 -13.417 15.024 1050 HG2 LYS 18 2HG LYS 18 13.317 -15.189 13.394 1051 HG3 LYS 18 3HG LYS 18 11.861 -14.278 12.982 1052 HD2 LYS 18 2HD LYS 18 13.185 -13.014 11.276 1053 HD3 LYS 18 3HD LYS 18 14.594 -14.008 11.665 1054 HE2 LYS 18 2HE LYS 18 11.956 -15.004 10.538 1055 HE3 LYS 18 3HE LYS 18 13.473 -14.841 9.652 1056 HZ1 LYS 18 1HZ LYS 18 13.119 -17.115 10.316 1057 HZ2 LYS 18 2HZ LYS 18 12.974 -16.673 11.936 1058 HZ3 LYS 18 3HZ LYS 18 14.454 -16.493 11.141 1059 H GLU 19 H GLU 19 11.009 -11.580 15.441 1060 HA GLU 19 HA GLU 19 8.768 -12.462 13.996 1061 HB2 GLU 19 2HB GLU 19 8.622 -10.562 16.373 1062 HB3 GLU 19 3HB GLU 19 7.432 -11.755 15.871 1063 HG2 GLU 19 2HG GLU 19 10.122 -12.259 17.155 1064 HG3 GLU 19 3HG GLU 19 8.534 -12.559 17.847 1065 H ILE 20 H ILE 20 10.032 -9.229 14.587 1066 HA ILE 20 HA ILE 20 7.953 -7.697 13.396 1067 HB ILE 20 HB ILE 20 10.895 -7.047 13.893 1068 HG12 ILE 20 2HG1 ILE 20 8.413 -6.327 15.523 1069 HG13 ILE 20 3HG1 ILE 20 9.605 -7.547 15.956 1070 HG21 ILE 20 1HG2 ILE 20 8.648 -5.162 13.137 1071 HG22 ILE 20 2HG2 ILE 20 10.067 -5.551 12.165 1072 HG23 ILE 20 3HG2 ILE 20 10.250 -4.655 13.673 1073 HD11 ILE 20 1HD1 ILE 20 9.957 -5.550 17.239 1074 HD12 ILE 20 2HD1 ILE 20 10.077 -4.571 15.778 1075 HD13 ILE 20 3HD1 ILE 20 11.314 -5.782 16.138 1076 H ALA 21 H ALA 21 11.061 -8.942 12.226 1077 HA ALA 21 HA ALA 21 10.986 -7.854 9.613 1078 HB1 ALA 21 1HB ALA 21 12.845 -9.397 9.161 1079 HB2 ALA 21 2HB ALA 21 12.490 -10.275 10.653 1080 HB3 ALA 21 3HB ALA 21 13.045 -8.598 10.725 1081 H CYS 22 H CYS 22 9.587 -10.746 11.016 1082 HA CYS 22 HA CYS 22 8.764 -11.981 8.556 1083 HB2 CYS 22 2HB CYS 22 7.814 -12.392 11.413 1084 HB3 CYS 22 3HB CYS 22 7.339 -13.401 10.046 1085 HG CYS 22 HG CYS 22 10.649 -13.043 10.698 1086 H MET 23 H MET 23 7.284 -9.663 10.848 1087 HA MET 23 HA MET 23 4.676 -9.582 9.714 1088 HB2 MET 23 2HB MET 23 6.139 -7.303 11.127 1089 HB3 MET 23 3HB MET 23 4.419 -7.334 10.766 1090 HG2 MET 23 2HG MET 23 4.281 -9.399 12.251 1091 HG3 MET 23 3HG MET 23 5.921 -9.017 12.771 1092 HE1 MET 23 1HE MET 23 5.219 -5.315 14.266 1093 HE2 MET 23 2HE MET 23 5.538 -5.644 12.564 1094 HE3 MET 23 3HE MET 23 6.499 -6.442 13.811 1095 H SER 24 H SER 24 7.648 -7.885 8.972 1096 HA SER 24 HA SER 24 6.682 -6.407 6.718 1097 HB2 SER 24 2HB SER 24 8.790 -5.810 7.924 1098 HB3 SER 24 3HB SER 24 9.521 -7.326 7.389 1099 HG SER 24 HG SER 24 8.445 -5.464 5.564 1100 H VAL 25 H VAL 25 5.763 -7.521 5.063 1101 HA VAL 25 HA VAL 25 6.065 -10.304 4.700 1102 HB VAL 25 HB VAL 25 4.818 -8.302 2.768 1103 HG11 VAL 25 1HG1 VAL 25 5.262 -10.450 1.652 1104 HG12 VAL 25 2HG1 VAL 25 3.528 -10.212 1.869 1105 HG13 VAL 25 3HG1 VAL 25 4.407 -11.314 2.932 1106 HG21 VAL 25 1HG2 VAL 25 2.653 -8.883 3.833 1107 HG22 VAL 25 2HG2 VAL 25 3.773 -8.151 4.984 1108 HG23 VAL 25 3HG2 VAL 25 3.507 -9.895 5.005 1109 H THR 26 H THR 26 7.461 -7.545 2.922 1110 HA THR 26 HA THR 26 8.663 -8.978 0.798 1111 HB THR 26 HB THR 26 9.408 -6.288 2.022 1112 HG1 THR 26 HG1 THR 26 8.149 -5.478 0.353 1113 HG21 THR 26 1HG2 THR 26 10.596 -5.780 -0.097 1114 HG22 THR 26 2HG2 THR 26 10.334 -7.437 -0.647 1115 HG23 THR 26 3HG2 THR 26 11.363 -7.129 0.752 1116 H ILE 27 H ILE 27 10.032 -7.935 3.952 1117 HA ILE 27 HA ILE 27 12.655 -8.956 3.534 1118 HB ILE 27 HB ILE 27 11.176 -8.415 6.150 1119 HG12 ILE 27 2HG1 ILE 27 13.210 -6.690 4.655 1120 HG13 ILE 27 3HG1 ILE 27 11.470 -6.420 4.661 1121 HG21 ILE 27 1HG2 ILE 27 14.159 -8.871 5.728 1122 HG22 ILE 27 2HG2 ILE 27 13.051 -9.963 6.562 1123 HG23 ILE 27 3HG2 ILE 27 13.402 -8.375 7.245 1124 HD11 ILE 27 1HD1 ILE 27 12.599 -4.914 6.176 1125 HD12 ILE 27 2HD1 ILE 27 13.281 -6.275 7.066 1126 HD13 ILE 27 3HD1 ILE 27 11.537 -6.006 7.062 1127 H LYS 28 H LYS 28 9.756 -10.297 5.099 1128 HA LYS 28 HA LYS 28 10.619 -12.836 5.846 1129 HB2 LYS 28 2HB LYS 28 8.411 -11.929 6.450 1130 HB3 LYS 28 3HB LYS 28 7.923 -11.924 4.760 1131 HG2 LYS 28 2HG LYS 28 8.232 -14.488 4.827 1132 HG3 LYS 28 3HG LYS 28 8.327 -14.307 6.579 1133 HD2 LYS 28 2HD LYS 28 6.056 -14.926 5.842 1134 HD3 LYS 28 3HD LYS 28 6.073 -13.353 6.641 1135 HE2 LYS 28 2HE LYS 28 4.624 -13.447 4.602 1136 HE3 LYS 28 3HE LYS 28 5.874 -12.207 4.513 1137 HZ1 LYS 28 1HZ LYS 28 5.642 -13.434 2.440 1138 HZ2 LYS 28 2HZ LYS 28 6.000 -14.883 3.225 1139 HZ3 LYS 28 3HZ LYS 28 7.174 -13.681 3.104 1140 H ASN 29 H ASN 29 9.418 -11.679 2.688 1141 HA ASN 29 HA ASN 29 9.419 -14.171 1.321 1142 HB2 ASN 29 2HB ASN 29 9.517 -11.304 0.277 1143 HB3 ASN 29 3HB ASN 29 9.439 -12.698 -0.795 1144 HD21 ASN 29 1HD2 ASN 29 7.567 -10.516 -0.499 1145 HD22 ASN 29 2HD2 ASN 29 6.045 -11.222 -0.085 1146 H MET 30 H MET 30 11.868 -11.629 1.700 1147 HA MET 30 HA MET 30 13.830 -12.633 -0.063 1148 HB2 MET 30 2HB MET 30 13.847 -10.716 2.257 1149 HB3 MET 30 3HB MET 30 15.399 -11.399 1.807 1150 HG2 MET 30 2HG MET 30 15.059 -9.234 0.757 1151 HG3 MET 30 3HG MET 30 15.172 -10.509 -0.453 1152 HE1 MET 30 1HE MET 30 14.213 -8.783 -2.301 1153 HE2 MET 30 2HE MET 30 14.117 -7.535 -1.054 1154 HE3 MET 30 3HE MET 30 12.718 -7.876 -2.073 1155 H ILE 31 H ILE 31 13.278 -13.188 3.408 1156 HA ILE 31 HA ILE 31 15.447 -14.892 3.954 1157 HB ILE 31 HB ILE 31 12.698 -14.737 5.291 1158 HG12 ILE 31 2HG1 ILE 31 15.366 -13.525 6.164 1159 HG13 ILE 31 3HG1 ILE 31 14.095 -12.637 5.335 1160 HG21 ILE 31 1HG2 ILE 31 13.706 -15.867 7.256 1161 HG22 ILE 31 2HG2 ILE 31 15.202 -16.107 6.351 1162 HG23 ILE 31 3HG2 ILE 31 13.720 -16.913 5.831 1163 HD11 ILE 31 1HD1 ILE 31 12.596 -13.032 7.236 1164 HD12 ILE 31 2HD1 ILE 31 14.059 -12.159 7.687 1165 HD13 ILE 31 3HD1 ILE 31 13.905 -13.872 8.078 1166 H GLU 32 H GLU 32 12.080 -15.646 3.018 1167 HA GLU 32 HA GLU 32 12.293 -18.473 3.035 1168 HB2 GLU 32 2HB GLU 32 10.343 -16.641 1.575 1169 HB3 GLU 32 3HB GLU 32 10.148 -18.387 1.700 1170 HG2 GLU 32 2HG GLU 32 9.913 -18.236 4.126 1171 HG3 GLU 32 3HG GLU 32 10.253 -16.507 4.082 1172 H ASP 33 H ASP 33 12.854 -16.073 0.509 1173 HA ASP 33 HA ASP 33 12.928 -17.881 -1.717 1174 HB2 ASP 33 2HB ASP 33 12.365 -15.446 -1.906 1175 HB3 ASP 33 3HB ASP 33 14.030 -15.039 -1.512 1176 H ILE 34 H ILE 34 15.397 -16.399 0.345 1177 HA ILE 34 HA ILE 34 17.625 -17.779 -0.943 1178 HB ILE 34 HB ILE 34 17.600 -16.170 1.667 1179 HG12 ILE 34 2HG1 ILE 34 18.346 -15.181 -1.133 1180 HG13 ILE 34 3HG1 ILE 34 16.831 -14.814 -0.316 1181 HG21 ILE 34 1HG2 ILE 34 20.039 -15.918 1.328 1182 HG22 ILE 34 2HG2 ILE 34 19.949 -16.919 -0.122 1183 HG23 ILE 34 3HG2 ILE 34 19.591 -17.623 1.456 1184 HD11 ILE 34 1HD1 ILE 34 18.069 -13.629 1.441 1185 HD12 ILE 34 2HD1 ILE 34 18.356 -12.952 -0.160 1186 HD13 ILE 34 3HD1 ILE 34 19.584 -13.966 0.596 1187 H GLY 35 H GLY 35 15.186 -18.715 1.126 1188 HA2 GLY 35 2HA GLY 35 14.922 -20.890 2.001 1189 HA3 GLY 35 3HA GLY 35 16.668 -21.053 2.159 1190 H GLU 36 H GLU 36 17.578 -19.126 3.576 1191 HA GLU 36 HA GLU 36 15.970 -18.022 5.645 1192 HB2 GLU 36 2HB GLU 36 16.104 -20.313 6.560 1193 HB3 GLU 36 3HB GLU 36 17.858 -20.305 6.414 1194 HG2 GLU 36 2HG GLU 36 18.035 -18.580 8.124 1195 HG3 GLU 36 3HG GLU 36 16.280 -18.439 8.214 1196 H SER 37 H SER 37 17.064 -16.255 6.553 1197 HA SER 37 HA SER 37 19.951 -15.929 6.167 1198 HB2 SER 37 2HB SER 37 17.920 -14.018 4.918 1199 HB3 SER 37 3HB SER 37 19.661 -13.732 5.001 1200 HG SER 37 HG SER 37 19.693 -15.933 3.892 1201 H ASP 38 H ASP 38 20.548 -15.459 8.214 1202 HA ASP 38 HA ASP 38 19.176 -13.364 9.784 1203 HB2 ASP 38 2HB ASP 38 20.746 -13.941 11.592 1204 HB3 ASP 38 3HB ASP 38 19.985 -15.402 10.984 1205 H SER 39 H SER 39 21.551 -13.677 7.441 1206 HA SER 39 HA SER 39 23.624 -11.950 8.115 1207 HB2 SER 39 2HB SER 39 23.935 -11.872 5.569 1208 HB3 SER 39 3HB SER 39 23.838 -13.487 6.271 1209 HG SER 39 HG SER 39 22.289 -13.796 4.901 1210 HA PRO 40 HA PRO 40 22.041 -7.752 7.659 1211 HB2 PRO 40 2HB PRO 40 24.420 -7.031 5.976 1212 HB3 PRO 40 3HB PRO 40 23.882 -6.348 7.526 1213 HG2 PRO 40 2HG PRO 40 26.034 -7.930 7.404 1214 HG3 PRO 40 3HG PRO 40 24.917 -8.002 8.788 1215 HD2 PRO 40 2HD PRO 40 25.129 -9.882 6.438 1216 HD3 PRO 40 3HD PRO 40 24.879 -10.251 8.161 1217 H ILE 41 H ILE 41 20.243 -8.199 6.380 1218 HA ILE 41 HA ILE 41 20.271 -8.499 3.540 1219 HB ILE 41 HB ILE 41 17.953 -7.781 5.397 1220 HG12 ILE 41 2HG1 ILE 41 18.927 -9.981 5.945 1221 HG13 ILE 41 3HG1 ILE 41 17.330 -10.188 5.238 1222 HG21 ILE 41 1HG2 ILE 41 17.404 -7.113 3.106 1223 HG22 ILE 41 2HG2 ILE 41 16.451 -8.525 3.562 1224 HG23 ILE 41 3HG2 ILE 41 17.851 -8.712 2.502 1225 HD11 ILE 41 1HD1 ILE 41 19.975 -10.614 3.847 1226 HD12 ILE 41 2HD1 ILE 41 18.387 -10.796 3.091 1227 HD13 ILE 41 3HD1 ILE 41 18.864 -11.855 4.416 1228 HA PRO 42 HA PRO 42 20.838 -4.015 3.042 1229 HB2 PRO 42 2HB PRO 42 21.588 -4.002 0.430 1230 HB3 PRO 42 3HB PRO 42 22.668 -4.582 1.714 1231 HG2 PRO 42 2HG PRO 42 21.016 -6.169 -0.214 1232 HG3 PRO 42 3HG PRO 42 22.673 -6.465 0.362 1233 HD2 PRO 42 2HD PRO 42 20.429 -7.741 1.374 1234 HD3 PRO 42 3HD PRO 42 21.951 -7.544 2.268 1235 H LEU 43 H LEU 43 19.240 -2.622 2.804 1236 HA LEU 43 HA LEU 43 17.026 -3.011 0.899 1237 HB2 LEU 43 2HB LEU 43 16.966 -1.654 3.638 1238 HB3 LEU 43 3HB LEU 43 15.595 -1.827 2.556 1239 HG LEU 43 HG LEU 43 17.045 -4.160 3.881 1240 HD11 LEU 43 1HD1 LEU 43 14.410 -2.882 4.676 1241 HD12 LEU 43 2HD1 LEU 43 15.924 -2.827 5.582 1242 HD13 LEU 43 3HD1 LEU 43 15.090 -4.363 5.362 1243 HD21 LEU 43 1HD2 LEU 43 15.111 -5.515 3.148 1244 HD22 LEU 43 2HD2 LEU 43 15.993 -4.833 1.785 1245 HD23 LEU 43 3HD2 LEU 43 14.459 -4.118 2.284 1246 HA PRO 44 HA PRO 44 19.520 0.710 -0.326 1247 HB2 PRO 44 2HB PRO 44 19.077 0.575 -3.029 1248 HB3 PRO 44 3HB PRO 44 20.222 -0.496 -2.194 1249 HG2 PRO 44 2HG PRO 44 17.382 -1.064 -3.003 1250 HG3 PRO 44 3HG PRO 44 18.837 -2.063 -3.242 1251 HD2 PRO 44 2HD PRO 44 17.116 -2.534 -1.206 1252 HD3 PRO 44 3HD PRO 44 18.864 -2.796 -1.025 1253 H ASN 45 H ASN 45 16.141 0.063 -1.107 1254 HA ASN 45 HA ASN 45 15.631 2.736 -2.156 1255 HB2 ASN 45 2HB ASN 45 13.794 0.349 -1.713 1256 HB3 ASN 45 3HB ASN 45 13.266 1.877 -2.409 1257 HD21 ASN 45 1HD2 ASN 45 12.665 0.851 -4.344 1258 HD22 ASN 45 2HD2 ASN 45 13.832 0.300 -5.491 1259 H VAL 46 H VAL 46 16.225 2.035 0.861 1260 HA VAL 46 HA VAL 46 14.425 4.098 1.876 1261 HB VAL 46 HB VAL 46 13.282 1.953 2.427 1262 HG11 VAL 46 1HG1 VAL 46 15.220 0.465 2.596 1263 HG12 VAL 46 2HG1 VAL 46 14.209 0.357 4.038 1264 HG13 VAL 46 3HG1 VAL 46 15.723 1.264 4.088 1265 HG21 VAL 46 1HG2 VAL 46 12.948 3.876 3.897 1266 HG22 VAL 46 2HG2 VAL 46 14.350 3.416 4.868 1267 HG23 VAL 46 3HG2 VAL 46 12.920 2.380 4.834 1268 H THR 47 H THR 47 15.522 5.531 3.103 1269 HA THR 47 HA THR 47 18.339 5.234 3.657 1270 HB THR 47 HB THR 47 18.114 7.498 4.748 1271 HG1 THR 47 HG1 THR 47 16.142 8.406 5.010 1272 HG21 THR 47 1HG2 THR 47 16.785 7.305 2.014 1273 HG22 THR 47 2HG2 THR 47 18.524 7.394 2.309 1274 HG23 THR 47 3HG2 THR 47 17.490 8.765 2.714 1275 H SER 48 H SER 48 19.172 5.750 5.896 1276 HA SER 48 HA SER 48 18.366 3.753 7.726 1277 HB2 SER 48 2HB SER 48 20.070 4.833 9.246 1278 HB3 SER 48 3HB SER 48 20.681 4.454 7.636 1279 HG SER 48 HG SER 48 20.459 6.619 7.079 1280 H THR 49 H THR 49 17.746 7.229 7.577 1281 HA THR 49 HA THR 49 16.650 7.600 10.156 1282 HB THR 49 HB THR 49 15.606 9.679 9.075 1283 HG1 THR 49 HG1 THR 49 15.769 9.935 6.942 1284 HG21 THR 49 1HG2 THR 49 17.762 10.803 8.657 1285 HG22 THR 49 2HG2 THR 49 18.572 9.237 8.560 1286 HG23 THR 49 3HG2 THR 49 17.864 9.773 10.088 1287 H ILE 50 H ILE 50 15.073 6.986 6.990 1288 HA ILE 50 HA ILE 50 12.401 6.992 8.012 1289 HB ILE 50 HB ILE 50 13.489 5.885 5.382 1290 HG12 ILE 50 2HG1 ILE 50 13.854 8.328 5.610 1291 HG13 ILE 50 3HG1 ILE 50 12.676 7.989 4.353 1292 HG21 ILE 50 1HG2 ILE 50 11.153 5.995 4.539 1293 HG22 ILE 50 2HG2 ILE 50 10.600 6.405 6.164 1294 HG23 ILE 50 3HG2 ILE 50 11.341 4.835 5.858 1295 HD11 ILE 50 1HD1 ILE 50 12.069 9.927 5.685 1296 HD12 ILE 50 2HD1 ILE 50 12.035 8.944 7.146 1297 HD13 ILE 50 3HD1 ILE 50 10.866 8.650 5.855 1298 H LEU 51 H LEU 51 14.715 4.401 7.117 1299 HA LEU 51 HA LEU 51 13.081 2.162 7.555 1300 HB2 LEU 51 2HB LEU 51 15.261 2.050 6.344 1301 HB3 LEU 51 3HB LEU 51 16.113 2.330 7.854 1302 HG LEU 51 HG LEU 51 15.267 0.151 8.738 1303 HD11 LEU 51 1HD1 LEU 51 14.034 -0.240 5.996 1304 HD12 LEU 51 2HD1 LEU 51 13.164 -0.013 7.517 1305 HD13 LEU 51 3HD1 LEU 51 14.143 -1.457 7.273 1306 HD21 LEU 51 1HD2 LEU 51 17.449 0.199 7.628 1307 HD22 LEU 51 2HD2 LEU 51 16.685 -0.131 6.070 1308 HD23 LEU 51 3HD2 LEU 51 16.631 -1.340 7.357 1309 H GLU 52 H GLU 52 15.115 4.017 9.777 1310 HA GLU 52 HA GLU 52 15.063 2.410 12.058 1311 HB2 GLU 52 2HB GLU 52 16.449 4.467 11.827 1312 HB3 GLU 52 3HB GLU 52 14.996 5.459 11.890 1313 HG2 GLU 52 2HG GLU 52 14.568 4.655 14.203 1314 HG3 GLU 52 3HG GLU 52 16.051 3.703 14.133 1315 H LYS 53 H LYS 53 12.812 4.931 10.963 1316 HA LYS 53 HA LYS 53 11.060 4.777 13.216 1317 HB2 LYS 53 2HB LYS 53 10.634 6.057 10.481 1318 HB3 LYS 53 3HB LYS 53 9.582 6.273 11.880 1319 HG2 LYS 53 2HG LYS 53 11.550 7.228 13.128 1320 HG3 LYS 53 3HG LYS 53 12.468 7.158 11.624 1321 HD2 LYS 53 2HD LYS 53 11.578 9.417 12.014 1322 HD3 LYS 53 3HD LYS 53 10.879 8.705 10.558 1323 HE2 LYS 53 2HE LYS 53 8.772 8.386 11.584 1324 HE3 LYS 53 3HE LYS 53 9.438 8.547 13.211 1325 HZ1 LYS 53 1HZ LYS 53 8.198 10.512 12.528 1326 HZ2 LYS 53 2HZ LYS 53 9.267 10.753 11.238 1327 HZ3 LYS 53 3HZ LYS 53 9.820 10.871 12.826 1328 H VAL 54 H VAL 54 11.009 3.341 9.981 1329 HA VAL 54 HA VAL 54 8.358 2.344 10.022 1330 HB VAL 54 HB VAL 54 10.803 1.393 8.446 1331 HG11 VAL 54 1HG1 VAL 54 7.881 0.651 8.015 1332 HG12 VAL 54 2HG1 VAL 54 9.156 -0.436 8.569 1333 HG13 VAL 54 3HG1 VAL 54 9.218 0.231 6.938 1334 HG21 VAL 54 1HG2 VAL 54 9.802 2.660 6.576 1335 HG22 VAL 54 2HG2 VAL 54 10.092 3.715 7.958 1336 HG23 VAL 54 3HG2 VAL 54 8.458 3.150 7.613 1337 H LEU 55 H LEU 55 11.475 0.929 10.960 1338 HA LEU 55 HA LEU 55 10.399 -1.566 11.881 1339 HB2 LEU 55 2HB LEU 55 13.080 -0.230 12.429 1340 HB3 LEU 55 3HB LEU 55 12.677 -1.877 12.893 1341 HG LEU 55 HG LEU 55 12.877 -0.836 10.038 1342 HD11 LEU 55 1HD1 LEU 55 14.719 -2.707 11.555 1343 HD12 LEU 55 2HD1 LEU 55 15.061 -1.032 11.110 1344 HD13 LEU 55 3HD1 LEU 55 14.865 -2.253 9.854 1345 HD21 LEU 55 1HD2 LEU 55 12.284 -3.659 11.000 1346 HD22 LEU 55 2HD2 LEU 55 12.595 -3.179 9.329 1347 HD23 LEU 55 3HD2 LEU 55 11.166 -2.574 10.161 1348 H ASP 56 H ASP 56 10.983 1.574 13.319 1349 HA ASP 56 HA ASP 56 10.964 0.887 16.074 1350 HB2 ASP 56 2HB ASP 56 11.936 2.998 15.213 1351 HB3 ASP 56 3HB ASP 56 10.341 3.555 14.721 1352 H TYR 57 H TYR 57 8.407 2.129 13.929 1353 HA TYR 57 HA TYR 57 6.259 2.145 15.739 1354 HB2 TYR 57 2HB TYR 57 6.067 3.216 13.545 1355 HB3 TYR 57 3HB TYR 57 6.321 1.683 12.719 1356 HD1 TYR 57 HD1 TYR 57 3.914 3.620 14.792 1357 HD2 TYR 57 HD2 TYR 57 4.465 0.151 12.354 1358 HE1 TYR 57 HE1 TYR 57 1.496 3.205 14.825 1359 HE2 TYR 57 HE2 TYR 57 2.047 -0.264 12.388 1360 HH TYR 57 HH TYR 57 -0.205 2.027 13.589 1361 H CYS 58 H CYS 58 7.564 -0.401 13.658 1362 HA CYS 58 HA CYS 58 5.648 -2.397 14.259 1363 HB2 CYS 58 2HB CYS 58 8.440 -2.585 13.096 1364 HB3 CYS 58 3HB CYS 58 7.289 -3.917 13.146 1365 HG CYS 58 HG CYS 58 7.666 -1.769 10.809 1366 H ARG 59 H ARG 59 8.669 -1.422 15.843 1367 HA ARG 59 HA ARG 59 9.019 -3.551 17.656 1368 HB2 ARG 59 2HB ARG 59 9.570 -0.585 18.100 1369 HB3 ARG 59 3HB ARG 59 10.092 -1.856 19.197 1370 HG2 ARG 59 2HG ARG 59 11.544 -2.792 17.459 1371 HG3 ARG 59 3HG ARG 59 10.985 -1.568 16.317 1372 HD2 ARG 59 2HD ARG 59 11.894 0.203 17.853 1373 HD3 ARG 59 3HD ARG 59 12.552 -1.079 18.875 1374 HE ARG 59 HE ARG 59 13.362 -0.621 16.061 1375 HH11 ARG 59 1HH1 ARG 59 14.217 -1.446 19.375 1376 HH12 ARG 59 2HH1 ARG 59 15.900 -1.660 19.017 1377 HH21 ARG 59 1HH2 ARG 59 15.573 -0.891 15.599 1378 HH22 ARG 59 2HH2 ARG 59 16.668 -1.342 16.872 1379 H HIS 60 H HIS 60 6.942 -0.684 17.803 1380 HA HIS 60 HA HIS 60 5.851 -0.990 20.372 1381 HB2 HIS 60 2HB HIS 60 5.558 1.068 19.066 1382 HB3 HIS 60 3HB HIS 60 4.598 0.220 17.866 1383 HD1 HIS 60 HD1 HIS 60 4.411 1.485 21.427 1384 HD2 HIS 60 HD2 HIS 60 1.899 0.076 18.432 1385 HE1 HIS 60 HE1 HIS 60 2.079 1.970 22.216 1386 HE2 HIS 60 HE2 HIS 60 0.634 1.406 20.247 1387 H HIS 61 H HIS 61 4.974 -2.497 17.313 1388 HA HIS 61 HA HIS 61 2.578 -3.777 18.317 1389 HB2 HIS 61 2HB HIS 61 4.083 -3.866 15.686 1390 HB3 HIS 61 3HB HIS 61 2.769 -4.997 16.007 1391 HD1 HIS 61 HD1 HIS 61 0.651 -4.209 15.028 1392 HD2 HIS 61 HD2 HIS 61 2.993 -1.021 16.317 1393 HE1 HIS 61 HE1 HIS 61 -0.696 -2.144 14.553 1394 HE2 HIS 61 HE2 HIS 61 0.755 -0.232 15.293 1395 H HIS 62 H HIS 62 5.946 -4.571 18.246 1396 HA HIS 62 HA HIS 62 5.589 -7.414 18.730 1397 HB2 HIS 62 2HB HIS 62 7.595 -6.631 17.569 1398 HB3 HIS 62 3HB HIS 62 8.025 -5.594 18.920 1399 HD1 HIS 62 HD1 HIS 62 7.150 -9.324 18.964 1400 HD2 HIS 62 HD2 HIS 62 10.302 -6.757 19.824 1401 HE1 HIS 62 HE1 HIS 62 8.960 -10.773 19.939 1402 HE2 HIS 62 HE2 HIS 62 10.873 -9.203 20.400 1403 H GLN 63 H GLN 63 6.461 -4.555 20.639 1404 HA GLN 63 HA GLN 63 6.742 -5.938 23.150 1405 HB2 GLN 63 2HB GLN 63 6.549 -2.950 22.554 1406 HB3 GLN 63 3HB GLN 63 7.021 -3.648 24.103 1407 HG2 GLN 63 2HG GLN 63 9.021 -4.643 23.043 1408 HG3 GLN 63 3HG GLN 63 8.545 -3.946 21.495 1409 HE21 GLN 63 1HE2 GLN 63 10.450 -2.748 21.324 1410 HE22 GLN 63 2HE2 GLN 63 10.788 -1.372 22.307 1411 H HIS 64 H HIS 64 4.216 -4.184 21.498 1412 HA HIS 64 HA HIS 64 2.238 -5.045 23.523 1413 HB2 HIS 64 2HB HIS 64 2.191 -2.346 22.065 1414 HB3 HIS 64 3HB HIS 64 0.956 -2.942 23.169 1415 HD1 HIS 64 HD1 HIS 64 1.390 -2.699 25.671 1416 HD2 HIS 64 HD2 HIS 64 4.570 -1.427 23.324 1417 HE1 HIS 64 HE1 HIS 64 2.958 -1.534 27.232 1418 HE2 HIS 64 HE2 HIS 64 4.951 -0.938 25.826 1419 HA PRO 65 HA PRO 65 1.262 -6.914 19.340 1420 HB2 PRO 65 2HB PRO 65 -0.524 -8.785 20.484 1421 HB3 PRO 65 3HB PRO 65 1.200 -9.064 20.170 1422 HG2 PRO 65 2HG PRO 65 -0.141 -8.254 22.722 1423 HG3 PRO 65 3HG PRO 65 1.201 -9.394 22.469 1424 HD2 PRO 65 2HD PRO 65 1.671 -6.931 23.408 1425 HD3 PRO 65 3HD PRO 65 2.794 -7.676 22.243 1426 H GLY 66 H GLY 66 0.167 -5.184 18.515 1427 HA2 GLY 66 2HA GLY 66 -1.743 -4.197 17.626 1428 HA3 GLY 66 3HA GLY 66 -2.743 -5.048 18.796 1429 H GLY 67 H GLY 67 -1.535 -4.284 21.193 1430 HA2 GLY 67 2HA GLY 67 -1.495 -2.578 22.751 1431 HA3 GLY 67 3HA GLY 67 -1.481 -1.394 21.448 1432 H SER 68 H SER 68 -3.413 -0.539 20.720 1433 HA SER 68 HA SER 68 -5.584 0.005 20.515 1434 HB2 SER 68 2HB SER 68 -6.011 -2.943 21.147 1435 HB3 SER 68 3HB SER 68 -7.227 -1.873 20.437 1436 HG SER 68 HG SER 68 -5.543 -1.499 18.750 1437 H GLY 69 H GLY 69 -7.905 -0.221 21.594 1438 HA2 GLY 69 2HA GLY 69 -8.494 -0.958 24.147 1439 HA3 GLY 69 3HA GLY 69 -7.708 0.609 24.360 1440 H LEU 70 H LEU 70 -9.524 1.681 25.060 1441 HA LEU 70 HA LEU 70 -11.906 1.924 23.423 1442 HB2 LEU 70 2HB LEU 70 -12.085 2.063 25.879 1443 HB3 LEU 70 3HB LEU 70 -10.971 3.418 25.912 1444 HG LEU 70 HG LEU 70 -12.654 4.787 24.652 1445 HD11 LEU 70 1HD1 LEU 70 -14.982 4.009 24.460 1446 HD12 LEU 70 2HD1 LEU 70 -14.499 2.416 25.045 1447 HD13 LEU 70 3HD1 LEU 70 -13.877 3.017 23.506 1448 HD21 LEU 70 1HD2 LEU 70 -12.513 4.952 27.096 1449 HD22 LEU 70 2HD2 LEU 70 -13.684 3.641 27.265 1450 HD23 LEU 70 3HD2 LEU 70 -14.171 5.174 26.540 1451 H ASP 71 H ASP 71 -9.010 3.774 24.221 1452 HA ASP 71 HA ASP 71 -9.439 5.539 21.885 1453 HB2 ASP 71 2HB ASP 71 -9.213 6.772 24.028 1454 HB3 ASP 71 3HB ASP 71 -7.671 5.980 24.336 1455 H ASP 72 H ASP 72 -8.458 4.649 20.221 1456 HA ASP 72 HA ASP 72 -6.011 3.062 20.451 1457 HB2 ASP 72 2HB ASP 72 -8.105 3.448 18.305 1458 HB3 ASP 72 3HB ASP 72 -6.518 2.844 17.832 1459 H ILE 73 H ILE 73 -5.989 6.075 20.781 1460 HA ILE 73 HA ILE 73 -3.782 6.542 18.839 1461 HB ILE 73 HB ILE 73 -5.391 8.713 20.269 1462 HG12 ILE 73 2HG1 ILE 73 -6.815 7.568 18.579 1463 HG13 ILE 73 3HG1 ILE 73 -6.472 9.226 18.112 1464 HG21 ILE 73 1HG2 ILE 73 -3.091 9.410 19.757 1465 HG22 ILE 73 2HG2 ILE 73 -4.234 10.286 18.742 1466 HG23 ILE 73 3HG2 ILE 73 -3.298 8.951 18.063 1467 HD11 ILE 73 1HD1 ILE 73 -6.387 7.752 16.201 1468 HD12 ILE 73 2HD1 ILE 73 -5.167 6.749 16.981 1469 HD13 ILE 73 3HD1 ILE 73 -4.782 8.410 16.515 1470 HA PRO 74 HA PRO 74 -1.779 6.265 23.058 1471 HB2 PRO 74 2HB PRO 74 0.359 4.785 21.601 1472 HB3 PRO 74 3HB PRO 74 -0.585 4.273 23.015 1473 HG2 PRO 74 2HG PRO 74 -0.937 3.131 20.607 1474 HG3 PRO 74 3HG PRO 74 -2.302 3.378 21.724 1475 HD2 PRO 74 2HD PRO 74 -1.485 5.063 19.343 1476 HD3 PRO 74 3HD PRO 74 -3.099 4.463 19.805 1477 HA PRO 75 HA PRO 75 0.746 9.937 22.354 1478 HB2 PRO 75 2HB PRO 75 2.583 8.602 24.363 1479 HB3 PRO 75 3HB PRO 75 1.987 10.277 24.318 1480 HG2 PRO 75 2HG PRO 75 0.895 8.545 26.002 1481 HG3 PRO 75 3HG PRO 75 -0.132 9.701 25.125 1482 HD2 PRO 75 2HD PRO 75 0.228 6.763 24.648 1483 HD3 PRO 75 3HD PRO 75 -1.218 7.779 24.438 1484 H TYR 76 H TYR 76 2.376 6.796 22.458 1485 HA TYR 76 HA TYR 76 4.834 7.359 21.263 1486 HB2 TYR 76 2HB TYR 76 4.187 5.223 22.439 1487 HB3 TYR 76 3HB TYR 76 3.188 4.788 21.065 1488 HD1 TYR 76 HD1 TYR 76 4.369 4.347 18.795 1489 HD2 TYR 76 HD2 TYR 76 6.499 4.668 22.489 1490 HE1 TYR 76 HE1 TYR 76 6.285 3.182 17.787 1491 HE2 TYR 76 HE2 TYR 76 8.409 3.503 21.486 1492 HH TYR 76 HH TYR 76 8.664 2.901 18.132 1493 H ASP 77 H ASP 77 1.872 6.098 19.760 1494 HA ASP 77 HA ASP 77 2.905 6.055 17.083 1495 HB2 ASP 77 2HB ASP 77 0.023 5.756 18.053 1496 HB3 ASP 77 3HB ASP 77 0.647 5.267 16.477 1497 H ARG 78 H ARG 78 1.055 8.273 19.006 1498 HA ARG 78 HA ARG 78 0.084 10.033 17.003 1499 HB2 ARG 78 2HB ARG 78 -0.759 9.876 19.365 1500 HB3 ARG 78 3HB ARG 78 0.744 10.591 19.935 1501 HG2 ARG 78 2HG ARG 78 0.190 12.672 18.672 1502 HG3 ARG 78 3HG ARG 78 -1.339 11.936 18.181 1503 HD2 ARG 78 2HD ARG 78 -1.977 11.727 20.579 1504 HD3 ARG 78 3HD ARG 78 -0.473 12.535 21.036 1505 HE ARG 78 HE ARG 78 -2.180 13.999 19.204 1506 HH11 ARG 78 1HH1 ARG 78 -1.347 13.506 22.601 1507 HH12 ARG 78 2HH1 ARG 78 -2.027 15.022 23.102 1508 HH21 ARG 78 1HH2 ARG 78 -3.103 15.938 19.891 1509 HH22 ARG 78 2HH2 ARG 78 -3.023 16.402 21.562 1510 H ASP 79 H ASP 79 3.040 9.952 18.974 1511 HA ASP 79 HA ASP 79 4.199 12.332 17.812 1512 HB2 ASP 79 2HB ASP 79 5.341 10.201 19.654 1513 HB3 ASP 79 3HB ASP 79 6.314 11.536 19.044 1514 H PHE 80 H PHE 80 4.248 8.906 17.080 1515 HA PHE 80 HA PHE 80 6.428 8.839 15.273 1516 HB2 PHE 80 2HB PHE 80 5.415 6.746 16.041 1517 HB3 PHE 80 3HB PHE 80 3.861 7.180 15.343 1518 HD1 PHE 80 HD1 PHE 80 7.408 6.426 14.410 1519 HD2 PHE 80 HD2 PHE 80 3.326 6.469 13.133 1520 HE1 PHE 80 HE1 PHE 80 8.039 5.326 12.308 1521 HE2 PHE 80 HE2 PHE 80 3.970 5.359 11.035 1522 HZ PHE 80 HZ PHE 80 6.336 4.792 10.620 1523 H CYS 81 H CYS 81 3.082 9.854 14.943 1524 HA CYS 81 HA CYS 81 3.034 10.191 12.115 1525 HB2 CYS 81 2HB CYS 81 1.252 11.335 14.288 1526 HB3 CYS 81 3HB CYS 81 0.911 11.436 12.561 1527 HG CYS 81 HG CYS 81 1.428 8.370 13.904 1528 H LYS 82 H LYS 82 4.612 12.049 14.517 1529 HA LYS 82 HA LYS 82 4.561 14.584 13.177 1530 HB2 LYS 82 2HB LYS 82 6.324 13.412 15.347 1531 HB3 LYS 82 3HB LYS 82 6.757 14.939 14.593 1532 HG2 LYS 82 2HG LYS 82 4.172 14.371 16.083 1533 HG3 LYS 82 3HG LYS 82 5.555 15.288 16.698 1534 HD2 LYS 82 2HD LYS 82 5.237 16.941 14.833 1535 HD3 LYS 82 3HD LYS 82 3.800 16.048 14.325 1536 HE2 LYS 82 2HE LYS 82 4.200 17.510 16.954 1537 HE3 LYS 82 3HE LYS 82 3.132 17.977 15.631 1538 HZ1 LYS 82 1HZ LYS 82 2.865 15.597 17.380 1539 HZ2 LYS 82 2HZ LYS 82 1.914 15.871 16.013 1540 HZ3 LYS 82 3HZ LYS 82 1.836 16.940 17.316 1541 H VAL 83 H VAL 83 4.891 14.019 11.046 1542 HA VAL 83 HA VAL 83 7.723 13.883 10.252 1543 HB VAL 83 HB VAL 83 6.911 12.533 8.171 1544 HG11 VAL 83 1HG1 VAL 83 8.355 11.547 9.913 1545 HG12 VAL 83 2HG1 VAL 83 7.223 10.362 9.266 1546 HG13 VAL 83 3HG1 VAL 83 6.930 11.090 10.849 1547 HG21 VAL 83 1HG2 VAL 83 4.480 12.786 8.545 1548 HG22 VAL 83 2HG2 VAL 83 4.598 11.845 10.029 1549 HG23 VAL 83 3HG2 VAL 83 4.938 11.084 8.471 1550 H ASP 84 H ASP 84 8.216 15.169 8.487 1551 HA ASP 84 HA ASP 84 6.586 17.423 7.877 1552 HB2 ASP 84 2HB ASP 84 9.081 17.441 7.829 1553 HB3 ASP 84 3HB ASP 84 9.070 16.334 6.463 1554 H GLN 85 H GLN 85 5.851 17.983 5.570 1555 HA GLN 85 HA GLN 85 3.832 16.195 4.914 1556 HB2 GLN 85 2HB GLN 85 3.944 18.720 4.476 1557 HB3 GLN 85 3HB GLN 85 4.805 18.347 2.993 1558 HG2 GLN 85 2HG GLN 85 2.042 17.266 3.614 1559 HG3 GLN 85 3HG GLN 85 2.295 18.803 2.801 1560 HE21 GLN 85 1HE2 GLN 85 0.922 16.407 1.856 1561 HE22 GLN 85 2HE2 GLN 85 1.706 15.958 0.385 1562 HA PRO 86 HA PRO 86 6.409 14.476 1.054 1563 HB2 PRO 86 2HB PRO 86 9.187 14.715 1.349 1564 HB3 PRO 86 3HB PRO 86 8.183 15.774 0.338 1565 HG2 PRO 86 2HG PRO 86 9.181 16.239 3.127 1566 HG3 PRO 86 3HG PRO 86 9.132 17.358 1.743 1567 HD2 PRO 86 2HD PRO 86 7.289 17.511 3.674 1568 HD3 PRO 86 3HD PRO 86 6.836 17.757 1.972 1569 H THR 87 H THR 87 7.692 14.504 4.359 1570 HA THR 87 HA THR 87 8.943 11.959 4.297 1571 HB THR 87 HB THR 87 8.009 13.453 6.776 1572 HG1 THR 87 HG1 THR 87 10.585 13.732 5.647 1573 HG21 THR 87 1HG2 THR 87 8.857 11.173 7.241 1574 HG22 THR 87 2HG2 THR 87 9.965 12.402 7.854 1575 HG23 THR 87 3HG2 THR 87 10.345 11.544 6.359 1576 H LEU 88 H LEU 88 5.596 12.961 5.098 1577 HA LEU 88 HA LEU 88 4.578 10.551 6.107 1578 HB2 LEU 88 2HB LEU 88 3.255 12.585 4.277 1579 HB3 LEU 88 3HB LEU 88 2.413 11.137 4.775 1580 HG LEU 88 HG LEU 88 2.956 12.017 7.229 1581 HD11 LEU 88 1HD1 LEU 88 2.897 14.455 7.425 1582 HD12 LEU 88 2HD1 LEU 88 3.028 14.603 5.671 1583 HD13 LEU 88 3HD1 LEU 88 4.351 13.896 6.599 1584 HD21 LEU 88 1HD2 LEU 88 0.699 11.672 6.366 1585 HD22 LEU 88 2HD2 LEU 88 0.753 13.230 5.539 1586 HD23 LEU 88 3HD2 LEU 88 0.788 13.166 7.303 1587 H PHE 89 H PHE 89 5.112 11.541 2.734 1588 HA PHE 89 HA PHE 89 4.137 9.153 1.519 1589 HB2 PHE 89 2HB PHE 89 5.991 11.287 0.382 1590 HB3 PHE 89 3HB PHE 89 5.168 10.049 -0.564 1591 HD1 PHE 89 HD1 PHE 89 2.471 9.979 0.157 1592 HD2 PHE 89 HD2 PHE 89 5.026 13.406 0.130 1593 HE1 PHE 89 HE1 PHE 89 0.525 11.439 -0.134 1594 HE2 PHE 89 HE2 PHE 89 3.069 14.859 -0.156 1595 HZ PHE 89 HZ PHE 89 0.816 13.880 -0.286 1596 H GLU 90 H GLU 90 7.316 10.178 2.660 1597 HA GLU 90 HA GLU 90 8.867 8.121 1.479 1598 HB2 GLU 90 2HB GLU 90 9.368 9.586 4.106 1599 HB3 GLU 90 3HB GLU 90 10.561 8.637 3.226 1600 HG2 GLU 90 2HG GLU 90 9.252 11.194 2.276 1601 HG3 GLU 90 3HG GLU 90 10.895 11.031 2.875 1602 H LEU 91 H LEU 91 7.014 8.273 4.505 1603 HA LEU 91 HA LEU 91 7.716 5.678 5.481 1604 HB2 LEU 91 2HB LEU 91 5.282 7.392 6.110 1605 HB3 LEU 91 3HB LEU 91 5.712 5.925 6.973 1606 HG LEU 91 HG LEU 91 7.240 8.558 6.976 1607 HD11 LEU 91 1HD1 LEU 91 5.770 7.084 9.188 1608 HD12 LEU 91 2HD1 LEU 91 5.233 8.556 8.372 1609 HD13 LEU 91 3HD1 LEU 91 6.682 8.587 9.373 1610 HD21 LEU 91 1HD2 LEU 91 8.020 5.957 8.346 1611 HD22 LEU 91 2HD2 LEU 91 8.817 7.521 8.552 1612 HD23 LEU 91 3HD2 LEU 91 8.863 6.713 6.987 1613 H ILE 92 H ILE 92 5.031 6.903 3.461 1614 HA ILE 92 HA ILE 92 3.564 4.498 3.171 1615 HB ILE 92 HB ILE 92 3.837 6.834 1.211 1616 HG12 ILE 92 2HG1 ILE 92 1.673 6.238 3.285 1617 HG13 ILE 92 3HG1 ILE 92 2.915 7.474 3.427 1618 HG21 ILE 92 1HG2 ILE 92 1.724 6.047 0.169 1619 HG22 ILE 92 2HG2 ILE 92 1.749 4.617 1.203 1620 HG23 ILE 92 3HG2 ILE 92 3.016 4.855 -0.002 1621 HD11 ILE 92 1HD1 ILE 92 0.694 7.427 1.388 1622 HD12 ILE 92 2HD1 ILE 92 1.956 8.656 1.510 1623 HD13 ILE 92 3HD1 ILE 92 0.798 8.449 2.822 1624 H LEU 93 H LEU 93 6.282 5.840 1.311 1625 HA LEU 93 HA LEU 93 6.387 3.885 -0.742 1626 HB2 LEU 93 2HB LEU 93 8.465 5.845 0.306 1627 HB3 LEU 93 3HB LEU 93 8.785 4.786 -1.058 1628 HG LEU 93 HG LEU 93 6.608 6.918 -0.982 1629 HD11 LEU 93 1HD1 LEU 93 8.009 8.186 -2.538 1630 HD12 LEU 93 2HD1 LEU 93 9.278 6.964 -2.422 1631 HD13 LEU 93 3HD1 LEU 93 8.842 7.924 -1.007 1632 HD21 LEU 93 1HD2 LEU 93 5.991 5.052 -2.429 1633 HD22 LEU 93 2HD2 LEU 93 7.534 5.165 -3.281 1634 HD23 LEU 93 3HD2 LEU 93 6.364 6.484 -3.386 1635 H ALA 94 H ALA 94 8.036 4.195 2.387 1636 HA ALA 94 HA ALA 94 9.714 1.876 2.080 1637 HB1 ALA 94 1HB ALA 94 10.303 2.272 4.433 1638 HB2 ALA 94 2HB ALA 94 8.998 3.455 4.575 1639 HB3 ALA 94 3HB ALA 94 10.366 3.768 3.503 1640 H ALA 95 H ALA 95 6.531 2.484 3.497 1641 HA ALA 95 HA ALA 95 6.249 -0.058 4.804 1642 HB1 ALA 95 1HB ALA 95 3.899 0.563 5.093 1643 HB2 ALA 95 2HB ALA 95 4.087 1.900 3.952 1644 HB3 ALA 95 3HB ALA 95 4.949 1.924 5.493 1645 H ASN 96 H ASN 96 5.408 1.213 1.602 1646 HA ASN 96 HA ASN 96 4.066 -1.173 0.681 1647 HB2 ASN 96 2HB ASN 96 3.603 1.122 -0.238 1648 HB3 ASN 96 3HB ASN 96 5.222 1.161 -0.926 1649 HD21 ASN 96 1HD2 ASN 96 4.264 1.475 -2.996 1650 HD22 ASN 96 2HD2 ASN 96 3.552 0.169 -3.871 1651 H TYR 97 H TYR 97 7.349 0.137 0.549 1652 HA TYR 97 HA TYR 97 8.533 -1.695 -1.272 1653 HB2 TYR 97 2HB TYR 97 9.687 0.399 -0.773 1654 HB3 TYR 97 3HB TYR 97 9.762 0.016 0.942 1655 HD1 TYR 97 HD1 TYR 97 11.894 -0.616 1.721 1656 HD2 TYR 97 HD2 TYR 97 10.846 -1.592 -2.310 1657 HE1 TYR 97 HE1 TYR 97 14.078 -1.680 1.417 1658 HE2 TYR 97 HE2 TYR 97 13.045 -2.659 -2.611 1659 HH TYR 97 HH TYR 97 15.156 -3.262 0.089 1660 H LEU 98 H LEU 98 8.316 -1.663 2.277 1661 HA LEU 98 HA LEU 98 9.542 -4.305 2.539 1662 HB2 LEU 98 2HB LEU 98 8.468 -2.350 4.608 1663 HB3 LEU 98 3HB LEU 98 9.249 -3.876 4.997 1664 HG LEU 98 HG LEU 98 10.556 -1.476 3.652 1665 HD11 LEU 98 1HD1 LEU 98 11.003 -2.681 6.401 1666 HD12 LEU 98 2HD1 LEU 98 10.185 -1.159 6.044 1667 HD13 LEU 98 3HD1 LEU 98 11.900 -1.333 5.694 1668 HD21 LEU 98 1HD2 LEU 98 12.663 -2.752 3.764 1669 HD22 LEU 98 2HD2 LEU 98 11.484 -3.534 2.716 1670 HD23 LEU 98 3HD2 LEU 98 11.780 -4.170 4.336 1671 H ASP 99 H ASP 99 6.495 -3.069 1.972 1672 HA ASP 99 HA ASP 99 4.402 -3.839 1.884 1673 HB2 ASP 99 2HB ASP 99 5.664 -5.705 0.687 1674 HB3 ASP 99 3HB ASP 99 5.558 -6.635 2.175 1675 H ILE 100 H ILE 100 5.497 -3.112 4.452 1676 HA ILE 100 HA ILE 100 4.067 -4.690 6.432 1677 HB ILE 100 HB ILE 100 5.240 -1.895 6.834 1678 HG12 ILE 100 2HG1 ILE 100 6.570 -4.611 7.238 1679 HG13 ILE 100 3HG1 ILE 100 7.024 -3.397 6.051 1680 HG21 ILE 100 1HG2 ILE 100 4.537 -4.072 8.853 1681 HG22 ILE 100 2HG2 ILE 100 3.606 -2.601 8.562 1682 HG23 ILE 100 3HG2 ILE 100 5.232 -2.494 9.238 1683 HD11 ILE 100 1HD1 ILE 100 8.583 -3.434 7.882 1684 HD12 ILE 100 2HD1 ILE 100 7.290 -3.143 9.046 1685 HD13 ILE 100 3HD1 ILE 100 7.713 -1.902 7.863 1686 H LYS 101 H LYS 101 2.079 -4.682 5.380 1687 HA LYS 101 HA LYS 101 0.539 -2.448 4.687 1688 HB2 LYS 101 2HB LYS 101 -0.364 -5.248 5.422 1689 HB3 LYS 101 3HB LYS 101 -1.382 -4.029 4.658 1690 HG2 LYS 101 2HG LYS 101 0.152 -3.994 2.698 1691 HG3 LYS 101 3HG LYS 101 1.130 -5.255 3.460 1692 HD2 LYS 101 2HD LYS 101 -0.385 -6.264 1.813 1693 HD3 LYS 101 3HD LYS 101 -0.846 -6.775 3.441 1694 HE2 LYS 101 2HE LYS 101 -2.592 -4.946 3.428 1695 HE3 LYS 101 3HE LYS 101 -2.195 -4.658 1.735 1696 HZ1 LYS 101 1HZ LYS 101 -2.863 -6.915 1.229 1697 HZ2 LYS 101 2HZ LYS 101 -4.122 -6.074 1.980 1698 HZ3 LYS 101 3HZ LYS 101 -3.226 -7.209 2.856 1699 HA PRO 102 HA PRO 102 -1.288 -2.754 9.437 1700 HB2 PRO 102 2HB PRO 102 1.569 -3.103 10.431 1701 HB3 PRO 102 3HB PRO 102 0.040 -3.512 11.242 1702 HG2 PRO 102 2HG PRO 102 1.452 -5.435 10.103 1703 HG3 PRO 102 3HG PRO 102 -0.321 -5.411 9.931 1704 HD2 PRO 102 2HD PRO 102 1.777 -4.703 7.909 1705 HD3 PRO 102 3HD PRO 102 0.181 -5.446 7.667 1706 H LEU 103 H LEU 103 2.070 -1.587 8.760 1707 HA LEU 103 HA LEU 103 1.686 0.974 9.957 1708 HB2 LEU 103 2HB LEU 103 3.888 -0.252 9.594 1709 HB3 LEU 103 3HB LEU 103 3.816 0.235 7.915 1710 HG LEU 103 HG LEU 103 3.786 2.331 10.126 1711 HD11 LEU 103 1HD1 LEU 103 6.281 1.094 8.934 1712 HD12 LEU 103 2HD1 LEU 103 5.714 0.917 10.595 1713 HD13 LEU 103 3HD1 LEU 103 6.226 2.497 10.010 1714 HD21 LEU 103 1HD2 LEU 103 3.287 3.141 7.858 1715 HD22 LEU 103 2HD2 LEU 103 4.804 2.466 7.264 1716 HD23 LEU 103 3HD2 LEU 103 4.821 3.789 8.435 1717 H LEU 104 H LEU 104 1.556 -0.216 6.613 1718 HA LEU 104 HA LEU 104 1.396 2.148 5.170 1719 HB2 LEU 104 2HB LEU 104 1.682 -0.016 4.082 1720 HB3 LEU 104 3HB LEU 104 0.113 -0.556 4.638 1721 HG LEU 104 HG LEU 104 -0.953 1.182 3.140 1722 HD11 LEU 104 1HD1 LEU 104 1.858 1.588 2.083 1723 HD12 LEU 104 2HD1 LEU 104 0.889 2.766 2.972 1724 HD13 LEU 104 3HD1 LEU 104 0.373 2.235 1.375 1725 HD21 LEU 104 1HD2 LEU 104 -0.770 -1.161 2.428 1726 HD22 LEU 104 2HD2 LEU 104 0.815 -0.837 1.720 1727 HD23 LEU 104 3HD2 LEU 104 -0.627 -0.061 1.056 1728 H ASP 105 H ASP 105 -1.238 0.215 6.562 1729 HA ASP 105 HA ASP 105 -3.396 1.769 5.583 1730 HB2 ASP 105 2HB ASP 105 -3.628 -0.609 6.294 1731 HB3 ASP 105 3HB ASP 105 -3.349 -0.144 7.969 1732 H VAL 106 H VAL 106 -1.621 1.820 8.657 1733 HA VAL 106 HA VAL 106 -3.238 3.734 9.990 1734 HB VAL 106 HB VAL 106 -0.345 2.888 10.438 1735 HG11 VAL 106 1HG1 VAL 106 -2.066 4.592 12.284 1736 HG12 VAL 106 2HG1 VAL 106 -0.631 5.132 11.410 1737 HG13 VAL 106 3HG1 VAL 106 -0.483 3.920 12.683 1738 HG21 VAL 106 1HG2 VAL 106 -2.908 2.125 11.893 1739 HG22 VAL 106 2HG2 VAL 106 -1.287 1.557 12.293 1740 HG23 VAL 106 3HG2 VAL 106 -2.021 1.108 10.756 1741 H THR 107 H THR 107 -0.291 4.087 7.995 1742 HA THR 107 HA THR 107 -0.124 6.934 8.222 1743 HB THR 107 HB THR 107 1.075 5.199 6.009 1744 HG1 THR 107 HG1 THR 107 1.841 4.351 7.892 1745 HG21 THR 107 1HG2 THR 107 1.986 7.870 7.166 1746 HG22 THR 107 2HG2 THR 107 1.249 7.644 5.576 1747 HG23 THR 107 3HG2 THR 107 2.833 6.945 5.925 1748 H CYS 108 H CYS 108 -1.838 4.737 6.079 1749 HA CYS 108 HA CYS 108 -2.761 6.647 4.175 1750 HB2 CYS 108 2HB CYS 108 -3.853 3.921 4.960 1751 HB3 CYS 108 3HB CYS 108 -4.532 4.900 3.659 1752 HG CYS 108 HG CYS 108 -1.224 4.177 3.551 1753 H LYS 109 H LYS 109 -3.935 5.562 7.345 1754 HA LYS 109 HA LYS 109 -6.358 7.083 7.326 1755 HB2 LYS 109 2HB LYS 109 -4.831 5.524 9.372 1756 HB3 LYS 109 3HB LYS 109 -5.746 6.869 10.030 1757 HG2 LYS 109 2HG LYS 109 -7.060 4.846 10.174 1758 HG3 LYS 109 3HG LYS 109 -7.818 5.958 9.028 1759 HD2 LYS 109 2HD LYS 109 -6.938 4.640 7.143 1760 HD3 LYS 109 3HD LYS 109 -6.086 3.572 8.262 1761 HE2 LYS 109 2HE LYS 109 -8.292 2.888 9.224 1762 HE3 LYS 109 3HE LYS 109 -9.091 3.900 8.018 1763 HZ1 LYS 109 1HZ LYS 109 -8.131 2.535 6.282 1764 HZ2 LYS 109 2HZ LYS 109 -9.019 1.575 7.350 1765 HZ3 LYS 109 3HZ LYS 109 -7.333 1.582 7.422 1766 H THR 110 H THR 110 -3.027 7.752 8.394 1767 HA THR 110 HA THR 110 -3.422 10.232 9.634 1768 HB THR 110 HB THR 110 -0.934 9.283 8.132 1769 HG1 THR 110 HG1 THR 110 -0.418 8.800 10.506 1770 HG21 THR 110 1HG2 THR 110 -0.784 11.699 8.683 1771 HG22 THR 110 2HG2 THR 110 0.324 10.761 9.684 1772 HG23 THR 110 3HG2 THR 110 -1.195 11.347 10.364 1773 H VAL 111 H VAL 111 -2.588 9.528 6.203 1774 HA VAL 111 HA VAL 111 -2.599 12.261 5.365 1775 HB VAL 111 HB VAL 111 -2.565 11.421 3.037 1776 HG11 VAL 111 1HG1 VAL 111 -0.442 11.562 4.242 1777 HG12 VAL 111 2HG1 VAL 111 -0.420 10.199 3.124 1778 HG13 VAL 111 3HG1 VAL 111 -0.643 9.917 4.854 1779 HG21 VAL 111 1HG2 VAL 111 -4.071 9.499 3.233 1780 HG22 VAL 111 2HG2 VAL 111 -2.891 8.647 4.230 1781 HG23 VAL 111 3HG2 VAL 111 -2.525 9.000 2.539 1782 H ALA 112 H ALA 112 -5.070 9.739 5.521 1783 HA ALA 112 HA ALA 112 -7.127 11.093 4.096 1784 HB1 ALA 112 1HB ALA 112 -8.649 9.449 5.116 1785 HB2 ALA 112 2HB ALA 112 -7.372 8.947 6.230 1786 HB3 ALA 112 3HB ALA 112 -7.191 8.669 4.495 1787 H ASN 113 H ASN 113 -6.020 11.196 7.436 1788 HA ASN 113 HA ASN 113 -8.245 12.559 8.590 1789 HB2 ASN 113 2HB ASN 113 -5.348 12.228 9.485 1790 HB3 ASN 113 3HB ASN 113 -6.499 13.169 10.425 1791 HD21 ASN 113 1HD2 ASN 113 -5.044 10.705 11.088 1792 HD22 ASN 113 2HD2 ASN 113 -6.248 9.559 11.548 1793 H MET 114 H MET 114 -5.289 13.632 6.988 1794 HA MET 114 HA MET 114 -5.382 16.381 7.670 1795 HB2 MET 114 2HB MET 114 -4.195 15.125 5.152 1796 HB3 MET 114 3HB MET 114 -3.864 16.747 5.743 1797 HG2 MET 114 2HG MET 114 -2.889 15.702 7.813 1798 HG3 MET 114 3HG MET 114 -3.049 14.134 7.020 1799 HE1 MET 114 1HE MET 114 -2.390 15.192 3.899 1800 HE2 MET 114 2HE MET 114 -1.792 13.657 4.533 1801 HE3 MET 114 3HE MET 114 -0.669 14.812 3.824 1802 H ILE 115 H ILE 115 -6.709 14.563 4.918 1803 HA ILE 115 HA ILE 115 -7.851 16.951 3.674 1804 HB ILE 115 HB ILE 115 -8.574 15.436 1.863 1805 HG12 ILE 115 2HG1 ILE 115 -7.431 13.178 3.584 1806 HG13 ILE 115 3HG1 ILE 115 -9.137 13.446 3.257 1807 HG21 ILE 115 1HG2 ILE 115 -6.285 16.332 1.802 1808 HG22 ILE 115 2HG2 ILE 115 -6.338 14.725 1.080 1809 HG23 ILE 115 3HG2 ILE 115 -5.695 14.937 2.710 1810 HD11 ILE 115 1HD1 ILE 115 -7.055 12.700 1.208 1811 HD12 ILE 115 2HD1 ILE 115 -8.774 12.962 0.897 1812 HD13 ILE 115 3HD1 ILE 115 -8.256 11.630 1.930 1813 H ARG 116 H ARG 116 -8.856 14.719 6.032 1814 HA ARG 116 HA ARG 116 -11.571 14.278 5.391 1815 HB2 ARG 116 2HB ARG 116 -10.279 12.912 7.021 1816 HB3 ARG 116 3HB ARG 116 -10.232 14.272 8.135 1817 HG2 ARG 116 2HG ARG 116 -12.613 14.144 8.506 1818 HG3 ARG 116 3HG ARG 116 -12.811 12.972 7.199 1819 HD2 ARG 116 2HD ARG 116 -12.932 11.845 9.355 1820 HD3 ARG 116 3HD ARG 116 -11.490 11.321 8.487 1821 HE ARG 116 HE ARG 116 -10.574 13.337 10.079 1822 HH11 ARG 116 1HH1 ARG 116 -12.398 10.387 10.755 1823 HH12 ARG 116 2HH1 ARG 116 -11.748 10.209 12.350 1824 HH21 ARG 116 1HH2 ARG 116 -9.735 13.055 12.189 1825 HH22 ARG 116 2HH2 ARG 116 -10.240 11.726 13.153 1826 H GLY 117 H GLY 117 -9.987 16.786 7.337 1827 HA2 GLY 117 2HA GLY 117 -10.653 18.990 7.629 1828 HA3 GLY 117 3HA GLY 117 -12.242 18.607 6.984 Start of MODEL 17 1 H1 SER 2 1H SER 2 -17.177 -15.843 -12.838 2 H2 SER 2 2H SER 2 -16.035 -16.043 -11.611 3 H3 SER 2 3H SER 2 -16.233 -17.238 -12.788 4 HA SER 2 HA SER 2 -14.256 -15.978 -13.188 5 HB2 SER 2 2HB SER 2 -16.447 -15.428 -15.224 6 HB3 SER 2 3HB SER 2 -14.714 -15.404 -15.552 7 HG SER 2 HG SER 2 -14.661 -17.627 -14.982 8 H LEU 3 H LEU 3 -17.184 -13.972 -13.050 9 HA LEU 3 HA LEU 3 -15.517 -11.518 -12.951 10 HB2 LEU 3 2HB LEU 3 -18.487 -11.807 -13.589 11 HB3 LEU 3 3HB LEU 3 -17.561 -10.316 -13.641 12 HG LEU 3 HG LEU 3 -17.045 -12.694 -15.470 13 HD11 LEU 3 1HD1 LEU 3 -19.258 -11.768 -15.938 14 HD12 LEU 3 2HD1 LEU 3 -18.138 -11.424 -17.252 15 HD13 LEU 3 3HD1 LEU 3 -18.568 -10.150 -16.104 16 HD21 LEU 3 1HD2 LEU 3 -15.981 -9.852 -15.596 17 HD22 LEU 3 2HD2 LEU 3 -15.682 -11.121 -16.786 18 HD23 LEU 3 3HD2 LEU 3 -15.062 -11.292 -15.147 19 H VAL 4 H VAL 4 -15.193 -10.904 -10.884 20 HA VAL 4 HA VAL 4 -17.175 -11.364 -8.800 21 HB VAL 4 HB VAL 4 -15.478 -10.275 -7.264 22 HG11 VAL 4 1HG1 VAL 4 -13.909 -12.198 -7.278 23 HG12 VAL 4 2HG1 VAL 4 -14.467 -12.648 -8.893 24 HG13 VAL 4 3HG1 VAL 4 -15.576 -12.723 -7.522 25 HG21 VAL 4 1HG2 VAL 4 -13.151 -9.945 -8.075 26 HG22 VAL 4 2HG2 VAL 4 -14.273 -8.847 -8.877 27 HG23 VAL 4 3HG2 VAL 4 -13.680 -10.272 -9.730 28 H LYS 5 H LYS 5 -18.851 -10.091 -8.793 29 HA LYS 5 HA LYS 5 -18.948 -7.483 -10.005 30 HB2 LYS 5 2HB LYS 5 -21.024 -8.935 -8.319 31 HB3 LYS 5 3HB LYS 5 -21.323 -7.533 -9.337 32 HG2 LYS 5 2HG LYS 5 -20.718 -8.895 -11.333 33 HG3 LYS 5 3HG LYS 5 -20.513 -10.301 -10.285 34 HD2 LYS 5 2HD LYS 5 -22.898 -10.172 -9.635 35 HD3 LYS 5 3HD LYS 5 -23.105 -8.742 -10.655 36 HE2 LYS 5 2HE LYS 5 -22.509 -10.117 -12.647 37 HE3 LYS 5 3HE LYS 5 -22.386 -11.536 -11.606 38 HZ1 LYS 5 1HZ LYS 5 -24.827 -9.917 -12.072 39 HZ2 LYS 5 2HZ LYS 5 -24.728 -11.234 -11.023 40 HZ3 LYS 5 3HZ LYS 5 -24.518 -11.461 -12.684 41 H LEU 6 H LEU 6 -18.032 -5.814 -8.973 42 HA LEU 6 HA LEU 6 -18.066 -5.600 -6.039 43 HB2 LEU 6 2HB LEU 6 -16.449 -3.995 -8.059 44 HB3 LEU 6 3HB LEU 6 -16.282 -3.932 -6.312 45 HG LEU 6 HG LEU 6 -15.549 -6.271 -8.116 46 HD11 LEU 6 1HD1 LEU 6 -13.243 -5.811 -7.400 47 HD12 LEU 6 2HD1 LEU 6 -13.801 -4.420 -6.466 48 HD13 LEU 6 3HD1 LEU 6 -13.957 -4.425 -8.223 49 HD21 LEU 6 1HD2 LEU 6 -15.341 -6.099 -5.089 50 HD22 LEU 6 2HD2 LEU 6 -14.695 -7.398 -6.096 51 HD23 LEU 6 3HD2 LEU 6 -16.435 -7.141 -6.003 52 H GLU 7 H GLU 7 -20.238 -4.863 -5.803 53 HA GLU 7 HA GLU 7 -21.162 -2.416 -6.966 54 HB2 GLU 7 2HB GLU 7 -22.022 -3.836 -4.405 55 HB3 GLU 7 3HB GLU 7 -22.773 -2.346 -4.989 56 HG2 GLU 7 2HG GLU 7 -24.206 -4.018 -5.720 57 HG3 GLU 7 3HG GLU 7 -23.251 -3.642 -7.147 58 H SER 8 H SER 8 -19.979 -0.627 -6.726 59 HA SER 8 HA SER 8 -18.274 0.059 -4.591 60 HB2 SER 8 2HB SER 8 -18.394 2.374 -5.617 61 HB3 SER 8 3HB SER 8 -18.045 1.095 -6.785 62 HG SER 8 HG SER 8 -19.962 1.341 -7.673 63 H SER 9 H SER 9 -18.699 2.327 -3.452 64 HA SER 9 HA SER 9 -20.848 2.095 -1.618 65 HB2 SER 9 2HB SER 9 -18.622 3.239 -1.181 66 HB3 SER 9 3HB SER 9 -19.169 4.578 -2.190 67 HG SER 9 HG SER 9 -20.866 4.915 -0.735 68 H ASP 10 H ASP 10 -20.651 3.421 -4.776 69 HA ASP 10 HA ASP 10 -23.141 4.977 -4.601 70 HB2 ASP 10 2HB ASP 10 -21.090 5.885 -5.750 71 HB3 ASP 10 3HB ASP 10 -21.182 4.564 -6.904 72 H GLU 11 H GLU 11 -22.457 1.834 -4.773 73 HA GLU 11 HA GLU 11 -23.587 -0.046 -5.190 74 HB2 GLU 11 2HB GLU 11 -25.840 1.805 -6.048 75 HB3 GLU 11 3HB GLU 11 -26.007 0.066 -5.834 76 HG2 GLU 11 2HG GLU 11 -25.428 0.313 -3.437 77 HG3 GLU 11 3HG GLU 11 -25.299 2.055 -3.659 78 H LYS 12 H LYS 12 -22.235 1.652 -7.517 79 HA LYS 12 HA LYS 12 -23.354 0.522 -9.905 80 HB2 LYS 12 2HB LYS 12 -20.662 1.841 -9.383 81 HB3 LYS 12 3HB LYS 12 -21.201 1.345 -10.979 82 HG2 LYS 12 2HG LYS 12 -22.773 3.325 -9.313 83 HG3 LYS 12 3HG LYS 12 -21.423 3.825 -10.322 84 HD2 LYS 12 2HD LYS 12 -23.318 4.242 -11.652 85 HD3 LYS 12 3HD LYS 12 -22.676 2.731 -12.288 86 HE2 LYS 12 2HE LYS 12 -24.408 1.477 -11.066 87 HE3 LYS 12 3HE LYS 12 -25.021 2.980 -10.372 88 HZ1 LYS 12 1HZ LYS 12 -24.962 2.324 -13.265 89 HZ2 LYS 12 2HZ LYS 12 -25.572 3.746 -12.585 90 HZ3 LYS 12 3HZ LYS 12 -26.326 2.266 -12.273 91 H VAL 13 H VAL 13 -23.075 -1.456 -10.667 92 HA VAL 13 HA VAL 13 -21.491 -3.407 -9.228 93 HB VAL 13 HB VAL 13 -23.262 -3.788 -11.696 94 HG11 VAL 13 1HG1 VAL 13 -21.712 -5.668 -11.318 95 HG12 VAL 13 2HG1 VAL 13 -23.377 -6.156 -11.014 96 HG13 VAL 13 3HG1 VAL 13 -22.293 -5.835 -9.660 97 HG21 VAL 13 1HG2 VAL 13 -25.066 -4.448 -10.145 98 HG22 VAL 13 2HG2 VAL 13 -24.551 -2.786 -9.848 99 HG23 VAL 13 3HG2 VAL 13 -24.027 -4.076 -8.765 100 H PHE 14 H PHE 14 -19.334 -3.184 -9.698 101 HA PHE 14 HA PHE 14 -18.367 -3.049 -12.469 102 HB2 PHE 14 2HB PHE 14 -16.888 -2.932 -9.799 103 HB3 PHE 14 3HB PHE 14 -16.101 -2.832 -11.372 104 HD1 PHE 14 HD1 PHE 14 -16.703 -0.893 -12.920 105 HD2 PHE 14 HD2 PHE 14 -17.824 -0.960 -8.794 106 HE1 PHE 14 HE1 PHE 14 -17.068 1.535 -12.967 107 HE2 PHE 14 HE2 PHE 14 -18.182 1.471 -8.857 108 HZ PHE 14 HZ PHE 14 -17.807 2.716 -10.941 109 H GLU 15 H GLU 15 -18.957 -5.067 -13.212 110 HA GLU 15 HA GLU 15 -18.253 -7.542 -11.898 111 HB2 GLU 15 2HB GLU 15 -19.110 -7.216 -14.801 112 HB3 GLU 15 3HB GLU 15 -19.293 -8.637 -13.779 113 HG2 GLU 15 2HG GLU 15 -21.013 -7.530 -12.462 114 HG3 GLU 15 3HG GLU 15 -20.748 -6.017 -13.322 115 H ILE 16 H ILE 16 -15.980 -7.056 -11.644 116 HA ILE 16 HA ILE 16 -14.287 -6.906 -14.041 117 HB ILE 16 HB ILE 16 -13.864 -5.281 -12.205 118 HG12 ILE 16 2HG1 ILE 16 -11.573 -7.267 -12.600 119 HG13 ILE 16 3HG1 ILE 16 -11.973 -5.928 -13.667 120 HG21 ILE 16 1HG2 ILE 16 -13.125 -7.669 -10.472 121 HG22 ILE 16 2HG2 ILE 16 -14.554 -6.652 -10.277 122 HG23 ILE 16 3HG2 ILE 16 -12.948 -5.969 -10.026 123 HD11 ILE 16 1HD1 ILE 16 -10.956 -5.725 -10.840 124 HD12 ILE 16 2HD1 ILE 16 -11.422 -4.358 -11.855 125 HD13 ILE 16 3HD1 ILE 16 -10.068 -5.381 -12.323 126 H GLU 17 H GLU 17 -12.603 -8.393 -14.405 127 HA GLU 17 HA GLU 17 -13.244 -11.120 -13.914 128 HB2 GLU 17 2HB GLU 17 -10.643 -9.982 -15.017 129 HB3 GLU 17 3HB GLU 17 -11.252 -11.619 -15.244 130 HG2 GLU 17 2HG GLU 17 -13.102 -10.809 -16.598 131 HG3 GLU 17 3HG GLU 17 -12.669 -9.134 -16.266 132 H LYS 18 H LYS 18 -12.391 -12.557 -12.535 133 HA LYS 18 HA LYS 18 -11.569 -11.661 -9.990 134 HB2 LYS 18 2HB LYS 18 -13.003 -13.594 -10.264 135 HB3 LYS 18 3HB LYS 18 -11.790 -14.440 -11.215 136 HG2 LYS 18 2HG LYS 18 -10.380 -14.729 -9.261 137 HG3 LYS 18 3HG LYS 18 -11.455 -13.720 -8.286 138 HD2 LYS 18 2HD LYS 18 -13.238 -15.368 -8.428 139 HD3 LYS 18 3HD LYS 18 -12.324 -16.333 -9.590 140 HE2 LYS 18 2HE LYS 18 -11.459 -15.821 -6.730 141 HE3 LYS 18 3HE LYS 18 -12.311 -17.264 -7.282 142 HZ1 LYS 18 1HZ LYS 18 -9.660 -16.370 -8.271 143 HZ2 LYS 18 2HZ LYS 18 -10.466 -17.783 -8.724 144 HZ3 LYS 18 3HZ LYS 18 -9.915 -17.594 -7.136 145 H GLU 19 H GLU 19 -9.774 -13.000 -12.719 146 HA GLU 19 HA GLU 19 -7.297 -13.583 -11.520 147 HB2 GLU 19 2HB GLU 19 -7.764 -12.496 -14.322 148 HB3 GLU 19 3HB GLU 19 -6.310 -13.309 -13.760 149 HG2 GLU 19 2HG GLU 19 -7.699 -15.370 -13.372 150 HG3 GLU 19 3HG GLU 19 -9.046 -14.534 -14.150 151 H ILE 20 H ILE 20 -8.676 -10.537 -12.554 152 HA ILE 20 HA ILE 20 -6.294 -8.921 -12.303 153 HB ILE 20 HB ILE 20 -9.212 -8.006 -12.320 154 HG12 ILE 20 2HG1 ILE 20 -7.393 -8.322 -14.761 155 HG13 ILE 20 3HG1 ILE 20 -8.658 -9.464 -14.318 156 HG21 ILE 20 1HG2 ILE 20 -8.309 -5.877 -13.185 157 HG22 ILE 20 2HG2 ILE 20 -6.669 -6.516 -13.074 158 HG23 ILE 20 3HG2 ILE 20 -7.621 -6.272 -11.608 159 HD11 ILE 20 1HD1 ILE 20 -9.090 -6.570 -15.021 160 HD12 ILE 20 2HD1 ILE 20 -10.342 -7.749 -14.618 161 HD13 ILE 20 3HD1 ILE 20 -9.372 -7.954 -16.074 162 H ALA 21 H ALA 21 -9.159 -9.665 -10.379 163 HA ALA 21 HA ALA 21 -8.650 -7.906 -8.179 164 HB1 ALA 21 1HB ALA 21 -10.565 -9.042 -7.137 165 HB2 ALA 21 2HB ALA 21 -10.510 -10.299 -8.376 166 HB3 ALA 21 3HB ALA 21 -10.914 -8.638 -8.818 167 H CYS 22 H CYS 22 -7.073 -10.734 -9.043 168 HA CYS 22 HA CYS 22 -6.446 -11.803 -6.461 169 HB2 CYS 22 2HB CYS 22 -4.936 -12.037 -9.095 170 HB3 CYS 22 3HB CYS 22 -4.684 -13.054 -7.675 171 HG CYS 22 HG CYS 22 -7.846 -13.223 -8.363 172 H MET 23 H MET 23 -5.092 -9.236 -8.489 173 HA MET 23 HA MET 23 -2.686 -8.773 -7.006 174 HB2 MET 23 2HB MET 23 -4.274 -6.826 -8.731 175 HB3 MET 23 3HB MET 23 -2.642 -6.549 -8.135 176 HG2 MET 23 2HG MET 23 -1.921 -8.584 -9.445 177 HG3 MET 23 3HG MET 23 -3.529 -8.602 -10.167 178 HE1 MET 23 1HE MET 23 -4.063 -5.364 -10.332 179 HE2 MET 23 2HE MET 23 -4.502 -6.491 -11.620 180 HE3 MET 23 3HE MET 23 -3.535 -5.060 -11.985 181 H SER 24 H SER 24 -6.000 -7.661 -6.718 182 HA SER 24 HA SER 24 -5.646 -6.046 -4.391 183 HB2 SER 24 2HB SER 24 -8.071 -7.564 -5.440 184 HB3 SER 24 3HB SER 24 -8.113 -6.437 -4.083 185 HG SER 24 HG SER 24 -7.897 -4.810 -5.398 186 H VAL 25 H VAL 25 -4.508 -7.060 -2.758 187 HA VAL 25 HA VAL 25 -4.781 -9.785 -2.007 188 HB VAL 25 HB VAL 25 -3.750 -7.504 -0.253 189 HG11 VAL 25 1HG1 VAL 25 -3.265 -10.498 -0.007 190 HG12 VAL 25 2HG1 VAL 25 -4.246 -9.513 1.076 191 HG13 VAL 25 3HG1 VAL 25 -2.505 -9.251 0.985 192 HG21 VAL 25 1HG2 VAL 25 -2.190 -9.315 -2.140 193 HG22 VAL 25 2HG2 VAL 25 -1.485 -8.122 -1.046 194 HG23 VAL 25 3HG2 VAL 25 -2.511 -7.596 -2.382 195 H THR 26 H THR 26 -6.552 -6.854 -1.086 196 HA THR 26 HA THR 26 -7.915 -7.872 1.202 197 HB THR 26 HB THR 26 -8.811 -5.707 -0.755 198 HG1 THR 26 HG1 THR 26 -6.798 -5.626 0.732 199 HG21 THR 26 1HG2 THR 26 -10.281 -4.888 1.058 200 HG22 THR 26 2HG2 THR 26 -9.844 -6.277 2.054 201 HG23 THR 26 3HG2 THR 26 -10.752 -6.515 0.557 202 H ILE 27 H ILE 27 -8.886 -7.695 -2.251 203 HA ILE 27 HA ILE 27 -11.421 -8.934 -1.908 204 HB ILE 27 HB ILE 27 -9.764 -8.692 -4.463 205 HG12 ILE 27 2HG1 ILE 27 -12.070 -6.964 -3.423 206 HG13 ILE 27 3HG1 ILE 27 -10.376 -6.488 -3.458 207 HG21 ILE 27 1HG2 ILE 27 -11.881 -9.121 -5.691 208 HG22 ILE 27 2HG2 ILE 27 -12.713 -9.407 -4.163 209 HG23 ILE 27 3HG2 ILE 27 -11.433 -10.502 -4.682 210 HD11 ILE 27 1HD1 ILE 27 -11.587 -5.452 -5.263 211 HD12 ILE 27 2HD1 ILE 27 -12.127 -7.024 -5.850 212 HD13 ILE 27 3HD1 ILE 27 -10.415 -6.599 -5.911 213 H LYS 28 H LYS 28 -8.216 -10.133 -2.885 214 HA LYS 28 HA LYS 28 -8.762 -12.813 -3.339 215 HB2 LYS 28 2HB LYS 28 -6.559 -11.938 -3.864 216 HB3 LYS 28 3HB LYS 28 -6.257 -11.514 -2.180 217 HG2 LYS 28 2HG LYS 28 -6.291 -13.930 -1.586 218 HG3 LYS 28 3HG LYS 28 -6.546 -14.330 -3.284 219 HD2 LYS 28 2HD LYS 28 -4.343 -13.472 -3.872 220 HD3 LYS 28 3HD LYS 28 -4.107 -12.851 -2.233 221 HE2 LYS 28 2HE LYS 28 -2.898 -14.992 -2.647 222 HE3 LYS 28 3HE LYS 28 -4.061 -15.112 -1.326 223 HZ1 LYS 28 1HZ LYS 28 -4.165 -17.035 -2.785 224 HZ2 LYS 28 2HZ LYS 28 -4.502 -16.047 -4.113 225 HZ3 LYS 28 3HZ LYS 28 -5.619 -16.172 -2.849 226 H ASN 29 H ASN 29 -7.838 -11.262 -0.222 227 HA ASN 29 HA ASN 29 -7.776 -13.558 1.392 228 HB2 ASN 29 2HB ASN 29 -8.327 -10.651 2.130 229 HB3 ASN 29 3HB ASN 29 -8.188 -11.920 3.343 230 HD21 ASN 29 1HD2 ASN 29 -6.565 -9.547 2.992 231 HD22 ASN 29 2HD2 ASN 29 -4.940 -10.085 2.772 232 H MET 30 H MET 30 -10.442 -11.414 0.520 233 HA MET 30 HA MET 30 -12.389 -12.602 2.242 234 HB2 MET 30 2HB MET 30 -12.707 -10.833 -0.214 235 HB3 MET 30 3HB MET 30 -14.056 -11.369 0.780 236 HG2 MET 30 2HG MET 30 -13.009 -10.240 2.743 237 HG3 MET 30 3HG MET 30 -11.754 -9.618 1.671 238 HE1 MET 30 1HE MET 30 -13.333 -8.809 -0.997 239 HE2 MET 30 2HE MET 30 -12.162 -7.760 -0.193 240 HE3 MET 30 3HE MET 30 -13.757 -7.140 -0.618 241 H ILE 31 H ILE 31 -11.433 -13.175 -1.146 242 HA ILE 31 HA ILE 31 -13.465 -15.070 -1.783 243 HB ILE 31 HB ILE 31 -10.668 -14.755 -2.995 244 HG12 ILE 31 2HG1 ILE 31 -13.362 -13.722 -4.023 245 HG13 ILE 31 3HG1 ILE 31 -12.148 -12.733 -3.232 246 HG21 ILE 31 1HG2 ILE 31 -13.057 -16.299 -4.091 247 HG22 ILE 31 2HG2 ILE 31 -11.570 -17.006 -3.454 248 HG23 ILE 31 3HG2 ILE 31 -11.524 -16.042 -4.926 249 HD11 ILE 31 1HD1 ILE 31 -11.838 -14.141 -5.877 250 HD12 ILE 31 2HD1 ILE 31 -10.596 -13.174 -5.078 251 HD13 ILE 31 3HD1 ILE 31 -12.092 -12.413 -5.621 252 H GLU 32 H GLU 32 -10.203 -15.358 -0.378 253 HA GLU 32 HA GLU 32 -10.026 -18.197 -0.356 254 HB2 GLU 32 2HB GLU 32 -8.633 -16.230 1.527 255 HB3 GLU 32 3HB GLU 32 -8.172 -17.904 1.253 256 HG2 GLU 32 2HG GLU 32 -7.935 -15.593 -0.674 257 HG3 GLU 32 3HG GLU 32 -6.629 -16.476 0.096 258 H ASP 33 H ASP 33 -11.161 -15.786 1.951 259 HA ASP 33 HA ASP 33 -11.561 -17.459 4.209 260 HB2 ASP 33 2HB ASP 33 -11.235 -14.978 4.302 261 HB3 ASP 33 3HB ASP 33 -12.815 -14.750 3.559 262 H ILE 34 H ILE 34 -13.721 -16.295 1.658 263 HA ILE 34 HA ILE 34 -16.090 -17.648 2.653 264 HB ILE 34 HB ILE 34 -15.568 -16.205 -0.005 265 HG12 ILE 34 2HG1 ILE 34 -17.075 -15.210 2.472 266 HG13 ILE 34 3HG1 ILE 34 -15.431 -14.747 2.050 267 HG21 ILE 34 1HG2 ILE 34 -18.242 -17.118 1.146 268 HG22 ILE 34 2HG2 ILE 34 -17.431 -17.806 -0.264 269 HG23 ILE 34 3HG2 ILE 34 -18.028 -16.148 -0.314 270 HD11 ILE 34 1HD1 ILE 34 -17.903 -14.141 0.430 271 HD12 ILE 34 2HD1 ILE 34 -16.250 -13.687 0.005 272 HD13 ILE 34 3HD1 ILE 34 -17.005 -13.017 1.450 273 H GLY 35 H GLY 35 -13.353 -18.479 0.769 274 HA2 GLY 35 2HA GLY 35 -12.757 -20.619 0.028 275 HA3 GLY 35 3HA GLY 35 -14.447 -21.111 0.043 276 H GLU 36 H GLU 36 -15.837 -19.733 -1.510 277 HA GLU 36 HA GLU 36 -14.454 -18.894 -3.982 278 HB2 GLU 36 2HB GLU 36 -16.962 -20.636 -3.865 279 HB3 GLU 36 3HB GLU 36 -16.285 -19.943 -5.336 280 HG2 GLU 36 2HG GLU 36 -14.243 -21.312 -5.019 281 HG3 GLU 36 3HG GLU 36 -14.946 -22.005 -3.562 282 H SER 37 H SER 37 -15.144 -16.874 -4.552 283 HA SER 37 HA SER 37 -17.150 -15.493 -3.031 284 HB2 SER 37 2HB SER 37 -16.555 -13.569 -4.630 285 HB3 SER 37 3HB SER 37 -15.219 -14.220 -3.683 286 HG SER 37 HG SER 37 -15.824 -14.699 -6.407 287 H ASP 38 H ASP 38 -18.907 -16.971 -3.570 288 HA ASP 38 HA ASP 38 -20.177 -16.971 -6.159 289 HB2 ASP 38 2HB ASP 38 -20.433 -18.861 -4.570 290 HB3 ASP 38 3HB ASP 38 -21.220 -17.802 -3.404 291 H SER 39 H SER 39 -20.504 -15.224 -3.140 292 HA SER 39 HA SER 39 -22.796 -13.654 -3.978 293 HB2 SER 39 2HB SER 39 -22.427 -12.535 -1.743 294 HB3 SER 39 3HB SER 39 -22.632 -14.281 -1.631 295 HG SER 39 HG SER 39 -20.331 -12.724 -1.248 296 HA PRO 40 HA PRO 40 -20.245 -10.350 -5.883 297 HB2 PRO 40 2HB PRO 40 -22.621 -8.634 -5.187 298 HB3 PRO 40 3HB PRO 40 -21.826 -8.870 -6.754 299 HG2 PRO 40 2HG PRO 40 -24.205 -9.934 -6.254 300 HG3 PRO 40 3HG PRO 40 -22.996 -10.816 -7.219 301 HD2 PRO 40 2HD PRO 40 -23.784 -11.232 -4.339 302 HD3 PRO 40 3HD PRO 40 -23.390 -12.439 -5.586 303 H ILE 41 H ILE 41 -18.952 -8.681 -5.015 304 HA ILE 41 HA ILE 41 -19.009 -8.459 -2.078 305 HB ILE 41 HB ILE 41 -16.779 -7.760 -4.036 306 HG12 ILE 41 2HG1 ILE 41 -17.185 -10.206 -3.980 307 HG13 ILE 41 3HG1 ILE 41 -15.640 -9.818 -3.237 308 HG21 ILE 41 1HG2 ILE 41 -15.321 -7.602 -2.043 309 HG22 ILE 41 2HG2 ILE 41 -16.718 -7.862 -1.000 310 HG23 ILE 41 3HG2 ILE 41 -16.620 -6.409 -1.996 311 HD11 ILE 41 1HD1 ILE 41 -16.667 -10.095 -1.011 312 HD12 ILE 41 2HD1 ILE 41 -16.778 -11.552 -1.996 313 HD13 ILE 41 3HD1 ILE 41 -18.194 -10.524 -1.785 314 HA PRO 42 HA PRO 42 -20.350 -4.154 -2.967 315 HB2 PRO 42 2HB PRO 42 -21.822 -3.749 -0.729 316 HB3 PRO 42 3HB PRO 42 -22.438 -4.730 -2.074 317 HG2 PRO 42 2HG PRO 42 -21.305 -5.619 0.543 318 HG3 PRO 42 3HG PRO 42 -22.654 -6.300 -0.391 319 HD2 PRO 42 2HD PRO 42 -20.041 -7.304 -0.384 320 HD3 PRO 42 3HD PRO 42 -21.266 -7.645 -1.623 321 H LEU 43 H LEU 43 -18.571 -2.919 -2.783 322 HA LEU 43 HA LEU 43 -17.037 -2.612 -0.315 323 HB2 LEU 43 2HB LEU 43 -16.698 -1.285 -3.039 324 HB3 LEU 43 3HB LEU 43 -15.531 -1.246 -1.726 325 HG LEU 43 HG LEU 43 -16.359 -3.758 -3.236 326 HD11 LEU 43 1HD1 LEU 43 -14.144 -3.681 -4.291 327 HD12 LEU 43 2HD1 LEU 43 -13.809 -2.139 -3.500 328 HD13 LEU 43 3HD1 LEU 43 -15.102 -2.256 -4.696 329 HD21 LEU 43 1HD2 LEU 43 -14.449 -4.837 -2.085 330 HD22 LEU 43 2HD2 LEU 43 -15.685 -4.293 -0.954 331 HD23 LEU 43 3HD2 LEU 43 -14.194 -3.367 -1.139 332 HA PRO 44 HA PRO 44 -20.058 0.835 0.252 333 HB2 PRO 44 2HB PRO 44 -20.413 0.683 2.898 334 HB3 PRO 44 3HB PRO 44 -20.938 -0.660 1.859 335 HG2 PRO 44 2HG PRO 44 -18.470 -0.453 3.551 336 HG3 PRO 44 3HG PRO 44 -19.569 -1.833 3.333 337 HD2 PRO 44 2HD PRO 44 -17.151 -1.467 1.954 338 HD3 PRO 44 3HD PRO 44 -18.465 -2.551 1.449 339 H ASN 45 H ASN 45 -17.019 1.228 0.183 340 HA ASN 45 HA ASN 45 -16.789 3.648 1.878 341 HB2 ASN 45 2HB ASN 45 -15.411 1.861 2.838 342 HB3 ASN 45 3HB ASN 45 -14.662 1.544 1.280 343 HD21 ASN 45 1HD2 ASN 45 -14.812 3.770 3.990 344 HD22 ASN 45 2HD2 ASN 45 -13.343 4.605 3.632 345 H VAL 46 H VAL 46 -15.199 1.987 -0.878 346 HA VAL 46 HA VAL 46 -14.301 4.460 -2.045 347 HB VAL 46 HB VAL 46 -12.901 2.462 -2.255 348 HG11 VAL 46 1HG1 VAL 46 -14.621 0.711 -2.330 349 HG12 VAL 46 2HG1 VAL 46 -13.486 0.539 -3.670 350 HG13 VAL 46 3HG1 VAL 46 -15.090 1.217 -3.957 351 HG21 VAL 46 1HG2 VAL 46 -12.670 4.176 -3.997 352 HG22 VAL 46 2HG2 VAL 46 -13.911 3.390 -4.974 353 HG23 VAL 46 3HG2 VAL 46 -12.377 2.572 -4.676 354 H THR 47 H THR 47 -15.307 5.690 -3.500 355 HA THR 47 HA THR 47 -18.048 5.224 -4.257 356 HB THR 47 HB THR 47 -17.838 7.455 -5.375 357 HG1 THR 47 HG1 THR 47 -15.144 7.474 -4.408 358 HG21 THR 47 1HG2 THR 47 -17.405 8.799 -3.345 359 HG22 THR 47 2HG2 THR 47 -16.672 7.399 -2.561 360 HG23 THR 47 3HG2 THR 47 -18.390 7.386 -2.964 361 H SER 48 H SER 48 -18.701 5.681 -6.626 362 HA SER 48 HA SER 48 -17.807 3.472 -8.146 363 HB2 SER 48 2HB SER 48 -19.362 4.339 -9.913 364 HB3 SER 48 3HB SER 48 -20.108 4.207 -8.322 365 HG SER 48 HG SER 48 -20.645 6.180 -9.270 366 H THR 49 H THR 49 -17.331 6.970 -8.592 367 HA THR 49 HA THR 49 -16.089 6.935 -11.109 368 HB THR 49 HB THR 49 -15.191 9.214 -10.414 369 HG1 THR 49 HG1 THR 49 -16.598 9.516 -8.163 370 HG21 THR 49 1HG2 THR 49 -17.447 9.054 -11.414 371 HG22 THR 49 2HG2 THR 49 -17.410 10.303 -10.167 372 HG23 THR 49 3HG2 THR 49 -18.139 8.734 -9.821 373 H ILE 50 H ILE 50 -14.674 6.954 -7.839 374 HA ILE 50 HA ILE 50 -11.947 6.967 -8.656 375 HB ILE 50 HB ILE 50 -13.192 6.134 -5.993 376 HG12 ILE 50 2HG1 ILE 50 -13.695 8.475 -6.581 377 HG13 ILE 50 3HG1 ILE 50 -12.562 8.425 -5.237 378 HG21 ILE 50 1HG2 ILE 50 -10.950 6.503 -4.994 379 HG22 ILE 50 2HG2 ILE 50 -10.277 6.758 -6.604 380 HG23 ILE 50 3HG2 ILE 50 -10.939 5.183 -6.168 381 HD11 ILE 50 1HD1 ILE 50 -11.981 10.183 -6.802 382 HD12 ILE 50 2HD1 ILE 50 -11.873 9.018 -8.122 383 HD13 ILE 50 3HD1 ILE 50 -10.721 8.949 -6.786 384 H LEU 51 H LEU 51 -14.145 4.362 -7.575 385 HA LEU 51 HA LEU 51 -12.296 2.231 -7.661 386 HB2 LEU 51 2HB LEU 51 -14.514 2.196 -6.461 387 HB3 LEU 51 3HB LEU 51 -15.321 2.059 -8.016 388 HG LEU 51 HG LEU 51 -14.219 -0.142 -8.392 389 HD11 LEU 51 1HD1 LEU 51 -13.049 0.199 -5.611 390 HD12 LEU 51 2HD1 LEU 51 -12.153 0.189 -7.132 391 HD13 LEU 51 3HD1 LEU 51 -12.978 -1.268 -6.592 392 HD21 LEU 51 1HD2 LEU 51 -16.441 -0.092 -7.331 393 HD22 LEU 51 2HD2 LEU 51 -15.689 -0.025 -5.736 394 HD23 LEU 51 3HD2 LEU 51 -15.479 -1.453 -6.752 395 H GLU 52 H GLU 52 -14.381 3.656 -10.116 396 HA GLU 52 HA GLU 52 -14.296 1.712 -12.143 397 HB2 GLU 52 2HB GLU 52 -15.841 3.640 -12.193 398 HB3 GLU 52 3HB GLU 52 -14.489 4.754 -12.374 399 HG2 GLU 52 2HG GLU 52 -13.982 3.720 -14.584 400 HG3 GLU 52 3HG GLU 52 -15.393 2.681 -14.399 401 H LYS 53 H LYS 53 -12.278 4.591 -11.609 402 HA LYS 53 HA LYS 53 -10.501 4.210 -13.774 403 HB2 LYS 53 2HB LYS 53 -10.333 5.875 -11.238 404 HB3 LYS 53 3HB LYS 53 -8.992 5.816 -12.376 405 HG2 LYS 53 2HG LYS 53 -10.497 6.660 -14.168 406 HG3 LYS 53 3HG LYS 53 -11.801 6.791 -12.987 407 HD2 LYS 53 2HD LYS 53 -9.143 8.274 -12.793 408 HD3 LYS 53 3HD LYS 53 -10.624 8.971 -13.447 409 HE2 LYS 53 2HE LYS 53 -10.251 7.985 -10.594 410 HE3 LYS 53 3HE LYS 53 -10.242 9.670 -11.113 411 HZ1 LYS 53 1HZ LYS 53 -12.514 9.458 -11.820 412 HZ2 LYS 53 2HZ LYS 53 -12.378 9.007 -10.198 413 HZ3 LYS 53 3HZ LYS 53 -12.545 7.825 -11.398 414 H VAL 54 H VAL 54 -10.175 3.377 -10.295 415 HA VAL 54 HA VAL 54 -7.495 2.505 -10.418 416 HB VAL 54 HB VAL 54 -9.655 1.717 -8.395 417 HG11 VAL 54 1HG1 VAL 54 -6.630 1.421 -8.166 418 HG12 VAL 54 2HG1 VAL 54 -7.790 0.101 -8.324 419 HG13 VAL 54 3HG1 VAL 54 -7.794 1.105 -6.875 420 HG21 VAL 54 1HG2 VAL 54 -8.659 3.466 -6.958 421 HG22 VAL 54 2HG2 VAL 54 -9.225 4.155 -8.479 422 HG23 VAL 54 3HG2 VAL 54 -7.502 3.869 -8.231 423 H LEU 55 H LEU 55 -10.564 0.665 -10.678 424 HA LEU 55 HA LEU 55 -9.381 -1.911 -11.030 425 HB2 LEU 55 2HB LEU 55 -12.141 -0.914 -11.828 426 HB3 LEU 55 3HB LEU 55 -11.639 -2.595 -11.904 427 HG LEU 55 HG LEU 55 -12.004 -0.919 -9.397 428 HD11 LEU 55 1HD1 LEU 55 -14.087 -1.697 -10.404 429 HD12 LEU 55 2HD1 LEU 55 -13.788 -2.517 -8.875 430 HD13 LEU 55 3HD1 LEU 55 -13.495 -3.362 -10.395 431 HD21 LEU 55 1HD2 LEU 55 -10.991 -3.782 -9.568 432 HD22 LEU 55 2HD2 LEU 55 -11.422 -2.926 -8.085 433 HD23 LEU 55 3HD2 LEU 55 -10.058 -2.373 -9.051 434 H ASP 56 H ASP 56 -10.173 0.684 -13.260 435 HA ASP 56 HA ASP 56 -10.013 -0.779 -15.704 436 HB2 ASP 56 2HB ASP 56 -11.061 1.546 -15.344 437 HB3 ASP 56 3HB ASP 56 -9.431 2.202 -15.353 438 H TYR 57 H TYR 57 -7.701 1.140 -13.826 439 HA TYR 57 HA TYR 57 -5.427 0.772 -15.499 440 HB2 TYR 57 2HB TYR 57 -5.569 2.609 -13.819 441 HB3 TYR 57 3HB TYR 57 -5.535 1.430 -12.512 442 HD1 TYR 57 HD1 TYR 57 -3.517 3.115 -15.115 443 HD2 TYR 57 HD2 TYR 57 -3.420 0.292 -11.906 444 HE1 TYR 57 HE1 TYR 57 -1.059 3.165 -15.131 445 HE2 TYR 57 HE2 TYR 57 -0.969 0.345 -11.918 446 HH TYR 57 HH TYR 57 0.817 2.677 -13.645 447 H CYS 58 H CYS 58 -6.774 -1.002 -12.742 448 HA CYS 58 HA CYS 58 -4.687 -2.843 -12.320 449 HB2 CYS 58 2HB CYS 58 -7.679 -3.164 -11.849 450 HB3 CYS 58 3HB CYS 58 -6.448 -4.278 -11.249 451 HG CYS 58 HG CYS 58 -7.611 -1.673 -9.809 452 H ARG 59 H ARG 59 -7.506 -2.904 -14.492 453 HA ARG 59 HA ARG 59 -7.067 -5.507 -15.531 454 HB2 ARG 59 2HB ARG 59 -9.249 -4.283 -15.760 455 HB3 ARG 59 3HB ARG 59 -8.503 -3.204 -16.939 456 HG2 ARG 59 2HG ARG 59 -8.176 -5.006 -18.503 457 HG3 ARG 59 3HG ARG 59 -8.583 -6.213 -17.287 458 HD2 ARG 59 2HD ARG 59 -10.929 -5.067 -17.256 459 HD3 ARG 59 3HD ARG 59 -10.423 -4.365 -18.804 460 HE ARG 59 HE ARG 59 -10.097 -7.245 -18.504 461 HH11 ARG 59 1HH1 ARG 59 -12.163 -4.715 -19.790 462 HH12 ARG 59 2HH1 ARG 59 -13.001 -5.788 -20.862 463 HH21 ARG 59 1HH2 ARG 59 -11.223 -8.634 -19.832 464 HH22 ARG 59 2HH2 ARG 59 -12.461 -8.020 -20.881 465 H HIS 60 H HIS 60 -6.088 -2.276 -16.609 466 HA HIS 60 HA HIS 60 -4.649 -2.839 -18.919 467 HB2 HIS 60 2HB HIS 60 -5.054 -0.545 -18.264 468 HB3 HIS 60 3HB HIS 60 -4.211 -0.759 -16.736 469 HD1 HIS 60 HD1 HIS 60 -3.511 -0.412 -20.444 470 HD2 HIS 60 HD2 HIS 60 -1.519 -0.206 -16.809 471 HE1 HIS 60 HE1 HIS 60 -1.225 0.466 -20.973 472 HE2 HIS 60 HE2 HIS 60 -0.146 0.795 -18.737 473 H HIS 61 H HIS 61 -3.624 -3.035 -15.541 474 HA HIS 61 HA HIS 61 -0.877 -3.658 -16.065 475 HB2 HIS 61 2HB HIS 61 -1.679 -2.498 -13.988 476 HB3 HIS 61 3HB HIS 61 -2.475 -3.988 -13.485 477 HD1 HIS 61 HD1 HIS 61 -0.970 -5.870 -12.534 478 HD2 HIS 61 HD2 HIS 61 1.131 -2.510 -13.783 479 HE1 HIS 61 HE1 HIS 61 1.363 -6.180 -11.672 480 HE2 HIS 61 HE2 HIS 61 2.535 -4.026 -12.227 481 H HIS 62 H HIS 62 -3.809 -5.556 -15.638 482 HA HIS 62 HA HIS 62 -2.427 -8.062 -15.197 483 HB2 HIS 62 2HB HIS 62 -4.683 -7.698 -14.251 484 HB3 HIS 62 3HB HIS 62 -5.358 -7.549 -15.873 485 HD1 HIS 62 HD1 HIS 62 -3.612 -10.131 -13.684 486 HD2 HIS 62 HD2 HIS 62 -6.093 -9.942 -17.012 487 HE1 HIS 62 HE1 HIS 62 -4.190 -12.512 -14.236 488 HE2 HIS 62 HE2 HIS 62 -5.529 -12.381 -16.354 489 H GLN 63 H GLN 63 -3.953 -6.418 -17.913 490 HA GLN 63 HA GLN 63 -3.675 -8.531 -19.822 491 HB2 GLN 63 2HB GLN 63 -4.071 -5.535 -20.268 492 HB3 GLN 63 3HB GLN 63 -4.213 -6.768 -21.510 493 HG2 GLN 63 2HG GLN 63 -6.049 -6.317 -19.148 494 HG3 GLN 63 3HG GLN 63 -6.424 -6.119 -20.857 495 HE21 GLN 63 1HE2 GLN 63 -6.651 -8.027 -22.152 496 HE22 GLN 63 2HE2 GLN 63 -7.028 -9.553 -21.434 497 H HIS 64 H HIS 64 -1.775 -5.719 -18.889 498 HA HIS 64 HA HIS 64 0.551 -6.711 -20.420 499 HB2 HIS 64 2HB HIS 64 -0.314 -3.806 -20.053 500 HB3 HIS 64 3HB HIS 64 1.236 -4.301 -20.724 501 HD1 HIS 64 HD1 HIS 64 1.288 -4.941 -23.173 502 HD2 HIS 64 HD2 HIS 64 -2.578 -4.310 -21.777 503 HE1 HIS 64 HE1 HIS 64 -0.169 -4.913 -25.214 504 HE2 HIS 64 HE2 HIS 64 -2.510 -4.704 -24.333 505 HA PRO 65 HA PRO 65 1.742 -6.387 -15.938 506 HB2 PRO 65 2HB PRO 65 3.023 -8.773 -15.730 507 HB3 PRO 65 3HB PRO 65 1.250 -8.675 -15.694 508 HG2 PRO 65 2HG PRO 65 3.044 -9.419 -17.981 509 HG3 PRO 65 3HG PRO 65 1.534 -10.188 -17.443 510 HD2 PRO 65 2HD PRO 65 1.650 -8.402 -19.536 511 HD3 PRO 65 3HD PRO 65 0.202 -8.646 -18.538 512 H GLY 66 H GLY 66 2.957 -4.635 -17.246 513 HA2 GLY 66 2HA GLY 66 5.615 -5.019 -18.163 514 HA3 GLY 66 3HA GLY 66 4.892 -3.494 -17.667 515 H GLY 67 H GLY 67 7.446 -5.353 -17.045 516 HA2 GLY 67 2HA GLY 67 7.485 -5.805 -14.250 517 HA3 GLY 67 3HA GLY 67 8.881 -5.753 -15.312 518 H SER 68 H SER 68 8.634 -3.073 -16.213 519 HA SER 68 HA SER 68 8.595 -1.277 -13.942 520 HB2 SER 68 2HB SER 68 11.005 -0.553 -14.259 521 HB3 SER 68 3HB SER 68 10.833 -2.180 -13.603 522 HG SER 68 HG SER 68 10.882 -2.317 -16.277 523 H GLY 69 H GLY 69 7.174 0.046 -14.968 524 HA2 GLY 69 2HA GLY 69 7.791 1.148 -17.639 525 HA3 GLY 69 3HA GLY 69 6.272 1.288 -16.769 526 H LEU 70 H LEU 70 8.648 1.892 -14.553 527 HA LEU 70 HA LEU 70 8.133 4.746 -14.577 528 HB2 LEU 70 2HB LEU 70 7.967 3.429 -12.476 529 HB3 LEU 70 3HB LEU 70 9.655 2.971 -12.625 530 HG LEU 70 HG LEU 70 10.267 5.403 -12.408 531 HD11 LEU 70 1HD1 LEU 70 7.353 5.789 -11.673 532 HD12 LEU 70 2HD1 LEU 70 8.171 6.436 -13.095 533 HD13 LEU 70 3HD1 LEU 70 8.630 6.996 -11.490 534 HD21 LEU 70 1HD2 LEU 70 8.782 4.211 -10.040 535 HD22 LEU 70 2HD2 LEU 70 9.987 5.498 -9.958 536 HD23 LEU 70 3HD2 LEU 70 10.458 3.886 -10.489 537 H ASP 71 H ASP 71 9.265 4.937 -16.627 538 HA ASP 71 HA ASP 71 11.638 6.337 -16.541 539 HB2 ASP 71 2HB ASP 71 12.840 4.197 -16.133 540 HB3 ASP 71 3HB ASP 71 12.108 3.493 -17.571 541 H ASP 72 H ASP 72 10.129 3.854 -18.587 542 HA ASP 72 HA ASP 72 10.103 5.221 -21.052 543 HB2 ASP 72 2HB ASP 72 9.681 2.844 -21.027 544 HB3 ASP 72 3HB ASP 72 8.346 3.013 -19.893 545 H ILE 73 H ILE 73 7.677 4.884 -18.509 546 HA ILE 73 HA ILE 73 5.842 5.970 -17.852 547 HB ILE 73 HB ILE 73 7.108 8.427 -19.156 548 HG12 ILE 73 2HG1 ILE 73 7.308 7.454 -16.259 549 HG13 ILE 73 3HG1 ILE 73 8.591 7.326 -17.453 550 HG21 ILE 73 1HG2 ILE 73 5.703 9.760 -17.605 551 HG22 ILE 73 2HG2 ILE 73 4.945 8.280 -17.016 552 HG23 ILE 73 3HG2 ILE 73 4.710 8.782 -18.690 553 HD11 ILE 73 1HD1 ILE 73 8.997 9.150 -15.926 554 HD12 ILE 73 2HD1 ILE 73 7.453 9.890 -16.343 555 HD13 ILE 73 3HD1 ILE 73 8.734 9.771 -17.553 556 HA PRO 74 HA PRO 74 3.817 5.296 -21.971 557 HB2 PRO 74 2HB PRO 74 1.775 3.901 -20.289 558 HB3 PRO 74 3HB PRO 74 2.679 3.292 -21.691 559 HG2 PRO 74 2HG PRO 74 3.201 2.408 -19.219 560 HG3 PRO 74 3HG PRO 74 4.502 2.637 -20.415 561 HD2 PRO 74 2HD PRO 74 3.702 4.445 -18.131 562 HD3 PRO 74 3HD PRO 74 5.326 3.938 -18.657 563 HA PRO 75 HA PRO 75 1.335 9.003 -21.655 564 HB2 PRO 75 2HB PRO 75 -0.589 8.339 -23.658 565 HB3 PRO 75 3HB PRO 75 0.951 9.178 -23.909 566 HG2 PRO 75 2HG PRO 75 0.317 6.274 -24.252 567 HG3 PRO 75 3HG PRO 75 1.370 7.325 -25.226 568 HD2 PRO 75 2HD PRO 75 2.438 5.586 -23.516 569 HD3 PRO 75 3HD PRO 75 3.134 7.216 -23.671 570 H TYR 76 H TYR 76 -0.642 5.978 -21.902 571 HA TYR 76 HA TYR 76 -2.978 6.969 -20.687 572 HB2 TYR 76 2HB TYR 76 -3.196 4.851 -21.791 573 HB3 TYR 76 3HB TYR 76 -1.875 4.134 -20.874 574 HD1 TYR 76 HD1 TYR 76 -5.408 5.390 -20.527 575 HD2 TYR 76 HD2 TYR 76 -2.323 2.958 -18.827 576 HE1 TYR 76 HE1 TYR 76 -6.988 4.540 -18.831 577 HE2 TYR 76 HE2 TYR 76 -3.904 2.116 -17.156 578 HH TYR 76 HH TYR 76 -7.274 2.766 -17.245 579 H ASP 77 H ASP 77 -0.301 5.154 -19.231 580 HA ASP 77 HA ASP 77 -1.244 5.063 -16.574 581 HB2 ASP 77 2HB ASP 77 1.616 4.881 -17.628 582 HB3 ASP 77 3HB ASP 77 1.094 4.364 -16.030 583 H ARG 78 H ARG 78 0.595 7.437 -18.328 584 HA ARG 78 HA ARG 78 1.583 9.017 -16.160 585 HB2 ARG 78 2HB ARG 78 2.630 8.998 -18.390 586 HB3 ARG 78 3HB ARG 78 1.149 9.601 -19.122 587 HG2 ARG 78 2HG ARG 78 1.472 11.702 -17.674 588 HG3 ARG 78 3HG ARG 78 3.097 11.086 -17.347 589 HD2 ARG 78 2HD ARG 78 3.144 12.685 -19.195 590 HD3 ARG 78 3HD ARG 78 3.572 11.074 -19.777 591 HE ARG 78 HE ARG 78 0.764 11.661 -20.073 592 HH11 ARG 78 1HH1 ARG 78 3.895 12.144 -21.612 593 HH12 ARG 78 2HH1 ARG 78 3.218 12.349 -23.193 594 HH21 ARG 78 1HH2 ARG 78 -0.102 11.889 -22.158 595 HH22 ARG 78 2HH2 ARG 78 0.947 12.202 -23.506 596 H ASP 79 H ASP 79 -1.048 9.464 -18.514 597 HA ASP 79 HA ASP 79 -1.965 11.939 -17.397 598 HB2 ASP 79 2HB ASP 79 -3.195 10.150 -19.533 599 HB3 ASP 79 3HB ASP 79 -3.815 11.740 -19.092 600 H PHE 80 H PHE 80 -2.706 8.615 -16.878 601 HA PHE 80 HA PHE 80 -5.220 8.689 -15.679 602 HB2 PHE 80 2HB PHE 80 -3.927 6.603 -16.226 603 HB3 PHE 80 3HB PHE 80 -2.825 6.943 -14.897 604 HD1 PHE 80 HD1 PHE 80 -6.189 5.784 -15.815 605 HD2 PHE 80 HD2 PHE 80 -3.553 6.643 -12.561 606 HE1 PHE 80 HE1 PHE 80 -7.692 4.608 -14.269 607 HE2 PHE 80 HE2 PHE 80 -5.066 5.466 -11.033 608 HZ PHE 80 HZ PHE 80 -7.124 4.451 -11.879 609 H CYS 81 H CYS 81 -2.011 9.356 -14.333 610 HA CYS 81 HA CYS 81 -2.847 9.656 -11.599 611 HB2 CYS 81 2HB CYS 81 -0.240 10.426 -12.967 612 HB3 CYS 81 3HB CYS 81 -0.495 10.370 -11.223 613 HG CYS 81 HG CYS 81 -0.340 7.771 -13.412 614 H LYS 82 H LYS 82 -3.065 11.735 -14.286 615 HA LYS 82 HA LYS 82 -2.687 14.270 -12.935 616 HB2 LYS 82 2HB LYS 82 -3.888 13.613 -15.655 617 HB3 LYS 82 3HB LYS 82 -3.581 15.242 -15.062 618 HG2 LYS 82 2HG LYS 82 -1.146 14.708 -14.955 619 HG3 LYS 82 3HG LYS 82 -1.498 13.116 -15.641 620 HD2 LYS 82 2HD LYS 82 -0.745 14.681 -17.393 621 HD3 LYS 82 3HD LYS 82 -2.412 14.177 -17.674 622 HE2 LYS 82 2HE LYS 82 -3.195 16.306 -16.644 623 HE3 LYS 82 3HE LYS 82 -1.516 16.812 -16.455 624 HZ1 LYS 82 1HZ LYS 82 -2.514 17.779 -18.405 625 HZ2 LYS 82 2HZ LYS 82 -2.889 16.253 -19.025 626 HZ3 LYS 82 3HZ LYS 82 -1.273 16.723 -18.858 627 H VAL 83 H VAL 83 -4.167 13.821 -11.180 628 HA VAL 83 HA VAL 83 -6.957 14.611 -11.772 629 HB VAL 83 HB VAL 83 -7.685 13.197 -9.810 630 HG11 VAL 83 1HG1 VAL 83 -6.380 11.592 -12.045 631 HG12 VAL 83 2HG1 VAL 83 -7.991 12.311 -12.092 632 HG13 VAL 83 3HG1 VAL 83 -7.645 11.007 -10.956 633 HG21 VAL 83 1HG2 VAL 83 -6.182 11.423 -8.934 634 HG22 VAL 83 2HG2 VAL 83 -5.528 13.031 -8.623 635 HG23 VAL 83 3HG2 VAL 83 -4.863 12.049 -9.930 636 H ASP 84 H ASP 84 -7.983 15.504 -9.654 637 HA ASP 84 HA ASP 84 -6.450 17.654 -8.584 638 HB2 ASP 84 2HB ASP 84 -9.051 16.399 -7.593 639 HB3 ASP 84 3HB ASP 84 -8.386 17.913 -6.981 640 H GLN 85 H GLN 85 -5.931 17.987 -6.266 641 HA GLN 85 HA GLN 85 -4.321 15.945 -5.199 642 HB2 GLN 85 2HB GLN 85 -4.783 18.700 -4.567 643 HB3 GLN 85 3HB GLN 85 -5.009 17.827 -3.065 644 HG2 GLN 85 2HG GLN 85 -2.519 17.806 -4.808 645 HG3 GLN 85 3HG GLN 85 -2.719 18.664 -3.285 646 HE21 GLN 85 1HE2 GLN 85 -1.163 17.694 -2.091 647 HE22 GLN 85 2HE2 GLN 85 -1.142 16.009 -1.698 648 HA PRO 86 HA PRO 86 -7.923 14.949 -1.945 649 HB2 PRO 86 2HB PRO 86 -10.498 15.443 -2.911 650 HB3 PRO 86 3HB PRO 86 -9.628 16.512 -1.791 651 HG2 PRO 86 2HG PRO 86 -9.873 16.734 -4.780 652 HG3 PRO 86 3HG PRO 86 -10.037 18.002 -3.541 653 HD2 PRO 86 2HD PRO 86 -7.765 17.776 -4.926 654 HD3 PRO 86 3HD PRO 86 -7.717 18.146 -3.188 655 H THR 87 H THR 87 -8.704 14.891 -5.433 656 HA THR 87 HA THR 87 -9.861 12.314 -5.565 657 HB THR 87 HB THR 87 -8.410 13.783 -7.815 658 HG1 THR 87 HG1 THR 87 -11.069 14.129 -6.829 659 HG21 THR 87 1HG2 THR 87 -10.063 12.696 -9.294 660 HG22 THR 87 2HG2 THR 87 -10.784 11.875 -7.910 661 HG23 THR 87 3HG2 THR 87 -9.136 11.483 -8.406 662 H LEU 88 H LEU 88 -6.544 13.437 -5.653 663 HA LEU 88 HA LEU 88 -5.288 11.078 -6.677 664 HB2 LEU 88 2HB LEU 88 -4.412 13.526 -6.619 665 HB3 LEU 88 3HB LEU 88 -3.955 13.220 -4.958 666 HG LEU 88 HG LEU 88 -2.872 11.639 -7.336 667 HD11 LEU 88 1HD1 LEU 88 -1.584 13.977 -5.892 668 HD12 LEU 88 2HD1 LEU 88 -2.203 13.975 -7.543 669 HD13 LEU 88 3HD1 LEU 88 -0.817 12.971 -7.128 670 HD21 LEU 88 1HD2 LEU 88 -2.698 10.401 -5.231 671 HD22 LEU 88 2HD2 LEU 88 -1.894 11.772 -4.466 672 HD23 LEU 88 3HD2 LEU 88 -1.101 10.907 -5.787 673 H PHE 89 H PHE 89 -5.746 12.478 -3.419 674 HA PHE 89 HA PHE 89 -4.658 10.359 -1.916 675 HB2 PHE 89 2HB PHE 89 -6.766 12.428 -1.190 676 HB3 PHE 89 3HB PHE 89 -6.125 11.273 -0.029 677 HD1 PHE 89 HD1 PHE 89 -3.259 11.219 -0.469 678 HD2 PHE 89 HD2 PHE 89 -5.923 14.562 -0.650 679 HE1 PHE 89 HE1 PHE 89 -1.410 12.738 0.118 680 HE2 PHE 89 HE2 PHE 89 -4.065 16.068 -0.067 681 HZ PHE 89 HZ PHE 89 -1.810 15.159 0.318 682 H GLU 90 H GLU 90 -7.882 10.829 -3.308 683 HA GLU 90 HA GLU 90 -9.214 8.651 -2.096 684 HB2 GLU 90 2HB GLU 90 -9.664 10.037 -4.767 685 HB3 GLU 90 3HB GLU 90 -10.716 8.761 -4.169 686 HG2 GLU 90 2HG GLU 90 -10.225 11.421 -2.818 687 HG3 GLU 90 3HG GLU 90 -11.651 10.986 -3.755 688 H LEU 91 H LEU 91 -7.227 8.847 -5.048 689 HA LEU 91 HA LEU 91 -7.568 6.148 -5.894 690 HB2 LEU 91 2HB LEU 91 -5.268 8.066 -6.446 691 HB3 LEU 91 3HB LEU 91 -5.510 6.536 -7.273 692 HG LEU 91 HG LEU 91 -7.320 8.983 -7.450 693 HD11 LEU 91 1HD1 LEU 91 -6.602 9.100 -9.795 694 HD12 LEU 91 2HD1 LEU 91 -5.529 7.720 -9.550 695 HD13 LEU 91 3HD1 LEU 91 -5.227 9.236 -8.699 696 HD21 LEU 91 1HD2 LEU 91 -8.687 6.941 -7.562 697 HD22 LEU 91 2HD2 LEU 91 -7.657 6.303 -8.843 698 HD23 LEU 91 3HD2 LEU 91 -8.630 7.748 -9.129 699 H ILE 92 H ILE 92 -5.226 7.734 -3.742 700 HA ILE 92 HA ILE 92 -3.529 5.527 -3.192 701 HB ILE 92 HB ILE 92 -4.214 7.891 -1.362 702 HG12 ILE 92 2HG1 ILE 92 -1.864 7.526 -3.282 703 HG13 ILE 92 3HG1 ILE 92 -3.225 8.612 -3.523 704 HG21 ILE 92 1HG2 ILE 92 -1.878 5.946 -1.163 705 HG22 ILE 92 2HG2 ILE 92 -3.246 6.038 -0.053 706 HG23 ILE 92 3HG2 ILE 92 -2.103 7.376 -0.155 707 HD11 ILE 92 1HD1 ILE 92 -2.524 9.906 -1.559 708 HD12 ILE 92 2HD1 ILE 92 -1.276 9.833 -2.803 709 HD13 ILE 92 3HD1 ILE 92 -1.138 8.830 -1.359 710 H LEU 93 H LEU 93 -6.487 6.729 -1.623 711 HA LEU 93 HA LEU 93 -6.528 4.900 0.557 712 HB2 LEU 93 2HB LEU 93 -8.706 6.653 -0.648 713 HB3 LEU 93 3HB LEU 93 -8.951 5.684 0.796 714 HG LEU 93 HG LEU 93 -6.913 7.935 0.549 715 HD11 LEU 93 1HD1 LEU 93 -8.399 9.252 1.981 716 HD12 LEU 93 2HD1 LEU 93 -9.591 7.950 1.978 717 HD13 LEU 93 3HD1 LEU 93 -9.209 8.802 0.481 718 HD21 LEU 93 1HD2 LEU 93 -6.188 6.231 2.156 719 HD22 LEU 93 2HD2 LEU 93 -7.740 6.325 2.992 720 HD23 LEU 93 3HD2 LEU 93 -6.652 7.715 2.990 721 H ALA 94 H ALA 94 -8.000 4.872 -2.669 722 HA ALA 94 HA ALA 94 -9.703 2.599 -2.284 723 HB1 ALA 94 1HB ALA 94 -8.641 3.818 -4.865 724 HB2 ALA 94 2HB ALA 94 -10.127 4.284 -4.034 725 HB3 ALA 94 3HB ALA 94 -9.984 2.672 -4.732 726 H ALA 95 H ALA 95 -6.484 3.084 -3.663 727 HA ALA 95 HA ALA 95 -5.979 0.399 -4.460 728 HB1 ALA 95 1HB ALA 95 -4.766 2.332 -5.383 729 HB2 ALA 95 2HB ALA 95 -3.657 1.133 -4.715 730 HB3 ALA 95 3HB ALA 95 -4.009 2.615 -3.817 731 H ASN 96 H ASN 96 -5.387 2.215 -1.468 732 HA ASN 96 HA ASN 96 -3.916 0.154 -0.096 733 HB2 ASN 96 2HB ASN 96 -3.880 2.671 0.401 734 HB3 ASN 96 3HB ASN 96 -5.459 2.487 1.146 735 HD21 ASN 96 1HD2 ASN 96 -2.974 3.399 2.311 736 HD22 ASN 96 2HD2 ASN 96 -2.629 2.351 3.633 737 H TYR 97 H TYR 97 -7.286 1.088 -0.386 738 HA TYR 97 HA TYR 97 -8.436 -0.417 1.726 739 HB2 TYR 97 2HB TYR 97 -9.580 1.487 0.646 740 HB3 TYR 97 3HB TYR 97 -9.669 0.611 -0.873 741 HD1 TYR 97 HD1 TYR 97 -11.733 -0.423 -1.382 742 HD2 TYR 97 HD2 TYR 97 -10.734 0.233 2.727 743 HE1 TYR 97 HE1 TYR 97 -13.961 -1.204 -0.712 744 HE2 TYR 97 HE2 TYR 97 -12.960 -0.556 3.389 745 HH TYR 97 HH TYR 97 -14.999 -2.213 1.563 746 H LEU 98 H LEU 98 -7.740 -1.146 -1.654 747 HA LEU 98 HA LEU 98 -8.825 -3.870 -1.364 748 HB2 LEU 98 2HB LEU 98 -8.086 -2.296 -3.853 749 HB3 LEU 98 3HB LEU 98 -8.645 -3.963 -3.861 750 HG LEU 98 HG LEU 98 -10.256 -1.535 -2.977 751 HD11 LEU 98 1HD1 LEU 98 -10.599 -3.360 -5.379 752 HD12 LEU 98 2HD1 LEU 98 -10.035 -1.689 -5.404 753 HD13 LEU 98 3HD1 LEU 98 -11.687 -2.050 -4.914 754 HD21 LEU 98 1HD2 LEU 98 -10.827 -3.452 -1.559 755 HD22 LEU 98 2HD2 LEU 98 -11.092 -4.456 -2.986 756 HD23 LEU 98 3HD2 LEU 98 -12.152 -3.083 -2.664 757 H ASP 99 H ASP 99 -5.887 -2.304 -1.095 758 HA ASP 99 HA ASP 99 -3.711 -2.869 -1.058 759 HB2 ASP 99 2HB ASP 99 -4.733 -5.730 -1.093 760 HB3 ASP 99 3HB ASP 99 -3.059 -5.283 -0.785 761 H ILE 100 H ILE 100 -5.047 -2.413 -3.591 762 HA ILE 100 HA ILE 100 -3.631 -3.877 -5.631 763 HB ILE 100 HB ILE 100 -5.022 -1.151 -5.807 764 HG12 ILE 100 2HG1 ILE 100 -6.090 -3.920 -6.515 765 HG13 ILE 100 3HG1 ILE 100 -6.514 -3.019 -5.068 766 HG21 ILE 100 1HG2 ILE 100 -5.079 -1.516 -8.254 767 HG22 ILE 100 2HG2 ILE 100 -4.202 -3.034 -8.063 768 HG23 ILE 100 3HG2 ILE 100 -3.413 -1.507 -7.668 769 HD11 ILE 100 1HD1 ILE 100 -8.265 -2.902 -6.702 770 HD12 ILE 100 2HD1 ILE 100 -7.158 -2.233 -7.899 771 HD13 ILE 100 3HD1 ILE 100 -7.566 -1.302 -6.455 772 H LYS 101 H LYS 101 -1.495 -3.774 -4.790 773 HA LYS 101 HA LYS 101 -0.076 -1.406 -4.240 774 HB2 LYS 101 2HB LYS 101 0.535 -3.720 -3.458 775 HB3 LYS 101 3HB LYS 101 1.135 -4.074 -5.070 776 HG2 LYS 101 2HG LYS 101 2.243 -1.691 -3.582 777 HG3 LYS 101 3HG LYS 101 2.779 -3.307 -3.131 778 HD2 LYS 101 2HD LYS 101 3.721 -3.702 -5.312 779 HD3 LYS 101 3HD LYS 101 2.962 -2.254 -5.979 780 HE2 LYS 101 2HE LYS 101 5.384 -1.938 -5.557 781 HE3 LYS 101 3HE LYS 101 4.397 -0.829 -4.608 782 HZ1 LYS 101 1HZ LYS 101 5.596 -3.342 -3.593 783 HZ2 LYS 101 2HZ LYS 101 4.706 -2.230 -2.689 784 HZ3 LYS 101 3HZ LYS 101 6.206 -1.793 -3.327 785 HA PRO 102 HA PRO 102 1.566 -1.893 -9.028 786 HB2 PRO 102 2HB PRO 102 -0.886 -2.135 -10.523 787 HB3 PRO 102 3HB PRO 102 0.428 -3.317 -10.415 788 HG2 PRO 102 2HG PRO 102 -2.126 -3.191 -8.870 789 HG3 PRO 102 3HG PRO 102 -1.223 -4.611 -9.453 790 HD2 PRO 102 2HD PRO 102 -1.150 -3.958 -6.878 791 HD3 PRO 102 3HD PRO 102 0.339 -4.490 -7.695 792 H LEU 103 H LEU 103 -1.749 -0.659 -8.333 793 HA LEU 103 HA LEU 103 -1.324 1.816 -9.767 794 HB2 LEU 103 2HB LEU 103 -3.548 0.702 -9.608 795 HB3 LEU 103 3HB LEU 103 -3.585 0.996 -7.882 796 HG LEU 103 HG LEU 103 -4.961 2.552 -9.528 797 HD11 LEU 103 1HD1 LEU 103 -3.338 3.823 -7.299 798 HD12 LEU 103 2HD1 LEU 103 -4.875 2.978 -7.120 799 HD13 LEU 103 3HD1 LEU 103 -4.805 4.486 -8.027 800 HD21 LEU 103 1HD2 LEU 103 -3.138 3.113 -11.062 801 HD22 LEU 103 2HD2 LEU 103 -2.230 3.872 -9.754 802 HD23 LEU 103 3HD2 LEU 103 -3.754 4.569 -10.287 803 H LEU 104 H LEU 104 -1.486 0.815 -6.376 804 HA LEU 104 HA LEU 104 -1.403 3.223 -5.024 805 HB2 LEU 104 2HB LEU 104 -1.794 1.067 -3.951 806 HB3 LEU 104 3HB LEU 104 -0.164 0.545 -4.332 807 HG LEU 104 HG LEU 104 0.684 2.366 -2.770 808 HD11 LEU 104 1HD1 LEU 104 -2.225 2.565 -1.924 809 HD12 LEU 104 2HD1 LEU 104 -1.278 3.827 -2.719 810 HD13 LEU 104 3HD1 LEU 104 -0.844 3.298 -1.097 811 HD21 LEU 104 1HD2 LEU 104 -1.054 0.204 -1.544 812 HD22 LEU 104 2HD2 LEU 104 0.290 1.042 -0.763 813 HD23 LEU 104 3HD2 LEU 104 0.595 -0.004 -2.145 814 H ASP 105 H ASP 105 1.300 1.320 -6.321 815 HA ASP 105 HA ASP 105 3.435 2.746 -5.126 816 HB2 ASP 105 2HB ASP 105 3.658 0.433 -6.046 817 HB3 ASP 105 3HB ASP 105 3.466 1.061 -7.681 818 H VAL 106 H VAL 106 2.045 2.836 -8.395 819 HA VAL 106 HA VAL 106 3.588 4.874 -9.527 820 HB VAL 106 HB VAL 106 0.689 4.111 -10.125 821 HG11 VAL 106 1HG1 VAL 106 1.030 5.077 -12.370 822 HG12 VAL 106 2HG1 VAL 106 2.635 5.641 -11.900 823 HG13 VAL 106 3HG1 VAL 106 1.202 6.307 -11.117 824 HG21 VAL 106 1HG2 VAL 106 2.245 2.208 -10.305 825 HG22 VAL 106 2HG2 VAL 106 3.264 3.127 -11.416 826 HG23 VAL 106 3HG2 VAL 106 1.625 2.673 -11.890 827 H THR 107 H THR 107 0.590 5.045 -7.648 828 HA THR 107 HA THR 107 0.092 7.845 -8.004 829 HB THR 107 HB THR 107 -1.086 5.950 -5.906 830 HG1 THR 107 HG1 THR 107 -1.214 5.463 -8.345 831 HG21 THR 107 1HG2 THR 107 -3.063 7.421 -6.005 832 HG22 THR 107 2HG2 THR 107 -2.243 8.471 -7.162 833 HG23 THR 107 3HG2 THR 107 -1.640 8.341 -5.509 834 H CYS 108 H CYS 108 1.754 5.907 -5.546 835 HA CYS 108 HA CYS 108 2.183 8.058 -3.668 836 HB2 CYS 108 2HB CYS 108 3.491 5.316 -3.887 837 HB3 CYS 108 3HB CYS 108 3.775 6.451 -2.565 838 HG CYS 108 HG CYS 108 0.606 5.435 -3.273 839 H LYS 109 H LYS 109 3.877 6.743 -6.440 840 HA LYS 109 HA LYS 109 6.309 8.232 -6.055 841 HB2 LYS 109 2HB LYS 109 5.222 6.432 -8.200 842 HB3 LYS 109 3HB LYS 109 6.418 7.615 -8.715 843 HG2 LYS 109 2HG LYS 109 7.382 5.372 -8.147 844 HG3 LYS 109 3HG LYS 109 8.093 6.705 -7.237 845 HD2 LYS 109 2HD LYS 109 6.710 6.106 -5.272 846 HD3 LYS 109 3HD LYS 109 5.974 4.787 -6.185 847 HE2 LYS 109 2HE LYS 109 8.926 4.999 -5.512 848 HE3 LYS 109 3HE LYS 109 7.758 4.019 -4.629 849 HZ1 LYS 109 1HZ LYS 109 7.360 2.744 -6.644 850 HZ2 LYS 109 2HZ LYS 109 8.991 2.692 -6.203 851 HZ3 LYS 109 3HZ LYS 109 8.491 3.676 -7.480 852 H THR 110 H THR 110 3.207 8.844 -7.616 853 HA THR 110 HA THR 110 3.836 11.146 -9.105 854 HB THR 110 HB THR 110 1.205 10.483 -7.697 855 HG1 THR 110 HG1 THR 110 2.342 9.082 -9.482 856 HG21 THR 110 1HG2 THR 110 1.714 12.327 -10.072 857 HG22 THR 110 2HG2 THR 110 1.248 12.847 -8.451 858 HG23 THR 110 3HG2 THR 110 0.132 11.893 -9.428 859 H VAL 111 H VAL 111 2.637 10.875 -5.708 860 HA VAL 111 HA VAL 111 2.885 13.670 -5.133 861 HB VAL 111 HB VAL 111 2.571 13.087 -2.733 862 HG11 VAL 111 1HG1 VAL 111 0.617 11.698 -4.597 863 HG12 VAL 111 2HG1 VAL 111 0.612 13.407 -4.164 864 HG13 VAL 111 3HG1 VAL 111 0.282 12.189 -2.934 865 HG21 VAL 111 1HG2 VAL 111 2.138 10.754 -2.035 866 HG22 VAL 111 2HG2 VAL 111 3.785 10.948 -2.634 867 HG23 VAL 111 3HG2 VAL 111 2.563 10.183 -3.651 868 H ALA 112 H ALA 112 5.077 10.941 -4.827 869 HA ALA 112 HA ALA 112 7.112 12.111 -3.266 870 HB1 ALA 112 1HB ALA 112 7.384 10.012 -5.443 871 HB2 ALA 112 2HB ALA 112 7.001 9.700 -3.751 872 HB3 ALA 112 3HB ALA 112 8.575 10.368 -4.184 873 H ASN 113 H ASN 113 6.490 12.163 -6.765 874 HA ASN 113 HA ASN 113 8.860 13.473 -7.603 875 HB2 ASN 113 2HB ASN 113 6.107 13.373 -8.918 876 HB3 ASN 113 3HB ASN 113 7.539 14.041 -9.696 877 HD21 ASN 113 1HD2 ASN 113 5.871 11.816 -10.542 878 HD22 ASN 113 2HD2 ASN 113 6.912 10.445 -10.662 879 H MET 114 H MET 114 5.810 14.675 -6.331 880 HA MET 114 HA MET 114 6.057 17.394 -7.141 881 HB2 MET 114 2HB MET 114 4.452 16.258 -4.808 882 HB3 MET 114 3HB MET 114 4.266 17.871 -5.484 883 HG2 MET 114 2HG MET 114 3.657 16.743 -7.680 884 HG3 MET 114 3HG MET 114 3.569 15.234 -6.774 885 HE1 MET 114 1HE MET 114 2.405 16.568 -3.926 886 HE2 MET 114 2HE MET 114 1.804 15.026 -4.534 887 HE3 MET 114 3HE MET 114 0.676 16.321 -4.142 888 H ILE 115 H ILE 115 7.135 15.640 -4.238 889 HA ILE 115 HA ILE 115 8.284 18.096 -3.080 890 HB ILE 115 HB ILE 115 8.837 16.722 -1.094 891 HG12 ILE 115 2HG1 ILE 115 7.520 14.402 -2.590 892 HG13 ILE 115 3HG1 ILE 115 9.243 14.548 -2.266 893 HG21 ILE 115 1HG2 ILE 115 5.944 16.394 -1.975 894 HG22 ILE 115 2HG2 ILE 115 6.635 17.824 -1.206 895 HG23 ILE 115 3HG2 ILE 115 6.531 16.306 -0.313 896 HD11 ILE 115 1HD1 ILE 115 7.068 14.241 -0.201 897 HD12 ILE 115 2HD1 ILE 115 8.797 14.392 0.133 898 HD13 ILE 115 3HD1 ILE 115 8.190 12.993 -0.749 899 H ARG 116 H ARG 116 9.265 15.514 -5.092 900 HA ARG 116 HA ARG 116 12.104 15.599 -4.466 901 HB2 ARG 116 2HB ARG 116 10.847 13.562 -5.376 902 HB3 ARG 116 3HB ARG 116 10.742 14.381 -6.919 903 HG2 ARG 116 2HG ARG 116 13.403 13.751 -5.598 904 HG3 ARG 116 3HG ARG 116 12.564 12.589 -6.621 905 HD2 ARG 116 2HD ARG 116 12.669 14.223 -8.505 906 HD3 ARG 116 3HD ARG 116 13.586 15.321 -7.471 907 HE ARG 116 HE ARG 116 14.906 12.861 -7.487 908 HH11 ARG 116 1HH1 ARG 116 14.176 15.415 -9.815 909 HH12 ARG 116 2HH1 ARG 116 15.582 15.083 -10.775 910 HH21 ARG 116 1HH2 ARG 116 16.719 12.464 -8.745 911 HH22 ARG 116 2HH2 ARG 116 17.020 13.409 -10.165 912 H GLY 117 H GLY 117 12.639 17.746 -4.668 913 HA2 GLY 117 2HA GLY 117 13.849 18.825 -6.781 914 HA3 GLY 117 3HA GLY 117 12.172 19.245 -7.133 915 H1 SER 2 1H SER 2 17.449 -15.642 12.579 916 H2 SER 2 2H SER 2 16.264 -15.857 11.396 917 H3 SER 2 3H SER 2 16.532 -17.057 12.560 918 HA SER 2 HA SER 2 14.552 -15.832 13.051 919 HB2 SER 2 2HB SER 2 16.804 -15.253 15.011 920 HB3 SER 2 3HB SER 2 15.084 -15.306 15.399 921 HG SER 2 HG SER 2 15.079 -17.504 14.839 922 H LEU 3 H LEU 3 17.456 -13.777 12.903 923 HA LEU 3 HA LEU 3 15.754 -11.351 12.807 924 HB2 LEU 3 2HB LEU 3 18.730 -11.587 13.437 925 HB3 LEU 3 3HB LEU 3 17.775 -10.112 13.496 926 HG LEU 3 HG LEU 3 17.291 -12.509 15.305 927 HD11 LEU 3 1HD1 LEU 3 19.491 -11.570 15.785 928 HD12 LEU 3 2HD1 LEU 3 18.364 -11.253 17.100 929 HD13 LEU 3 3HD1 LEU 3 18.787 -9.961 15.971 930 HD21 LEU 3 1HD2 LEU 3 16.200 -9.681 15.448 931 HD22 LEU 3 2HD2 LEU 3 15.919 -10.956 16.635 932 HD23 LEU 3 3HD2 LEU 3 15.297 -11.130 14.997 933 H VAL 4 H VAL 4 15.423 -10.707 10.760 934 HA VAL 4 HA VAL 4 17.399 -11.122 8.658 935 HB VAL 4 HB VAL 4 15.669 -10.057 7.140 936 HG11 VAL 4 1HG1 VAL 4 14.135 -12.007 7.152 937 HG12 VAL 4 2HG1 VAL 4 14.710 -12.457 8.761 938 HG13 VAL 4 3HG1 VAL 4 15.812 -12.505 7.382 939 HG21 VAL 4 1HG2 VAL 4 13.344 -9.772 7.972 940 HG22 VAL 4 2HG2 VAL 4 14.455 -8.662 8.773 941 HG23 VAL 4 3HG2 VAL 4 13.892 -10.105 9.620 942 H LYS 5 H LYS 5 19.043 -9.817 8.662 943 HA LYS 5 HA LYS 5 19.092 -7.214 9.882 944 HB2 LYS 5 2HB LYS 5 21.187 -8.623 8.184 945 HB3 LYS 5 3HB LYS 5 21.466 -7.220 9.207 946 HG2 LYS 5 2HG LYS 5 20.902 -8.596 11.202 947 HG3 LYS 5 3HG LYS 5 20.691 -9.999 10.154 948 HD2 LYS 5 2HD LYS 5 23.072 -9.831 9.462 949 HD3 LYS 5 3HD LYS 5 23.275 -8.432 10.522 950 HE2 LYS 5 2HE LYS 5 22.709 -9.865 12.475 951 HE3 LYS 5 3HE LYS 5 22.590 -11.259 11.396 952 HZ1 LYS 5 1HZ LYS 5 25.018 -9.627 11.887 953 HZ2 LYS 5 2HZ LYS 5 24.925 -10.923 10.812 954 HZ3 LYS 5 3HZ LYS 5 24.728 -11.190 12.469 955 H LEU 6 H LEU 6 18.138 -5.567 8.863 956 HA LEU 6 HA LEU 6 18.154 -5.329 5.932 957 HB2 LEU 6 2HB LEU 6 16.524 -3.773 7.980 958 HB3 LEU 6 3HB LEU 6 16.341 -3.693 6.235 959 HG LEU 6 HG LEU 6 15.664 -6.063 8.022 960 HD11 LEU 6 1HD1 LEU 6 13.347 -5.638 7.326 961 HD12 LEU 6 2HD1 LEU 6 13.873 -4.232 6.396 962 HD13 LEU 6 3HD1 LEU 6 14.040 -4.245 8.153 963 HD21 LEU 6 1HD2 LEU 6 15.432 -5.874 4.997 964 HD22 LEU 6 2HD2 LEU 6 14.818 -7.192 6.000 965 HD23 LEU 6 3HD2 LEU 6 16.552 -6.902 5.896 966 H GLU 7 H GLU 7 20.308 -4.541 5.676 967 HA GLU 7 HA GLU 7 21.198 -2.087 6.859 968 HB2 GLU 7 2HB GLU 7 22.066 -3.484 4.288 969 HB3 GLU 7 3HB GLU 7 22.793 -1.980 4.863 970 HG2 GLU 7 2HG GLU 7 24.266 -3.630 5.579 971 HG3 GLU 7 3HG GLU 7 23.319 -3.266 7.016 972 H SER 8 H SER 8 19.992 -0.308 6.633 973 HA SER 8 HA SER 8 18.247 0.344 4.516 974 HB2 SER 8 2HB SER 8 18.339 2.665 5.547 975 HB3 SER 8 3HB SER 8 18.008 1.374 6.706 976 HG SER 8 HG SER 8 19.947 1.608 7.575 977 H SER 9 H SER 9 18.622 2.635 3.381 978 HA SER 9 HA SER 9 20.757 2.469 1.532 979 HB2 SER 9 2HB SER 9 18.526 3.591 1.105 980 HB3 SER 9 3HB SER 9 19.046 4.922 2.141 981 HG SER 9 HG SER 9 20.493 5.534 0.656 982 H ASP 10 H ASP 10 20.549 3.752 4.708 983 HA ASP 10 HA ASP 10 23.015 5.344 4.542 984 HB2 ASP 10 2HB ASP 10 20.956 6.205 5.702 985 HB3 ASP 10 3HB ASP 10 21.068 4.873 6.841 986 H GLU 11 H GLU 11 22.400 2.175 4.677 987 HA GLU 11 HA GLU 11 23.558 0.308 5.098 988 HB2 GLU 11 2HB GLU 11 25.785 2.201 5.932 989 HB3 GLU 11 3HB GLU 11 25.984 0.462 5.739 990 HG2 GLU 11 2HG GLU 11 25.346 0.691 3.336 991 HG3 GLU 11 3HG GLU 11 25.243 2.435 3.560 992 H LYS 12 H LYS 12 22.190 1.977 7.437 993 HA LYS 12 HA LYS 12 23.350 0.866 9.816 994 HB2 LYS 12 2HB LYS 12 20.623 2.129 9.320 995 HB3 LYS 12 3HB LYS 12 21.203 1.662 10.910 996 HG2 LYS 12 2HG LYS 12 22.691 3.671 9.198 997 HG3 LYS 12 3HG LYS 12 21.348 4.140 10.229 998 HD2 LYS 12 2HD LYS 12 23.244 4.620 11.526 999 HD3 LYS 12 3HD LYS 12 22.672 3.088 12.173 1000 HE2 LYS 12 2HE LYS 12 24.416 1.914 10.852 1001 HE3 LYS 12 3HE LYS 12 24.997 3.472 10.258 1002 HZ1 LYS 12 1HZ LYS 12 24.902 2.666 13.114 1003 HZ2 LYS 12 2HZ LYS 12 25.528 4.113 12.503 1004 HZ3 LYS 12 3HZ LYS 12 26.287 2.646 12.147 1005 H VAL 13 H VAL 13 23.112 -1.124 10.561 1006 HA VAL 13 HA VAL 13 21.570 -3.099 9.123 1007 HB VAL 13 HB VAL 13 23.360 -3.454 11.584 1008 HG11 VAL 13 1HG1 VAL 13 21.855 -5.367 11.201 1009 HG12 VAL 13 2HG1 VAL 13 23.529 -5.815 10.893 1010 HG13 VAL 13 3HG1 VAL 13 22.434 -5.514 9.541 1011 HG21 VAL 13 1HG2 VAL 13 25.175 -4.064 10.022 1012 HG22 VAL 13 2HG2 VAL 13 24.626 -2.411 9.740 1013 HG23 VAL 13 3HG2 VAL 13 24.125 -3.703 8.647 1014 H PHE 14 H PHE 14 19.407 -2.907 9.600 1015 HA PHE 14 HA PHE 14 18.453 -2.811 12.375 1016 HB2 PHE 14 2HB PHE 14 16.959 -2.692 9.719 1017 HB3 PHE 14 3HB PHE 14 16.179 -2.621 11.298 1018 HD1 PHE 14 HD1 PHE 14 16.788 -0.693 12.873 1019 HD2 PHE 14 HD2 PHE 14 17.834 -0.690 8.725 1020 HE1 PHE 14 HE1 PHE 14 17.127 1.741 12.952 1021 HE2 PHE 14 HE2 PHE 14 18.166 1.745 8.818 1022 HZ PHE 14 HZ PHE 14 17.817 2.961 10.930 1023 H GLU 15 H GLU 15 19.097 -4.821 13.094 1024 HA GLU 15 HA GLU 15 18.430 -7.303 11.787 1025 HB2 GLU 15 2HB GLU 15 19.275 -6.935 14.693 1026 HB3 GLU 15 3HB GLU 15 19.467 -8.373 13.692 1027 HG2 GLU 15 2HG GLU 15 21.146 -7.237 12.322 1028 HG3 GLU 15 3HG GLU 15 20.900 -5.742 13.217 1029 H ILE 16 H ILE 16 16.136 -6.873 11.525 1030 HA ILE 16 HA ILE 16 14.459 -6.745 13.938 1031 HB ILE 16 HB ILE 16 13.989 -5.125 12.117 1032 HG12 ILE 16 2HG1 ILE 16 11.741 -7.156 12.522 1033 HG13 ILE 16 3HG1 ILE 16 12.126 -5.816 13.594 1034 HG21 ILE 16 1HG2 ILE 16 13.282 -7.516 10.380 1035 HG22 ILE 16 2HG2 ILE 16 14.691 -6.473 10.181 1036 HG23 ILE 16 3HG2 ILE 16 13.070 -5.819 9.941 1037 HD11 ILE 16 1HD1 ILE 16 11.076 -5.615 10.780 1038 HD12 ILE 16 2HD1 ILE 16 11.525 -4.246 11.799 1039 HD13 ILE 16 3HD1 ILE 16 10.197 -5.300 12.274 1040 H GLU 17 H GLU 17 12.800 -8.275 14.326 1041 HA GLU 17 HA GLU 17 13.487 -10.983 13.813 1042 HB2 GLU 17 2HB GLU 17 10.856 -9.924 14.927 1043 HB3 GLU 17 3HB GLU 17 11.510 -11.547 15.133 1044 HG2 GLU 17 2HG GLU 17 13.351 -10.676 16.481 1045 HG3 GLU 17 3HG GLU 17 12.805 -9.024 16.207 1046 H LYS 18 H LYS 18 12.672 -12.429 12.426 1047 HA LYS 18 HA LYS 18 11.807 -11.539 9.897 1048 HB2 LYS 18 2HB LYS 18 13.277 -13.451 10.148 1049 HB3 LYS 18 3HB LYS 18 12.082 -14.325 11.098 1050 HG2 LYS 18 2HG LYS 18 10.670 -14.625 9.148 1051 HG3 LYS 18 3HG LYS 18 11.723 -13.591 8.173 1052 HD2 LYS 18 2HD LYS 18 13.531 -15.211 8.287 1053 HD3 LYS 18 3HD LYS 18 12.648 -16.196 9.458 1054 HE2 LYS 18 2HE LYS 18 11.739 -15.690 6.611 1055 HE3 LYS 18 3HE LYS 18 12.622 -17.120 7.141 1056 HZ1 LYS 18 1HZ LYS 18 9.960 -16.277 8.156 1057 HZ2 LYS 18 2HZ LYS 18 10.797 -17.677 8.608 1058 HZ3 LYS 18 3HZ LYS 18 10.238 -17.497 7.022 1059 H GLU 19 H GLU 19 10.058 -12.907 12.633 1060 HA GLU 19 HA GLU 19 7.590 -13.540 11.441 1061 HB2 GLU 19 2HB GLU 19 8.050 -12.466 14.250 1062 HB3 GLU 19 3HB GLU 19 6.622 -13.331 13.696 1063 HG2 GLU 19 2HG GLU 19 8.063 -15.332 13.283 1064 HG3 GLU 19 3HG GLU 19 9.417 -14.459 14.007 1065 H ILE 20 H ILE 20 8.910 -10.476 12.480 1066 HA ILE 20 HA ILE 20 6.493 -8.909 12.258 1067 HB ILE 20 HB ILE 20 9.393 -7.935 12.255 1068 HG12 ILE 20 2HG1 ILE 20 7.605 -8.301 14.711 1069 HG13 ILE 20 3HG1 ILE 20 8.885 -9.419 14.248 1070 HG21 ILE 20 1HG2 ILE 20 8.451 -5.830 13.142 1071 HG22 ILE 20 2HG2 ILE 20 6.824 -6.506 13.040 1072 HG23 ILE 20 3HG2 ILE 20 7.758 -6.232 11.569 1073 HD11 ILE 20 1HD1 ILE 20 9.275 -6.523 14.966 1074 HD12 ILE 20 2HD1 ILE 20 10.542 -7.678 14.546 1075 HD13 ILE 20 3HD1 ILE 20 9.589 -7.907 16.009 1076 H ALA 21 H ALA 21 9.353 -9.587 10.304 1077 HA ALA 21 HA ALA 21 8.797 -7.823 8.119 1078 HB1 ALA 21 1HB ALA 21 10.723 -8.923 7.057 1079 HB2 ALA 21 2HB ALA 21 10.700 -10.185 8.292 1080 HB3 ALA 21 3HB ALA 21 11.077 -8.520 8.737 1081 H CYS 22 H CYS 22 7.278 -10.685 8.976 1082 HA CYS 22 HA CYS 22 6.650 -11.753 6.394 1083 HB2 CYS 22 2HB CYS 22 5.186 -12.031 9.051 1084 HB3 CYS 22 3HB CYS 22 4.907 -13.032 7.624 1085 HG CYS 22 HG CYS 22 8.094 -13.172 8.271 1086 H MET 23 H MET 23 5.263 -9.226 8.446 1087 HA MET 23 HA MET 23 2.841 -8.792 6.980 1088 HB2 MET 23 2HB MET 23 4.405 -6.827 8.709 1089 HB3 MET 23 3HB MET 23 2.764 -6.581 8.129 1090 HG2 MET 23 2HG MET 23 2.097 -8.641 9.428 1091 HG3 MET 23 3HG MET 23 3.713 -8.632 10.135 1092 HE1 MET 23 1HE MET 23 4.171 -5.383 10.321 1093 HE2 MET 23 2HE MET 23 4.652 -6.505 11.597 1094 HE3 MET 23 3HE MET 23 3.653 -5.101 11.981 1095 H SER 24 H SER 24 6.138 -7.625 6.678 1096 HA SER 24 HA SER 24 5.735 -5.994 4.369 1097 HB2 SER 24 2HB SER 24 8.197 -7.473 5.386 1098 HB3 SER 24 3HB SER 24 8.207 -6.334 4.039 1099 HG SER 24 HG SER 24 7.966 -4.723 5.369 1100 H VAL 25 H VAL 25 4.610 -7.013 2.733 1101 HA VAL 25 HA VAL 25 4.924 -9.731 1.965 1102 HB VAL 25 HB VAL 25 3.833 -7.458 0.235 1103 HG11 VAL 25 1HG1 VAL 25 3.401 -10.459 -0.023 1104 HG12 VAL 25 2HG1 VAL 25 4.352 -9.448 -1.111 1105 HG13 VAL 25 3HG1 VAL 25 2.607 -9.220 -1.000 1106 HG21 VAL 25 1HG2 VAL 25 2.321 -9.307 2.125 1107 HG22 VAL 25 2HG2 VAL 25 1.586 -8.121 1.043 1108 HG23 VAL 25 3HG2 VAL 25 2.612 -7.584 2.374 1109 H THR 26 H THR 26 6.622 -6.755 1.038 1110 HA THR 26 HA THR 26 7.990 -7.745 -1.259 1111 HB THR 26 HB THR 26 8.829 -5.543 0.680 1112 HG1 THR 26 HG1 THR 26 6.836 -5.506 -0.810 1113 HG21 THR 26 1HG2 THR 26 10.313 -4.710 -1.101 1114 HG22 THR 26 2HG2 THR 26 9.911 -6.098 -2.113 1115 HG23 THR 26 3HG2 THR 26 10.803 -6.332 -0.609 1116 H ILE 27 H ILE 27 8.982 -7.564 2.190 1117 HA ILE 27 HA ILE 27 11.539 -8.752 1.820 1118 HB ILE 27 HB ILE 27 9.898 -8.560 4.391 1119 HG12 ILE 27 2HG1 ILE 27 12.167 -6.788 3.348 1120 HG13 ILE 27 3HG1 ILE 27 10.466 -6.340 3.397 1121 HG21 ILE 27 1HG2 ILE 27 12.031 -8.962 5.600 1122 HG22 ILE 27 2HG2 ILE 27 12.859 -9.220 4.065 1123 HG23 ILE 27 3HG2 ILE 27 11.601 -10.341 4.585 1124 HD11 ILE 27 1HD1 ILE 27 11.668 -5.295 5.201 1125 HD12 ILE 27 2HD1 ILE 27 12.242 -6.860 5.773 1126 HD13 ILE 27 3HD1 ILE 27 10.522 -6.468 5.849 1127 H LYS 28 H LYS 28 8.366 -10.022 2.818 1128 HA LYS 28 HA LYS 28 8.967 -12.694 3.251 1129 HB2 LYS 28 2HB LYS 28 6.751 -11.861 3.792 1130 HB3 LYS 28 3HB LYS 28 6.431 -11.437 2.111 1131 HG2 LYS 28 2HG LYS 28 6.496 -13.842 1.508 1132 HG3 LYS 28 3HG LYS 28 6.784 -14.251 3.199 1133 HD2 LYS 28 2HD LYS 28 4.579 -13.438 3.827 1134 HD3 LYS 28 3HD LYS 28 4.306 -12.808 2.197 1135 HE2 LYS 28 2HE LYS 28 3.138 -14.969 2.618 1136 HE3 LYS 28 3HE LYS 28 4.275 -15.057 1.273 1137 HZ1 LYS 28 1HZ LYS 28 4.429 -16.998 2.706 1138 HZ2 LYS 28 2HZ LYS 28 4.789 -16.023 4.039 1139 HZ3 LYS 28 3HZ LYS 28 5.875 -16.119 2.748 1140 H ASN 29 H ASN 29 7.995 -11.142 0.152 1141 HA ASN 29 HA ASN 29 7.959 -13.429 -1.479 1142 HB2 ASN 29 2HB ASN 29 8.441 -10.504 -2.200 1143 HB3 ASN 29 3HB ASN 29 8.319 -11.765 -3.422 1144 HD21 ASN 29 1HD2 ASN 29 6.643 -9.441 -3.070 1145 HD22 ASN 29 2HD2 ASN 29 5.035 -10.012 -2.822 1146 H MET 30 H MET 30 10.594 -11.242 -0.609 1147 HA MET 30 HA MET 30 12.548 -12.383 -2.360 1148 HB2 MET 30 2HB MET 30 12.864 -10.621 0.107 1149 HB3 MET 30 3HB MET 30 14.207 -11.117 -0.919 1150 HG2 MET 30 2HG MET 30 13.101 -9.993 -2.850 1151 HG3 MET 30 3HG MET 30 11.841 -9.423 -1.757 1152 HE1 MET 30 1HE MET 30 13.446 -8.594 0.895 1153 HE2 MET 30 2HE MET 30 12.230 -7.562 0.136 1154 HE3 MET 30 3HE MET 30 13.819 -6.910 0.536 1155 H ILE 31 H ILE 31 11.633 -12.984 1.038 1156 HA ILE 31 HA ILE 31 13.692 -14.862 1.646 1157 HB ILE 31 HB ILE 31 10.900 -14.592 2.879 1158 HG12 ILE 31 2HG1 ILE 31 13.586 -13.525 3.892 1159 HG13 ILE 31 3HG1 ILE 31 12.347 -12.550 3.118 1160 HG21 ILE 31 1HG2 ILE 31 13.314 -16.109 3.952 1161 HG22 ILE 31 2HG2 ILE 31 11.833 -16.834 3.321 1162 HG23 ILE 31 3HG2 ILE 31 11.782 -15.877 4.799 1163 HD11 ILE 31 1HD1 ILE 31 12.087 -13.981 5.757 1164 HD12 ILE 31 2HD1 ILE 31 10.822 -13.030 4.974 1165 HD13 ILE 31 3HD1 ILE 31 12.308 -12.247 5.507 1166 H GLU 32 H GLU 32 10.432 -15.180 0.253 1167 HA GLU 32 HA GLU 32 10.299 -18.016 0.195 1168 HB2 GLU 32 2HB GLU 32 8.863 -16.064 -1.662 1169 HB3 GLU 32 3HB GLU 32 8.431 -17.746 -1.392 1170 HG2 GLU 32 2HG GLU 32 8.154 -15.436 0.527 1171 HG3 GLU 32 3HG GLU 32 6.867 -16.368 -0.220 1172 H ASP 33 H ASP 33 11.414 -15.567 -2.081 1173 HA ASP 33 HA ASP 33 11.804 -17.252 -4.341 1174 HB2 ASP 33 2HB ASP 33 11.478 -14.749 -4.412 1175 HB3 ASP 33 3HB ASP 33 13.099 -14.549 -3.750 1176 H ILE 34 H ILE 34 13.954 -16.015 -1.829 1177 HA ILE 34 HA ILE 34 16.339 -17.325 -2.802 1178 HB ILE 34 HB ILE 34 15.785 -15.919 -0.136 1179 HG12 ILE 34 2HG1 ILE 34 17.258 -14.870 -2.612 1180 HG13 ILE 34 3HG1 ILE 34 15.607 -14.444 -2.175 1181 HG21 ILE 34 1HG2 ILE 34 18.463 -16.750 -1.325 1182 HG22 ILE 34 2HG2 ILE 34 17.687 -17.473 0.085 1183 HG23 ILE 34 3HG2 ILE 34 18.244 -15.802 0.149 1184 HD11 ILE 34 1HD1 ILE 34 18.081 -13.809 -0.568 1185 HD12 ILE 34 2HD1 ILE 34 16.425 -13.388 -0.121 1186 HD13 ILE 34 3HD1 ILE 34 17.155 -12.689 -1.566 1187 H GLY 35 H GLY 35 13.627 -18.253 -0.917 1188 HA2 GLY 35 2HA GLY 35 13.095 -20.421 -0.200 1189 HA3 GLY 35 3HA GLY 35 14.801 -20.862 -0.231 1190 H GLU 36 H GLU 36 16.165 -19.486 1.326 1191 HA GLU 36 HA GLU 36 14.762 -18.652 3.788 1192 HB2 GLU 36 2HB GLU 36 17.292 -20.363 3.692 1193 HB3 GLU 36 3HB GLU 36 16.601 -19.662 5.154 1194 HG2 GLU 36 2HG GLU 36 14.576 -21.045 4.857 1195 HG3 GLU 36 3HG GLU 36 15.266 -21.734 3.391 1196 H SER 37 H SER 37 15.433 -16.649 4.372 1197 HA SER 37 HA SER 37 17.432 -15.231 2.878 1198 HB2 SER 37 2HB SER 37 16.803 -13.337 4.492 1199 HB3 SER 37 3HB SER 37 15.473 -13.997 3.544 1200 HG SER 37 HG SER 37 16.085 -14.467 6.267 1201 H ASP 38 H ASP 38 19.221 -16.668 3.398 1202 HA ASP 38 HA ASP 38 20.491 -16.631 6.007 1203 HB2 ASP 38 2HB ASP 38 20.858 -18.535 4.490 1204 HB3 ASP 38 3HB ASP 38 21.507 -17.475 3.252 1205 H SER 39 H SER 39 20.773 -14.913 2.946 1206 HA SER 39 HA SER 39 23.007 -13.266 3.772 1207 HB2 SER 39 2HB SER 39 22.608 -12.145 1.557 1208 HB3 SER 39 3HB SER 39 22.811 -13.890 1.416 1209 HG SER 39 HG SER 39 20.475 -12.338 1.157 1210 HA PRO 40 HA PRO 40 20.404 -10.046 5.737 1211 HB2 PRO 40 2HB PRO 40 22.735 -8.276 5.031 1212 HB3 PRO 40 3HB PRO 40 21.962 -8.543 6.604 1213 HG2 PRO 40 2HG PRO 40 24.361 -9.552 6.070 1214 HG3 PRO 40 3HG PRO 40 23.180 -10.469 7.038 1215 HD2 PRO 40 2HD PRO 40 23.944 -10.836 4.146 1216 HD3 PRO 40 3HD PRO 40 23.589 -12.063 5.384 1217 H ILE 41 H ILE 41 19.077 -8.385 4.885 1218 HA ILE 41 HA ILE 41 19.123 -8.154 1.945 1219 HB ILE 41 HB ILE 41 16.885 -7.507 3.913 1220 HG12 ILE 41 2HG1 ILE 41 17.338 -9.944 3.831 1221 HG13 ILE 41 3HG1 ILE 41 15.784 -9.580 3.095 1222 HG21 ILE 41 1HG2 ILE 41 15.417 -7.359 1.927 1223 HG22 ILE 41 2HG2 ILE 41 16.816 -7.582 0.875 1224 HG23 ILE 41 3HG2 ILE 41 16.694 -6.140 1.887 1225 HD11 ILE 41 1HD1 ILE 41 16.811 -9.816 0.863 1226 HD12 ILE 41 2HD1 ILE 41 16.956 -11.281 1.833 1227 HD13 ILE 41 3HD1 ILE 41 18.349 -10.220 1.629 1228 HA PRO 42 HA PRO 42 20.378 -3.827 2.840 1229 HB2 PRO 42 2HB PRO 42 21.809 -3.369 0.584 1230 HB3 PRO 42 3HB PRO 42 22.464 -4.348 1.911 1231 HG2 PRO 42 2HG PRO 42 21.332 -5.238 -0.705 1232 HG3 PRO 42 3HG PRO 42 22.691 -5.907 0.223 1233 HD2 PRO 42 2HD PRO 42 20.074 -6.937 0.213 1234 HD3 PRO 42 3HD PRO 42 21.319 -7.301 1.423 1235 H LEU 43 H LEU 43 18.606 -2.596 2.677 1236 HA LEU 43 HA LEU 43 17.021 -2.314 0.235 1237 HB2 LEU 43 2HB LEU 43 16.690 -1.020 2.974 1238 HB3 LEU 43 3HB LEU 43 15.507 -0.990 1.676 1239 HG LEU 43 HG LEU 43 16.399 -3.498 3.158 1240 HD11 LEU 43 1HD1 LEU 43 14.190 -3.472 4.229 1241 HD12 LEU 43 2HD1 LEU 43 13.819 -1.932 3.450 1242 HD13 LEU 43 3HD1 LEU 43 15.123 -2.031 4.635 1243 HD21 LEU 43 1HD2 LEU 43 14.503 -4.608 2.016 1244 HD22 LEU 43 2HD2 LEU 43 15.719 -4.035 0.880 1245 HD23 LEU 43 3HD2 LEU 43 14.211 -3.139 1.080 1246 HA PRO 44 HA PRO 44 19.945 1.229 -0.334 1247 HB2 PRO 44 2HB PRO 44 20.348 1.044 -2.970 1248 HB3 PRO 44 3HB PRO 44 20.886 -0.279 -1.912 1249 HG2 PRO 44 2HG PRO 44 18.436 -0.136 -3.636 1250 HG3 PRO 44 3HG PRO 44 19.562 -1.490 -3.398 1251 HD2 PRO 44 2HD PRO 44 17.123 -1.163 -2.039 1252 HD3 PRO 44 3HD PRO 44 18.451 -2.223 -1.523 1253 H ASN 45 H ASN 45 16.951 1.562 -0.195 1254 HA ASN 45 HA ASN 45 16.610 3.948 -1.921 1255 HB2 ASN 45 2HB ASN 45 15.261 2.126 -2.869 1256 HB3 ASN 45 3HB ASN 45 14.550 1.781 -1.299 1257 HD21 ASN 45 1HD2 ASN 45 14.611 4.044 -3.982 1258 HD22 ASN 45 2HD2 ASN 45 13.129 4.837 -3.593 1259 H VAL 46 H VAL 46 15.106 2.227 0.849 1260 HA VAL 46 HA VAL 46 14.174 4.677 2.036 1261 HB VAL 46 HB VAL 46 12.814 2.658 2.247 1262 HG11 VAL 46 1HG1 VAL 46 14.562 0.938 2.298 1263 HG12 VAL 46 2HG1 VAL 46 13.442 0.735 3.646 1264 HG13 VAL 46 3HG1 VAL 46 15.035 1.443 3.922 1265 HG21 VAL 46 1HG2 VAL 46 12.569 4.365 3.990 1266 HG22 VAL 46 2HG2 VAL 46 13.828 3.597 4.959 1267 HG23 VAL 46 3HG2 VAL 46 12.304 2.757 4.669 1268 H THR 47 H THR 47 15.165 5.911 3.501 1269 HA THR 47 HA THR 47 17.925 5.499 4.222 1270 HB THR 47 HB THR 47 17.668 7.722 5.365 1271 HG1 THR 47 HG1 THR 47 14.980 7.688 4.387 1272 HG21 THR 47 1HG2 THR 47 17.226 9.067 3.338 1273 HG22 THR 47 2HG2 THR 47 16.516 7.661 2.542 1274 HG23 THR 47 3HG2 THR 47 18.235 7.673 2.951 1275 H SER 48 H SER 48 18.586 5.953 6.582 1276 HA SER 48 HA SER 48 17.774 3.715 8.099 1277 HB2 SER 48 2HB SER 48 19.302 4.669 9.862 1278 HB3 SER 48 3HB SER 48 20.041 4.528 8.269 1279 HG SER 48 HG SER 48 20.523 6.536 9.145 1280 H THR 49 H THR 49 17.227 7.185 8.590 1281 HA THR 49 HA THR 49 15.989 7.112 11.098 1282 HB THR 49 HB THR 49 15.060 9.384 10.395 1283 HG1 THR 49 HG1 THR 49 16.247 9.953 8.229 1284 HG21 THR 49 1HG2 THR 49 17.309 9.244 11.421 1285 HG22 THR 49 2HG2 THR 49 17.267 10.494 10.175 1286 HG23 THR 49 3HG2 THR 49 18.021 8.936 9.834 1287 H ILE 50 H ILE 50 14.541 7.171 7.832 1288 HA ILE 50 HA ILE 50 11.824 7.108 8.659 1289 HB ILE 50 HB ILE 50 13.069 6.302 5.987 1290 HG12 ILE 50 2HG1 ILE 50 13.514 8.658 6.594 1291 HG13 ILE 50 3HG1 ILE 50 12.398 8.579 5.236 1292 HG21 ILE 50 1HG2 ILE 50 10.809 6.628 5.007 1293 HG22 ILE 50 2HG2 ILE 50 10.146 6.860 6.625 1294 HG23 ILE 50 3HG2 ILE 50 10.839 5.301 6.175 1295 HD11 ILE 50 1HD1 ILE 50 11.748 10.314 6.800 1296 HD12 ILE 50 2HD1 ILE 50 11.658 9.143 8.114 1297 HD13 ILE 50 3HD1 ILE 50 10.523 9.046 6.765 1298 H LEU 51 H LEU 51 14.067 4.548 7.570 1299 HA LEU 51 HA LEU 51 12.254 2.386 7.646 1300 HB2 LEU 51 2HB LEU 51 14.463 2.399 6.434 1301 HB3 LEU 51 3HB LEU 51 15.283 2.264 7.982 1302 HG LEU 51 HG LEU 51 14.222 0.042 8.351 1303 HD11 LEU 51 1HD1 LEU 51 13.032 0.381 5.578 1304 HD12 LEU 51 2HD1 LEU 51 12.143 0.344 7.103 1305 HD13 LEU 51 3HD1 LEU 51 12.992 -1.095 6.549 1306 HD21 LEU 51 1HD2 LEU 51 16.436 0.139 7.280 1307 HD22 LEU 51 2HD2 LEU 51 15.678 0.203 5.688 1308 HD23 LEU 51 3HD2 LEU 51 15.498 -1.235 6.696 1309 H GLU 52 H GLU 52 14.320 3.830 10.102 1310 HA GLU 52 HA GLU 52 14.279 1.864 12.112 1311 HB2 GLU 52 2HB GLU 52 15.803 3.817 12.160 1312 HB3 GLU 52 3HB GLU 52 14.434 4.905 12.367 1313 HG2 GLU 52 2HG GLU 52 13.960 3.844 14.572 1314 HG3 GLU 52 3HG GLU 52 15.381 2.820 14.362 1315 H LYS 53 H LYS 53 12.223 4.722 11.618 1316 HA LYS 53 HA LYS 53 10.468 4.292 13.789 1317 HB2 LYS 53 2HB LYS 53 10.242 5.964 11.260 1318 HB3 LYS 53 3HB LYS 53 8.914 5.876 12.415 1319 HG2 LYS 53 2HG LYS 53 10.427 6.737 14.192 1320 HG3 LYS 53 3HG LYS 53 11.714 6.893 12.994 1321 HD2 LYS 53 2HD LYS 53 9.031 8.323 12.834 1322 HD3 LYS 53 3HD LYS 53 10.506 9.050 13.475 1323 HE2 LYS 53 2HE LYS 53 10.105 8.059 10.629 1324 HE3 LYS 53 3HE LYS 53 10.108 9.745 11.151 1325 HZ1 LYS 53 1HZ LYS 53 12.378 9.528 11.827 1326 HZ2 LYS 53 2HZ LYS 53 12.235 9.050 10.216 1327 HZ3 LYS 53 3HZ LYS 53 12.403 7.891 11.435 1328 H VAL 54 H VAL 54 10.134 3.471 10.309 1329 HA VAL 54 HA VAL 54 7.469 2.554 10.441 1330 HB VAL 54 HB VAL 54 9.628 1.818 8.400 1331 HG11 VAL 54 1HG1 VAL 54 6.607 1.465 8.188 1332 HG12 VAL 54 2HG1 VAL 54 7.792 0.167 8.332 1333 HG13 VAL 54 3HG1 VAL 54 7.769 1.177 6.888 1334 HG21 VAL 54 1HG2 VAL 54 8.591 3.557 6.981 1335 HG22 VAL 54 2HG2 VAL 54 9.151 4.247 8.503 1336 HG23 VAL 54 3HG2 VAL 54 7.433 3.930 8.263 1337 H LEU 55 H LEU 55 10.570 0.765 10.652 1338 HA LEU 55 HA LEU 55 9.440 -1.832 10.999 1339 HB2 LEU 55 2HB LEU 55 12.185 -0.787 11.784 1340 HB3 LEU 55 3HB LEU 55 11.716 -2.479 11.856 1341 HG LEU 55 HG LEU 55 12.037 -0.784 9.353 1342 HD11 LEU 55 1HD1 LEU 55 14.137 -1.535 10.350 1343 HD12 LEU 55 2HD1 LEU 55 13.845 -2.350 8.816 1344 HD13 LEU 55 3HD1 LEU 55 13.572 -3.208 10.334 1345 HD21 LEU 55 1HD2 LEU 55 11.078 -3.665 9.512 1346 HD22 LEU 55 2HD2 LEU 55 11.484 -2.793 8.034 1347 HD23 LEU 55 3HD2 LEU 55 10.114 -2.273 9.009 1348 H ASP 56 H ASP 56 10.206 0.754 13.265 1349 HA ASP 56 HA ASP 56 10.069 -0.762 15.679 1350 HB2 ASP 56 2HB ASP 56 11.100 1.589 15.367 1351 HB3 ASP 56 3HB ASP 56 9.459 2.221 15.425 1352 H TYR 57 H TYR 57 7.728 1.159 13.842 1353 HA TYR 57 HA TYR 57 5.466 0.745 15.524 1354 HB2 TYR 57 2HB TYR 57 5.572 2.595 13.855 1355 HB3 TYR 57 3HB TYR 57 5.549 1.425 12.540 1356 HD1 TYR 57 HD1 TYR 57 3.514 3.062 15.169 1357 HD2 TYR 57 HD2 TYR 57 3.446 0.254 11.942 1358 HE1 TYR 57 HE1 TYR 57 1.058 3.060 15.208 1359 HE2 TYR 57 HE2 TYR 57 0.992 0.256 11.982 1360 HH TYR 57 HH TYR 57 -0.823 2.539 13.733 1361 H CYS 58 H CYS 58 6.824 -0.986 12.742 1362 HA CYS 58 HA CYS 58 4.768 -2.861 12.323 1363 HB2 CYS 58 2HB CYS 58 7.762 -3.124 11.833 1364 HB3 CYS 58 3HB CYS 58 6.547 -4.255 11.229 1365 HG CYS 58 HG CYS 58 7.661 -1.625 9.802 1366 H ARG 59 H ARG 59 7.609 -2.897 14.473 1367 HA ARG 59 HA ARG 59 7.221 -5.519 15.489 1368 HB2 ARG 59 2HB ARG 59 9.382 -4.267 15.721 1369 HB3 ARG 59 3HB ARG 59 8.626 -3.207 16.912 1370 HG2 ARG 59 2HG ARG 59 8.339 -5.033 18.465 1371 HG3 ARG 59 3HG ARG 59 8.762 -6.220 17.234 1372 HD2 ARG 59 2HD ARG 59 11.076 -5.026 17.188 1373 HD3 ARG 59 3HD ARG 59 10.572 -4.339 18.740 1374 HE ARG 59 HE ARG 59 10.334 -7.234 18.450 1375 HH11 ARG 59 1HH1 ARG 59 12.332 -4.616 19.705 1376 HH12 ARG 59 2HH1 ARG 59 13.213 -5.667 20.768 1377 HH21 ARG 59 1HH2 ARG 59 11.516 -8.573 19.782 1378 HH22 ARG 59 2HH2 ARG 59 12.751 -7.914 20.812 1379 H HIS 60 H HIS 60 6.196 -2.322 16.601 1380 HA HIS 60 HA HIS 60 4.796 -2.920 18.922 1381 HB2 HIS 60 2HB HIS 60 5.171 -0.623 18.264 1382 HB3 HIS 60 3HB HIS 60 4.303 -0.840 16.752 1383 HD1 HIS 60 HD1 HIS 60 3.683 -0.537 20.468 1384 HD2 HIS 60 HD2 HIS 60 1.608 -0.314 16.877 1385 HE1 HIS 60 HE1 HIS 60 1.407 0.322 21.053 1386 HE2 HIS 60 HE2 HIS 60 0.278 0.682 18.839 1387 H HIS 61 H HIS 61 3.733 -3.088 15.556 1388 HA HIS 61 HA HIS 61 1.006 -3.780 16.096 1389 HB2 HIS 61 2HB HIS 61 1.774 -2.582 14.029 1390 HB3 HIS 61 3HB HIS 61 2.594 -4.051 13.505 1391 HD1 HIS 61 HD1 HIS 61 1.120 -5.957 12.560 1392 HD2 HIS 61 HD2 HIS 61 -1.030 -2.635 13.826 1393 HE1 HIS 61 HE1 HIS 61 -1.209 -6.301 11.696 1394 HE2 HIS 61 HE2 HIS 61 -2.456 -4.219 12.350 1395 H HIS 62 H HIS 62 3.977 -5.617 15.623 1396 HA HIS 62 HA HIS 62 2.652 -8.152 15.165 1397 HB2 HIS 62 2HB HIS 62 4.903 -7.748 14.228 1398 HB3 HIS 62 3HB HIS 62 5.572 -7.563 15.848 1399 HD1 HIS 62 HD1 HIS 62 3.868 -10.198 13.709 1400 HD2 HIS 62 HD2 HIS 62 6.434 -9.955 16.975 1401 HE1 HIS 62 HE1 HIS 62 4.481 -12.562 14.260 1402 HE2 HIS 62 HE2 HIS 62 5.939 -12.405 16.305 1403 H GLN 63 H GLN 63 4.142 -6.487 17.904 1404 HA GLN 63 HA GLN 63 3.902 -8.612 19.807 1405 HB2 GLN 63 2HB GLN 63 4.255 -5.618 20.294 1406 HB3 GLN 63 3HB GLN 63 4.443 -6.872 21.509 1407 HG2 GLN 63 2HG GLN 63 6.222 -6.346 19.118 1408 HG3 GLN 63 3HG GLN 63 6.631 -6.171 20.820 1409 HE21 GLN 63 1HE2 GLN 63 6.915 -8.084 22.071 1410 HE22 GLN 63 2HE2 GLN 63 7.325 -9.582 21.316 1411 H HIS 64 H HIS 64 1.955 -5.829 18.900 1412 HA HIS 64 HA HIS 64 -0.343 -6.883 20.433 1413 HB2 HIS 64 2HB HIS 64 0.451 -3.955 20.074 1414 HB3 HIS 64 3HB HIS 64 -1.080 -4.494 20.755 1415 HD1 HIS 64 HD1 HIS 64 -1.095 -5.164 23.205 1416 HD2 HIS 64 HD2 HIS 64 2.734 -4.392 21.773 1417 HE1 HIS 64 HE1 HIS 64 0.381 -5.107 25.228 1418 HE2 HIS 64 HE2 HIS 64 2.707 -4.845 24.324 1419 HA PRO 65 HA PRO 65 -1.583 -6.556 15.966 1420 HB2 PRO 65 2HB PRO 65 -2.807 -8.971 15.749 1421 HB3 PRO 65 3HB PRO 65 -1.037 -8.830 15.707 1422 HG2 PRO 65 2HG PRO 65 -2.804 -9.636 17.993 1423 HG3 PRO 65 3HG PRO 65 -1.273 -10.360 17.447 1424 HD2 PRO 65 2HD PRO 65 -1.441 -8.584 19.551 1425 HD3 PRO 65 3HD PRO 65 0.016 -8.798 18.557 1426 H GLY 66 H GLY 66 -2.812 -4.839 17.258 1427 HA2 GLY 66 2HA GLY 66 -5.451 -5.270 18.208 1428 HA3 GLY 66 3HA GLY 66 -4.755 -3.733 17.714 1429 H GLY 67 H GLY 67 -7.282 -5.632 17.102 1430 HA2 GLY 67 2HA GLY 67 -7.365 -6.056 14.306 1431 HA3 GLY 67 3HA GLY 67 -8.745 -6.020 15.389 1432 H SER 68 H SER 68 -8.508 -3.340 16.299 1433 HA SER 68 HA SER 68 -8.507 -1.533 14.043 1434 HB2 SER 68 2HB SER 68 -10.939 -0.855 14.363 1435 HB3 SER 68 3HB SER 68 -10.726 -2.470 13.684 1436 HG SER 68 HG SER 68 -10.774 -2.607 16.372 1437 H GLY 69 H GLY 69 -7.095 -0.218 15.108 1438 HA2 GLY 69 2HA GLY 69 -7.751 0.875 17.766 1439 HA3 GLY 69 3HA GLY 69 -6.238 1.057 16.895 1440 H LEU 70 H LEU 70 -8.632 1.614 14.684 1441 HA LEU 70 HA LEU 70 -8.177 4.477 14.712 1442 HB2 LEU 70 2HB LEU 70 -8.010 3.166 12.607 1443 HB3 LEU 70 3HB LEU 70 -9.691 2.685 12.767 1444 HG LEU 70 HG LEU 70 -10.337 5.107 12.565 1445 HD11 LEU 70 1HD1 LEU 70 -7.430 5.548 11.822 1446 HD12 LEU 70 2HD1 LEU 70 -8.254 6.168 13.253 1447 HD13 LEU 70 3HD1 LEU 70 -8.729 6.735 11.655 1448 HD21 LEU 70 1HD2 LEU 70 -8.841 3.955 10.183 1449 HD22 LEU 70 2HD2 LEU 70 -10.069 5.221 10.115 1450 HD23 LEU 70 3HD2 LEU 70 -10.509 3.597 10.637 1451 H ASP 71 H ASP 71 -9.310 4.650 16.778 1452 HA ASP 71 HA ASP 71 -11.729 5.983 16.714 1453 HB2 ASP 71 2HB ASP 71 -12.878 3.824 16.295 1454 HB3 ASP 71 3HB ASP 71 -12.090 3.102 17.691 1455 H ASP 72 H ASP 72 -10.153 3.536 18.740 1456 HA ASP 72 HA ASP 72 -10.112 4.904 21.205 1457 HB2 ASP 72 2HB ASP 72 -9.681 2.525 21.153 1458 HB3 ASP 72 3HB ASP 72 -8.343 2.716 20.028 1459 H ILE 73 H ILE 73 -7.690 4.598 18.644 1460 HA ILE 73 HA ILE 73 -5.871 5.717 17.985 1461 HB ILE 73 HB ILE 73 -7.188 8.145 19.292 1462 HG12 ILE 73 2HG1 ILE 73 -7.371 7.167 16.396 1463 HG13 ILE 73 3HG1 ILE 73 -8.652 7.020 17.591 1464 HG21 ILE 73 1HG2 ILE 73 -5.815 9.512 17.743 1465 HG22 ILE 73 2HG2 ILE 73 -5.027 8.051 17.146 1466 HG23 ILE 73 3HG2 ILE 73 -4.798 8.553 18.821 1467 HD11 ILE 73 1HD1 ILE 73 -9.087 8.838 16.060 1468 HD12 ILE 73 2HD1 ILE 73 -7.554 9.600 16.476 1469 HD13 ILE 73 3HD1 ILE 73 -8.831 9.463 17.686 1470 HA PRO 74 HA PRO 74 -3.804 5.064 22.093 1471 HB2 PRO 74 2HB PRO 74 -1.745 3.728 20.392 1472 HB3 PRO 74 3HB PRO 74 -2.629 3.089 21.794 1473 HG2 PRO 74 2HG PRO 74 -3.137 2.212 19.315 1474 HG3 PRO 74 3HG PRO 74 -4.436 2.394 20.519 1475 HD2 PRO 74 2HD PRO 74 -3.708 4.239 18.245 1476 HD3 PRO 74 3HD PRO 74 -5.312 3.689 18.788 1477 HA PRO 75 HA PRO 75 -1.394 8.826 21.783 1478 HB2 PRO 75 2HB PRO 75 0.545 8.184 23.780 1479 HB3 PRO 75 3HB PRO 75 -1.007 8.999 24.036 1480 HG2 PRO 75 2HG PRO 75 -0.328 6.104 24.365 1481 HG3 PRO 75 3HG PRO 75 -1.398 7.133 25.347 1482 HD2 PRO 75 2HD PRO 75 -2.443 5.389 23.633 1483 HD3 PRO 75 3HD PRO 75 -3.158 7.010 23.790 1484 H TYR 76 H TYR 76 0.626 5.829 21.988 1485 HA TYR 76 HA TYR 76 2.946 6.861 20.767 1486 HB2 TYR 76 2HB TYR 76 3.139 4.731 21.877 1487 HB3 TYR 76 3HB TYR 76 1.858 4.014 20.904 1488 HD1 TYR 76 HD1 TYR 76 5.384 5.309 20.708 1489 HD2 TYR 76 HD2 TYR 76 2.389 2.886 18.843 1490 HE1 TYR 76 HE1 TYR 76 7.052 4.459 19.112 1491 HE2 TYR 76 HE2 TYR 76 4.063 2.038 17.257 1492 HH TYR 76 HH TYR 76 6.421 3.027 16.347 1493 H ASP 77 H ASP 77 0.293 5.002 19.321 1494 HA ASP 77 HA ASP 77 1.214 4.945 16.659 1495 HB2 ASP 77 2HB ASP 77 -1.635 4.698 17.732 1496 HB3 ASP 77 3HB ASP 77 -1.112 4.201 16.128 1497 H ARG 78 H ARG 78 -0.648 7.282 18.440 1498 HA ARG 78 HA ARG 78 -1.676 8.851 16.278 1499 HB2 ARG 78 2HB ARG 78 -2.712 8.804 18.517 1500 HB3 ARG 78 3HB ARG 78 -1.243 9.447 19.239 1501 HG2 ARG 78 2HG ARG 78 -1.624 11.532 17.782 1502 HG3 ARG 78 3HG ARG 78 -3.234 10.877 17.464 1503 HD2 ARG 78 2HD ARG 78 -3.308 12.491 19.303 1504 HD3 ARG 78 3HD ARG 78 -3.705 10.874 19.892 1505 HE ARG 78 HE ARG 78 -0.905 11.557 20.158 1506 HH11 ARG 78 1HH1 ARG 78 -4.042 11.834 21.738 1507 HH12 ARG 78 2HH1 ARG 78 -3.351 12.021 23.320 1508 HH21 ARG 78 1HH2 ARG 78 -0.031 11.747 22.231 1509 HH22 ARG 78 2HH2 ARG 78 -1.070 11.969 23.604 1510 H ASP 79 H ASP 79 0.959 9.336 18.627 1511 HA ASP 79 HA ASP 79 1.823 11.835 17.518 1512 HB2 ASP 79 2HB ASP 79 3.099 10.060 19.636 1513 HB3 ASP 79 3HB ASP 79 3.688 11.664 19.200 1514 H PHE 80 H PHE 80 2.619 8.534 16.978 1515 HA PHE 80 HA PHE 80 5.118 8.650 15.754 1516 HB2 PHE 80 2HB PHE 80 3.864 6.534 16.302 1517 HB3 PHE 80 3HB PHE 80 2.744 6.863 14.984 1518 HD1 PHE 80 HD1 PHE 80 6.126 5.748 15.871 1519 HD2 PHE 80 HD2 PHE 80 3.465 6.608 12.640 1520 HE1 PHE 80 HE1 PHE 80 7.640 4.614 14.303 1521 HE2 PHE 80 HE2 PHE 80 4.987 5.478 11.090 1522 HZ PHE 80 HZ PHE 80 7.065 4.481 11.915 1523 H CYS 81 H CYS 81 1.885 9.277 14.440 1524 HA CYS 81 HA CYS 81 2.701 9.618 11.701 1525 HB2 CYS 81 2HB CYS 81 0.077 10.308 13.083 1526 HB3 CYS 81 3HB CYS 81 0.330 10.270 11.337 1527 HG CYS 81 HG CYS 81 0.185 7.665 13.514 1528 H LYS 82 H LYS 82 2.885 11.670 14.407 1529 HA LYS 82 HA LYS 82 2.468 14.210 13.076 1530 HB2 LYS 82 2HB LYS 82 3.710 13.555 15.775 1531 HB3 LYS 82 3HB LYS 82 3.365 15.182 15.197 1532 HG2 LYS 82 2HG LYS 82 0.936 14.592 15.113 1533 HG3 LYS 82 3HG LYS 82 1.335 13.013 15.802 1534 HD2 LYS 82 2HD LYS 82 0.569 14.575 17.554 1535 HD3 LYS 82 3HD LYS 82 2.244 14.101 17.823 1536 HE2 LYS 82 2HE LYS 82 2.993 16.236 16.819 1537 HE3 LYS 82 3HE LYS 82 1.310 16.707 16.573 1538 HZ1 LYS 82 1HZ LYS 82 2.207 17.721 18.542 1539 HZ2 LYS 82 2HZ LYS 82 2.621 16.218 19.189 1540 HZ3 LYS 82 3HZ LYS 82 0.996 16.622 18.972 1541 H VAL 83 H VAL 83 3.928 13.814 11.306 1542 HA VAL 83 HA VAL 83 6.713 14.638 11.867 1543 HB VAL 83 HB VAL 83 7.461 13.239 9.909 1544 HG11 VAL 83 1HG1 VAL 83 6.210 11.599 12.149 1545 HG12 VAL 83 2HG1 VAL 83 7.805 12.355 12.184 1546 HG13 VAL 83 3HG1 VAL 83 7.477 11.047 11.047 1547 HG21 VAL 83 1HG2 VAL 83 5.990 11.440 9.033 1548 HG22 VAL 83 2HG2 VAL 83 5.301 13.035 8.736 1549 HG23 VAL 83 3HG2 VAL 83 4.665 12.030 10.041 1550 H ASP 84 H ASP 84 7.703 15.599 9.795 1551 HA ASP 84 HA ASP 84 6.126 17.690 8.703 1552 HB2 ASP 84 2HB ASP 84 8.729 16.475 7.664 1553 HB3 ASP 84 3HB ASP 84 8.039 17.995 7.097 1554 H GLN 85 H GLN 85 5.574 18.009 6.410 1555 HA GLN 85 HA GLN 85 4.013 15.937 5.336 1556 HB2 GLN 85 2HB GLN 85 4.410 18.708 4.739 1557 HB3 GLN 85 3HB GLN 85 4.653 17.861 3.223 1558 HG2 GLN 85 2HG GLN 85 2.175 17.748 4.974 1559 HG3 GLN 85 3HG GLN 85 2.349 18.634 3.466 1560 HE21 GLN 85 1HE2 GLN 85 0.787 17.655 2.304 1561 HE22 GLN 85 2HE2 GLN 85 0.797 15.980 1.870 1562 HA PRO 86 HA PRO 86 7.598 15.052 2.054 1563 HB2 PRO 86 2HB PRO 86 10.171 15.619 2.981 1564 HB3 PRO 86 3HB PRO 86 9.259 16.657 1.866 1565 HG2 PRO 86 2HG PRO 86 9.543 16.901 4.846 1566 HG3 PRO 86 3HG PRO 86 9.644 18.167 3.600 1567 HD2 PRO 86 2HD PRO 86 7.413 17.868 5.040 1568 HD3 PRO 86 3HD PRO 86 7.317 18.244 3.303 1569 H THR 87 H THR 87 8.413 14.998 5.543 1570 HA THR 87 HA THR 87 9.631 12.443 5.639 1571 HB THR 87 HB THR 87 8.160 13.843 7.924 1572 HG1 THR 87 HG1 THR 87 10.776 14.293 6.879 1573 HG21 THR 87 1HG2 THR 87 9.845 12.767 9.374 1574 HG22 THR 87 2HG2 THR 87 10.573 11.983 7.970 1575 HG23 THR 87 3HG2 THR 87 8.937 11.551 8.471 1576 H LEU 88 H LEU 88 6.288 13.492 5.749 1577 HA LEU 88 HA LEU 88 5.088 11.103 6.772 1578 HB2 LEU 88 2HB LEU 88 4.169 13.536 6.740 1579 HB3 LEU 88 3HB LEU 88 3.699 13.233 5.080 1580 HG LEU 88 HG LEU 88 2.668 11.614 7.457 1581 HD11 LEU 88 1HD1 LEU 88 1.326 13.950 6.054 1582 HD12 LEU 88 2HD1 LEU 88 1.961 13.939 7.702 1583 HD13 LEU 88 3HD1 LEU 88 0.589 12.917 7.285 1584 HD21 LEU 88 1HD2 LEU 88 2.492 10.398 5.341 1585 HD22 LEU 88 2HD2 LEU 88 1.660 11.761 4.597 1586 HD23 LEU 88 3HD2 LEU 88 0.895 10.872 5.916 1587 H PHE 89 H PHE 89 5.484 12.535 3.523 1588 HA PHE 89 HA PHE 89 4.430 10.407 2.011 1589 HB2 PHE 89 2HB PHE 89 6.490 12.522 1.287 1590 HB3 PHE 89 3HB PHE 89 5.863 11.365 0.121 1591 HD1 PHE 89 HD1 PHE 89 3.001 11.256 0.590 1592 HD2 PHE 89 HD2 PHE 89 5.605 14.644 0.761 1593 HE1 PHE 89 HE1 PHE 89 1.120 12.741 0.023 1594 HE2 PHE 89 HE2 PHE 89 3.717 16.118 0.198 1595 HZ PHE 89 HZ PHE 89 1.475 15.170 -0.173 1596 H GLU 90 H GLU 90 7.660 10.935 3.375 1597 HA GLU 90 HA GLU 90 9.014 8.786 2.140 1598 HB2 GLU 90 2HB GLU 90 9.471 10.126 4.836 1599 HB3 GLU 90 3HB GLU 90 10.544 8.896 4.184 1600 HG2 GLU 90 2HG GLU 90 9.966 11.583 2.927 1601 HG3 GLU 90 3HG GLU 90 11.418 11.156 3.827 1602 H LEU 91 H LEU 91 7.050 8.924 5.113 1603 HA LEU 91 HA LEU 91 7.445 6.227 5.937 1604 HB2 LEU 91 2HB LEU 91 5.112 8.095 6.521 1605 HB3 LEU 91 3HB LEU 91 5.391 6.565 7.334 1606 HG LEU 91 HG LEU 91 7.154 9.045 7.515 1607 HD11 LEU 91 1HD1 LEU 91 6.454 9.129 9.869 1608 HD12 LEU 91 2HD1 LEU 91 5.404 7.732 9.621 1609 HD13 LEU 91 3HD1 LEU 91 5.066 9.251 8.786 1610 HD21 LEU 91 1HD2 LEU 91 8.559 7.029 7.603 1611 HD22 LEU 91 2HD2 LEU 91 7.550 6.362 8.886 1612 HD23 LEU 91 3HD2 LEU 91 8.499 7.822 9.177 1613 H ILE 92 H ILE 92 5.053 7.783 3.816 1614 HA ILE 92 HA ILE 92 3.396 5.546 3.263 1615 HB ILE 92 HB ILE 92 4.025 7.935 1.444 1616 HG12 ILE 92 2HG1 ILE 92 1.697 7.515 3.379 1617 HG13 ILE 92 3HG1 ILE 92 3.040 8.624 3.617 1618 HG21 ILE 92 1HG2 ILE 92 1.724 5.949 1.248 1619 HG22 ILE 92 2HG2 ILE 92 3.081 6.074 0.129 1620 HG23 ILE 92 3HG2 ILE 92 1.915 7.392 0.249 1621 HD11 ILE 92 1HD1 ILE 92 2.301 9.917 1.669 1622 HD12 ILE 92 2HD1 ILE 92 1.063 9.813 2.921 1623 HD13 ILE 92 3HD1 ILE 92 0.933 8.819 1.471 1624 H LEU 93 H LEU 93 6.323 6.813 1.685 1625 HA LEU 93 HA LEU 93 6.380 5.002 -0.510 1626 HB2 LEU 93 2HB LEU 93 8.536 6.789 0.691 1627 HB3 LEU 93 3HB LEU 93 8.786 5.835 -0.763 1628 HG LEU 93 HG LEU 93 6.701 8.036 -0.486 1629 HD11 LEU 93 1HD1 LEU 93 8.146 9.402 -1.911 1630 HD12 LEU 93 2HD1 LEU 93 9.368 8.129 -1.929 1631 HD13 LEU 93 3HD1 LEU 93 8.977 8.958 -0.421 1632 HD21 LEU 93 1HD2 LEU 93 6.011 6.330 -2.102 1633 HD22 LEU 93 2HD2 LEU 93 7.556 6.467 -2.943 1634 HD23 LEU 93 3HD2 LEU 93 6.436 7.830 -2.927 1635 H ALA 94 H ALA 94 7.873 4.978 2.704 1636 HA ALA 94 HA ALA 94 9.616 2.739 2.292 1637 HB1 ALA 94 1HB ALA 94 8.551 3.921 4.889 1638 HB2 ALA 94 2HB ALA 94 10.022 4.418 4.050 1639 HB3 ALA 94 3HB ALA 94 9.914 2.799 4.736 1640 H ALA 95 H ALA 95 6.401 3.158 3.704 1641 HA ALA 95 HA ALA 95 5.948 0.458 4.482 1642 HB1 ALA 95 1HB ALA 95 4.706 2.362 5.425 1643 HB2 ALA 95 2HB ALA 95 3.615 1.148 4.754 1644 HB3 ALA 95 3HB ALA 95 3.934 2.641 3.866 1645 H ASN 96 H ASN 96 5.298 2.287 1.512 1646 HA ASN 96 HA ASN 96 3.874 0.208 0.122 1647 HB2 ASN 96 2HB ASN 96 3.796 2.734 -0.350 1648 HB3 ASN 96 3HB ASN 96 5.371 2.577 -1.109 1649 HD21 ASN 96 1HD2 ASN 96 2.853 3.454 -2.241 1650 HD22 ASN 96 2HD2 ASN 96 2.515 2.407 -3.566 1651 H TYR 97 H TYR 97 7.228 1.209 0.419 1652 HA TYR 97 HA TYR 97 8.383 -0.272 -1.710 1653 HB2 TYR 97 2HB TYR 97 9.521 1.659 -0.693 1654 HB3 TYR 97 3HB TYR 97 9.622 0.833 0.854 1655 HD1 TYR 97 HD1 TYR 97 11.676 -0.172 1.398 1656 HD2 TYR 97 HD2 TYR 97 10.716 0.354 -2.737 1657 HE1 TYR 97 HE1 TYR 97 13.884 -1.036 0.778 1658 HE2 TYR 97 HE2 TYR 97 12.939 -0.514 -3.354 1659 HH TYR 97 HH TYR 97 15.101 -0.943 -2.450 1660 H LEU 98 H LEU 98 7.703 -1.031 1.664 1661 HA LEU 98 HA LEU 98 8.838 -3.736 1.345 1662 HB2 LEU 98 2HB LEU 98 8.098 -2.200 3.856 1663 HB3 LEU 98 3HB LEU 98 8.689 -3.856 3.838 1664 HG LEU 98 HG LEU 98 10.246 -1.390 2.960 1665 HD11 LEU 98 1HD1 LEU 98 10.644 -3.226 5.347 1666 HD12 LEU 98 2HD1 LEU 98 10.049 -1.564 5.387 1667 HD13 LEU 98 3HD1 LEU 98 11.704 -1.891 4.880 1668 HD21 LEU 98 1HD2 LEU 98 10.837 -3.287 1.524 1669 HD22 LEU 98 2HD2 LEU 98 11.135 -4.297 2.939 1670 HD23 LEU 98 3HD2 LEU 98 12.167 -2.903 2.616 1671 H ASP 99 H ASP 99 5.878 -2.222 1.102 1672 HA ASP 99 HA ASP 99 3.712 -2.830 1.069 1673 HB2 ASP 99 2HB ASP 99 4.777 -5.674 1.103 1674 HB3 ASP 99 3HB ASP 99 3.096 -5.251 0.798 1675 H ILE 100 H ILE 100 5.059 -2.362 3.602 1676 HA ILE 100 HA ILE 100 3.687 -3.868 5.639 1677 HB ILE 100 HB ILE 100 5.027 -1.119 5.823 1678 HG12 ILE 100 2HG1 ILE 100 6.150 -3.874 6.504 1679 HG13 ILE 100 3HG1 ILE 100 6.547 -2.955 5.061 1680 HG21 ILE 100 1HG2 ILE 100 5.109 -1.499 8.267 1681 HG22 ILE 100 2HG2 ILE 100 4.259 -3.032 8.072 1682 HG23 ILE 100 3HG2 ILE 100 3.440 -1.517 7.693 1683 HD11 ILE 100 1HD1 ILE 100 8.307 -2.815 6.682 1684 HD12 ILE 100 2HD1 ILE 100 7.198 -2.175 7.890 1685 HD13 ILE 100 3HD1 ILE 100 7.577 -1.229 6.449 1686 H LYS 101 H LYS 101 1.540 -3.800 4.815 1687 HA LYS 101 HA LYS 101 0.077 -1.456 4.289 1688 HB2 LYS 101 2HB LYS 101 -0.495 -3.776 3.495 1689 HB3 LYS 101 3HB LYS 101 -1.082 -4.150 5.105 1690 HG2 LYS 101 2HG LYS 101 -2.240 -1.779 3.640 1691 HG3 LYS 101 3HG LYS 101 -2.743 -3.398 3.174 1692 HD2 LYS 101 2HD LYS 101 -3.682 -3.832 5.349 1693 HD3 LYS 101 3HD LYS 101 -2.944 -2.382 6.034 1694 HE2 LYS 101 2HE LYS 101 -5.371 -2.094 5.617 1695 HE3 LYS 101 3HE LYS 101 -4.399 -0.959 4.683 1696 HZ1 LYS 101 1HZ LYS 101 -5.581 -3.471 3.634 1697 HZ2 LYS 101 2HZ LYS 101 -4.692 -2.346 2.743 1698 HZ3 LYS 101 3HZ LYS 101 -6.191 -1.917 3.383 1699 HA PRO 102 HA PRO 102 -1.525 -1.997 9.089 1700 HB2 PRO 102 2HB PRO 102 0.946 -2.206 10.558 1701 HB3 PRO 102 3HB PRO 102 -0.351 -3.409 10.459 1702 HG2 PRO 102 2HG PRO 102 2.185 -3.236 8.884 1703 HG3 PRO 102 3HG PRO 102 1.312 -4.672 9.474 1704 HD2 PRO 102 2HD PRO 102 1.198 -4.015 6.903 1705 HD3 PRO 102 3HD PRO 102 -0.274 -4.569 7.733 1706 H LEU 103 H LEU 103 1.764 -0.703 8.373 1707 HA LEU 103 HA LEU 103 1.304 1.756 9.825 1708 HB2 LEU 103 2HB LEU 103 3.545 0.682 9.644 1709 HB3 LEU 103 3HB LEU 103 3.567 0.988 7.920 1710 HG LEU 103 HG LEU 103 4.925 2.554 9.567 1711 HD11 LEU 103 1HD1 LEU 103 3.266 3.813 7.358 1712 HD12 LEU 103 2HD1 LEU 103 4.818 2.996 7.164 1713 HD13 LEU 103 3HD1 LEU 103 4.726 4.497 8.081 1714 HD21 LEU 103 1HD2 LEU 103 3.106 3.074 11.118 1715 HD22 LEU 103 2HD2 LEU 103 2.176 3.827 9.822 1716 HD23 LEU 103 3HD2 LEU 103 3.692 4.545 10.348 1717 H LEU 104 H LEU 104 1.459 0.778 6.429 1718 HA LEU 104 HA LEU 104 1.321 3.194 5.091 1719 HB2 LEU 104 2HB LEU 104 1.746 1.051 4.004 1720 HB3 LEU 104 3HB LEU 104 0.128 0.499 4.390 1721 HG LEU 104 HG LEU 104 -0.763 2.313 2.846 1722 HD11 LEU 104 1HD1 LEU 104 2.136 2.571 1.981 1723 HD12 LEU 104 2HD1 LEU 104 1.173 3.811 2.791 1724 HD13 LEU 104 3HD1 LEU 104 0.735 3.284 1.169 1725 HD21 LEU 104 1HD2 LEU 104 1.006 0.192 1.596 1726 HD22 LEU 104 2HD2 LEU 104 -0.360 1.009 0.831 1727 HD23 LEU 104 3HD2 LEU 104 -0.634 -0.051 2.208 1728 H ASP 105 H ASP 105 -1.338 1.226 6.388 1729 HA ASP 105 HA ASP 105 -3.501 2.627 5.216 1730 HB2 ASP 105 2HB ASP 105 -3.682 0.305 6.124 1731 HB3 ASP 105 3HB ASP 105 -3.492 0.929 7.762 1732 H VAL 106 H VAL 106 -2.091 2.716 8.480 1733 HA VAL 106 HA VAL 106 -3.663 4.717 9.635 1734 HB VAL 106 HB VAL 106 -0.744 4.009 10.213 1735 HG11 VAL 106 1HG1 VAL 106 -1.091 4.956 12.468 1736 HG12 VAL 106 2HG1 VAL 106 -2.709 5.490 12.006 1737 HG13 VAL 106 3HG1 VAL 106 -1.295 6.189 11.219 1738 HG21 VAL 106 1HG2 VAL 106 -2.265 2.075 10.394 1739 HG22 VAL 106 2HG2 VAL 106 -3.291 2.970 11.519 1740 HG23 VAL 106 3HG2 VAL 106 -1.641 2.542 11.976 1741 H THR 107 H THR 107 -0.679 4.962 7.745 1742 HA THR 107 HA THR 107 -0.234 7.768 8.112 1743 HB THR 107 HB THR 107 0.963 5.911 5.992 1744 HG1 THR 107 HG1 THR 107 1.115 5.419 8.436 1745 HG21 THR 107 1HG2 THR 107 2.917 7.415 6.092 1746 HG22 THR 107 2HG2 THR 107 2.085 8.441 7.263 1747 HG23 THR 107 3HG2 THR 107 1.474 8.313 5.613 1748 H CYS 108 H CYS 108 -1.880 5.815 5.653 1749 HA CYS 108 HA CYS 108 -2.359 7.971 3.791 1750 HB2 CYS 108 2HB CYS 108 -3.606 5.200 3.997 1751 HB3 CYS 108 3HB CYS 108 -3.927 6.338 2.685 1752 HG CYS 108 HG CYS 108 -0.735 5.376 3.370 1753 H LYS 109 H LYS 109 -4.007 6.608 6.562 1754 HA LYS 109 HA LYS 109 -6.471 8.054 6.211 1755 HB2 LYS 109 2HB LYS 109 -5.331 6.260 8.333 1756 HB3 LYS 109 3HB LYS 109 -6.541 7.419 8.866 1757 HG2 LYS 109 2HG LYS 109 -7.476 5.169 8.291 1758 HG3 LYS 109 3HG LYS 109 -8.210 6.499 7.395 1759 HD2 LYS 109 2HD LYS 109 -6.846 5.931 5.415 1760 HD3 LYS 109 3HD LYS 109 -6.065 4.627 6.311 1761 HE2 LYS 109 2HE LYS 109 -9.033 4.767 5.685 1762 HE3 LYS 109 3HE LYS 109 -7.852 3.824 4.777 1763 HZ1 LYS 109 1HZ LYS 109 -7.385 2.554 6.776 1764 HZ2 LYS 109 2HZ LYS 109 -9.019 2.458 6.373 1765 HZ3 LYS 109 3HZ LYS 109 -8.521 3.450 7.641 1766 H THR 110 H THR 110 -3.366 8.707 7.747 1767 HA THR 110 HA THR 110 -4.024 10.982 9.260 1768 HB THR 110 HB THR 110 -1.393 10.387 7.819 1769 HG1 THR 110 HG1 THR 110 -2.512 8.971 9.651 1770 HG21 THR 110 1HG2 THR 110 -1.924 12.187 10.221 1771 HG22 THR 110 2HG2 THR 110 -1.485 12.740 8.603 1772 HG23 THR 110 3HG2 THR 110 -0.335 11.803 9.556 1773 H VAL 111 H VAL 111 -2.851 10.756 5.850 1774 HA VAL 111 HA VAL 111 -3.154 13.551 5.302 1775 HB VAL 111 HB VAL 111 -2.843 12.998 2.896 1776 HG11 VAL 111 1HG1 VAL 111 -0.853 11.627 4.736 1777 HG12 VAL 111 2HG1 VAL 111 -0.880 13.339 4.314 1778 HG13 VAL 111 3HG1 VAL 111 -0.538 12.135 3.072 1779 HG21 VAL 111 1HG2 VAL 111 -2.373 10.679 2.172 1780 HG22 VAL 111 2HG2 VAL 111 -4.021 10.838 2.781 1781 HG23 VAL 111 3HG2 VAL 111 -2.780 10.084 3.785 1782 H ALA 112 H ALA 112 -5.298 10.780 4.992 1783 HA ALA 112 HA ALA 112 -7.357 11.932 3.449 1784 HB1 ALA 112 1HB ALA 112 -7.587 9.802 5.601 1785 HB2 ALA 112 2HB ALA 112 -7.211 9.519 3.903 1786 HB3 ALA 112 3HB ALA 112 -8.791 10.155 4.354 1787 H ASN 113 H ASN 113 -6.729 11.962 6.949 1788 HA ASN 113 HA ASN 113 -9.111 13.232 7.808 1789 HB2 ASN 113 2HB ASN 113 -6.347 13.161 9.102 1790 HB3 ASN 113 3HB ASN 113 -7.779 13.815 9.895 1791 HD21 ASN 113 1HD2 ASN 113 -6.066 11.583 10.688 1792 HD22 ASN 113 2HD2 ASN 113 -7.098 10.207 10.819 1793 H MET 114 H MET 114 -6.080 14.501 6.536 1794 HA MET 114 HA MET 114 -6.379 17.212 7.355 1795 HB2 MET 114 2HB MET 114 -4.773 16.106 5.012 1796 HB3 MET 114 3HB MET 114 -4.629 17.733 5.660 1797 HG2 MET 114 2HG MET 114 -3.968 16.646 7.869 1798 HG3 MET 114 3HG MET 114 -3.820 15.138 6.966 1799 HE1 MET 114 1HE MET 114 -2.715 16.414 4.103 1800 HE2 MET 114 2HE MET 114 -2.056 14.927 4.787 1801 HE3 MET 114 3HE MET 114 -0.975 16.243 4.334 1802 H ILE 115 H ILE 115 -7.442 15.463 4.449 1803 HA ILE 115 HA ILE 115 -8.651 17.903 3.323 1804 HB ILE 115 HB ILE 115 -9.188 16.544 1.328 1805 HG12 ILE 115 2HG1 ILE 115 -7.817 14.225 2.782 1806 HG13 ILE 115 3HG1 ILE 115 -9.545 14.346 2.470 1807 HG21 ILE 115 1HG2 ILE 115 -6.283 16.265 2.184 1808 HG22 ILE 115 2HG2 ILE 115 -7.010 17.687 1.434 1809 HG23 ILE 115 3HG2 ILE 115 -6.879 16.182 0.524 1810 HD11 ILE 115 1HD1 ILE 115 -7.378 14.116 0.383 1811 HD12 ILE 115 2HD1 ILE 115 -9.114 14.234 0.067 1812 HD13 ILE 115 3HD1 ILE 115 -8.468 12.834 0.921 1813 H ARG 116 H ARG 116 -9.551 15.284 5.326 1814 HA ARG 116 HA ARG 116 -12.392 15.321 4.728 1815 HB2 ARG 116 2HB ARG 116 -11.077 13.301 5.620 1816 HB3 ARG 116 3HB ARG 116 -11.007 14.114 7.169 1817 HG2 ARG 116 2HG ARG 116 -13.646 13.443 5.832 1818 HG3 ARG 116 3HG ARG 116 -12.785 12.279 6.833 1819 HD2 ARG 116 2HD ARG 116 -12.913 13.871 8.743 1820 HD3 ARG 116 3HD ARG 116 -13.839 14.980 7.729 1821 HE ARG 116 HE ARG 116 -15.137 12.511 7.702 1822 HH11 ARG 116 1HH1 ARG 116 -14.413 15.029 10.052 1823 HH12 ARG 116 2HH1 ARG 116 -15.816 14.686 11.014 1824 HH21 ARG 116 1HH2 ARG 116 -16.974 12.101 8.951 1825 HH22 ARG 116 2HH2 ARG 116 -17.262 13.031 10.390 1826 H GLY 117 H GLY 117 -12.966 17.453 4.942 1827 HA2 GLY 117 2HA GLY 117 -14.154 18.481 7.112 1828 HA3 GLY 117 3HA GLY 117 -12.482 18.971 7.392 Start of MODEL 18 1 H1 SER 2 1H SER 2 -15.260 -16.048 -17.709 2 H2 SER 2 2H SER 2 -14.339 -14.927 -16.842 3 H3 SER 2 3H SER 2 -15.238 -14.426 -18.184 4 HA SER 2 HA SER 2 -17.282 -14.888 -17.100 5 HB2 SER 2 2HB SER 2 -15.607 -15.698 -14.681 6 HB3 SER 2 3HB SER 2 -17.370 -15.722 -14.802 7 HG SER 2 HG SER 2 -15.789 -17.690 -15.339 8 H LEU 3 H LEU 3 -18.327 -13.276 -15.795 9 HA LEU 3 HA LEU 3 -16.602 -10.947 -15.113 10 HB2 LEU 3 2HB LEU 3 -19.505 -11.012 -16.041 11 HB3 LEU 3 3HB LEU 3 -18.637 -9.560 -15.568 12 HG LEU 3 HG LEU 3 -17.799 -11.307 -17.916 13 HD11 LEU 3 1HD1 LEU 3 -18.788 -9.612 -19.373 14 HD12 LEU 3 2HD1 LEU 3 -19.439 -8.762 -17.967 15 HD13 LEU 3 3HD1 LEU 3 -20.005 -10.386 -18.363 16 HD21 LEU 3 1HD2 LEU 3 -16.457 -9.350 -18.573 17 HD22 LEU 3 2HD2 LEU 3 -15.979 -9.973 -16.998 18 HD23 LEU 3 3HD2 LEU 3 -16.957 -8.507 -17.102 19 H VAL 4 H VAL 4 -16.418 -10.675 -12.959 20 HA VAL 4 HA VAL 4 -18.610 -11.393 -11.132 21 HB VAL 4 HB VAL 4 -17.046 -10.801 -9.282 22 HG11 VAL 4 1HG1 VAL 4 -17.122 -13.118 -10.092 23 HG12 VAL 4 2HG1 VAL 4 -15.501 -12.707 -9.536 24 HG13 VAL 4 3HG1 VAL 4 -15.850 -12.772 -11.266 25 HG21 VAL 4 1HG2 VAL 4 -14.647 -10.346 -9.744 26 HG22 VAL 4 2HG2 VAL 4 -15.694 -9.070 -10.366 27 HG23 VAL 4 3HG2 VAL 4 -15.004 -10.258 -11.475 28 H LYS 5 H LYS 5 -19.812 -9.886 -10.051 29 HA LYS 5 HA LYS 5 -19.786 -7.146 -11.113 30 HB2 LYS 5 2HB LYS 5 -21.882 -8.582 -9.427 31 HB3 LYS 5 3HB LYS 5 -22.085 -7.032 -10.238 32 HG2 LYS 5 2HG LYS 5 -21.891 -8.145 -12.428 33 HG3 LYS 5 3HG LYS 5 -21.638 -9.697 -11.634 34 HD2 LYS 5 2HD LYS 5 -23.906 -9.595 -10.676 35 HD3 LYS 5 3HD LYS 5 -24.159 -8.006 -11.400 36 HE2 LYS 5 2HE LYS 5 -23.995 -8.982 -13.643 37 HE3 LYS 5 3HE LYS 5 -23.673 -10.573 -12.947 38 HZ1 LYS 5 1HZ LYS 5 -25.862 -10.535 -11.932 39 HZ2 LYS 5 2HZ LYS 5 -25.992 -10.324 -13.603 40 HZ3 LYS 5 3HZ LYS 5 -26.171 -9.001 -12.569 41 H LEU 6 H LEU 6 -18.934 -5.541 -9.895 42 HA LEU 6 HA LEU 6 -18.545 -5.968 -6.981 43 HB2 LEU 6 2HB LEU 6 -16.701 -4.460 -8.880 44 HB3 LEU 6 3HB LEU 6 -16.454 -4.672 -7.154 45 HG LEU 6 HG LEU 6 -16.356 -6.864 -9.262 46 HD11 LEU 6 1HD1 LEU 6 -14.411 -5.407 -9.325 47 HD12 LEU 6 2HD1 LEU 6 -13.975 -6.999 -8.713 48 HD13 LEU 6 3HD1 LEU 6 -14.144 -5.641 -7.596 49 HD21 LEU 6 1HD2 LEU 6 -17.274 -7.756 -7.172 50 HD22 LEU 6 2HD2 LEU 6 -15.903 -7.109 -6.271 51 HD23 LEU 6 3HD2 LEU 6 -15.654 -8.382 -7.469 52 H GLU 7 H GLU 7 -20.276 -4.773 -6.220 53 HA GLU 7 HA GLU 7 -20.818 -2.110 -7.152 54 HB2 GLU 7 2HB GLU 7 -21.785 -3.563 -4.662 55 HB3 GLU 7 3HB GLU 7 -22.255 -1.913 -5.065 56 HG2 GLU 7 2HG GLU 7 -24.030 -3.325 -5.781 57 HG3 GLU 7 3HG GLU 7 -23.191 -2.782 -7.234 58 H SER 8 H SER 8 -20.225 -0.194 -6.288 59 HA SER 8 HA SER 8 -17.976 -0.054 -4.458 60 HB2 SER 8 2HB SER 8 -18.260 2.437 -4.892 61 HB3 SER 8 3HB SER 8 -18.029 1.469 -6.347 62 HG SER 8 HG SER 8 -19.975 1.954 -6.995 63 H SER 9 H SER 9 -18.261 1.848 -2.748 64 HA SER 9 HA SER 9 -20.213 1.296 -0.793 65 HB2 SER 9 2HB SER 9 -18.033 2.436 -0.341 66 HB3 SER 9 3HB SER 9 -18.606 3.859 -1.207 67 HG SER 9 HG SER 9 -19.868 4.371 0.435 68 H ASP 10 H ASP 10 -20.192 3.355 -3.601 69 HA ASP 10 HA ASP 10 -22.657 4.770 -3.022 70 HB2 ASP 10 2HB ASP 10 -20.751 5.814 -4.248 71 HB3 ASP 10 3HB ASP 10 -20.960 4.654 -5.549 72 H GLU 11 H GLU 11 -22.019 1.657 -3.919 73 HA GLU 11 HA GLU 11 -23.347 -0.102 -4.361 74 HB2 GLU 11 2HB GLU 11 -25.631 1.898 -4.472 75 HB3 GLU 11 3HB GLU 11 -25.814 0.149 -4.391 76 HG2 GLU 11 2HG GLU 11 -24.849 0.090 -2.160 77 HG3 GLU 11 3HG GLU 11 -24.468 1.812 -2.240 78 H LYS 12 H LYS 12 -22.326 1.861 -6.569 79 HA LYS 12 HA LYS 12 -23.923 1.178 -8.880 80 HB2 LYS 12 2HB LYS 12 -21.160 2.435 -8.608 81 HB3 LYS 12 3HB LYS 12 -21.921 2.128 -10.164 82 HG2 LYS 12 2HG LYS 12 -22.999 3.963 -8.002 83 HG3 LYS 12 3HG LYS 12 -22.161 4.467 -9.474 84 HD2 LYS 12 2HD LYS 12 -23.997 3.424 -10.829 85 HD3 LYS 12 3HD LYS 12 -24.844 3.039 -9.328 86 HE2 LYS 12 2HE LYS 12 -24.194 5.813 -10.380 87 HE3 LYS 12 3HE LYS 12 -25.786 5.058 -10.294 88 HZ1 LYS 12 1HZ LYS 12 -24.080 5.797 -7.985 89 HZ2 LYS 12 2HZ LYS 12 -25.567 5.010 -7.875 90 HZ3 LYS 12 3HZ LYS 12 -25.489 6.586 -8.480 91 H VAL 13 H VAL 13 -23.799 -0.659 -10.025 92 HA VAL 13 HA VAL 13 -22.055 -2.827 -9.323 93 HB VAL 13 HB VAL 13 -23.910 -2.569 -11.749 94 HG11 VAL 13 1HG1 VAL 13 -22.279 -4.395 -12.007 95 HG12 VAL 13 2HG1 VAL 13 -23.911 -5.030 -11.813 96 HG13 VAL 13 3HG1 VAL 13 -22.779 -5.083 -10.459 97 HG21 VAL 13 1HG2 VAL 13 -25.628 -3.742 -10.425 98 HG22 VAL 13 2HG2 VAL 13 -25.169 -2.221 -9.659 99 HG23 VAL 13 3HG2 VAL 13 -24.559 -3.747 -9.017 100 H PHE 14 H PHE 14 -19.994 -3.053 -10.062 101 HA PHE 14 HA PHE 14 -19.261 -2.051 -12.760 102 HB2 PHE 14 2HB PHE 14 -17.532 -2.326 -10.256 103 HB3 PHE 14 3HB PHE 14 -16.877 -2.009 -11.863 104 HD1 PHE 14 HD1 PHE 14 -18.685 -0.554 -9.008 105 HD2 PHE 14 HD2 PHE 14 -17.295 0.153 -12.989 106 HE1 PHE 14 HE1 PHE 14 -19.056 1.861 -8.710 107 HE2 PHE 14 HE2 PHE 14 -17.671 2.563 -12.680 108 HZ PHE 14 HZ PHE 14 -18.549 3.418 -10.546 109 H GLU 15 H GLU 15 -19.882 -3.882 -13.808 110 HA GLU 15 HA GLU 15 -19.041 -6.528 -13.137 111 HB2 GLU 15 2HB GLU 15 -20.070 -5.419 -15.777 112 HB3 GLU 15 3HB GLU 15 -19.896 -7.132 -15.388 113 HG2 GLU 15 2HG GLU 15 -21.545 -6.822 -13.535 114 HG3 GLU 15 3HG GLU 15 -21.762 -5.155 -14.051 115 H ILE 16 H ILE 16 -16.954 -6.874 -13.049 116 HA ILE 16 HA ILE 16 -15.149 -6.159 -15.295 117 HB ILE 16 HB ILE 16 -14.660 -4.909 -13.177 118 HG12 ILE 16 2HG1 ILE 16 -12.500 -6.945 -13.888 119 HG13 ILE 16 3HG1 ILE 16 -12.793 -5.426 -14.727 120 HG21 ILE 16 1HG2 ILE 16 -13.827 -6.082 -11.183 121 HG22 ILE 16 2HG2 ILE 16 -14.145 -7.636 -11.955 122 HG23 ILE 16 3HG2 ILE 16 -15.485 -6.557 -11.562 123 HD11 ILE 16 1HD1 ILE 16 -11.879 -5.713 -11.862 124 HD12 ILE 16 2HD1 ILE 16 -12.192 -4.189 -12.698 125 HD13 ILE 16 3HD1 ILE 16 -10.892 -5.245 -13.246 126 H GLU 17 H GLU 17 -13.746 -7.752 -15.956 127 HA GLU 17 HA GLU 17 -14.610 -10.437 -15.736 128 HB2 GLU 17 2HB GLU 17 -13.419 -9.379 -17.694 129 HB3 GLU 17 3HB GLU 17 -11.937 -9.384 -16.743 130 HG2 GLU 17 2HG GLU 17 -12.210 -11.874 -16.551 131 HG3 GLU 17 3HG GLU 17 -13.519 -11.771 -17.707 132 H LYS 18 H LYS 18 -13.833 -12.120 -14.489 133 HA LYS 18 HA LYS 18 -12.932 -11.545 -11.897 134 HB2 LYS 18 2HB LYS 18 -14.317 -13.507 -12.463 135 HB3 LYS 18 3HB LYS 18 -12.988 -14.209 -13.380 136 HG2 LYS 18 2HG LYS 18 -11.658 -14.387 -11.279 137 HG3 LYS 18 3HG LYS 18 -13.021 -13.712 -10.382 138 HD2 LYS 18 2HD LYS 18 -12.965 -16.161 -10.159 139 HD3 LYS 18 3HD LYS 18 -14.418 -15.652 -11.023 140 HE2 LYS 18 2HE LYS 18 -13.337 -16.252 -13.173 141 HE3 LYS 18 3HE LYS 18 -11.887 -16.757 -12.303 142 HZ1 LYS 18 1HZ LYS 18 -14.570 -17.967 -11.890 143 HZ2 LYS 18 2HZ LYS 18 -13.098 -18.513 -11.265 144 HZ3 LYS 18 3HZ LYS 18 -13.395 -18.601 -12.927 145 H GLU 19 H GLU 19 -11.211 -12.632 -14.760 146 HA GLU 19 HA GLU 19 -8.675 -13.197 -13.708 147 HB2 GLU 19 2HB GLU 19 -9.241 -13.862 -15.938 148 HB3 GLU 19 3HB GLU 19 -9.608 -12.215 -16.422 149 HG2 GLU 19 2HG GLU 19 -7.290 -11.613 -16.480 150 HG3 GLU 19 3HG GLU 19 -6.807 -13.122 -15.689 151 H ILE 20 H ILE 20 -10.120 -10.109 -14.664 152 HA ILE 20 HA ILE 20 -7.735 -8.531 -14.157 153 HB ILE 20 HB ILE 20 -10.570 -7.429 -14.394 154 HG12 ILE 20 2HG1 ILE 20 -8.716 -8.128 -16.717 155 HG13 ILE 20 3HG1 ILE 20 -10.224 -8.941 -16.325 156 HG21 ILE 20 1HG2 ILE 20 -8.819 -5.844 -13.683 157 HG22 ILE 20 2HG2 ILE 20 -9.457 -5.423 -15.269 158 HG23 ILE 20 3HG2 ILE 20 -7.883 -6.211 -15.137 159 HD11 ILE 20 1HD1 ILE 20 -10.508 -7.441 -18.194 160 HD12 ILE 20 2HD1 ILE 20 -9.945 -6.075 -17.233 161 HD13 ILE 20 3HD1 ILE 20 -11.463 -6.883 -16.819 162 H ALA 21 H ALA 21 -10.614 -9.532 -12.403 163 HA ALA 21 HA ALA 21 -10.337 -7.775 -10.143 164 HB1 ALA 21 1HB ALA 21 -12.508 -8.744 -10.774 165 HB2 ALA 21 2HB ALA 21 -12.083 -9.173 -9.116 166 HB3 ALA 21 3HB ALA 21 -11.909 -10.363 -10.411 167 H CYS 22 H CYS 22 -8.863 -10.757 -11.083 168 HA CYS 22 HA CYS 22 -7.917 -11.599 -8.520 169 HB2 CYS 22 2HB CYS 22 -6.989 -12.272 -11.332 170 HB3 CYS 22 3HB CYS 22 -6.349 -13.038 -9.880 171 HG CYS 22 HG CYS 22 -9.681 -13.170 -10.029 172 H MET 23 H MET 23 -6.844 -9.195 -10.818 173 HA MET 23 HA MET 23 -4.162 -8.801 -9.963 174 HB2 MET 23 2HB MET 23 -6.152 -6.768 -11.062 175 HB3 MET 23 3HB MET 23 -4.421 -6.503 -10.925 176 HG2 MET 23 2HG MET 23 -3.984 -8.225 -12.587 177 HG3 MET 23 3HG MET 23 -5.699 -8.631 -12.659 178 HE1 MET 23 1HE MET 23 -4.144 -4.953 -12.410 179 HE2 MET 23 2HE MET 23 -3.961 -4.591 -14.128 180 HE3 MET 23 3HE MET 23 -2.988 -5.860 -13.391 181 H SER 24 H SER 24 -7.242 -7.712 -8.743 182 HA SER 24 HA SER 24 -6.179 -6.204 -6.504 183 HB2 SER 24 2HB SER 24 -8.381 -5.619 -7.546 184 HB3 SER 24 3HB SER 24 -9.010 -7.205 -7.095 185 HG SER 24 HG SER 24 -8.110 -5.169 -5.331 186 H VAL 25 H VAL 25 -5.188 -7.363 -4.874 187 HA VAL 25 HA VAL 25 -5.435 -10.176 -4.604 188 HB VAL 25 HB VAL 25 -4.312 -8.244 -2.528 189 HG11 VAL 25 1HG1 VAL 25 -2.979 -10.171 -1.722 190 HG12 VAL 25 2HG1 VAL 25 -3.804 -11.225 -2.875 191 HG13 VAL 25 3HG1 VAL 25 -4.714 -10.464 -1.567 192 HG21 VAL 25 1HG2 VAL 25 -2.836 -9.629 -4.802 193 HG22 VAL 25 2HG2 VAL 25 -2.095 -8.639 -3.542 194 HG23 VAL 25 3HG2 VAL 25 -3.203 -7.906 -4.700 195 H THR 26 H THR 26 -6.928 -7.472 -2.812 196 HA THR 26 HA THR 26 -8.217 -8.920 -0.775 197 HB THR 26 HB THR 26 -9.053 -6.303 -2.101 198 HG1 THR 26 HG1 THR 26 -7.926 -5.374 -0.400 199 HG21 THR 26 1HG2 THR 26 -10.000 -7.435 0.566 200 HG22 THR 26 2HG2 THR 26 -10.995 -7.252 -0.878 201 HG23 THR 26 3HG2 THR 26 -10.363 -5.824 -0.058 202 H ILE 27 H ILE 27 -9.484 -7.918 -3.978 203 HA ILE 27 HA ILE 27 -12.074 -9.090 -3.632 204 HB ILE 27 HB ILE 27 -10.642 -8.150 -6.158 205 HG12 ILE 27 2HG1 ILE 27 -12.758 -6.708 -4.482 206 HG13 ILE 27 3HG1 ILE 27 -11.029 -6.413 -4.354 207 HG21 ILE 27 1HG2 ILE 27 -13.601 -8.777 -5.808 208 HG22 ILE 27 2HG2 ILE 27 -12.448 -9.719 -6.756 209 HG23 ILE 27 3HG2 ILE 27 -12.859 -8.077 -7.248 210 HD11 ILE 27 1HD1 ILE 27 -12.104 -4.704 -5.669 211 HD12 ILE 27 2HD1 ILE 27 -12.725 -5.912 -6.787 212 HD13 ILE 27 3HD1 ILE 27 -10.989 -5.634 -6.667 213 H LYS 28 H LYS 28 -9.053 -10.149 -5.135 214 HA LYS 28 HA LYS 28 -9.795 -12.594 -6.275 215 HB2 LYS 28 2HB LYS 28 -7.582 -11.515 -6.585 216 HB3 LYS 28 3HB LYS 28 -7.181 -11.816 -4.901 217 HG2 LYS 28 2HG LYS 28 -7.199 -14.247 -5.333 218 HG3 LYS 28 3HG LYS 28 -7.613 -13.943 -7.025 219 HD2 LYS 28 2HD LYS 28 -5.477 -12.723 -7.336 220 HD3 LYS 28 3HD LYS 28 -5.073 -12.983 -5.637 221 HE2 LYS 28 2HE LYS 28 -5.427 -15.180 -7.702 222 HE3 LYS 28 3HE LYS 28 -3.881 -14.540 -7.139 223 HZ1 LYS 28 1HZ LYS 28 -4.394 -15.306 -4.918 224 HZ2 LYS 28 2HZ LYS 28 -4.486 -16.595 -6.006 225 HZ3 LYS 28 3HZ LYS 28 -5.899 -15.884 -5.421 226 H ASN 29 H ASN 29 -8.716 -11.809 -2.978 227 HA ASN 29 HA ASN 29 -8.827 -14.402 -1.854 228 HB2 ASN 29 2HB ASN 29 -8.980 -11.652 -0.536 229 HB3 ASN 29 3HB ASN 29 -8.919 -13.150 0.386 230 HD21 ASN 29 1HD2 ASN 29 -7.044 -10.947 0.425 231 HD22 ASN 29 2HD2 ASN 29 -5.509 -11.588 -0.042 232 H MET 30 H MET 30 -11.266 -11.856 -2.204 233 HA MET 30 HA MET 30 -13.264 -12.932 -0.511 234 HB2 MET 30 2HB MET 30 -13.584 -11.156 -2.979 235 HB3 MET 30 3HB MET 30 -14.883 -11.533 -1.852 236 HG2 MET 30 2HG MET 30 -12.360 -10.002 -1.206 237 HG3 MET 30 3HG MET 30 -13.977 -9.327 -1.403 238 HE1 MET 30 1HE MET 30 -13.693 -8.096 0.980 239 HE2 MET 30 2HE MET 30 -12.090 -8.810 1.175 240 HE3 MET 30 3HE MET 30 -13.284 -8.955 2.465 241 H ILE 31 H ILE 31 -12.658 -13.295 -3.994 242 HA ILE 31 HA ILE 31 -14.908 -14.914 -4.619 243 HB ILE 31 HB ILE 31 -12.261 -14.609 -6.123 244 HG12 ILE 31 2HG1 ILE 31 -14.924 -13.195 -6.627 245 HG13 ILE 31 3HG1 ILE 31 -13.584 -12.477 -5.745 246 HG21 ILE 31 1HG2 ILE 31 -13.472 -15.417 -8.132 247 HG22 ILE 31 2HG2 ILE 31 -14.903 -15.722 -7.149 248 HG23 ILE 31 3HG2 ILE 31 -13.430 -16.651 -6.868 249 HD11 ILE 31 1HD1 ILE 31 -13.571 -13.285 -8.648 250 HD12 ILE 31 2HD1 ILE 31 -12.196 -12.616 -7.766 251 HD13 ILE 31 3HD1 ILE 31 -13.650 -11.647 -7.998 252 H GLU 32 H GLU 32 -11.517 -15.678 -3.820 253 HA GLU 32 HA GLU 32 -11.734 -18.511 -4.188 254 HB2 GLU 32 2HB GLU 32 -9.646 -16.872 -2.692 255 HB3 GLU 32 3HB GLU 32 -9.500 -18.588 -3.063 256 HG2 GLU 32 2HG GLU 32 -9.520 -18.096 -5.471 257 HG3 GLU 32 3HG GLU 32 -9.717 -16.376 -5.126 258 H ASP 33 H ASP 33 -12.293 -16.364 -1.471 259 HA ASP 33 HA ASP 33 -12.265 -18.308 0.631 260 HB2 ASP 33 2HB ASP 33 -11.976 -15.910 1.099 261 HB3 ASP 33 3HB ASP 33 -13.584 -15.557 0.476 262 H ILE 34 H ILE 34 -14.827 -16.834 -1.304 263 HA ILE 34 HA ILE 34 -16.981 -18.484 -0.323 264 HB ILE 34 HB ILE 34 -16.796 -16.775 -2.862 265 HG12 ILE 34 2HG1 ILE 34 -17.956 -16.033 -0.132 266 HG13 ILE 34 3HG1 ILE 34 -16.415 -15.468 -0.762 267 HG21 ILE 34 1HG2 ILE 34 -18.641 -18.410 -2.993 268 HG22 ILE 34 2HG2 ILE 34 -19.263 -16.767 -2.859 269 HG23 ILE 34 3HG2 ILE 34 -19.276 -17.831 -1.449 270 HD11 ILE 34 1HD1 ILE 34 -18.081 -13.759 -0.982 271 HD12 ILE 34 2HD1 ILE 34 -19.138 -14.837 -1.890 272 HD13 ILE 34 3HD1 ILE 34 -17.600 -14.317 -2.583 273 H GLY 35 H GLY 35 -14.426 -18.837 -2.600 274 HA2 GLY 35 2HA GLY 35 -13.752 -20.662 -3.850 275 HA3 GLY 35 3HA GLY 35 -15.282 -21.466 -3.506 276 H GLU 36 H GLU 36 -17.196 -20.568 -4.549 277 HA GLU 36 HA GLU 36 -16.689 -19.414 -7.237 278 HB2 GLU 36 2HB GLU 36 -18.953 -21.245 -6.307 279 HB3 GLU 36 3HB GLU 36 -18.749 -20.617 -7.940 280 HG2 GLU 36 2HG GLU 36 -16.799 -21.946 -8.325 281 HG3 GLU 36 3HG GLU 36 -16.647 -22.348 -6.616 282 H SER 37 H SER 37 -16.917 -17.253 -6.665 283 HA SER 37 HA SER 37 -19.053 -16.309 -4.972 284 HB2 SER 37 2HB SER 37 -16.806 -15.228 -4.985 285 HB3 SER 37 3HB SER 37 -17.078 -14.699 -6.643 286 HG SER 37 HG SER 37 -18.828 -13.450 -5.882 287 H ASP 38 H ASP 38 -20.811 -17.191 -6.202 288 HA ASP 38 HA ASP 38 -21.648 -16.077 -8.716 289 HB2 ASP 38 2HB ASP 38 -23.195 -17.524 -6.511 290 HB3 ASP 38 3HB ASP 38 -23.914 -17.047 -8.047 291 H SER 39 H SER 39 -22.004 -15.273 -5.338 292 HA SER 39 HA SER 39 -23.917 -13.154 -5.640 293 HB2 SER 39 2HB SER 39 -21.976 -13.761 -3.355 294 HB3 SER 39 3HB SER 39 -23.313 -12.613 -3.284 295 HG SER 39 HG SER 39 -23.967 -14.549 -2.399 296 HA PRO 40 HA PRO 40 -20.877 -10.073 -7.014 297 HB2 PRO 40 2HB PRO 40 -22.333 -7.798 -6.519 298 HB3 PRO 40 3HB PRO 40 -22.689 -8.882 -7.877 299 HG2 PRO 40 2HG PRO 40 -24.029 -8.745 -5.195 300 HG3 PRO 40 3HG PRO 40 -24.764 -8.847 -6.813 301 HD2 PRO 40 2HD PRO 40 -24.490 -11.033 -5.247 302 HD3 PRO 40 3HD PRO 40 -24.336 -11.130 -7.015 303 H ILE 41 H ILE 41 -19.256 -8.856 -5.988 304 HA ILE 41 HA ILE 41 -19.265 -8.875 -3.035 305 HB ILE 41 HB ILE 41 -16.945 -8.433 -4.970 306 HG12 ILE 41 2HG1 ILE 41 -17.763 -10.763 -5.078 307 HG13 ILE 41 3HG1 ILE 41 -16.177 -10.706 -4.320 308 HG21 ILE 41 1HG2 ILE 41 -15.463 -8.687 -3.002 309 HG22 ILE 41 2HG2 ILE 41 -16.880 -8.751 -1.953 310 HG23 ILE 41 3HG2 ILE 41 -16.518 -7.280 -2.856 311 HD11 ILE 41 1HD1 ILE 41 -17.234 -10.959 -2.116 312 HD12 ILE 41 2HD1 ILE 41 -17.630 -12.285 -3.208 313 HD13 ILE 41 3HD1 ILE 41 -18.819 -11.022 -2.893 314 HA PRO 42 HA PRO 42 -19.775 -4.325 -3.513 315 HB2 PRO 42 2HB PRO 42 -21.064 -3.836 -1.180 316 HB3 PRO 42 3HB PRO 42 -21.912 -4.564 -2.560 317 HG2 PRO 42 2HG PRO 42 -20.828 -5.897 -0.109 318 HG3 PRO 42 3HG PRO 42 -22.368 -6.177 -0.952 319 HD2 PRO 42 2HD PRO 42 -20.110 -7.762 -1.284 320 HD3 PRO 42 3HD PRO 42 -21.411 -7.615 -2.483 321 H LEU 43 H LEU 43 -18.495 -2.719 -2.709 322 HA LEU 43 HA LEU 43 -16.580 -3.321 -0.525 323 HB2 LEU 43 2HB LEU 43 -16.152 -1.664 -3.061 324 HB3 LEU 43 3HB LEU 43 -15.027 -1.716 -1.726 325 HG LEU 43 HG LEU 43 -14.076 -3.128 -3.365 326 HD11 LEU 43 1HD1 LEU 43 -14.008 -5.355 -2.406 327 HD12 LEU 43 2HD1 LEU 43 -15.465 -5.025 -1.464 328 HD13 LEU 43 3HD1 LEU 43 -13.982 -4.123 -1.143 329 HD21 LEU 43 1HD2 LEU 43 -15.991 -3.345 -4.866 330 HD22 LEU 43 2HD2 LEU 43 -16.743 -4.514 -3.778 331 HD23 LEU 43 3HD2 LEU 43 -15.225 -4.909 -4.591 332 HA PRO 44 HA PRO 44 -19.210 0.288 0.785 333 HB2 PRO 44 2HB PRO 44 -19.623 -0.419 3.363 334 HB3 PRO 44 3HB PRO 44 -20.440 -1.284 2.042 335 HG2 PRO 44 2HG PRO 44 -18.007 -2.099 3.595 336 HG3 PRO 44 3HG PRO 44 -19.411 -3.078 3.111 337 HD2 PRO 44 2HD PRO 44 -17.004 -3.047 1.735 338 HD3 PRO 44 3HD PRO 44 -18.565 -3.479 1.002 339 H ASN 45 H ASN 45 -16.871 1.121 0.277 340 HA ASN 45 HA ASN 45 -15.916 2.726 2.478 341 HB2 ASN 45 2HB ASN 45 -14.611 0.718 2.963 342 HB3 ASN 45 3HB ASN 45 -14.157 0.538 1.275 343 HD21 ASN 45 1HD2 ASN 45 -13.575 2.322 4.227 344 HD22 ASN 45 2HD2 ASN 45 -12.084 3.040 3.735 345 H VAL 46 H VAL 46 -14.903 1.458 -0.712 346 HA VAL 46 HA VAL 46 -13.895 4.047 -1.566 347 HB VAL 46 HB VAL 46 -12.581 2.071 -2.108 348 HG11 VAL 46 1HG1 VAL 46 -13.316 0.312 -3.652 349 HG12 VAL 46 2HG1 VAL 46 -14.918 1.047 -3.750 350 HG13 VAL 46 3HG1 VAL 46 -14.349 0.376 -2.219 351 HG21 VAL 46 1HG2 VAL 46 -12.420 3.945 -3.663 352 HG22 VAL 46 2HG2 VAL 46 -13.763 3.311 -4.618 353 HG23 VAL 46 3HG2 VAL 46 -12.241 2.423 -4.537 354 H THR 47 H THR 47 -14.920 5.465 -2.905 355 HA THR 47 HA THR 47 -17.747 5.216 -3.398 356 HB THR 47 HB THR 47 -17.527 7.498 -4.397 357 HG1 THR 47 HG1 THR 47 -14.895 7.863 -3.719 358 HG21 THR 47 1HG2 THR 47 -15.998 7.201 -1.779 359 HG22 THR 47 2HG2 THR 47 -17.753 7.307 -1.936 360 HG23 THR 47 3HG2 THR 47 -16.744 8.684 -2.378 361 H SER 48 H SER 48 -18.603 5.912 -5.678 362 HA SER 48 HA SER 48 -18.084 3.739 -7.395 363 HB2 SER 48 2HB SER 48 -19.656 4.959 -8.984 364 HB3 SER 48 3HB SER 48 -20.288 4.685 -7.361 365 HG SER 48 HG SER 48 -20.723 6.779 -7.759 366 H THR 49 H THR 49 -17.222 7.178 -7.746 367 HA THR 49 HA THR 49 -16.137 7.025 -10.362 368 HB THR 49 HB THR 49 -15.067 9.263 -9.738 369 HG1 THR 49 HG1 THR 49 -15.194 9.962 -7.707 370 HG21 THR 49 1HG2 THR 49 -18.035 8.962 -9.114 371 HG22 THR 49 2HG2 THR 49 -17.341 9.211 -10.717 372 HG23 THR 49 3HG2 THR 49 -17.220 10.480 -9.497 373 H ILE 50 H ILE 50 -14.653 6.814 -7.139 374 HA ILE 50 HA ILE 50 -11.942 6.758 -8.063 375 HB ILE 50 HB ILE 50 -13.106 5.973 -5.353 376 HG12 ILE 50 2HG1 ILE 50 -13.592 8.320 -5.895 377 HG13 ILE 50 3HG1 ILE 50 -12.380 8.255 -4.625 378 HG21 ILE 50 1HG2 ILE 50 -10.827 6.288 -4.446 379 HG22 ILE 50 2HG2 ILE 50 -10.213 6.545 -6.081 380 HG23 ILE 50 3HG2 ILE 50 -10.886 4.977 -5.628 381 HD11 ILE 50 1HD1 ILE 50 -11.860 9.999 -6.199 382 HD12 ILE 50 2HD1 ILE 50 -11.890 8.860 -7.544 383 HD13 ILE 50 3HD1 ILE 50 -10.632 8.738 -6.307 384 H LEU 51 H LEU 51 -14.264 4.277 -7.006 385 HA LEU 51 HA LEU 51 -12.609 1.994 -7.209 386 HB2 LEU 51 2HB LEU 51 -14.806 2.140 -5.993 387 HB3 LEU 51 3HB LEU 51 -15.643 2.189 -7.524 388 HG LEU 51 HG LEU 51 -15.675 -0.028 -6.220 389 HD11 LEU 51 1HD1 LEU 51 -15.619 -1.451 -8.159 390 HD12 LEU 51 2HD1 LEU 51 -14.710 -0.244 -9.070 391 HD13 LEU 51 3HD1 LEU 51 -16.361 0.095 -8.561 392 HD21 LEU 51 1HD2 LEU 51 -13.312 -0.092 -5.561 393 HD22 LEU 51 2HD2 LEU 51 -12.836 -0.310 -7.248 394 HD23 LEU 51 3HD2 LEU 51 -13.789 -1.550 -6.426 395 H GLU 52 H GLU 52 -14.658 3.705 -9.542 396 HA GLU 52 HA GLU 52 -14.505 1.971 -11.740 397 HB2 GLU 52 2HB GLU 52 -16.042 3.924 -11.658 398 HB3 GLU 52 3HB GLU 52 -14.667 5.022 -11.747 399 HG2 GLU 52 2HG GLU 52 -14.111 4.095 -13.997 400 HG3 GLU 52 3HG GLU 52 -15.533 3.061 -13.904 401 H LYS 53 H LYS 53 -12.467 4.749 -10.821 402 HA LYS 53 HA LYS 53 -10.678 4.690 -12.979 403 HB2 LYS 53 2HB LYS 53 -10.310 5.721 -10.132 404 HB3 LYS 53 3HB LYS 53 -9.126 5.976 -11.410 405 HG2 LYS 53 2HG LYS 53 -10.801 7.242 -12.722 406 HG3 LYS 53 3HG LYS 53 -11.994 6.977 -11.451 407 HD2 LYS 53 2HD LYS 53 -11.003 9.237 -11.318 408 HD3 LYS 53 3HD LYS 53 -10.658 8.287 -9.871 409 HE2 LYS 53 2HE LYS 53 -8.702 9.599 -10.642 410 HE3 LYS 53 3HE LYS 53 -8.380 7.866 -10.649 411 HZ1 LYS 53 1HZ LYS 53 -7.530 8.918 -12.643 412 HZ2 LYS 53 2HZ LYS 53 -9.056 9.533 -13.022 413 HZ3 LYS 53 3HZ LYS 53 -8.789 7.866 -13.054 414 H VAL 54 H VAL 54 -10.332 3.216 -9.726 415 HA VAL 54 HA VAL 54 -7.687 2.289 -10.058 416 HB VAL 54 HB VAL 54 -9.856 1.290 -8.151 417 HG11 VAL 54 1HG1 VAL 54 -8.028 0.399 -6.752 418 HG12 VAL 54 2HG1 VAL 54 -6.847 0.870 -7.977 419 HG13 VAL 54 3HG1 VAL 54 -8.044 -0.374 -8.340 420 HG21 VAL 54 1HG2 VAL 54 -9.341 3.707 -7.916 421 HG22 VAL 54 2HG2 VAL 54 -7.636 3.323 -7.685 422 HG23 VAL 54 3HG2 VAL 54 -8.828 2.794 -6.495 423 H LEU 55 H LEU 55 -10.824 0.650 -10.592 424 HA LEU 55 HA LEU 55 -9.651 -1.833 -11.453 425 HB2 LEU 55 2HB LEU 55 -12.488 -0.784 -11.713 426 HB3 LEU 55 3HB LEU 55 -11.995 -2.388 -12.225 427 HG LEU 55 HG LEU 55 -12.107 -1.318 -9.381 428 HD11 LEU 55 1HD1 LEU 55 -13.715 -3.135 -9.022 429 HD12 LEU 55 2HD1 LEU 55 -13.551 -3.638 -10.706 430 HD13 LEU 55 3HD1 LEU 55 -14.249 -2.062 -10.316 431 HD21 LEU 55 1HD2 LEU 55 -10.054 -2.626 -9.540 432 HD22 LEU 55 2HD2 LEU 55 -10.924 -3.968 -10.290 433 HD23 LEU 55 3HD2 LEU 55 -11.263 -3.517 -8.615 434 H ASP 56 H ASP 56 -10.524 1.146 -13.098 435 HA ASP 56 HA ASP 56 -10.697 0.052 -15.758 436 HB2 ASP 56 2HB ASP 56 -11.846 2.180 -15.095 437 HB3 ASP 56 3HB ASP 56 -10.279 2.966 -14.933 438 H TYR 57 H TYR 57 -8.155 1.536 -13.818 439 HA TYR 57 HA TYR 57 -6.055 1.577 -15.706 440 HB2 TYR 57 2HB TYR 57 -5.897 2.659 -13.465 441 HB3 TYR 57 3HB TYR 57 -5.922 1.082 -12.688 442 HD1 TYR 57 HD1 TYR 57 -3.898 3.375 -14.798 443 HD2 TYR 57 HD2 TYR 57 -3.878 -0.274 -12.562 444 HE1 TYR 57 HE1 TYR 57 -1.450 3.266 -14.987 445 HE2 TYR 57 HE2 TYR 57 -1.427 -0.377 -12.752 446 HH TYR 57 HH TYR 57 0.460 2.227 -13.840 447 H CYS 58 H CYS 58 -7.259 -0.923 -13.504 448 HA CYS 58 HA CYS 58 -5.388 -2.947 -14.072 449 HB2 CYS 58 2HB CYS 58 -8.247 -3.157 -13.045 450 HB3 CYS 58 3HB CYS 58 -7.083 -4.482 -13.036 451 HG CYS 58 HG CYS 58 -7.562 -2.139 -10.809 452 H ARG 59 H ARG 59 -8.470 -2.079 -15.635 453 HA ARG 59 HA ARG 59 -8.697 -4.220 -17.475 454 HB2 ARG 59 2HB ARG 59 -9.565 -1.311 -17.786 455 HB3 ARG 59 3HB ARG 59 -10.061 -2.614 -18.859 456 HG2 ARG 59 2HG ARG 59 -11.307 -3.684 -17.058 457 HG3 ARG 59 3HG ARG 59 -10.726 -2.482 -15.900 458 HD2 ARG 59 2HD ARG 59 -11.883 -0.701 -17.172 459 HD3 ARG 59 3HD ARG 59 -12.466 -1.903 -18.328 460 HE ARG 59 HE ARG 59 -13.258 -2.565 -15.672 461 HH11 ARG 59 1HH1 ARG 59 -14.021 -0.327 -18.285 462 HH12 ARG 59 2HH1 ARG 59 -15.670 -0.131 -17.796 463 HH21 ARG 59 1HH2 ARG 59 -15.447 -2.328 -15.065 464 HH22 ARG 59 2HH2 ARG 59 -16.483 -1.269 -15.968 465 H HIS 60 H HIS 60 -7.106 -1.057 -17.696 466 HA HIS 60 HA HIS 60 -6.163 -1.186 -20.330 467 HB2 HIS 60 2HB HIS 60 -6.154 0.933 -19.148 468 HB3 HIS 60 3HB HIS 60 -5.056 0.310 -17.919 469 HD1 HIS 60 HD1 HIS 60 -2.616 0.708 -18.332 470 HD2 HIS 60 HD2 HIS 60 -4.852 1.145 -21.799 471 HE1 HIS 60 HE1 HIS 60 -0.994 1.446 -20.087 472 HE2 HIS 60 HE2 HIS 60 -2.391 1.841 -22.135 473 H HIS 61 H HIS 61 -4.615 -2.186 -17.283 474 HA HIS 61 HA HIS 61 -2.144 -2.936 -18.568 475 HB2 HIS 61 2HB HIS 61 -2.367 -2.037 -16.183 476 HB3 HIS 61 3HB HIS 61 -2.990 -3.619 -15.724 477 HD1 HIS 61 HD1 HIS 61 -1.256 -5.489 -15.376 478 HD2 HIS 61 HD2 HIS 61 0.377 -2.037 -17.026 479 HE1 HIS 61 HE1 HIS 61 1.226 -5.847 -15.391 480 HE2 HIS 61 HE2 HIS 61 2.202 -3.707 -16.277 481 H HIS 62 H HIS 62 -5.130 -4.497 -17.886 482 HA HIS 62 HA HIS 62 -4.360 -7.233 -18.001 483 HB2 HIS 62 2HB HIS 62 -6.544 -6.676 -17.137 484 HB3 HIS 62 3HB HIS 62 -6.967 -5.775 -18.585 485 HD1 HIS 62 HD1 HIS 62 -8.602 -7.018 -19.997 486 HD2 HIS 62 HD2 HIS 62 -6.104 -9.588 -17.971 487 HE1 HIS 62 HE1 HIS 62 -9.446 -9.327 -20.493 488 HE2 HIS 62 HE2 HIS 62 -8.089 -10.823 -19.039 489 H GLN 63 H GLN 63 -5.471 -4.915 -20.437 490 HA GLN 63 HA GLN 63 -5.312 -6.889 -22.589 491 HB2 GLN 63 2HB GLN 63 -6.264 -3.992 -22.682 492 HB3 GLN 63 3HB GLN 63 -6.530 -5.235 -23.904 493 HG2 GLN 63 2HG GLN 63 -7.901 -6.522 -22.254 494 HG3 GLN 63 3HG GLN 63 -7.675 -5.224 -21.088 495 HE21 GLN 63 1HE2 GLN 63 -9.273 -6.168 -24.037 496 HE22 GLN 63 2HE2 GLN 63 -10.387 -4.850 -24.097 497 H HIS 64 H HIS 64 -3.498 -4.299 -21.268 498 HA HIS 64 HA HIS 64 -1.436 -4.561 -23.367 499 HB2 HIS 64 2HB HIS 64 -2.282 -1.968 -21.981 500 HB3 HIS 64 3HB HIS 64 -0.864 -2.134 -23.009 501 HD1 HIS 64 HD1 HIS 64 -1.224 -2.141 -25.532 502 HD2 HIS 64 HD2 HIS 64 -4.780 -1.955 -23.382 503 HE1 HIS 64 HE1 HIS 64 -2.992 -1.530 -27.198 504 HE2 HIS 64 HE2 HIS 64 -5.143 -1.556 -25.908 505 HA PRO 65 HA PRO 65 0.318 -5.663 -19.199 506 HB2 PRO 65 2HB PRO 65 2.131 -7.509 -20.189 507 HB3 PRO 65 3HB PRO 65 0.457 -7.916 -19.767 508 HG2 PRO 65 2HG PRO 65 1.632 -7.360 -22.464 509 HG3 PRO 65 3HG PRO 65 0.449 -8.598 -21.987 510 HD2 PRO 65 2HD PRO 65 -0.293 -6.292 -23.229 511 HD3 PRO 65 3HD PRO 65 -1.336 -7.112 -22.045 512 H GLY 66 H GLY 66 1.142 -3.556 -19.090 513 HA2 GLY 66 2HA GLY 66 3.348 -2.629 -20.708 514 HA3 GLY 66 3HA GLY 66 2.556 -1.764 -19.402 515 H GLY 67 H GLY 67 4.970 -1.231 -19.281 516 HA2 GLY 67 2HA GLY 67 6.372 -1.536 -17.177 517 HA3 GLY 67 3HA GLY 67 6.531 -3.211 -17.702 518 H SER 68 H SER 68 6.768 -2.841 -20.457 519 HA SER 68 HA SER 68 9.470 -1.907 -20.800 520 HB2 SER 68 2HB SER 68 7.441 -2.783 -22.903 521 HB3 SER 68 3HB SER 68 9.176 -2.587 -23.159 522 HG SER 68 HG SER 68 8.707 -4.204 -21.046 523 H GLY 69 H GLY 69 9.332 0.230 -20.170 524 HA2 GLY 69 2HA GLY 69 9.065 2.299 -21.955 525 HA3 GLY 69 3HA GLY 69 7.468 2.146 -21.219 526 H LEU 70 H LEU 70 10.847 1.937 -20.111 527 HA LEU 70 HA LEU 70 10.399 2.800 -17.495 528 HB2 LEU 70 2HB LEU 70 12.895 3.111 -17.380 529 HB3 LEU 70 3HB LEU 70 12.359 1.554 -17.960 530 HG LEU 70 HG LEU 70 12.787 2.664 -20.369 531 HD11 LEU 70 1HD1 LEU 70 14.785 4.195 -18.678 532 HD12 LEU 70 2HD1 LEU 70 13.442 4.887 -19.591 533 HD13 LEU 70 3HD1 LEU 70 14.767 4.098 -20.441 534 HD21 LEU 70 1HD2 LEU 70 13.835 0.605 -19.589 535 HD22 LEU 70 2HD2 LEU 70 15.026 1.529 -18.670 536 HD23 LEU 70 3HD2 LEU 70 15.001 1.623 -20.433 537 H ASP 71 H ASP 71 9.822 4.660 -16.729 538 HA ASP 71 HA ASP 71 9.528 6.830 -16.279 539 HB2 ASP 71 2HB ASP 71 12.033 6.909 -16.428 540 HB3 ASP 71 3HB ASP 71 11.896 7.354 -18.122 541 H ASP 72 H ASP 72 8.727 5.531 -19.124 542 HA ASP 72 HA ASP 72 7.792 7.997 -20.466 543 HB2 ASP 72 2HB ASP 72 9.270 6.521 -21.829 544 HB3 ASP 72 3HB ASP 72 8.161 5.177 -21.584 545 H ILE 73 H ILE 73 5.954 8.315 -19.232 546 HA ILE 73 HA ILE 73 3.903 6.235 -18.988 547 HB ILE 73 HB ILE 73 3.884 9.120 -17.969 548 HG12 ILE 73 2HG1 ILE 73 4.503 6.559 -16.422 549 HG13 ILE 73 3HG1 ILE 73 5.691 7.760 -16.911 550 HG21 ILE 73 1HG2 ILE 73 2.040 6.810 -17.241 551 HG22 ILE 73 2HG2 ILE 73 1.604 8.203 -18.233 552 HG23 ILE 73 3HG2 ILE 73 2.001 8.428 -16.532 553 HD11 ILE 73 1HD1 ILE 73 3.433 8.188 -14.952 554 HD12 ILE 73 2HD1 ILE 73 4.592 9.416 -15.469 555 HD13 ILE 73 3HD1 ILE 73 5.147 8.002 -14.578 556 HA PRO 74 HA PRO 74 2.056 7.936 -22.847 557 HB2 PRO 74 2HB PRO 74 -0.157 6.271 -22.912 558 HB3 PRO 74 3HB PRO 74 1.455 5.764 -23.451 559 HG2 PRO 74 2HG PRO 74 0.093 5.240 -20.837 560 HG3 PRO 74 3HG PRO 74 1.057 4.135 -21.840 561 HD2 PRO 74 2HD PRO 74 2.075 5.344 -19.631 562 HD3 PRO 74 3HD PRO 74 3.079 4.975 -21.053 563 HA PRO 75 HA PRO 75 -0.652 11.222 -21.492 564 HB2 PRO 75 2HB PRO 75 -2.438 10.330 -23.777 565 HB3 PRO 75 3HB PRO 75 -1.912 11.972 -23.331 566 HG2 PRO 75 2HG PRO 75 -0.712 10.736 -25.329 567 HG3 PRO 75 3HG PRO 75 0.259 11.655 -24.152 568 HD2 PRO 75 2HD PRO 75 -0.062 8.683 -24.428 569 HD3 PRO 75 3HD PRO 75 1.362 9.624 -23.929 570 H TYR 76 H TYR 76 -2.449 8.182 -22.266 571 HA TYR 76 HA TYR 76 -4.797 8.779 -20.826 572 HB2 TYR 76 2HB TYR 76 -4.980 6.914 -22.293 573 HB3 TYR 76 3HB TYR 76 -3.543 6.133 -21.641 574 HD1 TYR 76 HD1 TYR 76 -3.854 4.332 -20.125 575 HD2 TYR 76 HD2 TYR 76 -7.008 7.188 -20.548 576 HE1 TYR 76 HE1 TYR 76 -5.233 3.038 -18.567 577 HE2 TYR 76 HE2 TYR 76 -8.390 5.877 -18.985 578 HH TYR 76 HH TYR 76 -8.564 3.656 -18.050 579 H ASP 77 H ASP 77 -1.998 6.802 -19.791 580 HA ASP 77 HA ASP 77 -2.886 6.387 -17.127 581 HB2 ASP 77 2HB ASP 77 -0.103 6.124 -18.350 582 HB3 ASP 77 3HB ASP 77 -0.530 5.557 -16.741 583 H ARG 78 H ARG 78 -1.077 8.932 -18.659 584 HA ARG 78 HA ARG 78 0.124 10.093 -16.351 585 HB2 ARG 78 2HB ARG 78 0.896 10.465 -18.706 586 HB3 ARG 78 3HB ARG 78 -0.568 11.389 -19.024 587 HG2 ARG 78 2HG ARG 78 0.145 13.026 -17.265 588 HG3 ARG 78 3HG ARG 78 1.650 12.121 -17.084 589 HD2 ARG 78 2HD ARG 78 0.672 13.539 -19.579 590 HD3 ARG 78 3HD ARG 78 2.004 14.043 -18.538 591 HE ARG 78 HE ARG 78 3.050 11.814 -19.232 592 HH11 ARG 78 1HH1 ARG 78 0.953 13.664 -21.380 593 HH12 ARG 78 2HH1 ARG 78 1.700 13.047 -22.819 594 HH21 ARG 78 1HH2 ARG 78 3.994 11.021 -21.126 595 HH22 ARG 78 2HH2 ARG 78 3.416 11.554 -22.674 596 H ASP 79 H ASP 79 -2.709 11.084 -18.325 597 HA ASP 79 HA ASP 79 -3.641 13.103 -16.530 598 HB2 ASP 79 2HB ASP 79 -4.986 11.657 -18.851 599 HB3 ASP 79 3HB ASP 79 -5.793 12.931 -17.941 600 H PHE 80 H PHE 80 -4.122 9.683 -16.722 601 HA PHE 80 HA PHE 80 -6.437 9.335 -15.160 602 HB2 PHE 80 2HB PHE 80 -5.500 7.461 -16.433 603 HB3 PHE 80 3HB PHE 80 -3.983 7.548 -15.546 604 HD1 PHE 80 HD1 PHE 80 -3.798 6.638 -13.275 605 HD2 PHE 80 HD2 PHE 80 -7.495 6.466 -15.412 606 HE1 PHE 80 HE1 PHE 80 -4.695 5.115 -11.593 607 HE2 PHE 80 HE2 PHE 80 -8.381 4.925 -13.722 608 HZ PHE 80 HZ PHE 80 -6.988 4.254 -11.805 609 H CYS 81 H CYS 81 -2.995 9.395 -14.267 610 HA CYS 81 HA CYS 81 -3.540 9.133 -11.430 611 HB2 CYS 81 2HB CYS 81 -0.930 9.502 -12.953 612 HB3 CYS 81 3HB CYS 81 -1.056 9.149 -11.230 613 HG CYS 81 HG CYS 81 -1.464 7.103 -13.872 614 H LYS 82 H LYS 82 -2.808 11.709 -13.692 615 HA LYS 82 HA LYS 82 -2.282 13.711 -11.654 616 HB2 LYS 82 2HB LYS 82 -2.731 13.938 -14.659 617 HB3 LYS 82 3HB LYS 82 -2.448 15.331 -13.618 618 HG2 LYS 82 2HG LYS 82 -0.229 14.421 -13.004 619 HG3 LYS 82 3HG LYS 82 -0.523 13.026 -14.043 620 HD2 LYS 82 2HD LYS 82 0.861 14.475 -15.318 621 HD3 LYS 82 3HD LYS 82 -0.754 14.674 -15.991 622 HE2 LYS 82 2HE LYS 82 0.511 16.578 -13.989 623 HE3 LYS 82 3HE LYS 82 0.540 16.806 -15.732 624 HZ1 LYS 82 1HZ LYS 82 -1.900 16.875 -15.696 625 HZ2 LYS 82 2HZ LYS 82 -1.207 18.109 -14.774 626 HZ3 LYS 82 3HZ LYS 82 -1.881 16.760 -14.010 627 H VAL 83 H VAL 83 -4.105 13.429 -10.384 628 HA VAL 83 HA VAL 83 -6.598 14.706 -11.372 629 HB VAL 83 HB VAL 83 -7.839 13.290 -9.678 630 HG11 VAL 83 1HG1 VAL 83 -6.411 11.719 -11.857 631 HG12 VAL 83 2HG1 VAL 83 -7.874 12.685 -12.062 632 HG13 VAL 83 3HG1 VAL 83 -7.909 11.242 -11.049 633 HG21 VAL 83 1HG2 VAL 83 -6.766 11.223 -8.797 634 HG22 VAL 83 2HG2 VAL 83 -5.969 12.677 -8.196 635 HG23 VAL 83 3HG2 VAL 83 -5.221 11.736 -9.487 636 H ASP 84 H ASP 84 -7.916 15.238 -9.140 637 HA ASP 84 HA ASP 84 -6.553 17.511 -8.123 638 HB2 ASP 84 2HB ASP 84 -9.034 17.351 -8.465 639 HB3 ASP 84 3HB ASP 84 -9.128 16.215 -7.122 640 H GLN 85 H GLN 85 -6.099 17.961 -5.820 641 HA GLN 85 HA GLN 85 -4.190 16.179 -4.882 642 HB2 GLN 85 2HB GLN 85 -4.098 18.595 -4.444 643 HB3 GLN 85 3HB GLN 85 -5.486 18.481 -3.373 644 HG2 GLN 85 2HG GLN 85 -3.422 18.681 -2.087 645 HG3 GLN 85 3HG GLN 85 -4.171 17.111 -1.801 646 HE21 GLN 85 1HE2 GLN 85 -2.143 16.335 -1.064 647 HE22 GLN 85 2HE2 GLN 85 -0.892 15.913 -2.167 648 HA PRO 86 HA PRO 86 -7.245 14.590 -1.334 649 HB2 PRO 86 2HB PRO 86 -9.916 15.235 -2.579 650 HB3 PRO 86 3HB PRO 86 -9.415 15.289 -0.872 651 HG2 PRO 86 2HG PRO 86 -9.727 17.550 -2.201 652 HG3 PRO 86 3HG PRO 86 -8.339 17.353 -1.101 653 HD2 PRO 86 2HD PRO 86 -8.403 17.104 -4.112 654 HD3 PRO 86 3HD PRO 86 -7.246 17.977 -3.077 655 H THR 87 H THR 87 -8.321 14.568 -4.739 656 HA THR 87 HA THR 87 -9.454 11.985 -4.826 657 HB THR 87 HB THR 87 -8.192 13.476 -7.174 658 HG1 THR 87 HG1 THR 87 -10.751 13.764 -5.958 659 HG21 THR 87 1HG2 THR 87 -10.530 11.521 -7.126 660 HG22 THR 87 2HG2 THR 87 -8.905 11.146 -7.705 661 HG23 THR 87 3HG2 THR 87 -9.887 12.342 -8.549 662 H LEU 88 H LEU 88 -6.148 13.125 -5.233 663 HA LEU 88 HA LEU 88 -4.839 10.805 -6.126 664 HB2 LEU 88 2HB LEU 88 -3.943 13.125 -4.383 665 HB3 LEU 88 3HB LEU 88 -2.829 11.859 -4.869 666 HG LEU 88 HG LEU 88 -4.350 13.554 -6.888 667 HD11 LEU 88 1HD1 LEU 88 -2.351 14.919 -7.160 668 HD12 LEU 88 2HD1 LEU 88 -1.532 14.037 -5.869 669 HD13 LEU 88 3HD1 LEU 88 -2.943 15.032 -5.504 670 HD21 LEU 88 1HD2 LEU 88 -2.639 12.754 -8.455 671 HD22 LEU 88 2HD2 LEU 88 -3.514 11.408 -7.732 672 HD23 LEU 88 3HD2 LEU 88 -1.885 11.800 -7.174 673 H PHE 89 H PHE 89 -5.475 11.979 -2.817 674 HA PHE 89 HA PHE 89 -4.344 9.752 -1.458 675 HB2 PHE 89 2HB PHE 89 -6.350 11.831 -0.482 676 HB3 PHE 89 3HB PHE 89 -5.568 10.644 0.560 677 HD1 PHE 89 HD1 PHE 89 -2.858 10.587 0.182 678 HD2 PHE 89 HD2 PHE 89 -5.395 13.976 -0.418 679 HE1 PHE 89 HE1 PHE 89 -0.943 12.092 0.515 680 HE2 PHE 89 HE2 PHE 89 -3.474 15.468 -0.085 681 HZ PHE 89 HZ PHE 89 -1.245 14.528 0.376 682 H GLU 90 H GLU 90 -7.569 10.410 -2.723 683 HA GLU 90 HA GLU 90 -8.952 8.266 -1.503 684 HB2 GLU 90 2HB GLU 90 -9.453 9.692 -4.148 685 HB3 GLU 90 3HB GLU 90 -10.550 8.496 -3.467 686 HG2 GLU 90 2HG GLU 90 -9.801 11.148 -2.226 687 HG3 GLU 90 3HG GLU 90 -11.331 10.753 -3.001 688 H LEU 91 H LEU 91 -7.047 8.459 -4.493 689 HA LEU 91 HA LEU 91 -7.525 5.786 -5.381 690 HB2 LEU 91 2HB LEU 91 -5.252 7.702 -6.031 691 HB3 LEU 91 3HB LEU 91 -5.517 6.177 -6.857 692 HG LEU 91 HG LEU 91 -7.411 8.565 -6.912 693 HD11 LEU 91 1HD1 LEU 91 -6.731 8.835 -9.256 694 HD12 LEU 91 2HD1 LEU 91 -5.581 7.506 -9.096 695 HD13 LEU 91 3HD1 LEU 91 -5.347 8.991 -8.175 696 HD21 LEU 91 1HD2 LEU 91 -8.678 7.315 -8.601 697 HD22 LEU 91 2HD2 LEU 91 -8.639 6.449 -7.068 698 HD23 LEU 91 3HD2 LEU 91 -7.605 5.926 -8.401 699 H ILE 92 H ILE 92 -5.082 7.270 -3.277 700 HA ILE 92 HA ILE 92 -3.384 5.008 -2.941 701 HB ILE 92 HB ILE 92 -3.857 7.394 -1.080 702 HG12 ILE 92 2HG1 ILE 92 -1.602 6.879 -3.082 703 HG13 ILE 92 3HG1 ILE 92 -2.942 7.991 -3.325 704 HG21 ILE 92 1HG2 ILE 92 -1.716 6.810 0.029 705 HG22 ILE 92 2HG2 ILE 92 -1.612 5.343 -0.945 706 HG23 ILE 92 3HG2 ILE 92 -2.918 5.531 0.226 707 HD11 ILE 92 1HD1 ILE 92 -0.780 8.253 -1.236 708 HD12 ILE 92 2HD1 ILE 92 -2.141 9.358 -1.455 709 HD13 ILE 92 3HD1 ILE 92 -0.935 9.184 -2.728 710 H LEU 93 H LEU 93 -6.184 6.229 -1.095 711 HA LEU 93 HA LEU 93 -6.227 4.280 0.963 712 HB2 LEU 93 2HB LEU 93 -8.413 6.070 -0.169 713 HB3 LEU 93 3HB LEU 93 -8.666 5.040 1.225 714 HG LEU 93 HG LEU 93 -6.679 7.341 1.094 715 HD11 LEU 93 1HD1 LEU 93 -9.363 7.200 2.516 716 HD12 LEU 93 2HD1 LEU 93 -8.999 8.143 1.069 717 HD13 LEU 93 3HD1 LEU 93 -8.209 8.537 2.592 718 HD21 LEU 93 1HD2 LEU 93 -5.907 5.576 2.604 719 HD22 LEU 93 2HD2 LEU 93 -7.454 5.590 3.455 720 HD23 LEU 93 3HD2 LEU 93 -6.397 7.004 3.512 721 H ALA 94 H ALA 94 -7.795 4.476 -2.210 722 HA ALA 94 HA ALA 94 -9.476 2.183 -1.947 723 HB1 ALA 94 1HB ALA 94 -9.960 3.987 -3.540 724 HB2 ALA 94 2HB ALA 94 -9.838 2.435 -4.369 725 HB3 ALA 94 3HB ALA 94 -8.506 3.594 -4.458 726 H ALA 95 H ALA 95 -6.259 2.717 -3.381 727 HA ALA 95 HA ALA 95 -5.979 0.069 -4.462 728 HB1 ALA 95 1HB ALA 95 -3.675 0.719 -4.940 729 HB2 ALA 95 2HB ALA 95 -3.836 2.145 -3.908 730 HB3 ALA 95 3HB ALA 95 -4.784 2.014 -5.389 731 H ASN 96 H ASN 96 -5.149 1.595 -1.402 732 HA ASN 96 HA ASN 96 -3.600 -0.531 -0.258 733 HB2 ASN 96 2HB ASN 96 -3.688 1.892 0.546 734 HB3 ASN 96 3HB ASN 96 -5.291 1.578 1.187 735 HD21 ASN 96 1HD2 ASN 96 -2.965 2.484 2.617 736 HD22 ASN 96 2HD2 ASN 96 -2.617 1.303 3.827 737 H TYR 97 H TYR 97 -7.025 0.356 -0.213 738 HA TYR 97 HA TYR 97 -7.961 -1.651 1.589 739 HB2 TYR 97 2HB TYR 97 -9.169 0.430 1.339 740 HB3 TYR 97 3HB TYR 97 -9.359 0.192 -0.389 741 HD1 TYR 97 HD1 TYR 97 -11.399 -0.706 -1.190 742 HD2 TYR 97 HD2 TYR 97 -10.347 -1.341 2.907 743 HE1 TYR 97 HE1 TYR 97 -13.612 -1.672 -0.764 744 HE2 TYR 97 HE2 TYR 97 -12.563 -2.314 3.323 745 HH TYR 97 HH TYR 97 -14.627 -3.343 1.060 746 H LEU 98 H LEU 98 -7.722 -1.460 -1.928 747 HA LEU 98 HA LEU 98 -9.027 -4.061 -2.340 748 HB2 LEU 98 2HB LEU 98 -7.912 -2.043 -4.328 749 HB3 LEU 98 3HB LEU 98 -8.729 -3.534 -4.773 750 HG LEU 98 HG LEU 98 -10.004 -1.208 -3.283 751 HD11 LEU 98 1HD1 LEU 98 -11.249 -0.782 -5.338 752 HD12 LEU 98 2HD1 LEU 98 -10.376 -2.073 -6.166 753 HD13 LEU 98 3HD1 LEU 98 -9.515 -0.637 -5.606 754 HD21 LEU 98 1HD2 LEU 98 -11.016 -3.326 -2.610 755 HD22 LEU 98 2HD2 LEU 98 -11.273 -3.774 -4.296 756 HD23 LEU 98 3HD2 LEU 98 -12.138 -2.400 -3.604 757 H ASP 99 H ASP 99 -5.965 -2.862 -1.705 758 HA ASP 99 HA ASP 99 -3.933 -3.785 -1.491 759 HB2 ASP 99 2HB ASP 99 -5.618 -5.827 -0.898 760 HB3 ASP 99 3HB ASP 99 -4.873 -6.529 -2.321 761 H ILE 100 H ILE 100 -5.004 -2.843 -4.142 762 HA ILE 100 HA ILE 100 -3.488 -4.325 -6.141 763 HB ILE 100 HB ILE 100 -4.947 -1.668 -6.525 764 HG12 ILE 100 2HG1 ILE 100 -5.942 -4.507 -6.998 765 HG13 ILE 100 3HG1 ILE 100 -6.533 -3.402 -5.770 766 HG21 ILE 100 1HG2 ILE 100 -3.985 -3.719 -8.567 767 HG22 ILE 100 2HG2 ILE 100 -3.242 -2.148 -8.260 768 HG23 ILE 100 3HG2 ILE 100 -4.867 -2.235 -8.939 769 HD11 ILE 100 1HD1 ILE 100 -8.069 -3.606 -7.632 770 HD12 ILE 100 2HD1 ILE 100 -6.831 -3.034 -8.749 771 HD13 ILE 100 3HD1 ILE 100 -7.454 -1.963 -7.493 772 H LYS 101 H LYS 101 -1.479 -4.145 -5.236 773 HA LYS 101 HA LYS 101 -0.088 -1.802 -4.563 774 HB2 LYS 101 2HB LYS 101 1.039 -4.478 -5.471 775 HB3 LYS 101 3HB LYS 101 1.914 -3.241 -4.569 776 HG2 LYS 101 2HG LYS 101 0.563 -3.573 -2.613 777 HG3 LYS 101 3HG LYS 101 -0.589 -4.579 -3.501 778 HD2 LYS 101 2HD LYS 101 1.201 -6.288 -3.829 779 HD3 LYS 101 3HD LYS 101 2.303 -5.294 -2.870 780 HE2 LYS 101 2HE LYS 101 0.824 -5.517 -0.921 781 HE3 LYS 101 3HE LYS 101 -0.308 -6.474 -1.882 782 HZ1 LYS 101 1HZ LYS 101 1.258 -8.222 -2.053 783 HZ2 LYS 101 2HZ LYS 101 1.253 -7.763 -0.428 784 HZ3 LYS 101 3HZ LYS 101 2.507 -7.273 -1.440 785 HA PRO 102 HA PRO 102 1.566 -2.033 -9.390 786 HB2 PRO 102 2HB PRO 102 -1.279 -2.639 -10.284 787 HB3 PRO 102 3HB PRO 102 0.253 -2.942 -11.138 788 HG2 PRO 102 2HG PRO 102 -0.945 -4.946 -9.909 789 HG3 PRO 102 3HG PRO 102 0.821 -4.759 -9.773 790 HD2 PRO 102 2HD PRO 102 -1.305 -4.163 -7.743 791 HD3 PRO 102 3HD PRO 102 0.348 -4.773 -7.501 792 H LEU 103 H LEU 103 -1.796 -1.063 -8.509 793 HA LEU 103 HA LEU 103 -1.645 1.457 -9.917 794 HB2 LEU 103 2HB LEU 103 -3.759 0.126 -9.663 795 HB3 LEU 103 3HB LEU 103 -3.757 0.459 -7.948 796 HG LEU 103 HG LEU 103 -5.347 1.828 -9.529 797 HD11 LEU 103 1HD1 LEU 103 -5.252 3.847 -8.153 798 HD12 LEU 103 2HD1 LEU 103 -3.697 3.338 -7.488 799 HD13 LEU 103 3HD1 LEU 103 -5.147 2.384 -7.175 800 HD21 LEU 103 1HD2 LEU 103 -3.664 2.430 -11.197 801 HD22 LEU 103 2HD2 LEU 103 -2.789 3.385 -9.997 802 HD23 LEU 103 3HD2 LEU 103 -4.413 3.856 -10.491 803 H LEU 104 H LEU 104 -1.491 0.375 -6.558 804 HA LEU 104 HA LEU 104 -1.527 2.784 -5.162 805 HB2 LEU 104 2HB LEU 104 -1.735 0.566 -4.105 806 HB3 LEU 104 3HB LEU 104 -0.074 0.191 -4.524 807 HG LEU 104 HG LEU 104 0.692 2.010 -2.964 808 HD11 LEU 104 1HD1 LEU 104 -2.218 2.188 -2.132 809 HD12 LEU 104 2HD1 LEU 104 -1.288 3.437 -2.965 810 HD13 LEU 104 3HD1 LEU 104 -0.849 2.964 -1.326 811 HD21 LEU 104 1HD2 LEU 104 0.643 -0.336 -2.250 812 HD22 LEU 104 2HD2 LEU 104 -1.016 -0.144 -1.675 813 HD23 LEU 104 3HD2 LEU 104 0.297 0.751 -0.907 814 H ASP 105 H ASP 105 1.181 1.003 -6.582 815 HA ASP 105 HA ASP 105 3.316 2.583 -5.618 816 HB2 ASP 105 2HB ASP 105 3.599 0.283 -6.547 817 HB3 ASP 105 3HB ASP 105 3.173 0.871 -8.151 818 H VAL 106 H VAL 106 1.521 2.626 -8.705 819 HA VAL 106 HA VAL 106 2.954 4.678 -9.984 820 HB VAL 106 HB VAL 106 0.040 3.865 -10.406 821 HG11 VAL 106 1HG1 VAL 106 1.860 5.434 -12.280 822 HG12 VAL 106 2HG1 VAL 106 0.468 6.077 -11.411 823 HG13 VAL 106 3HG1 VAL 106 0.235 4.858 -12.661 824 HG21 VAL 106 1HG2 VAL 106 1.645 2.001 -10.691 825 HG22 VAL 106 2HG2 VAL 106 2.534 2.947 -11.886 826 HG23 VAL 106 3HG2 VAL 106 0.875 2.437 -12.216 827 H THR 107 H THR 107 0.009 4.834 -7.970 828 HA THR 107 HA THR 107 -0.427 7.633 -8.239 829 HB THR 107 HB THR 107 -1.403 5.820 -5.980 830 HG1 THR 107 HG1 THR 107 -2.016 5.847 -8.656 831 HG21 THR 107 1HG2 THR 107 -1.795 8.253 -5.594 832 HG22 THR 107 2HG2 THR 107 -3.304 7.380 -5.854 833 HG23 THR 107 3HG2 THR 107 -2.620 8.354 -7.154 834 H CYS 108 H CYS 108 1.344 5.664 -5.859 835 HA CYS 108 HA CYS 108 1.956 7.743 -4.006 836 HB2 CYS 108 2HB CYS 108 3.313 5.069 -4.509 837 HB3 CYS 108 3HB CYS 108 3.710 6.135 -3.161 838 HG CYS 108 HG CYS 108 0.494 5.104 -3.561 839 H LYS 109 H LYS 109 3.481 6.585 -6.961 840 HA LYS 109 HA LYS 109 5.859 8.194 -6.716 841 HB2 LYS 109 2HB LYS 109 4.716 6.376 -8.820 842 HB3 LYS 109 3HB LYS 109 5.820 7.620 -9.386 843 HG2 LYS 109 2HG LYS 109 6.912 5.409 -8.935 844 HG3 LYS 109 3HG LYS 109 7.628 6.754 -8.043 845 HD2 LYS 109 2HD LYS 109 6.400 6.056 -6.009 846 HD3 LYS 109 3HD LYS 109 5.656 4.732 -6.904 847 HE2 LYS 109 2HE LYS 109 8.635 5.035 -6.410 848 HE3 LYS 109 3HE LYS 109 7.556 3.990 -5.489 849 HZ1 LYS 109 1HZ LYS 109 8.729 2.747 -7.168 850 HZ2 LYS 109 2HZ LYS 109 8.143 3.758 -8.385 851 HZ3 LYS 109 3HZ LYS 109 7.076 2.773 -7.527 852 H THR 110 H THR 110 2.666 8.615 -8.215 853 HA THR 110 HA THR 110 3.232 10.944 -9.733 854 HB THR 110 HB THR 110 0.572 10.004 -8.557 855 HG1 THR 110 HG1 THR 110 1.979 8.778 -10.277 856 HG21 THR 110 1HG2 THR 110 1.086 11.987 -10.815 857 HG22 THR 110 2HG2 THR 110 0.429 12.385 -9.225 858 HG23 THR 110 3HG2 THR 110 -0.494 11.368 -10.331 859 H VAL 111 H VAL 111 1.867 10.523 -6.453 860 HA VAL 111 HA VAL 111 1.638 13.291 -5.847 861 HB VAL 111 HB VAL 111 1.278 12.621 -3.499 862 HG11 VAL 111 1HG1 VAL 111 -0.722 11.215 -3.818 863 HG12 VAL 111 2HG1 VAL 111 -0.177 10.790 -5.443 864 HG13 VAL 111 3HG1 VAL 111 -0.608 12.459 -5.064 865 HG21 VAL 111 1HG2 VAL 111 2.029 9.808 -4.378 866 HG22 VAL 111 2HG2 VAL 111 1.356 10.243 -2.803 867 HG23 VAL 111 3HG2 VAL 111 2.946 10.840 -3.279 868 H ALA 112 H ALA 112 4.237 10.940 -5.470 869 HA ALA 112 HA ALA 112 6.011 12.583 -3.939 870 HB1 ALA 112 1HB ALA 112 6.247 10.136 -3.994 871 HB2 ALA 112 2HB ALA 112 7.733 10.925 -4.525 872 HB3 ALA 112 3HB ALA 112 6.644 10.198 -5.712 873 H ASN 113 H ASN 113 5.323 12.230 -7.390 874 HA ASN 113 HA ASN 113 7.673 13.502 -8.391 875 HB2 ASN 113 2HB ASN 113 4.995 12.792 -9.616 876 HB3 ASN 113 3HB ASN 113 6.027 13.920 -10.483 877 HD21 ASN 113 1HD2 ASN 113 7.329 11.216 -8.588 878 HD22 ASN 113 2HD2 ASN 113 7.895 10.326 -9.952 879 H MET 114 H MET 114 4.545 14.698 -7.364 880 HA MET 114 HA MET 114 4.655 17.317 -8.409 881 HB2 MET 114 2HB MET 114 3.255 16.359 -5.883 882 HB3 MET 114 3HB MET 114 2.908 17.854 -6.738 883 HG2 MET 114 2HG MET 114 2.201 16.494 -8.710 884 HG3 MET 114 3HG MET 114 2.414 15.043 -7.728 885 HE1 MET 114 1HE MET 114 1.355 16.613 -4.837 886 HE2 MET 114 2HE MET 114 1.199 14.906 -5.243 887 HE3 MET 114 3HE MET 114 -0.232 15.843 -4.829 888 H ILE 115 H ILE 115 6.011 15.912 -5.477 889 HA ILE 115 HA ILE 115 6.745 18.548 -4.389 890 HB ILE 115 HB ILE 115 7.271 17.418 -2.308 891 HG12 ILE 115 2HG1 ILE 115 6.740 14.754 -3.721 892 HG13 ILE 115 3HG1 ILE 115 8.321 15.345 -3.227 893 HG21 ILE 115 1HG2 ILE 115 4.897 17.911 -2.724 894 HG22 ILE 115 2HG2 ILE 115 5.051 16.454 -1.745 895 HG23 ILE 115 3HG2 ILE 115 4.679 16.325 -3.469 896 HD11 ILE 115 1HD1 ILE 115 6.054 14.614 -1.377 897 HD12 ILE 115 2HD1 ILE 115 7.638 15.219 -0.886 898 HD13 ILE 115 3HD1 ILE 115 7.503 13.664 -1.702 899 H ARG 116 H ARG 116 8.213 15.612 -5.675 900 HA ARG 116 HA ARG 116 10.456 16.673 -6.814 901 HB2 ARG 116 2HB ARG 116 11.323 17.195 -4.575 902 HB3 ARG 116 3HB ARG 116 11.068 15.539 -4.047 903 HG2 ARG 116 2HG ARG 116 13.414 15.926 -4.485 904 HG3 ARG 116 3HG ARG 116 12.788 14.767 -5.646 905 HD2 ARG 116 2HD ARG 116 12.588 16.673 -7.303 906 HD3 ARG 116 3HD ARG 116 13.426 17.698 -6.131 907 HE ARG 116 HE ARG 116 14.877 15.297 -6.675 908 HH11 ARG 116 1HH1 ARG 116 14.235 18.491 -8.027 909 HH12 ARG 116 2HH1 ARG 116 15.709 18.525 -8.932 910 HH21 ARG 116 1HH2 ARG 116 16.775 15.342 -7.907 911 HH22 ARG 116 2HH2 ARG 116 17.148 16.735 -8.863 912 H GLY 117 H GLY 117 9.543 15.145 -8.295 913 HA2 GLY 117 2HA GLY 117 10.038 12.292 -7.875 914 HA3 GLY 117 3HA GLY 117 9.434 13.056 -9.336 915 H1 SER 2 1H SER 2 15.671 -15.882 17.897 916 H2 SER 2 2H SER 2 14.741 -14.826 16.963 917 H3 SER 2 3H SER 2 15.553 -14.254 18.332 918 HA SER 2 HA SER 2 17.665 -14.655 17.339 919 HB2 SER 2 2HB SER 2 16.118 -15.572 14.878 920 HB3 SER 2 3HB SER 2 17.874 -15.535 15.066 921 HG SER 2 HG SER 2 16.354 -17.547 15.577 922 H LEU 3 H LEU 3 18.685 -13.039 16.023 923 HA LEU 3 HA LEU 3 16.891 -10.782 15.283 924 HB2 LEU 3 2HB LEU 3 19.778 -10.748 16.257 925 HB3 LEU 3 3HB LEU 3 18.869 -9.328 15.768 926 HG LEU 3 HG LEU 3 18.074 -11.104 18.112 927 HD11 LEU 3 1HD1 LEU 3 18.960 -9.345 19.570 928 HD12 LEU 3 2HD1 LEU 3 19.599 -8.488 18.160 929 HD13 LEU 3 3HD1 LEU 3 20.223 -10.084 18.588 930 HD21 LEU 3 1HD2 LEU 3 16.630 -9.214 18.749 931 HD22 LEU 3 2HD2 LEU 3 16.201 -9.858 17.168 932 HD23 LEU 3 3HD2 LEU 3 17.110 -8.349 17.283 933 H VAL 4 H VAL 4 16.725 -10.547 13.133 934 HA VAL 4 HA VAL 4 18.963 -11.196 11.332 935 HB VAL 4 HB VAL 4 17.394 -10.702 9.465 936 HG11 VAL 4 1HG1 VAL 4 17.547 -13.000 10.320 937 HG12 VAL 4 2HG1 VAL 4 15.917 -12.660 9.744 938 HG13 VAL 4 3HG1 VAL 4 16.253 -12.679 11.477 939 HG21 VAL 4 1HG2 VAL 4 14.976 -10.315 9.894 940 HG22 VAL 4 2HG2 VAL 4 15.972 -8.998 10.510 941 HG23 VAL 4 3HG2 VAL 4 15.308 -10.192 11.625 942 H LYS 5 H LYS 5 20.092 -9.650 10.228 943 HA LYS 5 HA LYS 5 19.967 -6.909 11.280 944 HB2 LYS 5 2HB LYS 5 22.132 -8.270 9.621 945 HB3 LYS 5 3HB LYS 5 22.271 -6.716 10.434 946 HG2 LYS 5 2HG LYS 5 22.095 -7.836 12.621 947 HG3 LYS 5 3HG LYS 5 21.898 -9.394 11.827 948 HD2 LYS 5 2HD LYS 5 24.172 -9.225 10.895 949 HD3 LYS 5 3HD LYS 5 24.372 -7.628 11.625 950 HE2 LYS 5 2HE LYS 5 24.184 -8.611 13.867 951 HE3 LYS 5 3HE LYS 5 23.926 -10.211 13.163 952 HZ1 LYS 5 1HZ LYS 5 26.144 -10.101 12.206 953 HZ2 LYS 5 2HZ LYS 5 26.209 -9.906 13.883 954 HZ3 LYS 5 3HZ LYS 5 26.379 -8.565 12.868 955 H LEU 6 H LEU 6 19.092 -5.332 10.038 956 HA LEU 6 HA LEU 6 18.742 -5.791 7.126 957 HB2 LEU 6 2HB LEU 6 16.829 -4.339 8.999 958 HB3 LEU 6 3HB LEU 6 16.606 -4.570 7.270 959 HG LEU 6 HG LEU 6 16.565 -6.748 9.393 960 HD11 LEU 6 1HD1 LEU 6 14.572 -5.362 9.423 961 HD12 LEU 6 2HD1 LEU 6 14.197 -6.972 8.817 962 HD13 LEU 6 3HD1 LEU 6 14.333 -5.616 7.693 963 HD21 LEU 6 1HD2 LEU 6 17.540 -7.628 7.324 964 HD22 LEU 6 2HD2 LEU 6 16.158 -7.037 6.399 965 HD23 LEU 6 3HD2 LEU 6 15.938 -8.306 7.606 966 H GLU 7 H GLU 7 20.436 -4.544 6.378 967 HA GLU 7 HA GLU 7 20.884 -1.862 7.306 968 HB2 GLU 7 2HB GLU 7 21.939 -3.322 4.856 969 HB3 GLU 7 3HB GLU 7 22.340 -1.645 5.223 970 HG2 GLU 7 2HG GLU 7 24.157 -2.966 5.997 971 HG3 GLU 7 3HG GLU 7 23.277 -2.428 7.425 972 H SER 8 H SER 8 20.258 0.026 6.407 973 HA SER 8 HA SER 8 18.015 0.085 4.559 974 HB2 SER 8 2HB SER 8 18.228 2.587 4.980 975 HB3 SER 8 3HB SER 8 18.004 1.621 6.439 976 HG SER 8 HG SER 8 19.937 2.147 7.101 977 H SER 9 H SER 9 18.269 1.991 2.839 978 HA SER 9 HA SER 9 20.257 1.485 0.904 979 HB2 SER 9 2HB SER 9 18.049 2.579 0.456 980 HB3 SER 9 3HB SER 9 18.596 4.024 1.301 981 HG SER 9 HG SER 9 19.793 4.557 -0.376 982 H ASP 10 H ASP 10 20.145 3.557 3.701 983 HA ASP 10 HA ASP 10 22.588 5.036 3.159 984 HB2 ASP 10 2HB ASP 10 20.621 6.040 4.341 985 HB3 ASP 10 3HB ASP 10 20.827 4.884 5.648 986 H GLU 11 H GLU 11 22.038 1.912 4.024 987 HA GLU 11 HA GLU 11 23.395 0.193 4.544 988 HB2 GLU 11 2HB GLU 11 25.617 2.269 4.644 989 HB3 GLU 11 3HB GLU 11 25.860 0.526 4.601 990 HG2 GLU 11 2HG GLU 11 24.897 0.397 2.365 991 HG3 GLU 11 3HG GLU 11 24.492 2.113 2.404 992 H LYS 12 H LYS 12 22.276 2.139 6.724 993 HA LYS 12 HA LYS 12 23.871 1.529 9.061 994 HB2 LYS 12 2HB LYS 12 21.069 2.681 8.746 995 HB3 LYS 12 3HB LYS 12 21.824 2.422 10.316 996 HG2 LYS 12 2HG LYS 12 22.840 4.274 8.139 997 HG3 LYS 12 3HG LYS 12 21.994 4.761 9.611 998 HD2 LYS 12 2HD LYS 12 23.875 3.778 10.957 999 HD3 LYS 12 3HD LYS 12 24.726 3.430 9.449 1000 HE2 LYS 12 2HE LYS 12 23.963 6.177 10.496 1001 HE3 LYS 12 3HE LYS 12 25.584 5.487 10.433 1002 HZ1 LYS 12 1HZ LYS 12 23.874 6.157 8.098 1003 HZ2 LYS 12 2HZ LYS 12 25.392 5.430 8.001 1004 HZ3 LYS 12 3HZ LYS 12 25.245 6.999 8.610 1005 H VAL 13 H VAL 13 23.782 -0.289 10.244 1006 HA VAL 13 HA VAL 13 22.124 -2.523 9.517 1007 HB VAL 13 HB VAL 13 23.948 -2.214 11.957 1008 HG11 VAL 13 1HG1 VAL 13 22.380 -4.099 12.172 1009 HG12 VAL 13 2HG1 VAL 13 24.036 -4.675 11.995 1010 HG13 VAL 13 3HG1 VAL 13 22.925 -4.752 10.625 1011 HG21 VAL 13 1HG2 VAL 13 25.727 -3.295 10.643 1012 HG22 VAL 13 2HG2 VAL 13 25.212 -1.788 9.882 1013 HG23 VAL 13 3HG2 VAL 13 24.676 -3.334 9.222 1014 H PHE 14 H PHE 14 20.061 -2.768 10.208 1015 HA PHE 14 HA PHE 14 19.253 -1.824 12.907 1016 HB2 PHE 14 2HB PHE 14 17.587 -2.165 10.371 1017 HB3 PHE 14 3HB PHE 14 16.892 -1.858 11.961 1018 HD1 PHE 14 HD1 PHE 14 18.710 -0.370 9.131 1019 HD2 PHE 14 HD2 PHE 14 17.224 0.324 13.076 1020 HE1 PHE 14 HE1 PHE 14 19.002 2.053 8.817 1021 HE2 PHE 14 HE2 PHE 14 17.522 2.740 12.753 1022 HZ PHE 14 HZ PHE 14 18.407 3.609 10.628 1023 H GLU 15 H GLU 15 19.946 -3.639 13.951 1024 HA GLU 15 HA GLU 15 19.185 -6.312 13.291 1025 HB2 GLU 15 2HB GLU 15 20.156 -5.152 15.937 1026 HB3 GLU 15 3HB GLU 15 20.036 -6.872 15.560 1027 HG2 GLU 15 2HG GLU 15 21.693 -6.523 13.720 1028 HG3 GLU 15 3HG GLU 15 21.852 -4.851 14.224 1029 H ILE 16 H ILE 16 17.127 -6.729 13.189 1030 HA ILE 16 HA ILE 16 15.271 -6.062 15.402 1031 HB ILE 16 HB ILE 16 14.758 -4.841 13.272 1032 HG12 ILE 16 2HG1 ILE 16 12.667 -6.962 13.941 1033 HG13 ILE 16 3HG1 ILE 16 12.886 -5.440 14.794 1034 HG21 ILE 16 1HG2 ILE 16 14.003 -6.057 11.272 1035 HG22 ILE 16 2HG2 ILE 16 14.365 -7.594 12.059 1036 HG23 ILE 16 3HG2 ILE 16 15.672 -6.470 11.679 1037 HD11 ILE 16 1HD1 ILE 16 12.031 -5.746 11.916 1038 HD12 ILE 16 2HD1 ILE 16 12.283 -4.214 12.757 1039 HD13 ILE 16 3HD1 ILE 16 11.009 -5.309 13.284 1040 H GLU 17 H GLU 17 13.911 -7.692 16.058 1041 HA GLU 17 HA GLU 17 14.864 -10.353 15.873 1042 HB2 GLU 17 2HB GLU 17 13.612 -9.301 17.802 1043 HB3 GLU 17 3HB GLU 17 12.144 -9.378 16.832 1044 HG2 GLU 17 2HG GLU 17 12.505 -11.855 16.695 1045 HG3 GLU 17 3HG GLU 17 13.797 -11.686 17.861 1046 H LYS 18 H LYS 18 14.153 -12.066 14.626 1047 HA LYS 18 HA LYS 18 13.253 -11.535 12.024 1048 HB2 LYS 18 2HB LYS 18 14.698 -13.447 12.612 1049 HB3 LYS 18 3HB LYS 18 13.385 -14.190 13.520 1050 HG2 LYS 18 2HG LYS 18 12.079 -14.411 11.407 1051 HG3 LYS 18 3HG LYS 18 13.432 -13.702 10.520 1052 HD2 LYS 18 2HD LYS 18 13.442 -16.155 10.308 1053 HD3 LYS 18 3HD LYS 18 14.874 -15.602 11.179 1054 HE2 LYS 18 2HE LYS 18 13.801 -16.219 13.326 1055 HE3 LYS 18 3HE LYS 18 12.366 -16.761 12.453 1056 HZ1 LYS 18 1HZ LYS 18 15.076 -17.908 12.054 1057 HZ2 LYS 18 2HZ LYS 18 13.619 -18.497 11.433 1058 HZ3 LYS 18 3HZ LYS 18 13.917 -18.567 13.094 1059 H GLU 19 H GLU 19 11.531 -12.658 14.877 1060 HA GLU 19 HA GLU 19 9.023 -13.310 13.802 1061 HB2 GLU 19 2HB GLU 19 9.597 -13.944 16.038 1062 HB3 GLU 19 3HB GLU 19 9.920 -12.285 16.514 1063 HG2 GLU 19 2HG GLU 19 7.593 -11.749 16.596 1064 HG3 GLU 19 3HG GLU 19 7.142 -13.249 15.776 1065 H ILE 20 H ILE 20 10.378 -10.171 14.721 1066 HA ILE 20 HA ILE 20 7.946 -8.668 14.181 1067 HB ILE 20 HB ILE 20 10.738 -7.475 14.448 1068 HG12 ILE 20 2HG1 ILE 20 8.883 -8.224 16.754 1069 HG13 ILE 20 3HG1 ILE 20 10.423 -8.989 16.382 1070 HG21 ILE 20 1HG2 ILE 20 8.943 -5.956 13.708 1071 HG22 ILE 20 2HG2 ILE 20 9.547 -5.502 15.298 1072 HG23 ILE 20 3HG2 ILE 20 8.003 -6.346 15.153 1073 HD11 ILE 20 1HD1 ILE 20 10.637 -7.472 18.239 1074 HD12 ILE 20 2HD1 ILE 20 10.036 -6.131 17.267 1075 HD13 ILE 20 3HD1 ILE 20 11.583 -6.888 16.871 1076 H ALA 21 H ALA 21 10.895 -9.572 12.486 1077 HA ALA 21 HA ALA 21 10.589 -7.856 10.206 1078 HB1 ALA 21 1HB ALA 21 12.779 -8.757 10.877 1079 HB2 ALA 21 2HB ALA 21 12.391 -9.211 9.217 1080 HB3 ALA 21 3HB ALA 21 12.232 -10.394 10.519 1081 H CYS 22 H CYS 22 9.209 -10.881 11.155 1082 HA CYS 22 HA CYS 22 8.309 -11.774 8.595 1083 HB2 CYS 22 2HB CYS 22 7.379 -12.470 11.401 1084 HB3 CYS 22 3HB CYS 22 6.785 -13.261 9.943 1085 HG CYS 22 HG CYS 22 10.119 -13.267 10.137 1086 H MET 23 H MET 23 7.137 -9.398 10.877 1087 HA MET 23 HA MET 23 4.454 -9.108 9.989 1088 HB2 MET 23 2HB MET 23 6.357 -6.998 11.110 1089 HB3 MET 23 3HB MET 23 4.621 -6.791 10.936 1090 HG2 MET 23 2HG MET 23 4.204 -8.529 12.588 1091 HG3 MET 23 3HG MET 23 5.930 -8.873 12.703 1092 HE1 MET 23 1HE MET 23 4.302 -5.246 12.410 1093 HE2 MET 23 2HE MET 23 4.055 -4.874 14.117 1094 HE3 MET 23 3HE MET 23 3.123 -6.159 13.352 1095 H SER 24 H SER 24 7.511 -7.911 8.783 1096 HA SER 24 HA SER 24 6.405 -6.455 6.526 1097 HB2 SER 24 2HB SER 24 8.580 -5.788 7.570 1098 HB3 SER 24 3HB SER 24 9.267 -7.355 7.138 1099 HG SER 24 HG SER 24 8.328 -5.348 5.360 1100 H VAL 25 H VAL 25 5.480 -7.636 4.861 1101 HA VAL 25 HA VAL 25 5.803 -10.445 4.608 1102 HB VAL 25 HB VAL 25 4.686 -8.570 2.476 1103 HG11 VAL 25 1HG1 VAL 25 3.412 -10.548 1.686 1104 HG12 VAL 25 2HG1 VAL 25 4.239 -11.552 2.880 1105 HG13 VAL 25 3HG1 VAL 25 5.156 -10.798 1.574 1106 HG21 VAL 25 1HG2 VAL 25 3.175 -9.943 4.726 1107 HG22 VAL 25 2HG2 VAL 25 2.453 -8.984 3.433 1108 HG23 VAL 25 3HG2 VAL 25 3.514 -8.215 4.614 1109 H THR 26 H THR 26 7.258 -7.709 2.837 1110 HA THR 26 HA THR 26 8.612 -9.126 0.817 1111 HB THR 26 HB THR 26 9.356 -6.481 2.147 1112 HG1 THR 26 HG1 THR 26 8.193 -5.579 0.481 1113 HG21 THR 26 1HG2 THR 26 10.355 -7.592 -0.513 1114 HG22 THR 26 2HG2 THR 26 11.334 -7.367 0.940 1115 HG23 THR 26 3HG2 THR 26 10.661 -5.968 0.104 1116 H ILE 27 H ILE 27 9.810 -8.054 4.025 1117 HA ILE 27 HA ILE 27 12.436 -9.149 3.730 1118 HB ILE 27 HB ILE 27 10.936 -8.242 6.229 1119 HG12 ILE 27 2HG1 ILE 27 13.028 -6.739 4.575 1120 HG13 ILE 27 3HG1 ILE 27 11.292 -6.503 4.418 1121 HG21 ILE 27 1HG2 ILE 27 13.917 -8.770 5.919 1122 HG22 ILE 27 2HG2 ILE 27 12.787 -9.745 6.860 1123 HG23 ILE 27 3HG2 ILE 27 13.133 -8.087 7.346 1124 HD11 ILE 27 1HD1 ILE 27 12.286 -4.750 5.740 1125 HD12 ILE 27 2HD1 ILE 27 12.931 -5.930 6.875 1126 HD13 ILE 27 3HD1 ILE 27 11.189 -5.712 6.725 1127 H LYS 28 H LYS 28 9.435 -10.302 5.205 1128 HA LYS 28 HA LYS 28 10.242 -12.716 6.363 1129 HB2 LYS 28 2HB LYS 28 7.995 -11.706 6.643 1130 HB3 LYS 28 3HB LYS 28 7.622 -12.028 4.955 1131 HG2 LYS 28 2HG LYS 28 7.720 -14.457 5.400 1132 HG3 LYS 28 3HG LYS 28 8.103 -14.129 7.095 1133 HD2 LYS 28 2HD LYS 28 5.923 -12.978 7.372 1134 HD3 LYS 28 3HD LYS 28 5.546 -13.269 5.674 1135 HE2 LYS 28 2HE LYS 28 5.968 -15.439 7.754 1136 HE3 LYS 28 3HE LYS 28 4.402 -14.850 7.197 1137 HZ1 LYS 28 1HZ LYS 28 4.943 -15.598 4.969 1138 HZ2 LYS 28 2HZ LYS 28 5.047 -16.884 6.060 1139 HZ3 LYS 28 3HZ LYS 28 6.451 -16.154 5.484 1140 H ASN 29 H ASN 29 9.164 -11.998 3.044 1141 HA ASN 29 HA ASN 29 9.392 -14.593 1.939 1142 HB2 ASN 29 2HB ASN 29 9.454 -11.840 0.609 1143 HB3 ASN 29 3HB ASN 29 9.497 -13.341 -0.313 1144 HD21 ASN 29 1HD2 ASN 29 7.489 -11.200 -0.331 1145 HD22 ASN 29 2HD2 ASN 29 5.989 -11.956 0.065 1146 H MET 30 H MET 30 11.736 -11.959 2.319 1147 HA MET 30 HA MET 30 13.797 -12.981 0.658 1148 HB2 MET 30 2HB MET 30 14.014 -11.180 3.117 1149 HB3 MET 30 3HB MET 30 15.343 -11.519 2.014 1150 HG2 MET 30 2HG MET 30 12.781 -10.073 1.327 1151 HG3 MET 30 3HG MET 30 14.380 -9.353 1.522 1152 HE1 MET 30 1HE MET 30 14.071 -8.162 -0.870 1153 HE2 MET 30 2HE MET 30 12.490 -8.922 -1.070 1154 HE3 MET 30 3HE MET 30 13.698 -9.043 -2.350 1155 H ILE 31 H ILE 31 13.156 -13.327 4.133 1156 HA ILE 31 HA ILE 31 15.441 -14.871 4.800 1157 HB ILE 31 HB ILE 31 12.766 -14.648 6.269 1158 HG12 ILE 31 2HG1 ILE 31 15.377 -13.148 6.792 1159 HG13 ILE 31 3HG1 ILE 31 14.025 -12.479 5.893 1160 HG21 ILE 31 1HG2 ILE 31 13.986 -15.408 8.297 1161 HG22 ILE 31 2HG2 ILE 31 15.434 -15.670 7.326 1162 HG23 ILE 31 3HG2 ILE 31 13.997 -16.649 7.037 1163 HD11 ILE 31 1HD1 ILE 31 14.011 -13.267 8.800 1164 HD12 ILE 31 2HD1 ILE 31 12.623 -12.650 7.900 1165 HD13 ILE 31 3HD1 ILE 31 14.042 -11.632 8.138 1166 H GLU 32 H GLU 32 12.090 -15.752 3.967 1167 HA GLU 32 HA GLU 32 12.376 -18.578 4.352 1168 HB2 GLU 32 2HB GLU 32 10.259 -17.016 2.808 1169 HB3 GLU 32 3HB GLU 32 10.163 -18.734 3.196 1170 HG2 GLU 32 2HG GLU 32 10.142 -18.219 5.598 1171 HG3 GLU 32 3HG GLU 32 10.285 -16.498 5.244 1172 H ASP 33 H ASP 33 12.871 -16.436 1.616 1173 HA ASP 33 HA ASP 33 12.947 -18.395 -0.463 1174 HB2 ASP 33 2HB ASP 33 12.622 -15.994 -0.928 1175 HB3 ASP 33 3HB ASP 33 14.225 -15.622 -0.306 1176 H ILE 34 H ILE 34 15.468 -16.811 1.465 1177 HA ILE 34 HA ILE 34 17.669 -18.411 0.533 1178 HB ILE 34 HB ILE 34 17.413 -16.708 3.066 1179 HG12 ILE 34 2HG1 ILE 34 18.568 -15.921 0.346 1180 HG13 ILE 34 3HG1 ILE 34 16.996 -15.423 0.953 1181 HG21 ILE 34 1HG2 ILE 34 19.312 -18.279 3.212 1182 HG22 ILE 34 2HG2 ILE 34 19.882 -16.616 3.075 1183 HG23 ILE 34 3HG2 ILE 34 19.938 -17.685 1.670 1184 HD11 ILE 34 1HD1 ILE 34 18.583 -13.647 1.192 1185 HD12 ILE 34 2HD1 ILE 34 19.671 -14.677 2.120 1186 HD13 ILE 34 3HD1 ILE 34 18.100 -14.219 2.787 1187 H GLY 35 H GLY 35 15.115 -18.835 2.801 1188 HA2 GLY 35 2HA GLY 35 14.491 -20.699 4.026 1189 HA3 GLY 35 3HA GLY 35 16.058 -21.443 3.704 1190 H GLU 36 H GLU 36 17.921 -20.467 4.772 1191 HA GLU 36 HA GLU 36 17.328 -19.282 7.427 1192 HB2 GLU 36 2HB GLU 36 19.684 -21.039 6.576 1193 HB3 GLU 36 3HB GLU 36 19.421 -20.384 8.190 1194 HG2 GLU 36 2HG GLU 36 17.517 -21.786 8.561 1195 HG3 GLU 36 3HG GLU 36 17.435 -22.241 6.862 1196 H SER 37 H SER 37 17.512 -17.126 6.886 1197 HA SER 37 HA SER 37 19.605 -16.132 5.158 1198 HB2 SER 37 2HB SER 37 17.324 -15.126 5.165 1199 HB3 SER 37 3HB SER 37 17.579 -14.585 6.823 1200 HG SER 37 HG SER 37 19.276 -13.273 6.069 1201 H ASP 38 H ASP 38 21.396 -16.951 6.404 1202 HA ASP 38 HA ASP 38 22.156 -15.832 8.940 1203 HB2 ASP 38 2HB ASP 38 23.785 -17.224 6.754 1204 HB3 ASP 38 3HB ASP 38 24.477 -16.709 8.289 1205 H SER 39 H SER 39 22.538 -15.004 5.579 1206 HA SER 39 HA SER 39 24.383 -12.826 5.911 1207 HB2 SER 39 2HB SER 39 22.483 -13.473 3.603 1208 HB3 SER 39 3HB SER 39 23.828 -12.332 3.544 1209 HG SER 39 HG SER 39 24.590 -14.206 2.699 1210 HA PRO 40 HA PRO 40 21.217 -9.833 7.210 1211 HB2 PRO 40 2HB PRO 40 22.603 -7.514 6.729 1212 HB3 PRO 40 3HB PRO 40 22.970 -8.577 8.101 1213 HG2 PRO 40 2HG PRO 40 24.356 -8.408 5.445 1214 HG3 PRO 40 3HG PRO 40 25.062 -8.479 7.078 1215 HD2 PRO 40 2HD PRO 40 24.891 -10.682 5.514 1216 HD3 PRO 40 3HD PRO 40 24.713 -10.776 7.282 1217 H ILE 41 H ILE 41 19.589 -8.658 6.163 1218 HA ILE 41 HA ILE 41 19.625 -8.700 3.216 1219 HB ILE 41 HB ILE 41 17.279 -8.332 5.131 1220 HG12 ILE 41 2HG1 ILE 41 18.181 -10.627 5.256 1221 HG13 ILE 41 3HG1 ILE 41 16.600 -10.634 4.487 1222 HG21 ILE 41 1HG2 ILE 41 15.820 -8.651 3.159 1223 HG22 ILE 41 2HG2 ILE 41 17.243 -8.667 2.118 1224 HG23 ILE 41 3HG2 ILE 41 16.823 -7.205 3.012 1225 HD11 ILE 41 1HD1 ILE 41 17.681 -10.856 2.290 1226 HD12 ILE 41 2HD1 ILE 41 18.113 -12.163 3.391 1227 HD13 ILE 41 3HD1 ILE 41 19.262 -10.864 3.081 1228 HA PRO 42 HA PRO 42 19.983 -4.134 3.677 1229 HB2 PRO 42 2HB PRO 42 21.282 -3.621 1.352 1230 HB3 PRO 42 3HB PRO 42 22.136 -4.313 2.748 1231 HG2 PRO 42 2HG PRO 42 21.122 -5.697 0.294 1232 HG3 PRO 42 3HG PRO 42 22.658 -5.923 1.159 1233 HD2 PRO 42 2HD PRO 42 20.443 -7.570 1.474 1234 HD3 PRO 42 3HD PRO 42 21.727 -7.380 2.687 1235 H LEU 43 H LEU 43 18.659 -2.574 2.843 1236 HA LEU 43 HA LEU 43 16.780 -3.259 0.653 1237 HB2 LEU 43 2HB LEU 43 16.275 -1.597 3.169 1238 HB3 LEU 43 3HB LEU 43 15.166 -1.700 1.826 1239 HG LEU 43 HG LEU 43 14.248 -3.127 3.472 1240 HD11 LEU 43 1HD1 LEU 43 14.261 -5.359 2.525 1241 HD12 LEU 43 2HD1 LEU 43 15.716 -4.989 1.598 1242 HD13 LEU 43 3HD1 LEU 43 14.211 -4.136 1.254 1243 HD21 LEU 43 1HD2 LEU 43 16.158 -3.273 4.988 1244 HD22 LEU 43 2HD2 LEU 43 16.955 -4.422 3.912 1245 HD23 LEU 43 3HD2 LEU 43 15.446 -4.863 4.714 1246 HA PRO 44 HA PRO 44 19.294 0.431 -0.670 1247 HB2 PRO 44 2HB PRO 44 19.761 -0.284 -3.233 1248 HB3 PRO 44 3HB PRO 44 20.584 -1.117 -1.896 1249 HG2 PRO 44 2HG PRO 44 18.189 -2.011 -3.467 1250 HG3 PRO 44 3HG PRO 44 19.620 -2.944 -2.976 1251 HD2 PRO 44 2HD PRO 44 17.215 -2.993 -1.607 1252 HD3 PRO 44 3HD PRO 44 18.788 -3.358 -0.862 1253 H ASN 45 H ASN 45 16.930 1.171 -0.185 1254 HA ASN 45 HA ASN 45 15.953 2.733 -2.404 1255 HB2 ASN 45 2HB ASN 45 14.697 0.690 -2.878 1256 HB3 ASN 45 3HB ASN 45 14.233 0.516 -1.193 1257 HD21 ASN 45 1HD2 ASN 45 13.653 2.283 -4.159 1258 HD22 ASN 45 2HD2 ASN 45 12.139 2.970 -3.687 1259 H VAL 46 H VAL 46 14.939 1.468 0.778 1260 HA VAL 46 HA VAL 46 13.845 4.031 1.599 1261 HB VAL 46 HB VAL 46 12.592 2.015 2.142 1262 HG11 VAL 46 1HG1 VAL 46 13.372 0.287 3.702 1263 HG12 VAL 46 2HG1 VAL 46 14.946 1.080 3.812 1264 HG13 VAL 46 3HG1 VAL 46 14.416 0.383 2.279 1265 HG21 VAL 46 1HG2 VAL 46 12.352 3.893 3.682 1266 HG22 VAL 46 2HG2 VAL 46 13.703 3.311 4.656 1267 HG23 VAL 46 3HG2 VAL 46 12.211 2.372 4.564 1268 H THR 47 H THR 47 14.809 5.494 2.934 1269 HA THR 47 HA THR 47 17.637 5.339 3.471 1270 HB THR 47 HB THR 47 17.304 7.628 4.450 1271 HG1 THR 47 HG1 THR 47 14.774 8.082 3.735 1272 HG21 THR 47 1HG2 THR 47 15.879 7.232 1.785 1273 HG22 THR 47 2HG2 THR 47 17.624 7.392 1.998 1274 HG23 THR 47 3HG2 THR 47 16.562 8.746 2.383 1275 H SER 48 H SER 48 18.437 6.091 5.767 1276 HA SER 48 HA SER 48 17.959 3.889 7.469 1277 HB2 SER 48 2HB SER 48 19.490 5.122 9.077 1278 HB3 SER 48 3HB SER 48 20.136 4.903 7.456 1279 HG SER 48 HG SER 48 20.501 7.007 8.001 1280 H THR 49 H THR 49 16.983 7.297 7.802 1281 HA THR 49 HA THR 49 15.867 7.115 10.401 1282 HB THR 49 HB THR 49 14.739 9.314 9.762 1283 HG1 THR 49 HG1 THR 49 15.044 10.096 7.714 1284 HG21 THR 49 1HG2 THR 49 17.719 9.097 9.153 1285 HG22 THR 49 2HG2 THR 49 17.008 9.325 10.752 1286 HG23 THR 49 3HG2 THR 49 16.858 10.590 9.532 1287 H ILE 50 H ILE 50 14.430 6.867 7.162 1288 HA ILE 50 HA ILE 50 11.717 6.704 8.051 1289 HB ILE 50 HB ILE 50 12.947 5.944 5.363 1290 HG12 ILE 50 2HG1 ILE 50 13.349 8.310 5.897 1291 HG13 ILE 50 3HG1 ILE 50 12.155 8.197 4.612 1292 HG21 ILE 50 1HG2 ILE 50 10.672 6.183 4.428 1293 HG22 ILE 50 2HG2 ILE 50 10.030 6.431 6.053 1294 HG23 ILE 50 3HG2 ILE 50 10.757 4.883 5.619 1295 HD11 ILE 50 1HD1 ILE 50 11.558 9.932 6.169 1296 HD12 ILE 50 2HD1 ILE 50 11.607 8.804 7.521 1297 HD13 ILE 50 3HD1 ILE 50 10.372 8.630 6.270 1298 H LEU 51 H LEU 51 14.140 4.296 7.044 1299 HA LEU 51 HA LEU 51 12.562 1.959 7.236 1300 HB2 LEU 51 2HB LEU 51 14.766 2.171 6.046 1301 HB3 LEU 51 3HB LEU 51 15.584 2.260 7.586 1302 HG LEU 51 HG LEU 51 15.705 0.037 6.299 1303 HD11 LEU 51 1HD1 LEU 51 15.671 -1.375 8.248 1304 HD12 LEU 51 2HD1 LEU 51 14.711 -0.192 9.140 1305 HD13 LEU 51 3HD1 LEU 51 16.356 0.197 8.650 1306 HD21 LEU 51 1HD2 LEU 51 13.355 -0.102 5.610 1307 HD22 LEU 51 2HD2 LEU 51 12.863 -0.325 7.290 1308 HD23 LEU 51 3HD2 LEU 51 13.863 -1.541 6.490 1309 H GLU 52 H GLU 52 14.526 3.750 9.582 1310 HA GLU 52 HA GLU 52 14.417 2.032 11.787 1311 HB2 GLU 52 2HB GLU 52 15.869 4.045 11.726 1312 HB3 GLU 52 3HB GLU 52 14.446 5.086 11.784 1313 HG2 GLU 52 2HG GLU 52 13.881 4.160 14.022 1314 HG3 GLU 52 3HG GLU 52 15.329 3.160 13.966 1315 H LYS 53 H LYS 53 12.281 4.725 10.850 1316 HA LYS 53 HA LYS 53 10.466 4.609 12.979 1317 HB2 LYS 53 2HB LYS 53 10.110 5.617 10.121 1318 HB3 LYS 53 3HB LYS 53 8.894 5.833 11.376 1319 HG2 LYS 53 2HG LYS 53 10.493 7.172 12.710 1320 HG3 LYS 53 3HG LYS 53 11.722 6.935 11.468 1321 HD2 LYS 53 2HD LYS 53 10.669 9.157 11.275 1322 HD3 LYS 53 3HD LYS 53 10.367 8.175 9.840 1323 HE2 LYS 53 2HE LYS 53 8.369 9.450 10.584 1324 HE3 LYS 53 3HE LYS 53 8.092 7.708 10.594 1325 HZ1 LYS 53 1HZ LYS 53 7.204 8.746 12.581 1326 HZ2 LYS 53 2HZ LYS 53 8.714 9.395 12.964 1327 HZ3 LYS 53 3HZ LYS 53 8.486 7.725 13.000 1328 H VAL 54 H VAL 54 10.215 3.117 9.729 1329 HA VAL 54 HA VAL 54 7.599 2.104 10.029 1330 HB VAL 54 HB VAL 54 9.822 1.171 8.149 1331 HG11 VAL 54 1HG1 VAL 54 8.037 0.208 6.740 1332 HG12 VAL 54 2HG1 VAL 54 6.829 0.652 7.950 1333 HG13 VAL 54 3HG1 VAL 54 8.061 -0.551 8.335 1334 HG21 VAL 54 1HG2 VAL 54 9.225 3.570 7.899 1335 HG22 VAL 54 2HG2 VAL 54 7.537 3.127 7.650 1336 HG23 VAL 54 3HG2 VAL 54 8.760 2.635 6.477 1337 H LEU 55 H LEU 55 10.785 0.580 10.617 1338 HA LEU 55 HA LEU 55 9.688 -1.939 11.478 1339 HB2 LEU 55 2HB LEU 55 12.485 -0.794 11.778 1340 HB3 LEU 55 3HB LEU 55 12.035 -2.413 12.291 1341 HG LEU 55 HG LEU 55 12.160 -1.352 9.444 1342 HD11 LEU 55 1HD1 LEU 55 13.827 -3.123 9.121 1343 HD12 LEU 55 2HD1 LEU 55 13.652 -3.620 10.807 1344 HD13 LEU 55 3HD1 LEU 55 14.307 -2.026 10.417 1345 HD21 LEU 55 1HD2 LEU 55 10.146 -2.720 9.577 1346 HD22 LEU 55 2HD2 LEU 55 11.041 -4.032 10.346 1347 HD23 LEU 55 3HD2 LEU 55 11.394 -3.578 8.675 1348 H ASP 56 H ASP 56 10.431 1.078 13.109 1349 HA ASP 56 HA ASP 56 10.602 0.010 15.780 1350 HB2 ASP 56 2HB ASP 56 11.685 2.166 15.111 1351 HB3 ASP 56 3HB ASP 56 10.097 2.894 14.920 1352 H TYR 57 H TYR 57 8.041 1.402 13.788 1353 HA TYR 57 HA TYR 57 5.923 1.387 15.654 1354 HB2 TYR 57 2HB TYR 57 5.749 2.442 13.402 1355 HB3 TYR 57 3HB TYR 57 5.825 0.857 12.643 1356 HD1 TYR 57 HD1 TYR 57 3.718 3.105 14.732 1357 HD2 TYR 57 HD2 TYR 57 3.828 -0.555 12.515 1358 HE1 TYR 57 HE1 TYR 57 1.268 2.917 14.897 1359 HE2 TYR 57 HE2 TYR 57 1.387 -0.733 12.682 1360 HH TYR 57 HH TYR 57 -0.595 1.775 13.601 1361 H CYS 58 H CYS 58 7.233 -1.095 13.490 1362 HA CYS 58 HA CYS 58 5.415 -3.170 14.046 1363 HB2 CYS 58 2HB CYS 58 8.295 -3.294 13.064 1364 HB3 CYS 58 3HB CYS 58 7.177 -4.658 13.048 1365 HG CYS 58 HG CYS 58 7.609 -2.314 10.812 1366 H ARG 59 H ARG 59 8.451 -2.195 15.636 1367 HA ARG 59 HA ARG 59 8.737 -4.309 17.498 1368 HB2 ARG 59 2HB ARG 59 9.479 -1.363 17.818 1369 HB3 ARG 59 3HB ARG 59 10.016 -2.647 18.894 1370 HG2 ARG 59 2HG ARG 59 11.333 -3.654 17.119 1371 HG3 ARG 59 3HG ARG 59 10.710 -2.489 15.947 1372 HD2 ARG 59 2HD ARG 59 11.769 -0.644 17.233 1373 HD3 ARG 59 3HD ARG 59 12.408 -1.824 18.385 1374 HE ARG 59 HE ARG 59 13.210 -2.463 15.737 1375 HH11 ARG 59 1HH1 ARG 59 13.912 -0.198 18.339 1376 HH12 ARG 59 2HH1 ARG 59 15.556 0.058 17.847 1377 HH21 ARG 59 1HH2 ARG 59 15.390 -2.192 15.141 1378 HH22 ARG 59 2HH2 ARG 59 16.397 -1.086 16.016 1379 H HIS 60 H HIS 60 7.042 -1.196 17.695 1380 HA HIS 60 HA HIS 60 6.063 -1.337 20.313 1381 HB2 HIS 60 2HB HIS 60 5.971 0.768 19.099 1382 HB3 HIS 60 3HB HIS 60 4.922 0.078 17.865 1383 HD1 HIS 60 HD1 HIS 60 2.449 0.393 18.231 1384 HD2 HIS 60 HD2 HIS 60 4.614 0.947 21.732 1385 HE1 HIS 60 HE1 HIS 60 0.775 1.091 19.957 1386 HE2 HIS 60 HE2 HIS 60 2.134 1.608 22.001 1387 H HIS 61 H HIS 61 4.590 -2.419 17.249 1388 HA HIS 61 HA HIS 61 2.134 -3.242 18.518 1389 HB2 HIS 61 2HB HIS 61 2.342 -2.348 16.131 1390 HB3 HIS 61 3HB HIS 61 3.018 -3.912 15.680 1391 HD1 HIS 61 HD1 HIS 61 1.357 -5.844 15.363 1392 HD2 HIS 61 HD2 HIS 61 -0.406 -2.427 16.937 1393 HE1 HIS 61 HE1 HIS 61 -1.107 -6.311 15.403 1394 HE2 HIS 61 HE2 HIS 61 -2.158 -4.163 16.183 1395 H HIS 62 H HIS 62 5.171 -4.719 17.850 1396 HA HIS 62 HA HIS 62 4.485 -7.476 17.987 1397 HB2 HIS 62 2HB HIS 62 6.663 -6.852 17.144 1398 HB3 HIS 62 3HB HIS 62 7.036 -5.924 18.588 1399 HD1 HIS 62 HD1 HIS 62 8.712 -7.081 20.010 1400 HD2 HIS 62 HD2 HIS 62 6.324 -9.769 17.998 1401 HE1 HIS 62 HE1 HIS 62 9.628 -9.349 20.555 1402 HE2 HIS 62 HE2 HIS 62 8.331 -10.920 19.115 1403 H GLN 63 H GLN 63 5.497 -5.094 20.414 1404 HA GLN 63 HA GLN 63 5.388 -7.060 22.575 1405 HB2 GLN 63 2HB GLN 63 6.207 -4.125 22.676 1406 HB3 GLN 63 3HB GLN 63 6.510 -5.353 23.905 1407 HG2 GLN 63 2HG GLN 63 7.951 -6.583 22.257 1408 HG3 GLN 63 3HG GLN 63 7.713 -5.261 21.117 1409 HE21 GLN 63 1HE2 GLN 63 9.290 -6.257 24.043 1410 HE22 GLN 63 2HE2 GLN 63 10.333 -4.892 24.206 1411 H HIS 64 H HIS 64 3.474 -4.579 21.218 1412 HA HIS 64 HA HIS 64 1.415 -4.878 23.308 1413 HB2 HIS 64 2HB HIS 64 2.202 -2.262 21.929 1414 HB3 HIS 64 3HB HIS 64 0.781 -2.467 22.948 1415 HD1 HIS 64 HD1 HIS 64 1.117 -2.423 25.462 1416 HD2 HIS 64 HD2 HIS 64 4.695 -2.214 23.352 1417 HE1 HIS 64 HE1 HIS 64 2.864 -1.830 27.156 1418 HE2 HIS 64 HE2 HIS 64 4.995 -1.572 25.844 1419 HA PRO 65 HA PRO 65 -0.286 -6.021 19.131 1420 HB2 PRO 65 2HB PRO 65 -2.036 -7.935 20.105 1421 HB3 PRO 65 3HB PRO 65 -0.347 -8.280 19.690 1422 HG2 PRO 65 2HG PRO 65 -1.555 -7.778 22.383 1423 HG3 PRO 65 3HG PRO 65 -0.320 -8.965 21.909 1424 HD2 PRO 65 2HD PRO 65 0.317 -6.631 23.160 1425 HD3 PRO 65 3HD PRO 65 1.406 -7.412 21.991 1426 H GLY 66 H GLY 66 -1.159 -3.957 19.016 1427 HA2 GLY 66 2HA GLY 66 -3.425 -3.083 20.581 1428 HA3 GLY 66 3HA GLY 66 -2.628 -2.206 19.288 1429 H GLY 67 H GLY 67 -5.044 -1.737 19.088 1430 HA2 GLY 67 2HA GLY 67 -6.417 -2.103 16.990 1431 HA3 GLY 67 3HA GLY 67 -6.505 -3.788 17.494 1432 H SER 68 H SER 68 -6.802 -3.459 20.241 1433 HA SER 68 HA SER 68 -9.518 -2.598 20.602 1434 HB2 SER 68 2HB SER 68 -7.429 -3.344 22.706 1435 HB3 SER 68 3HB SER 68 -9.173 -3.247 22.958 1436 HG SER 68 HG SER 68 -8.698 -4.862 20.886 1437 H GLY 69 H GLY 69 -9.503 -0.456 19.965 1438 HA2 GLY 69 2HA GLY 69 -9.233 1.659 21.662 1439 HA3 GLY 69 3HA GLY 69 -7.635 1.520 20.927 1440 H LEU 70 H LEU 70 -11.015 1.238 19.844 1441 HA LEU 70 HA LEU 70 -10.578 2.076 17.202 1442 HB2 LEU 70 2HB LEU 70 -13.086 2.287 17.075 1443 HB3 LEU 70 3HB LEU 70 -12.496 0.757 17.675 1444 HG LEU 70 HG LEU 70 -12.980 1.879 20.071 1445 HD11 LEU 70 1HD1 LEU 70 -15.019 3.314 18.341 1446 HD12 LEU 70 2HD1 LEU 70 -13.717 4.063 19.269 1447 HD13 LEU 70 3HD1 LEU 70 -15.020 3.227 20.105 1448 HD21 LEU 70 1HD2 LEU 70 -13.940 -0.232 19.318 1449 HD22 LEU 70 2HD2 LEU 70 -15.157 0.627 18.373 1450 HD23 LEU 70 3HD2 LEU 70 -15.155 0.751 20.133 1451 H ASP 71 H ASP 71 -10.054 3.960 16.446 1452 HA ASP 71 HA ASP 71 -9.787 6.145 16.033 1453 HB2 ASP 71 2HB ASP 71 -12.301 6.166 16.110 1454 HB3 ASP 71 3HB ASP 71 -12.220 6.606 17.811 1455 H ASP 72 H ASP 72 -9.012 4.842 18.875 1456 HA ASP 72 HA ASP 72 -8.164 7.333 20.231 1457 HB2 ASP 72 2HB ASP 72 -9.611 5.813 21.585 1458 HB3 ASP 72 3HB ASP 72 -8.453 4.505 21.351 1459 H ILE 73 H ILE 73 -6.343 7.709 19.001 1460 HA ILE 73 HA ILE 73 -4.207 5.719 18.789 1461 HB ILE 73 HB ILE 73 -4.287 8.597 17.759 1462 HG12 ILE 73 2HG1 ILE 73 -4.790 6.007 16.215 1463 HG13 ILE 73 3HG1 ILE 73 -6.026 7.173 16.673 1464 HG21 ILE 73 1HG2 ILE 73 -2.352 6.355 17.070 1465 HG22 ILE 73 2HG2 ILE 73 -1.982 7.764 18.063 1466 HG23 ILE 73 3HG2 ILE 73 -2.359 7.968 16.352 1467 HD11 ILE 73 1HD1 ILE 73 -3.745 7.659 14.755 1468 HD12 ILE 73 2HD1 ILE 73 -4.948 8.856 15.242 1469 HD13 ILE 73 3HD1 ILE 73 -5.445 7.422 14.349 1470 HA PRO 74 HA PRO 74 -2.477 7.509 22.665 1471 HB2 PRO 74 2HB PRO 74 -0.211 5.916 22.764 1472 HB3 PRO 74 3HB PRO 74 -1.809 5.368 23.303 1473 HG2 PRO 74 2HG PRO 74 -0.424 4.858 20.695 1474 HG3 PRO 74 3HG PRO 74 -1.345 3.730 21.714 1475 HD2 PRO 74 2HD PRO 74 -2.420 4.855 19.500 1476 HD3 PRO 74 3HD PRO 74 -3.404 4.501 20.940 1477 HA PRO 75 HA PRO 75 0.136 10.881 21.324 1478 HB2 PRO 75 2HB PRO 75 1.917 10.054 23.639 1479 HB3 PRO 75 3HB PRO 75 1.346 11.677 23.181 1480 HG2 PRO 75 2HG PRO 75 0.155 10.408 25.164 1481 HG3 PRO 75 3HG PRO 75 -0.824 11.294 23.972 1482 HD2 PRO 75 2HD PRO 75 -0.428 8.337 24.266 1483 HD3 PRO 75 3HD PRO 75 -1.866 9.236 23.734 1484 H TYR 76 H TYR 76 2.025 7.908 22.137 1485 HA TYR 76 HA TYR 76 4.369 8.566 20.717 1486 HB2 TYR 76 2HB TYR 76 4.587 6.712 22.198 1487 HB3 TYR 76 3HB TYR 76 3.186 5.885 21.529 1488 HD1 TYR 76 HD1 TYR 76 3.588 4.078 20.043 1489 HD2 TYR 76 HD2 TYR 76 6.623 7.061 20.470 1490 HE1 TYR 76 HE1 TYR 76 5.032 2.827 18.509 1491 HE2 TYR 76 HE2 TYR 76 8.071 5.794 18.932 1492 HH TYR 76 HH TYR 76 8.343 3.608 18.002 1493 H ASP 77 H ASP 77 1.643 6.493 19.669 1494 HA ASP 77 HA ASP 77 2.563 6.087 17.016 1495 HB2 ASP 77 2HB ASP 77 -0.223 5.761 18.215 1496 HB3 ASP 77 3HB ASP 77 0.223 5.209 16.608 1497 H ARG 78 H ARG 78 0.664 8.589 18.516 1498 HA ARG 78 HA ARG 78 -0.557 9.693 16.190 1499 HB2 ARG 78 2HB ARG 78 -1.357 10.056 18.539 1500 HB3 ARG 78 3HB ARG 78 0.072 11.033 18.860 1501 HG2 ARG 78 2HG ARG 78 -0.688 12.636 17.096 1502 HG3 ARG 78 3HG ARG 78 -2.154 11.674 16.894 1503 HD2 ARG 78 2HD ARG 78 -1.271 13.130 19.406 1504 HD3 ARG 78 3HD ARG 78 -2.602 13.592 18.341 1505 HE ARG 78 HE ARG 78 -3.585 11.329 19.011 1506 HH11 ARG 78 1HH1 ARG 78 -1.589 13.231 21.209 1507 HH12 ARG 78 2HH1 ARG 78 -2.339 12.581 22.630 1508 HH21 ARG 78 1HH2 ARG 78 -4.557 10.505 20.877 1509 HH22 ARG 78 2HH2 ARG 78 -4.024 11.033 22.438 1510 H ASP 79 H ASP 79 2.226 10.793 18.173 1511 HA ASP 79 HA ASP 79 3.099 12.826 16.366 1512 HB2 ASP 79 2HB ASP 79 4.437 11.470 18.740 1513 HB3 ASP 79 3HB ASP 79 5.231 12.748 17.826 1514 H PHE 80 H PHE 80 3.711 9.425 16.613 1515 HA PHE 80 HA PHE 80 6.052 9.139 15.080 1516 HB2 PHE 80 2HB PHE 80 5.160 7.239 16.351 1517 HB3 PHE 80 3HB PHE 80 3.654 7.273 15.443 1518 HD1 PHE 80 HD1 PHE 80 3.527 6.346 13.175 1519 HD2 PHE 80 HD2 PHE 80 7.203 6.310 15.358 1520 HE1 PHE 80 HE1 PHE 80 4.494 4.842 11.516 1521 HE2 PHE 80 HE2 PHE 80 8.160 4.790 13.687 1522 HZ PHE 80 HZ PHE 80 6.810 4.060 11.759 1523 H CYS 81 H CYS 81 2.621 9.090 14.143 1524 HA CYS 81 HA CYS 81 3.214 8.817 11.317 1525 HB2 CYS 81 2HB CYS 81 0.569 9.106 12.798 1526 HB3 CYS 81 3HB CYS 81 0.735 8.747 11.079 1527 HG CYS 81 HG CYS 81 1.178 6.735 13.742 1528 H LYS 82 H LYS 82 2.363 11.380 13.546 1529 HA LYS 82 HA LYS 82 1.792 13.352 11.494 1530 HB2 LYS 82 2HB LYS 82 2.207 13.599 14.501 1531 HB3 LYS 82 3HB LYS 82 1.897 14.981 13.453 1532 HG2 LYS 82 2HG LYS 82 -0.287 14.004 12.815 1533 HG3 LYS 82 3HG LYS 82 0.033 12.628 13.875 1534 HD2 LYS 82 2HD LYS 82 -1.399 14.062 15.113 1535 HD3 LYS 82 3HD LYS 82 0.204 14.295 15.804 1536 HE2 LYS 82 2HE LYS 82 -1.076 16.157 13.774 1537 HE3 LYS 82 3HE LYS 82 -1.120 16.402 15.514 1538 HZ1 LYS 82 1HZ LYS 82 1.318 16.513 15.494 1539 HZ2 LYS 82 2HZ LYS 82 0.608 17.722 14.554 1540 HZ3 LYS 82 3HZ LYS 82 1.310 16.384 13.806 1541 H VAL 83 H VAL 83 3.632 13.121 10.248 1542 HA VAL 83 HA VAL 83 6.063 14.489 11.256 1543 HB VAL 83 HB VAL 83 7.370 13.113 9.584 1544 HG11 VAL 83 1HG1 VAL 83 5.961 11.497 11.745 1545 HG12 VAL 83 2HG1 VAL 83 7.389 12.511 11.969 1546 HG13 VAL 83 3HG1 VAL 83 7.487 11.068 10.961 1547 HG21 VAL 83 1HG2 VAL 83 6.388 11.006 8.696 1548 HG22 VAL 83 2HG2 VAL 83 5.548 12.426 8.073 1549 HG23 VAL 83 3HG2 VAL 83 4.813 11.465 9.358 1550 H ASP 84 H ASP 84 7.379 15.061 9.052 1551 HA ASP 84 HA ASP 84 5.985 17.289 7.986 1552 HB2 ASP 84 2HB ASP 84 8.450 17.200 8.367 1553 HB3 ASP 84 3HB ASP 84 8.600 16.016 7.075 1554 H GLN 85 H GLN 85 5.537 17.704 5.681 1555 HA GLN 85 HA GLN 85 3.686 15.866 4.724 1556 HB2 GLN 85 2HB GLN 85 3.537 18.284 4.271 1557 HB3 GLN 85 3HB GLN 85 4.943 18.196 3.222 1558 HG2 GLN 85 2HG GLN 85 2.910 18.345 1.889 1559 HG3 GLN 85 3HG GLN 85 3.671 16.773 1.643 1560 HE21 GLN 85 1HE2 GLN 85 1.697 15.897 0.916 1561 HE22 GLN 85 2HE2 GLN 85 0.400 15.537 1.990 1562 HA PRO 86 HA PRO 86 6.851 14.367 1.232 1563 HB2 PRO 86 2HB PRO 86 9.473 15.122 2.513 1564 HB3 PRO 86 3HB PRO 86 8.997 15.151 0.800 1565 HG2 PRO 86 2HG PRO 86 9.213 17.422 2.126 1566 HG3 PRO 86 3HG PRO 86 7.853 17.174 1.002 1567 HD2 PRO 86 2HD PRO 86 7.872 16.942 4.012 1568 HD3 PRO 86 3HD PRO 86 6.698 17.761 2.954 1569 H THR 87 H THR 87 7.876 14.388 4.654 1570 HA THR 87 HA THR 87 9.117 11.848 4.754 1571 HB THR 87 HB THR 87 7.766 13.304 7.074 1572 HG1 THR 87 HG1 THR 87 10.294 13.712 5.836 1573 HG21 THR 87 1HG2 THR 87 10.156 11.416 7.078 1574 HG22 THR 87 2HG2 THR 87 8.530 11.001 7.628 1575 HG23 THR 87 3HG2 THR 87 9.465 12.227 8.485 1576 H LEU 88 H LEU 88 5.764 12.869 5.128 1577 HA LEU 88 HA LEU 88 4.524 10.509 6.012 1578 HB2 LEU 88 2HB LEU 88 3.569 12.792 4.248 1579 HB3 LEU 88 3HB LEU 88 2.495 11.489 4.722 1580 HG LEU 88 HG LEU 88 3.927 13.246 6.755 1581 HD11 LEU 88 1HD1 LEU 88 1.880 14.543 6.999 1582 HD12 LEU 88 2HD1 LEU 88 1.107 13.628 5.700 1583 HD13 LEU 88 3HD1 LEU 88 2.487 14.669 5.348 1584 HD21 LEU 88 1HD2 LEU 88 2.227 12.392 8.304 1585 HD22 LEU 88 2HD2 LEU 88 3.156 11.074 7.597 1586 HD23 LEU 88 3HD2 LEU 88 1.521 11.410 7.016 1587 H PHE 89 H PHE 89 5.160 11.699 2.708 1588 HA PHE 89 HA PHE 89 4.130 9.434 1.336 1589 HB2 PHE 89 2HB PHE 89 6.092 11.565 0.379 1590 HB3 PHE 89 3HB PHE 89 5.347 10.359 -0.668 1591 HD1 PHE 89 HD1 PHE 89 2.620 10.236 -0.240 1592 HD2 PHE 89 HD2 PHE 89 5.095 13.696 0.224 1593 HE1 PHE 89 HE1 PHE 89 0.668 11.689 -0.590 1594 HE2 PHE 89 HE2 PHE 89 3.132 15.139 -0.126 1595 HZ PHE 89 HZ PHE 89 0.918 14.136 -0.529 1596 H GLU 90 H GLU 90 7.311 10.190 2.655 1597 HA GLU 90 HA GLU 90 8.780 8.085 1.462 1598 HB2 GLU 90 2HB GLU 90 9.190 9.564 4.089 1599 HB3 GLU 90 3HB GLU 90 10.324 8.372 3.467 1600 HG2 GLU 90 2HG GLU 90 9.558 10.964 2.115 1601 HG3 GLU 90 3HG GLU 90 11.065 10.643 2.968 1602 H LEU 91 H LEU 91 6.822 8.227 4.422 1603 HA LEU 91 HA LEU 91 7.381 5.577 5.332 1604 HB2 LEU 91 2HB LEU 91 5.037 7.422 5.942 1605 HB3 LEU 91 3HB LEU 91 5.344 5.912 6.780 1606 HG LEU 91 HG LEU 91 7.155 8.361 6.841 1607 HD11 LEU 91 1HD1 LEU 91 6.439 8.622 9.176 1608 HD12 LEU 91 2HD1 LEU 91 5.336 7.255 9.011 1609 HD13 LEU 91 3HD1 LEU 91 5.064 8.728 8.078 1610 HD21 LEU 91 1HD2 LEU 91 8.441 7.164 8.555 1611 HD22 LEU 91 2HD2 LEU 91 8.451 6.288 7.029 1612 HD23 LEU 91 3HD2 LEU 91 7.418 5.740 8.351 1613 H ILE 92 H ILE 92 4.921 6.970 3.189 1614 HA ILE 92 HA ILE 92 3.306 4.648 2.845 1615 HB ILE 92 HB ILE 92 3.712 7.038 0.976 1616 HG12 ILE 92 2HG1 ILE 92 1.457 6.461 2.962 1617 HG13 ILE 92 3HG1 ILE 92 2.757 7.618 3.210 1618 HG21 ILE 92 1HG2 ILE 92 1.602 6.370 -0.142 1619 HG22 ILE 92 2HG2 ILE 92 1.539 4.910 0.845 1620 HG23 ILE 92 3HG2 ILE 92 2.847 5.131 -0.318 1621 HD11 ILE 92 1HD1 ILE 92 0.610 7.795 1.095 1622 HD12 ILE 92 2HD1 ILE 92 1.932 8.945 1.321 1623 HD13 ILE 92 3HD1 ILE 92 0.717 8.741 2.582 1624 H LEU 93 H LEU 93 6.084 5.960 1.018 1625 HA LEU 93 HA LEU 93 6.212 3.995 -1.026 1626 HB2 LEU 93 2HB LEU 93 8.345 5.853 0.105 1627 HB3 LEU 93 3HB LEU 93 8.620 4.830 -1.293 1628 HG LEU 93 HG LEU 93 6.566 7.074 -1.150 1629 HD11 LEU 93 1HD1 LEU 93 9.252 7.024 -2.574 1630 HD12 LEU 93 2HD1 LEU 93 8.849 7.960 -1.132 1631 HD13 LEU 93 3HD1 LEU 93 8.051 8.319 -2.660 1632 HD21 LEU 93 1HD2 LEU 93 5.841 5.295 -2.661 1633 HD22 LEU 93 2HD2 LEU 93 7.385 5.352 -3.514 1634 HD23 LEU 93 3HD2 LEU 93 6.291 6.736 -3.570 1635 H ALA 94 H ALA 94 7.723 4.259 2.168 1636 HA ALA 94 HA ALA 94 9.485 2.022 1.940 1637 HB1 ALA 94 1HB ALA 94 9.890 3.852 3.528 1638 HB2 ALA 94 2HB ALA 94 9.806 2.300 4.364 1639 HB3 ALA 94 3HB ALA 94 8.437 3.416 4.428 1640 H ALA 95 H ALA 95 6.228 2.458 3.317 1641 HA ALA 95 HA ALA 95 6.030 -0.194 4.416 1642 HB1 ALA 95 1HB ALA 95 3.703 0.384 4.876 1643 HB2 ALA 95 2HB ALA 95 3.824 1.809 3.839 1644 HB3 ALA 95 3HB ALA 95 4.766 1.716 5.327 1645 H ASN 96 H ASN 96 5.143 1.300 1.340 1646 HA ASN 96 HA ASN 96 3.712 -0.886 0.181 1647 HB2 ASN 96 2HB ASN 96 3.761 1.541 -0.644 1648 HB3 ASN 96 3HB ASN 96 5.374 1.244 -1.272 1649 HD21 ASN 96 1HD2 ASN 96 3.070 2.100 -2.753 1650 HD22 ASN 96 2HD2 ASN 96 2.743 0.894 -3.945 1651 H TYR 97 H TYR 97 7.110 0.117 0.163 1652 HA TYR 97 HA TYR 97 8.134 -1.883 -1.592 1653 HB2 TYR 97 2HB TYR 97 9.294 0.222 -1.374 1654 HB3 TYR 97 3HB TYR 97 9.435 0.052 0.367 1655 HD1 TYR 97 HD1 TYR 97 11.447 -0.752 1.264 1656 HD2 TYR 97 HD2 TYR 97 10.592 -1.569 -2.842 1657 HE1 TYR 97 HE1 TYR 97 13.676 -1.707 0.992 1658 HE2 TYR 97 HE2 TYR 97 12.844 -2.531 -3.114 1659 HH TYR 97 HH TYR 97 14.997 -2.571 -2.073 1660 H LEU 98 H LEU 98 7.862 -1.662 1.927 1661 HA LEU 98 HA LEU 98 9.246 -4.217 2.370 1662 HB2 LEU 98 2HB LEU 98 8.044 -2.236 4.346 1663 HB3 LEU 98 3HB LEU 98 8.909 -3.696 4.795 1664 HG LEU 98 HG LEU 98 10.121 -1.336 3.309 1665 HD11 LEU 98 1HD1 LEU 98 11.323 -0.862 5.383 1666 HD12 LEU 98 2HD1 LEU 98 10.479 -2.179 6.203 1667 HD13 LEU 98 3HD1 LEU 98 9.581 -0.772 5.626 1668 HD21 LEU 98 1HD2 LEU 98 11.203 -3.429 2.665 1669 HD22 LEU 98 2HD2 LEU 98 11.448 -3.857 4.358 1670 HD23 LEU 98 3HD2 LEU 98 12.284 -2.466 3.669 1671 H ASP 99 H ASP 99 6.145 -3.110 1.729 1672 HA ASP 99 HA ASP 99 4.165 -4.126 1.464 1673 HB2 ASP 99 2HB ASP 99 5.947 -6.116 0.940 1674 HB3 ASP 99 3HB ASP 99 5.157 -6.838 2.327 1675 H ILE 100 H ILE 100 5.154 -3.131 4.120 1676 HA ILE 100 HA ILE 100 3.661 -4.656 6.110 1677 HB ILE 100 HB ILE 100 5.033 -1.954 6.498 1678 HG12 ILE 100 2HG1 ILE 100 6.116 -4.759 6.989 1679 HG13 ILE 100 3HG1 ILE 100 6.680 -3.637 5.766 1680 HG21 ILE 100 1HG2 ILE 100 4.106 -4.022 8.543 1681 HG22 ILE 100 2HG2 ILE 100 3.323 -2.476 8.214 1682 HG23 ILE 100 3HG2 ILE 100 4.940 -2.508 8.915 1683 HD11 ILE 100 1HD1 ILE 100 8.203 -3.784 7.647 1684 HD12 ILE 100 2HD1 ILE 100 6.932 -3.246 8.745 1685 HD13 ILE 100 3HD1 ILE 100 7.536 -2.164 7.489 1686 H LYS 101 H LYS 101 1.662 -4.541 5.180 1687 HA LYS 101 HA LYS 101 0.190 -2.252 4.481 1688 HB2 LYS 101 2HB LYS 101 -0.848 -4.965 5.396 1689 HB3 LYS 101 3HB LYS 101 -1.753 -3.766 4.474 1690 HG2 LYS 101 2HG LYS 101 -0.349 -4.054 2.544 1691 HG3 LYS 101 3HG LYS 101 0.801 -5.043 3.452 1692 HD2 LYS 101 2HD LYS 101 -0.956 -6.788 3.733 1693 HD3 LYS 101 3HD LYS 101 -2.068 -5.804 2.775 1694 HE2 LYS 101 2HE LYS 101 -0.515 -5.961 0.849 1695 HE3 LYS 101 3HE LYS 101 0.558 -6.982 1.810 1696 HZ1 LYS 101 1HZ LYS 101 -1.086 -8.678 1.889 1697 HZ2 LYS 101 2HZ LYS 101 -0.973 -8.188 0.278 1698 HZ3 LYS 101 3HZ LYS 101 -2.268 -7.669 1.223 1699 HA PRO 102 HA PRO 102 -1.489 -2.522 9.301 1700 HB2 PRO 102 2HB PRO 102 1.366 -3.044 10.215 1701 HB3 PRO 102 3HB PRO 102 -0.163 -3.392 11.057 1702 HG2 PRO 102 2HG PRO 102 1.099 -5.357 9.837 1703 HG3 PRO 102 3HG PRO 102 -0.671 -5.218 9.682 1704 HD2 PRO 102 2HD PRO 102 1.460 -4.548 7.680 1705 HD3 PRO 102 3HD PRO 102 -0.164 -5.216 7.416 1706 H LEU 103 H LEU 103 1.831 -1.435 8.407 1707 HA LEU 103 HA LEU 103 1.588 1.078 9.829 1708 HB2 LEU 103 2HB LEU 103 3.749 -0.184 9.598 1709 HB3 LEU 103 3HB LEU 103 3.753 0.144 7.881 1710 HG LEU 103 HG LEU 103 5.278 1.570 9.476 1711 HD11 LEU 103 1HD1 LEU 103 5.131 3.577 8.084 1712 HD12 LEU 103 2HD1 LEU 103 3.601 3.012 7.408 1713 HD13 LEU 103 3HD1 LEU 103 5.085 2.104 7.115 1714 HD21 LEU 103 1HD2 LEU 103 3.554 2.125 11.120 1715 HD22 LEU 103 2HD2 LEU 103 2.664 3.044 9.904 1716 HD23 LEU 103 3HD2 LEU 103 4.264 3.571 10.416 1717 H LEU 104 H LEU 104 1.494 -0.029 6.474 1718 HA LEU 104 HA LEU 104 1.476 2.377 5.065 1719 HB2 LEU 104 2HB LEU 104 1.770 0.154 4.028 1720 HB3 LEU 104 3HB LEU 104 0.113 -0.263 4.415 1721 HG LEU 104 HG LEU 104 -0.666 1.532 2.832 1722 HD11 LEU 104 1HD1 LEU 104 2.261 1.777 2.067 1723 HD12 LEU 104 2HD1 LEU 104 1.282 3.006 2.873 1724 HD13 LEU 104 3HD1 LEU 104 0.895 2.519 1.225 1725 HD21 LEU 104 1HD2 LEU 104 -0.544 -0.825 2.141 1726 HD22 LEU 104 2HD2 LEU 104 1.115 -0.588 1.582 1727 HD23 LEU 104 3HD2 LEU 104 -0.216 0.263 0.795 1728 H ASP 105 H ASP 105 -1.183 0.514 6.468 1729 HA ASP 105 HA ASP 105 -3.360 2.014 5.473 1730 HB2 ASP 105 2HB ASP 105 -3.590 -0.286 6.412 1731 HB3 ASP 105 3HB ASP 105 -3.200 0.320 8.019 1732 H VAL 106 H VAL 106 -1.609 2.145 8.579 1733 HA VAL 106 HA VAL 106 -3.126 4.164 9.812 1734 HB VAL 106 HB VAL 106 -0.200 3.427 10.283 1735 HG11 VAL 106 1HG1 VAL 106 -2.082 4.964 12.123 1736 HG12 VAL 106 2HG1 VAL 106 -0.696 5.639 11.264 1737 HG13 VAL 106 3HG1 VAL 106 -0.445 4.433 12.525 1738 HG21 VAL 106 1HG2 VAL 106 -1.766 1.532 10.545 1739 HG22 VAL 106 2HG2 VAL 106 -2.705 2.460 11.715 1740 HG23 VAL 106 3HG2 VAL 106 -1.043 1.992 12.088 1741 H THR 107 H THR 107 -0.159 4.391 7.836 1742 HA THR 107 HA THR 107 0.191 7.205 8.093 1743 HB THR 107 HB THR 107 1.250 5.409 5.857 1744 HG1 THR 107 HG1 THR 107 1.846 5.494 8.542 1745 HG21 THR 107 1HG2 THR 107 1.572 7.849 5.459 1746 HG22 THR 107 2HG2 THR 107 3.104 7.025 5.744 1747 HG23 THR 107 3HG2 THR 107 2.372 7.989 7.027 1748 H CYS 108 H CYS 108 -1.486 5.168 5.702 1749 HA CYS 108 HA CYS 108 -2.134 7.218 3.831 1750 HB2 CYS 108 2HB CYS 108 -3.409 4.501 4.331 1751 HB3 CYS 108 3HB CYS 108 -3.848 5.554 2.985 1752 HG CYS 108 HG CYS 108 -0.600 4.616 3.380 1753 H LYS 109 H LYS 109 -3.666 6.025 6.773 1754 HA LYS 109 HA LYS 109 -6.086 7.560 6.490 1755 HB2 LYS 109 2HB LYS 109 -4.912 5.797 8.624 1756 HB3 LYS 109 3HB LYS 109 -6.066 7.008 9.163 1757 HG2 LYS 109 2HG LYS 109 -7.077 4.760 8.716 1758 HG3 LYS 109 3HG LYS 109 -7.821 6.073 7.796 1759 HD2 LYS 109 2HD LYS 109 -6.534 5.397 5.793 1760 HD3 LYS 109 3HD LYS 109 -5.756 4.111 6.716 1761 HE2 LYS 109 2HE LYS 109 -8.728 4.300 6.156 1762 HE3 LYS 109 3HE LYS 109 -7.593 3.266 5.293 1763 HZ1 LYS 109 1HZ LYS 109 -8.749 2.030 6.973 1764 HZ2 LYS 109 2HZ LYS 109 -8.254 3.101 8.179 1765 HZ3 LYS 109 3HZ LYS 109 -7.117 2.137 7.385 1766 H THR 110 H THR 110 -2.929 8.086 8.026 1767 HA THR 110 HA THR 110 -3.587 10.408 9.512 1768 HB THR 110 HB THR 110 -0.882 9.550 8.377 1769 HG1 THR 110 HG1 THR 110 -2.277 8.287 10.091 1770 HG21 THR 110 1HG2 THR 110 -1.499 11.521 10.621 1771 HG22 THR 110 2HG2 THR 110 -0.833 11.936 9.039 1772 HG23 THR 110 3HG2 THR 110 0.109 10.957 10.162 1773 H VAL 111 H VAL 111 -2.181 10.002 6.243 1774 HA VAL 111 HA VAL 111 -2.026 12.775 5.630 1775 HB VAL 111 HB VAL 111 -1.606 12.127 3.296 1776 HG11 VAL 111 1HG1 VAL 111 0.425 10.765 3.639 1777 HG12 VAL 111 2HG1 VAL 111 -0.134 10.329 5.256 1778 HG13 VAL 111 3HG1 VAL 111 0.260 12.008 4.881 1779 HG21 VAL 111 1HG2 VAL 111 -2.300 9.286 4.131 1780 HG22 VAL 111 2HG2 VAL 111 -1.609 9.754 2.574 1781 HG23 VAL 111 3HG2 VAL 111 -3.222 10.307 3.025 1782 H ALA 112 H ALA 112 -4.546 10.351 5.237 1783 HA ALA 112 HA ALA 112 -6.358 11.922 3.681 1784 HB1 ALA 112 1HB ALA 112 -6.508 9.468 3.769 1785 HB2 ALA 112 2HB ALA 112 -8.025 10.215 4.277 1786 HB3 ALA 112 3HB ALA 112 -6.921 9.544 5.483 1787 H ASN 113 H ASN 113 -5.687 11.613 7.140 1788 HA ASN 113 HA ASN 113 -8.082 12.826 8.109 1789 HB2 ASN 113 2HB ASN 113 -5.410 12.166 9.367 1790 HB3 ASN 113 3HB ASN 113 -6.479 13.267 10.225 1791 HD21 ASN 113 1HD2 ASN 113 -7.688 10.541 8.298 1792 HD22 ASN 113 2HD2 ASN 113 -8.254 9.630 9.644 1793 H MET 114 H MET 114 -5.009 14.115 7.055 1794 HA MET 114 HA MET 114 -5.214 16.731 8.128 1795 HB2 MET 114 2HB MET 114 -3.736 15.827 5.628 1796 HB3 MET 114 3HB MET 114 -3.457 17.336 6.490 1797 HG2 MET 114 2HG MET 114 -2.737 15.998 8.472 1798 HG3 MET 114 3HG MET 114 -2.892 14.540 7.493 1799 HE1 MET 114 1HE MET 114 -1.843 16.103 4.613 1800 HE2 MET 114 2HE MET 114 -1.623 14.408 5.037 1801 HE3 MET 114 3HE MET 114 -0.228 15.401 4.631 1802 H ILE 115 H ILE 115 -6.468 15.263 5.182 1803 HA ILE 115 HA ILE 115 -7.312 17.862 4.083 1804 HB ILE 115 HB ILE 115 -7.790 16.702 2.002 1805 HG12 ILE 115 2HG1 ILE 115 -7.154 14.071 3.435 1806 HG13 ILE 115 3HG1 ILE 115 -8.759 14.602 2.956 1807 HG21 ILE 115 1HG2 ILE 115 -5.439 17.297 2.423 1808 HG22 ILE 115 2HG2 ILE 115 -5.534 15.829 1.448 1809 HG23 ILE 115 3HG2 ILE 115 -5.157 15.722 3.171 1810 HD11 ILE 115 1HD1 ILE 115 -6.492 13.940 1.087 1811 HD12 ILE 115 2HD1 ILE 115 -8.101 14.485 0.612 1812 HD13 ILE 115 3HD1 ILE 115 -7.903 12.941 1.433 1813 H ARG 116 H ARG 116 -8.672 14.884 5.373 1814 HA ARG 116 HA ARG 116 -10.971 15.852 6.483 1815 HB2 ARG 116 2HB ARG 116 -11.837 16.317 4.223 1816 HB3 ARG 116 3HB ARG 116 -11.513 14.668 3.715 1817 HG2 ARG 116 2HG ARG 116 -13.883 14.979 4.142 1818 HG3 ARG 116 3HG ARG 116 -13.219 13.842 5.303 1819 HD2 ARG 116 2HD ARG 116 -13.082 15.750 6.962 1820 HD3 ARG 116 3HD ARG 116 -13.949 16.753 5.790 1821 HE ARG 116 HE ARG 116 -15.322 14.304 6.357 1822 HH11 ARG 116 1HH1 ARG 116 -14.798 17.557 7.624 1823 HH12 ARG 116 2HH1 ARG 116 -16.281 17.567 8.526 1824 HH21 ARG 116 1HH2 ARG 116 -17.234 14.323 7.549 1825 HH22 ARG 116 2HH2 ARG 116 -17.667 15.721 8.482 1826 H GLY 117 H GLY 117 -9.910 14.336 7.944 1827 HA2 GLY 117 2HA GLY 117 -10.457 11.487 7.570 1828 HA3 GLY 117 3HA GLY 117 -9.818 12.258 9.015 Start of MODEL 19 1 H1 SER 2 1H SER 2 -18.251 -13.406 -17.519 2 H2 SER 2 2H SER 2 -19.622 -13.732 -16.587 3 H3 SER 2 3H SER 2 -18.777 -14.999 -17.315 4 HA SER 2 HA SER 2 -18.331 -14.852 -14.949 5 HB2 SER 2 2HB SER 2 -15.968 -14.218 -16.768 6 HB3 SER 2 3HB SER 2 -15.875 -15.049 -15.215 7 HG SER 2 HG SER 2 -16.812 -16.811 -16.075 8 H LEU 3 H LEU 3 -19.378 -12.171 -15.633 9 HA LEU 3 HA LEU 3 -17.451 -10.204 -14.734 10 HB2 LEU 3 2HB LEU 3 -20.439 -9.938 -15.269 11 HB3 LEU 3 3HB LEU 3 -19.323 -8.602 -15.032 12 HG LEU 3 HG LEU 3 -19.165 -10.563 -17.357 13 HD11 LEU 3 1HD1 LEU 3 -20.321 -7.759 -17.328 14 HD12 LEU 3 2HD1 LEU 3 -21.225 -9.267 -17.499 15 HD13 LEU 3 3HD1 LEU 3 -20.090 -8.779 -18.753 16 HD21 LEU 3 1HD2 LEU 3 -17.624 -8.926 -18.359 17 HD22 LEU 3 2HD2 LEU 3 -16.998 -9.557 -16.839 18 HD23 LEU 3 3HD2 LEU 3 -17.706 -7.938 -16.896 19 H VAL 4 H VAL 4 -16.996 -10.037 -12.593 20 HA VAL 4 HA VAL 4 -19.002 -10.440 -10.518 21 HB VAL 4 HB VAL 4 -17.206 -9.758 -8.912 22 HG11 VAL 4 1HG1 VAL 4 -15.784 -11.763 -9.203 23 HG12 VAL 4 2HG1 VAL 4 -16.392 -11.956 -10.849 24 HG13 VAL 4 3HG1 VAL 4 -17.491 -12.123 -9.477 25 HG21 VAL 4 1HG2 VAL 4 -15.922 -8.204 -10.322 26 HG22 VAL 4 2HG2 VAL 4 -15.423 -9.531 -11.373 27 HG23 VAL 4 3HG2 VAL 4 -14.867 -9.474 -9.699 28 H LYS 5 H LYS 5 -20.106 -8.842 -9.526 29 HA LYS 5 HA LYS 5 -20.018 -6.172 -10.782 30 HB2 LYS 5 2HB LYS 5 -22.315 -7.550 -9.313 31 HB3 LYS 5 3HB LYS 5 -22.406 -6.043 -10.225 32 HG2 LYS 5 2HG LYS 5 -21.747 -7.327 -12.294 33 HG3 LYS 5 3HG LYS 5 -21.852 -8.814 -11.350 34 HD2 LYS 5 2HD LYS 5 -24.267 -8.378 -10.953 35 HD3 LYS 5 3HD LYS 5 -24.144 -6.890 -11.902 36 HE2 LYS 5 2HE LYS 5 -23.386 -8.302 -13.861 37 HE3 LYS 5 3HE LYS 5 -23.768 -9.734 -12.900 38 HZ1 LYS 5 1HZ LYS 5 -25.707 -7.602 -13.596 39 HZ2 LYS 5 2HZ LYS 5 -26.052 -9.053 -12.810 40 HZ3 LYS 5 3HZ LYS 5 -25.556 -9.062 -14.422 41 H LEU 6 H LEU 6 -19.481 -4.463 -9.568 42 HA LEU 6 HA LEU 6 -19.097 -4.821 -6.644 43 HB2 LEU 6 2HB LEU 6 -17.357 -3.158 -8.520 44 HB3 LEU 6 3HB LEU 6 -17.060 -3.483 -6.821 45 HG LEU 6 HG LEU 6 -16.942 -5.568 -9.042 46 HD11 LEU 6 1HD1 LEU 6 -14.511 -5.524 -8.746 47 HD12 LEU 6 2HD1 LEU 6 -14.660 -4.216 -7.570 48 HD13 LEU 6 3HD1 LEU 6 -15.122 -3.950 -9.252 49 HD21 LEU 6 1HD2 LEU 6 -15.929 -7.052 -7.350 50 HD22 LEU 6 2HD2 LEU 6 -17.573 -6.593 -6.915 51 HD23 LEU 6 3HD2 LEU 6 -16.204 -5.828 -6.105 52 H GLU 7 H GLU 7 -21.000 -3.741 -5.996 53 HA GLU 7 HA GLU 7 -21.674 -1.115 -6.975 54 HB2 GLU 7 2HB GLU 7 -22.671 -2.597 -4.504 55 HB3 GLU 7 3HB GLU 7 -23.250 -1.007 -4.998 56 HG2 GLU 7 2HG GLU 7 -24.869 -2.534 -5.775 57 HG3 GLU 7 3HG GLU 7 -23.943 -2.073 -7.201 58 H SER 8 H SER 8 -20.310 0.466 -6.632 59 HA SER 8 HA SER 8 -18.471 0.804 -4.520 60 HB2 SER 8 2HB SER 8 -18.360 3.181 -5.433 61 HB3 SER 8 3HB SER 8 -18.138 1.915 -6.644 62 HG SER 8 HG SER 8 -20.071 2.334 -7.484 63 H SER 9 H SER 9 -18.592 3.127 -3.326 64 HA SER 9 HA SER 9 -20.536 3.189 -1.329 65 HB2 SER 9 2HB SER 9 -18.346 4.357 -1.173 66 HB3 SER 9 3HB SER 9 -18.873 5.520 -2.393 67 HG SER 9 HG SER 9 -20.637 5.292 -0.313 68 H ASP 10 H ASP 10 -20.542 4.571 -4.547 69 HA ASP 10 HA ASP 10 -23.003 6.112 -4.185 70 HB2 ASP 10 2HB ASP 10 -21.194 5.673 -6.595 71 HB3 ASP 10 3HB ASP 10 -22.610 6.711 -6.609 72 H GLU 11 H GLU 11 -22.546 2.931 -4.411 73 HA GLU 11 HA GLU 11 -23.804 1.132 -4.931 74 HB2 GLU 11 2HB GLU 11 -25.980 3.226 -5.359 75 HB3 GLU 11 3HB GLU 11 -26.276 1.492 -5.270 76 HG2 GLU 11 2HG GLU 11 -25.599 1.407 -2.958 77 HG3 GLU 11 3HG GLU 11 -25.010 3.069 -3.006 78 H LYS 12 H LYS 12 -22.387 2.694 -7.133 79 HA LYS 12 HA LYS 12 -23.865 2.099 -9.555 80 HB2 LYS 12 2HB LYS 12 -20.958 2.929 -9.134 81 HB3 LYS 12 3HB LYS 12 -21.747 2.818 -10.703 82 HG2 LYS 12 2HG LYS 12 -22.597 4.702 -8.479 83 HG3 LYS 12 3HG LYS 12 -21.549 5.148 -9.828 84 HD2 LYS 12 2HD LYS 12 -23.378 4.674 -11.419 85 HD3 LYS 12 3HD LYS 12 -24.426 4.183 -10.085 86 HE2 LYS 12 2HE LYS 12 -24.373 6.457 -9.167 87 HE3 LYS 12 3HE LYS 12 -23.239 6.964 -10.423 88 HZ1 LYS 12 1HZ LYS 12 -26.028 6.037 -10.879 89 HZ2 LYS 12 2HZ LYS 12 -24.940 6.498 -12.086 90 HZ3 LYS 12 3HZ LYS 12 -25.483 7.637 -10.964 91 H VAL 13 H VAL 13 -23.941 0.145 -10.461 92 HA VAL 13 HA VAL 13 -22.525 -2.117 -9.371 93 HB VAL 13 HB VAL 13 -24.429 -1.993 -11.767 94 HG11 VAL 13 1HG1 VAL 13 -23.579 -4.394 -10.104 95 HG12 VAL 13 2HG1 VAL 13 -23.082 -4.052 -11.761 96 HG13 VAL 13 3HG1 VAL 13 -24.773 -4.408 -11.408 97 HG21 VAL 13 1HG2 VAL 13 -25.517 -1.141 -9.726 98 HG22 VAL 13 2HG2 VAL 13 -25.088 -2.621 -8.864 99 HG23 VAL 13 3HG2 VAL 13 -26.217 -2.685 -10.221 100 H PHE 14 H PHE 14 -20.356 -1.957 -9.892 101 HA PHE 14 HA PHE 14 -19.473 -1.511 -12.636 102 HB2 PHE 14 2HB PHE 14 -17.993 -1.915 -10.013 103 HB3 PHE 14 3HB PHE 14 -17.160 -1.848 -11.564 104 HD1 PHE 14 HD1 PHE 14 -18.531 0.137 -8.886 105 HD2 PHE 14 HD2 PHE 14 -17.526 0.221 -13.044 106 HE1 PHE 14 HE1 PHE 14 -18.532 2.596 -8.847 107 HE2 PHE 14 HE2 PHE 14 -17.529 2.677 -12.993 108 HZ PHE 14 HZ PHE 14 -18.036 3.867 -10.897 109 H GLU 15 H GLU 15 -20.304 -3.237 -13.701 110 HA GLU 15 HA GLU 15 -19.725 -5.997 -13.074 111 HB2 GLU 15 2HB GLU 15 -20.709 -4.777 -15.693 112 HB3 GLU 15 3HB GLU 15 -20.832 -6.469 -15.207 113 HG2 GLU 15 2HG GLU 15 -22.410 -5.866 -13.423 114 HG3 GLU 15 3HG GLU 15 -22.225 -4.162 -13.816 115 H ILE 16 H ILE 16 -17.572 -6.466 -13.115 116 HA ILE 16 HA ILE 16 -16.019 -5.944 -15.585 117 HB ILE 16 HB ILE 16 -15.326 -4.300 -13.838 118 HG12 ILE 16 2HG1 ILE 16 -13.165 -6.389 -14.349 119 HG13 ILE 16 3HG1 ILE 16 -13.682 -5.189 -15.517 120 HG21 ILE 16 1HG2 ILE 16 -14.200 -4.998 -11.760 121 HG22 ILE 16 2HG2 ILE 16 -14.508 -6.691 -12.148 122 HG23 ILE 16 3HG2 ILE 16 -15.858 -5.610 -11.809 123 HD11 ILE 16 1HD1 ILE 16 -12.312 -4.665 -12.894 124 HD12 ILE 16 2HD1 ILE 16 -12.921 -3.417 -13.986 125 HD13 ILE 16 3HD1 ILE 16 -11.638 -4.502 -14.516 126 H GLU 17 H GLU 17 -14.388 -7.556 -16.008 127 HA GLU 17 HA GLU 17 -15.230 -10.197 -15.562 128 HB2 GLU 17 2HB GLU 17 -12.496 -9.217 -16.473 129 HB3 GLU 17 3HB GLU 17 -13.108 -10.854 -16.681 130 HG2 GLU 17 2HG GLU 17 -14.836 -10.068 -18.205 131 HG3 GLU 17 3HG GLU 17 -14.384 -8.391 -17.909 132 H LYS 18 H LYS 18 -14.651 -11.759 -14.171 133 HA LYS 18 HA LYS 18 -13.847 -11.199 -11.562 134 HB2 LYS 18 2HB LYS 18 -15.209 -13.158 -12.214 135 HB3 LYS 18 3HB LYS 18 -13.824 -13.856 -13.043 136 HG2 LYS 18 2HG LYS 18 -12.644 -13.850 -10.736 137 HG3 LYS 18 3HG LYS 18 -14.244 -13.518 -10.057 138 HD2 LYS 18 2HD LYS 18 -13.808 -15.931 -9.984 139 HD3 LYS 18 3HD LYS 18 -15.111 -15.603 -11.132 140 HE2 LYS 18 2HE LYS 18 -13.396 -15.702 -12.990 141 HE3 LYS 18 3HE LYS 18 -12.201 -16.208 -11.793 142 HZ1 LYS 18 1HZ LYS 18 -13.168 -18.086 -12.983 143 HZ2 LYS 18 2HZ LYS 18 -14.709 -17.663 -12.429 144 HZ3 LYS 18 3HZ LYS 18 -13.525 -18.155 -11.334 145 H GLU 19 H GLU 19 -12.021 -12.467 -14.316 146 HA GLU 19 HA GLU 19 -9.609 -13.270 -13.207 147 HB2 GLU 19 2HB GLU 19 -9.944 -11.790 -15.856 148 HB3 GLU 19 3HB GLU 19 -8.601 -12.841 -15.417 149 HG2 GLU 19 2HG GLU 19 -10.140 -14.776 -15.352 150 HG3 GLU 19 3HG GLU 19 -11.472 -13.717 -15.802 151 H ILE 20 H ILE 20 -10.725 -10.064 -13.999 152 HA ILE 20 HA ILE 20 -8.236 -8.674 -13.659 153 HB ILE 20 HB ILE 20 -11.087 -7.577 -13.761 154 HG12 ILE 20 2HG1 ILE 20 -9.120 -8.109 -16.032 155 HG13 ILE 20 3HG1 ILE 20 -10.640 -8.945 -15.759 156 HG21 ILE 20 1HG2 ILE 20 -8.442 -6.201 -14.313 157 HG22 ILE 20 2HG2 ILE 20 -9.470 -5.947 -12.902 158 HG23 ILE 20 3HG2 ILE 20 -10.040 -5.475 -14.503 159 HD11 ILE 20 1HD1 ILE 20 -10.851 -7.396 -17.574 160 HD12 ILE 20 2HD1 ILE 20 -10.305 -6.059 -16.562 161 HD13 ILE 20 3HD1 ILE 20 -11.845 -6.855 -16.224 162 H ALA 21 H ALA 21 -11.188 -9.162 -11.743 163 HA ALA 21 HA ALA 21 -10.357 -7.624 -9.452 164 HB1 ALA 21 1HB ALA 21 -12.411 -8.483 -8.422 165 HB2 ALA 21 2HB ALA 21 -12.612 -9.631 -9.750 166 HB3 ALA 21 3HB ALA 21 -12.720 -7.897 -10.057 167 H CYS 22 H CYS 22 -9.547 -10.775 -10.525 168 HA CYS 22 HA CYS 22 -9.055 -12.031 -7.995 169 HB2 CYS 22 2HB CYS 22 -7.938 -12.642 -10.754 170 HB3 CYS 22 3HB CYS 22 -7.721 -13.672 -9.338 171 HG CYS 22 HG CYS 22 -10.752 -13.639 -9.175 172 H MET 23 H MET 23 -7.244 -9.812 -10.008 173 HA MET 23 HA MET 23 -4.672 -10.154 -8.788 174 HB2 MET 23 2HB MET 23 -5.759 -7.662 -10.158 175 HB3 MET 23 3HB MET 23 -4.065 -8.051 -9.877 176 HG2 MET 23 2HG MET 23 -4.308 -10.007 -11.404 177 HG3 MET 23 3HG MET 23 -5.959 -9.490 -11.747 178 HE1 MET 23 1HE MET 23 -6.520 -7.066 -12.785 179 HE2 MET 23 2HE MET 23 -5.289 -5.978 -13.421 180 HE3 MET 23 3HE MET 23 -5.435 -6.210 -11.680 181 H SER 24 H SER 24 -7.472 -8.140 -8.144 182 HA SER 24 HA SER 24 -6.488 -6.803 -5.820 183 HB2 SER 24 2HB SER 24 -8.490 -5.959 -6.984 184 HB3 SER 24 3HB SER 24 -9.339 -7.481 -6.700 185 HG SER 24 HG SER 24 -8.328 -5.947 -4.563 186 H VAL 25 H VAL 25 -5.724 -7.986 -4.161 187 HA VAL 25 HA VAL 25 -6.239 -10.690 -3.614 188 HB VAL 25 HB VAL 25 -5.177 -8.553 -1.700 189 HG11 VAL 25 1HG1 VAL 25 -5.861 -10.551 -0.446 190 HG12 VAL 25 2HG1 VAL 25 -4.103 -10.411 -0.458 191 HG13 VAL 25 3HG1 VAL 25 -4.901 -11.576 -1.515 192 HG21 VAL 25 1HG2 VAL 25 -2.915 -9.300 -2.388 193 HG22 VAL 25 2HG2 VAL 25 -3.832 -8.675 -3.760 194 HG23 VAL 25 3HG2 VAL 25 -3.639 -10.416 -3.554 195 H THR 26 H THR 26 -7.646 -7.730 -2.291 196 HA THR 26 HA THR 26 -9.121 -8.848 -0.165 197 HB THR 26 HB THR 26 -9.613 -6.251 -1.684 198 HG1 THR 26 HG1 THR 26 -8.268 -5.421 0.009 199 HG21 THR 26 1HG2 THR 26 -10.404 -6.995 1.163 200 HG22 THR 26 2HG2 THR 26 -11.528 -6.845 -0.191 201 HG23 THR 26 3HG2 THR 26 -10.650 -5.428 0.388 202 H ILE 27 H ILE 27 -10.241 -7.831 -3.454 203 HA ILE 27 HA ILE 27 -12.948 -8.628 -3.121 204 HB ILE 27 HB ILE 27 -11.369 -8.331 -5.720 205 HG12 ILE 27 2HG1 ILE 27 -13.254 -6.339 -4.374 206 HG13 ILE 27 3HG1 ILE 27 -11.498 -6.244 -4.317 207 HG21 ILE 27 1HG2 ILE 27 -13.573 -8.120 -6.855 208 HG22 ILE 27 2HG2 ILE 27 -14.388 -8.473 -5.331 209 HG23 ILE 27 3HG2 ILE 27 -13.383 -9.704 -6.096 210 HD11 ILE 27 1HD1 ILE 27 -11.436 -5.946 -6.745 211 HD12 ILE 27 2HD1 ILE 27 -12.396 -4.703 -5.942 212 HD13 ILE 27 3HD1 ILE 27 -13.200 -6.019 -6.798 213 H LYS 28 H LYS 28 -10.097 -10.277 -4.480 214 HA LYS 28 HA LYS 28 -11.305 -12.637 -5.407 215 HB2 LYS 28 2HB LYS 28 -8.979 -11.936 -5.973 216 HB3 LYS 28 3HB LYS 28 -8.479 -12.275 -4.319 217 HG2 LYS 28 2HG LYS 28 -9.082 -14.686 -4.668 218 HG3 LYS 28 3HG LYS 28 -9.494 -14.306 -6.343 219 HD2 LYS 28 2HD LYS 28 -7.268 -15.283 -6.247 220 HD3 LYS 28 3HD LYS 28 -7.146 -13.594 -6.742 221 HE2 LYS 28 2HE LYS 28 -5.391 -14.059 -5.158 222 HE3 LYS 28 3HE LYS 28 -6.561 -13.009 -4.360 223 HZ1 LYS 28 1HZ LYS 28 -7.453 -14.893 -3.200 224 HZ2 LYS 28 2HZ LYS 28 -5.774 -14.878 -2.971 225 HZ3 LYS 28 3HZ LYS 28 -6.472 -15.961 -4.063 226 H ASN 29 H ASN 29 -9.901 -11.835 -2.212 227 HA ASN 29 HA ASN 29 -10.275 -14.418 -1.050 228 HB2 ASN 29 2HB ASN 29 -9.773 -11.693 0.208 229 HB3 ASN 29 3HB ASN 29 -9.974 -13.146 1.180 230 HD21 ASN 29 1HD2 ASN 29 -8.522 -14.855 -0.803 231 HD22 ASN 29 2HD2 ASN 29 -6.863 -14.438 -0.583 232 H MET 30 H MET 30 -12.312 -11.557 -1.290 233 HA MET 30 HA MET 30 -14.360 -12.375 0.501 234 HB2 MET 30 2HB MET 30 -14.384 -10.463 -1.870 235 HB3 MET 30 3HB MET 30 -15.802 -10.745 -0.869 236 HG2 MET 30 2HG MET 30 -14.625 -9.919 1.099 237 HG3 MET 30 3HG MET 30 -13.154 -9.697 0.149 238 HE1 MET 30 1HE MET 30 -13.051 -7.194 1.097 239 HE2 MET 30 2HE MET 30 -14.565 -7.429 1.972 240 HE3 MET 30 3HE MET 30 -14.364 -6.031 0.915 241 H ILE 31 H ILE 31 -13.870 -12.859 -2.983 242 HA ILE 31 HA ILE 31 -16.256 -14.272 -3.559 243 HB ILE 31 HB ILE 31 -13.529 -14.412 -4.939 244 HG12 ILE 31 2HG1 ILE 31 -16.007 -12.795 -5.703 245 HG13 ILE 31 3HG1 ILE 31 -14.595 -12.132 -4.894 246 HG21 ILE 31 1HG2 ILE 31 -14.721 -15.308 -6.919 247 HG22 ILE 31 2HG2 ILE 31 -16.219 -15.361 -5.990 248 HG23 ILE 31 3HG2 ILE 31 -14.865 -16.394 -5.531 249 HD11 ILE 31 1HD1 ILE 31 -14.666 -13.300 -7.673 250 HD12 ILE 31 2HD1 ILE 31 -13.228 -12.676 -6.859 251 HD13 ILE 31 3HD1 ILE 31 -14.568 -11.594 -7.238 252 H GLU 32 H GLU 32 -12.976 -15.405 -2.660 253 HA GLU 32 HA GLU 32 -13.471 -18.202 -2.701 254 HB2 GLU 32 2HB GLU 32 -11.373 -16.583 -1.196 255 HB3 GLU 32 3HB GLU 32 -11.358 -18.342 -1.315 256 HG2 GLU 32 2HG GLU 32 -10.992 -18.264 -3.693 257 HG3 GLU 32 3HG GLU 32 -11.269 -16.524 -3.736 258 H ASP 33 H ASP 33 -13.847 -15.770 -0.177 259 HA ASP 33 HA ASP 33 -14.145 -17.510 2.067 260 HB2 ASP 33 2HB ASP 33 -13.508 -15.152 2.343 261 HB3 ASP 33 3HB ASP 33 -15.033 -14.616 1.654 262 H ILE 34 H ILE 34 -16.461 -15.854 -0.053 263 HA ILE 34 HA ILE 34 -18.837 -16.987 1.081 264 HB ILE 34 HB ILE 34 -18.386 -15.783 -1.705 265 HG12 ILE 34 2HG1 ILE 34 -19.555 -14.441 0.784 266 HG13 ILE 34 3HG1 ILE 34 -17.894 -14.234 0.243 267 HG21 ILE 34 1HG2 ILE 34 -21.007 -16.302 -0.240 268 HG22 ILE 34 2HG2 ILE 34 -20.429 -17.165 -1.666 269 HG23 ILE 34 3HG2 ILE 34 -20.848 -15.456 -1.782 270 HD11 ILE 34 1HD1 ILE 34 -20.372 -13.391 -1.258 271 HD12 ILE 34 2HD1 ILE 34 -18.715 -13.239 -1.850 272 HD13 ILE 34 3HD1 ILE 34 -19.224 -12.349 -0.416 273 H GLY 35 H GLY 35 -16.447 -18.058 -1.228 274 HA2 GLY 35 2HA GLY 35 -16.095 -20.253 -1.979 275 HA3 GLY 35 3HA GLY 35 -17.752 -20.673 -1.561 276 H GLU 36 H GLU 36 -17.414 -17.738 -3.223 277 HA GLU 36 HA GLU 36 -17.788 -16.915 -5.246 278 HB2 GLU 36 2HB GLU 36 -16.015 -18.433 -6.083 279 HB3 GLU 36 3HB GLU 36 -17.212 -19.693 -6.351 280 HG2 GLU 36 2HG GLU 36 -18.373 -18.163 -7.974 281 HG3 GLU 36 3HG GLU 36 -17.055 -17.010 -7.773 282 H SER 37 H SER 37 -19.874 -16.355 -4.993 283 HA SER 37 HA SER 37 -21.992 -18.193 -5.985 284 HB2 SER 37 2HB SER 37 -23.544 -16.729 -4.629 285 HB3 SER 37 3HB SER 37 -22.341 -17.546 -3.629 286 HG SER 37 HG SER 37 -22.534 -15.339 -3.081 287 H ASP 38 H ASP 38 -23.903 -16.668 -6.797 288 HA ASP 38 HA ASP 38 -22.914 -14.973 -8.940 289 HB2 ASP 38 2HB ASP 38 -25.805 -15.523 -8.121 290 HB3 ASP 38 3HB ASP 38 -25.269 -14.799 -9.635 291 H SER 39 H SER 39 -23.717 -14.553 -5.683 292 HA SER 39 HA SER 39 -24.920 -12.031 -5.550 293 HB2 SER 39 2HB SER 39 -22.993 -13.350 -3.585 294 HB3 SER 39 3HB SER 39 -24.030 -11.963 -3.215 295 HG SER 39 HG SER 39 -25.539 -13.865 -4.275 296 HA PRO 40 HA PRO 40 -21.424 -9.445 -6.917 297 HB2 PRO 40 2HB PRO 40 -22.529 -7.004 -6.291 298 HB3 PRO 40 3HB PRO 40 -23.051 -7.950 -7.699 299 HG2 PRO 40 2HG PRO 40 -24.332 -7.767 -4.990 300 HG3 PRO 40 3HG PRO 40 -25.090 -7.676 -6.598 301 HD2 PRO 40 2HD PRO 40 -25.121 -9.954 -5.151 302 HD3 PRO 40 3HD PRO 40 -25.001 -9.982 -6.924 303 H ILE 41 H ILE 41 -19.839 -8.034 -5.916 304 HA ILE 41 HA ILE 41 -19.701 -8.224 -2.959 305 HB ILE 41 HB ILE 41 -17.410 -7.949 -4.979 306 HG12 ILE 41 2HG1 ILE 41 -16.659 -10.208 -3.883 307 HG13 ILE 41 3HG1 ILE 41 -18.303 -10.319 -3.273 308 HG21 ILE 41 1HG2 ILE 41 -17.244 -8.076 -1.945 309 HG22 ILE 41 2HG2 ILE 41 -16.888 -6.670 -2.951 310 HG23 ILE 41 3HG2 ILE 41 -15.864 -8.103 -3.048 311 HD11 ILE 41 1HD1 ILE 41 -17.991 -11.656 -5.279 312 HD12 ILE 41 2HD1 ILE 41 -17.493 -10.225 -6.181 313 HD13 ILE 41 3HD1 ILE 41 -19.146 -10.356 -5.578 314 HA PRO 42 HA PRO 42 -20.396 -3.713 -3.731 315 HB2 PRO 42 2HB PRO 42 -21.497 -3.695 -0.960 316 HB3 PRO 42 3HB PRO 42 -22.298 -3.261 -2.485 317 HG2 PRO 42 2HG PRO 42 -22.965 -5.486 -1.116 318 HG3 PRO 42 3HG PRO 42 -23.016 -5.425 -2.895 319 HD2 PRO 42 2HD PRO 42 -20.866 -6.581 -1.112 320 HD3 PRO 42 3HD PRO 42 -21.615 -7.274 -2.569 321 H LEU 43 H LEU 43 -18.767 -2.344 -3.400 322 HA LEU 43 HA LEU 43 -17.047 -2.528 -0.987 323 HB2 LEU 43 2HB LEU 43 -16.442 -1.293 -3.712 324 HB3 LEU 43 3HB LEU 43 -15.315 -1.437 -2.374 325 HG LEU 43 HG LEU 43 -16.508 -3.798 -3.885 326 HD11 LEU 43 1HD1 LEU 43 -15.041 -2.535 -5.355 327 HD12 LEU 43 2HD1 LEU 43 -14.304 -4.077 -4.927 328 HD13 LEU 43 3HD1 LEU 43 -13.742 -2.588 -4.158 329 HD21 LEU 43 1HD2 LEU 43 -15.938 -4.425 -1.604 330 HD22 LEU 43 2HD2 LEU 43 -14.320 -3.739 -1.778 331 HD23 LEU 43 3HD2 LEU 43 -14.790 -5.153 -2.726 332 HA PRO 44 HA PRO 44 -19.622 1.354 -0.635 333 HB2 PRO 44 2HB PRO 44 -20.301 1.221 1.972 334 HB3 PRO 44 3HB PRO 44 -21.024 0.104 0.793 335 HG2 PRO 44 2HG PRO 44 -18.753 -0.400 2.694 336 HG3 PRO 44 3HG PRO 44 -20.166 -1.421 2.345 337 HD2 PRO 44 2HD PRO 44 -17.691 -1.807 1.178 338 HD3 PRO 44 3HD PRO 44 -19.222 -2.296 0.419 339 H ASN 45 H ASN 45 -16.621 0.505 0.573 340 HA ASN 45 HA ASN 45 -16.006 2.818 2.183 341 HB2 ASN 45 2HB ASN 45 -14.956 0.509 2.429 342 HB3 ASN 45 3HB ASN 45 -14.100 0.784 0.919 343 HD21 ASN 45 1HD2 ASN 45 -12.981 0.242 3.507 344 HD22 ASN 45 2HD2 ASN 45 -11.994 1.592 3.931 345 H VAL 46 H VAL 46 -15.162 1.657 -1.082 346 HA VAL 46 HA VAL 46 -13.841 4.182 -1.775 347 HB VAL 46 HB VAL 46 -12.686 2.099 -2.388 348 HG11 VAL 46 1HG1 VAL 46 -13.540 0.535 -4.077 349 HG12 VAL 46 2HG1 VAL 46 -15.052 1.439 -4.166 350 HG13 VAL 46 3HG1 VAL 46 -14.612 0.607 -2.674 351 HG21 VAL 46 1HG2 VAL 46 -12.310 4.064 -3.813 352 HG22 VAL 46 2HG2 VAL 46 -13.657 3.592 -4.856 353 HG23 VAL 46 3HG2 VAL 46 -12.212 2.579 -4.765 354 H THR 47 H THR 47 -14.645 5.659 -3.225 355 HA THR 47 HA THR 47 -17.473 5.678 -3.806 356 HB THR 47 HB THR 47 -16.992 7.927 -4.787 357 HG1 THR 47 HG1 THR 47 -14.609 8.523 -4.295 358 HG21 THR 47 1HG2 THR 47 -16.165 9.029 -2.737 359 HG22 THR 47 2HG2 THR 47 -15.597 7.477 -2.116 360 HG23 THR 47 3HG2 THR 47 -17.327 7.762 -2.338 361 H SER 48 H SER 48 -18.079 6.517 -6.164 362 HA SER 48 HA SER 48 -17.697 4.197 -7.791 363 HB2 SER 48 2HB SER 48 -19.269 5.330 -9.377 364 HB3 SER 48 3HB SER 48 -19.871 5.252 -7.725 365 HG SER 48 HG SER 48 -19.221 7.433 -7.463 366 H THR 49 H THR 49 -16.764 7.619 -8.231 367 HA THR 49 HA THR 49 -15.668 7.381 -10.825 368 HB THR 49 HB THR 49 -14.499 9.561 -10.271 369 HG1 THR 49 HG1 THR 49 -15.035 10.441 -8.157 370 HG21 THR 49 1HG2 THR 49 -16.836 9.630 -11.101 371 HG22 THR 49 2HG2 THR 49 -16.551 10.910 -9.921 372 HG23 THR 49 3HG2 THR 49 -17.436 9.458 -9.448 373 H ILE 50 H ILE 50 -14.272 7.000 -7.604 374 HA ILE 50 HA ILE 50 -11.539 6.815 -8.465 375 HB ILE 50 HB ILE 50 -12.824 6.042 -5.806 376 HG12 ILE 50 2HG1 ILE 50 -13.126 8.418 -6.287 377 HG13 ILE 50 3HG1 ILE 50 -11.907 8.253 -5.029 378 HG21 ILE 50 1HG2 ILE 50 -10.673 4.884 -6.067 379 HG22 ILE 50 2HG2 ILE 50 -10.539 6.153 -4.851 380 HG23 ILE 50 3HG2 ILE 50 -9.878 6.410 -6.466 381 HD11 ILE 50 1HD1 ILE 50 -10.147 8.592 -6.747 382 HD12 ILE 50 2HD1 ILE 50 -11.255 9.951 -6.587 383 HD13 ILE 50 3HD1 ILE 50 -11.419 8.849 -7.950 384 H LEU 51 H LEU 51 -14.001 4.443 -7.376 385 HA LEU 51 HA LEU 51 -12.438 2.116 -7.673 386 HB2 LEU 51 2HB LEU 51 -14.580 2.156 -6.407 387 HB3 LEU 51 3HB LEU 51 -15.469 2.389 -7.905 388 HG LEU 51 HG LEU 51 -14.774 0.128 -8.685 389 HD11 LEU 51 1HD1 LEU 51 -13.619 -1.446 -7.198 390 HD12 LEU 51 2HD1 LEU 51 -13.388 -0.168 -6.002 391 HD13 LEU 51 3HD1 LEU 51 -12.603 -0.058 -7.580 392 HD21 LEU 51 1HD2 LEU 51 -16.117 -1.224 -7.137 393 HD22 LEU 51 2HD2 LEU 51 -16.886 0.331 -7.449 394 HD23 LEU 51 3HD2 LEU 51 -16.038 0.058 -5.924 395 H GLU 52 H GLU 52 -14.360 3.977 -9.969 396 HA GLU 52 HA GLU 52 -14.466 2.216 -12.155 397 HB2 GLU 52 2HB GLU 52 -15.759 4.339 -12.011 398 HB3 GLU 52 3HB GLU 52 -14.270 5.268 -12.153 399 HG2 GLU 52 2HG GLU 52 -13.926 4.318 -14.435 400 HG3 GLU 52 3HG GLU 52 -15.454 3.450 -14.281 401 H LYS 53 H LYS 53 -12.121 4.816 -11.417 402 HA LYS 53 HA LYS 53 -10.323 4.298 -13.538 403 HB2 LYS 53 2HB LYS 53 -10.063 5.816 -10.927 404 HB3 LYS 53 3HB LYS 53 -8.651 5.584 -11.954 405 HG2 LYS 53 2HG LYS 53 -9.858 6.705 -13.829 406 HG3 LYS 53 3HG LYS 53 -11.217 7.011 -12.747 407 HD2 LYS 53 2HD LYS 53 -8.383 8.037 -12.296 408 HD3 LYS 53 3HD LYS 53 -9.685 8.986 -13.015 409 HE2 LYS 53 2HE LYS 53 -9.691 7.837 -10.199 410 HE3 LYS 53 3HE LYS 53 -9.390 9.520 -10.628 411 HZ1 LYS 53 1HZ LYS 53 -11.608 9.669 -11.535 412 HZ2 LYS 53 2HZ LYS 53 -11.672 9.180 -9.922 413 HZ3 LYS 53 3HZ LYS 53 -11.916 8.053 -11.159 414 H VAL 54 H VAL 54 -10.416 3.110 -10.194 415 HA VAL 54 HA VAL 54 -7.964 1.767 -10.099 416 HB VAL 54 HB VAL 54 -10.575 1.236 -8.612 417 HG11 VAL 54 1HG1 VAL 54 -9.303 -0.191 -7.029 418 HG12 VAL 54 2HG1 VAL 54 -7.884 -0.078 -8.072 419 HG13 VAL 54 3HG1 VAL 54 -9.338 -0.890 -8.650 420 HG21 VAL 54 1HG2 VAL 54 -9.443 3.375 -8.090 421 HG22 VAL 54 2HG2 VAL 54 -7.962 2.505 -7.691 422 HG23 VAL 54 3HG2 VAL 54 -9.408 2.288 -6.701 423 H LEU 55 H LEU 55 -11.119 0.774 -11.295 424 HA LEU 55 HA LEU 55 -10.375 -1.922 -11.936 425 HB2 LEU 55 2HB LEU 55 -12.786 -0.235 -12.709 426 HB3 LEU 55 3HB LEU 55 -12.602 -1.926 -13.150 427 HG LEU 55 HG LEU 55 -12.865 -0.814 -10.333 428 HD11 LEU 55 1HD1 LEU 55 -14.960 -2.062 -10.255 429 HD12 LEU 55 2HD1 LEU 55 -14.723 -2.594 -11.922 430 HD13 LEU 55 3HD1 LEU 55 -14.962 -0.882 -11.565 431 HD21 LEU 55 1HD2 LEU 55 -11.285 -2.681 -10.281 432 HD22 LEU 55 2HD2 LEU 55 -12.433 -3.709 -11.142 433 HD23 LEU 55 3HD2 LEU 55 -12.807 -3.129 -9.516 434 H ASP 56 H ASP 56 -10.347 1.148 -13.693 435 HA ASP 56 HA ASP 56 -10.080 0.040 -16.324 436 HB2 ASP 56 2HB ASP 56 -9.516 2.828 -15.236 437 HB3 ASP 56 3HB ASP 56 -9.291 2.413 -16.934 438 H TYR 57 H TYR 57 -7.709 1.169 -13.913 439 HA TYR 57 HA TYR 57 -5.360 0.691 -15.453 440 HB2 TYR 57 2HB TYR 57 -5.344 2.051 -13.369 441 HB3 TYR 57 3HB TYR 57 -5.722 0.624 -12.418 442 HD1 TYR 57 HD1 TYR 57 -3.061 2.434 -14.224 443 HD2 TYR 57 HD2 TYR 57 -3.984 -1.131 -12.044 444 HE1 TYR 57 HE1 TYR 57 -0.660 1.939 -13.994 445 HE2 TYR 57 HE2 TYR 57 -1.598 -1.615 -11.819 446 HH TYR 57 HH TYR 57 0.822 0.603 -12.454 447 H CYS 58 H CYS 58 -7.255 -1.309 -13.216 448 HA CYS 58 HA CYS 58 -5.644 -3.626 -13.295 449 HB2 CYS 58 2HB CYS 58 -8.592 -3.242 -12.663 450 HB3 CYS 58 3HB CYS 58 -7.734 -4.767 -12.435 451 HG CYS 58 HG CYS 58 -8.068 -2.404 -10.315 452 H ARG 59 H ARG 59 -8.286 -2.500 -15.381 453 HA ARG 59 HA ARG 59 -8.518 -4.769 -17.073 454 HB2 ARG 59 2HB ARG 59 -9.133 -1.817 -17.522 455 HB3 ARG 59 3HB ARG 59 -9.386 -3.017 -18.786 456 HG2 ARG 59 2HG ARG 59 -11.026 -4.186 -17.437 457 HG3 ARG 59 3HG ARG 59 -10.709 -3.133 -16.057 458 HD2 ARG 59 2HD ARG 59 -11.569 -1.203 -17.320 459 HD3 ARG 59 3HD ARG 59 -11.856 -2.236 -18.726 460 HE ARG 59 HE ARG 59 -13.307 -3.501 -16.887 461 HH11 ARG 59 1HH1 ARG 59 -13.164 -0.064 -17.656 462 HH12 ARG 59 2HH1 ARG 59 -14.805 0.225 -17.173 463 HH21 ARG 59 1HH2 ARG 59 -15.456 -3.101 -16.262 464 HH22 ARG 59 2HH2 ARG 59 -16.103 -1.495 -16.385 465 H HIS 60 H HIS 60 -6.471 -1.865 -17.180 466 HA HIS 60 HA HIS 60 -5.139 -2.243 -19.603 467 HB2 HIS 60 2HB HIS 60 -4.898 -0.163 -18.288 468 HB3 HIS 60 3HB HIS 60 -4.056 -1.034 -17.010 469 HD1 HIS 60 HD1 HIS 60 -1.547 -1.531 -17.384 470 HD2 HIS 60 HD2 HIS 60 -3.353 0.374 -20.583 471 HE1 HIS 60 HE1 HIS 60 0.328 -0.889 -18.917 472 HE2 HIS 60 HE2 HIS 60 -0.786 0.541 -20.656 473 H HIS 61 H HIS 61 -4.473 -3.626 -16.400 474 HA HIS 61 HA HIS 61 -2.061 -4.974 -17.162 475 HB2 HIS 61 2HB HIS 61 -2.589 -4.311 -14.794 476 HB3 HIS 61 3HB HIS 61 -3.843 -5.550 -14.756 477 HD1 HIS 61 HD1 HIS 61 -3.059 -8.026 -14.583 478 HD2 HIS 61 HD2 HIS 61 0.056 -5.283 -14.732 479 HE1 HIS 61 HE1 HIS 61 -0.993 -9.332 -14.033 480 HE2 HIS 61 HE2 HIS 61 0.875 -7.653 -14.090 481 H HIS 62 H HIS 62 -5.488 -5.858 -17.208 482 HA HIS 62 HA HIS 62 -4.979 -8.673 -17.684 483 HB2 HIS 62 2HB HIS 62 -7.064 -7.924 -16.564 484 HB3 HIS 62 3HB HIS 62 -7.565 -7.100 -18.037 485 HD1 HIS 62 HD1 HIS 62 -6.238 -10.651 -17.552 486 HD2 HIS 62 HD2 HIS 62 -9.607 -8.681 -18.981 487 HE1 HIS 62 HE1 HIS 62 -7.725 -12.442 -18.487 488 HE2 HIS 62 HE2 HIS 62 -9.820 -11.239 -19.196 489 H GLN 63 H GLN 63 -5.386 -5.815 -19.637 490 HA GLN 63 HA GLN 63 -5.627 -7.201 -22.176 491 HB2 GLN 63 2HB GLN 63 -5.078 -4.266 -21.513 492 HB3 GLN 63 3HB GLN 63 -5.351 -4.881 -23.138 493 HG2 GLN 63 2HG GLN 63 -7.358 -4.905 -20.865 494 HG3 GLN 63 3HG GLN 63 -7.364 -3.811 -22.242 495 HE21 GLN 63 1HE2 GLN 63 -7.934 -7.077 -21.191 496 HE22 GLN 63 2HE2 GLN 63 -8.796 -7.597 -22.590 497 H HIS 64 H HIS 64 -3.106 -5.706 -20.233 498 HA HIS 64 HA HIS 64 -0.979 -6.894 -21.892 499 HB2 HIS 64 2HB HIS 64 -1.007 -3.997 -20.898 500 HB3 HIS 64 3HB HIS 64 0.412 -4.799 -21.561 501 HD1 HIS 64 HD1 HIS 64 0.679 -4.761 -24.074 502 HD2 HIS 64 HD2 HIS 64 -3.096 -3.515 -22.861 503 HE1 HIS 64 HE1 HIS 64 -0.440 -3.873 -26.136 504 HE2 HIS 64 HE2 HIS 64 -2.773 -3.291 -25.409 505 HA PRO 65 HA PRO 65 -0.621 -8.212 -17.434 506 HB2 PRO 65 2HB PRO 65 1.108 -10.338 -18.054 507 HB3 PRO 65 3HB PRO 65 -0.660 -10.447 -18.010 508 HG2 PRO 65 2HG PRO 65 1.135 -10.053 -20.380 509 HG3 PRO 65 3HG PRO 65 -0.304 -11.086 -20.215 510 HD2 PRO 65 2HD PRO 65 -0.463 -8.741 -21.496 511 HD3 PRO 65 3HD PRO 65 -1.791 -9.285 -20.443 512 H GLY 66 H GLY 66 1.978 -7.792 -19.796 513 HA2 GLY 66 2HA GLY 66 4.016 -6.766 -19.672 514 HA3 GLY 66 3HA GLY 66 3.581 -6.164 -18.078 515 H GLY 67 H GLY 67 4.137 -7.385 -16.228 516 HA2 GLY 67 2HA GLY 67 5.156 -9.051 -14.972 517 HA3 GLY 67 3HA GLY 67 5.553 -9.930 -16.439 518 H SER 68 H SER 68 7.037 -8.270 -17.897 519 HA SER 68 HA SER 68 9.555 -8.002 -16.503 520 HB2 SER 68 2HB SER 68 10.332 -7.290 -18.821 521 HB3 SER 68 3HB SER 68 9.531 -8.862 -18.782 522 HG SER 68 HG SER 68 8.509 -7.892 -20.406 523 H GLY 69 H GLY 69 10.863 -5.916 -17.082 524 HA2 GLY 69 2HA GLY 69 9.488 -3.562 -16.092 525 HA3 GLY 69 3HA GLY 69 11.192 -3.699 -16.504 526 H LEU 70 H LEU 70 7.962 -3.169 -17.789 527 HA LEU 70 HA LEU 70 8.614 -2.747 -20.514 528 HB2 LEU 70 2HB LEU 70 6.263 -1.857 -18.813 529 HB3 LEU 70 3HB LEU 70 6.407 -1.342 -20.483 530 HG LEU 70 HG LEU 70 6.281 -3.693 -21.247 531 HD11 LEU 70 1HD1 LEU 70 5.743 -5.530 -19.752 532 HD12 LEU 70 2HD1 LEU 70 5.866 -4.461 -18.353 533 HD13 LEU 70 3HD1 LEU 70 7.296 -4.815 -19.325 534 HD21 LEU 70 1HD2 LEU 70 3.984 -2.938 -19.409 535 HD22 LEU 70 2HD2 LEU 70 3.912 -4.110 -20.728 536 HD23 LEU 70 3HD2 LEU 70 4.201 -2.409 -21.080 537 H ASP 71 H ASP 71 10.412 -1.440 -20.717 538 HA ASP 71 HA ASP 71 10.565 1.214 -19.568 539 HB2 ASP 71 2HB ASP 71 12.625 -0.123 -19.897 540 HB3 ASP 71 3HB ASP 71 12.340 -0.158 -21.632 541 H ASP 72 H ASP 72 8.474 1.792 -20.441 542 HA ASP 72 HA ASP 72 8.579 3.526 -22.689 543 HB2 ASP 72 2HB ASP 72 8.336 1.433 -23.986 544 HB3 ASP 72 3HB ASP 72 6.952 0.954 -23.011 545 H ILE 73 H ILE 73 7.377 5.150 -21.913 546 HA ILE 73 HA ILE 73 5.311 4.744 -19.900 547 HB ILE 73 HB ILE 73 6.304 7.332 -21.194 548 HG12 ILE 73 2HG1 ILE 73 7.035 6.117 -18.483 549 HG13 ILE 73 3HG1 ILE 73 8.077 6.120 -19.898 550 HG21 ILE 73 1HG2 ILE 73 4.019 7.589 -20.269 551 HG22 ILE 73 2HG2 ILE 73 5.185 8.506 -19.316 552 HG23 ILE 73 3HG2 ILE 73 4.571 6.969 -18.709 553 HD11 ILE 73 1HD1 ILE 73 8.158 8.579 -19.806 554 HD12 ILE 73 2HD1 ILE 73 8.766 7.810 -18.343 555 HD13 ILE 73 3HD1 ILE 73 7.162 8.540 -18.347 556 HA PRO 74 HA PRO 74 2.273 4.743 -23.339 557 HB2 PRO 74 2HB PRO 74 0.280 3.781 -21.398 558 HB3 PRO 74 3HB PRO 74 1.006 2.905 -22.758 559 HG2 PRO 74 2HG PRO 74 1.505 2.264 -20.159 560 HG3 PRO 74 3HG PRO 74 2.681 1.988 -21.464 561 HD2 PRO 74 2HD PRO 74 2.570 4.261 -19.478 562 HD3 PRO 74 3HD PRO 74 3.970 3.301 -20.020 563 HA PRO 75 HA PRO 75 0.600 8.925 -22.505 564 HB2 PRO 75 2HB PRO 75 -1.351 7.912 -24.600 565 HB3 PRO 75 3HB PRO 75 -0.532 9.490 -24.489 566 HG2 PRO 75 2HG PRO 75 0.380 7.681 -26.185 567 HG3 PRO 75 3HG PRO 75 1.528 8.631 -25.212 568 HD2 PRO 75 2HD PRO 75 0.668 5.773 -24.863 569 HD3 PRO 75 3HD PRO 75 2.260 6.516 -24.586 570 H TYR 76 H TYR 76 -1.555 6.098 -22.774 571 HA TYR 76 HA TYR 76 -3.852 7.113 -21.546 572 HB2 TYR 76 2HB TYR 76 -4.035 5.043 -22.737 573 HB3 TYR 76 3HB TYR 76 -2.761 4.286 -21.789 574 HD1 TYR 76 HD1 TYR 76 -6.206 5.765 -21.358 575 HD2 TYR 76 HD2 TYR 76 -3.389 2.831 -20.032 576 HE1 TYR 76 HE1 TYR 76 -7.890 4.828 -19.828 577 HE2 TYR 76 HE2 TYR 76 -5.069 1.899 -18.508 578 HH TYR 76 HH TYR 76 -8.376 2.808 -18.620 579 H ASP 77 H ASP 77 -1.213 5.211 -20.067 580 HA ASP 77 HA ASP 77 -2.303 5.255 -17.432 581 HB2 ASP 77 2HB ASP 77 0.510 4.570 -18.384 582 HB3 ASP 77 3HB ASP 77 -0.108 4.261 -16.759 583 H ARG 78 H ARG 78 -0.101 7.347 -19.160 584 HA ARG 78 HA ARG 78 0.840 8.897 -16.980 585 HB2 ARG 78 2HB ARG 78 1.912 8.937 -19.206 586 HB3 ARG 78 3HB ARG 78 0.471 9.672 -19.909 587 HG2 ARG 78 2HG ARG 78 0.821 11.680 -18.477 588 HG3 ARG 78 3HG ARG 78 2.278 10.933 -17.817 589 HD2 ARG 78 2HD ARG 78 3.350 10.986 -20.001 590 HD3 ARG 78 3HD ARG 78 1.871 11.577 -20.756 591 HE ARG 78 HE ARG 78 3.561 13.103 -18.868 592 HH11 ARG 78 1HH1 ARG 78 1.192 13.114 -21.478 593 HH12 ARG 78 2HH1 ARG 78 1.246 14.841 -21.668 594 HH21 ARG 78 1HH2 ARG 78 3.596 15.357 -19.122 595 HH22 ARG 78 2HH2 ARG 78 2.603 16.106 -20.335 596 H ASP 79 H ASP 79 -1.886 9.403 -19.256 597 HA ASP 79 HA ASP 79 -2.974 11.705 -17.973 598 HB2 ASP 79 2HB ASP 79 -4.089 9.740 -19.997 599 HB3 ASP 79 3HB ASP 79 -5.130 10.978 -19.302 600 H PHE 80 H PHE 80 -3.279 8.305 -17.374 601 HA PHE 80 HA PHE 80 -5.618 8.227 -15.805 602 HB2 PHE 80 2HB PHE 80 -4.590 6.173 -16.665 603 HB3 PHE 80 3HB PHE 80 -3.118 6.475 -15.752 604 HD1 PHE 80 HD1 PHE 80 -6.727 5.669 -15.415 605 HD2 PHE 80 HD2 PHE 80 -2.911 5.713 -13.480 606 HE1 PHE 80 HE1 PHE 80 -7.654 4.426 -13.526 607 HE2 PHE 80 HE2 PHE 80 -3.859 4.465 -11.583 608 HZ PHE 80 HZ PHE 80 -6.238 3.823 -11.608 609 H CYS 81 H CYS 81 -2.216 8.767 -14.965 610 HA CYS 81 HA CYS 81 -2.630 9.036 -12.138 611 HB2 CYS 81 2HB CYS 81 -0.243 9.794 -13.867 612 HB3 CYS 81 3HB CYS 81 -0.237 9.677 -12.107 613 HG CYS 81 HG CYS 81 -1.139 6.949 -13.918 614 H LYS 82 H LYS 82 -3.141 11.179 -14.777 615 HA LYS 82 HA LYS 82 -2.687 13.664 -13.359 616 HB2 LYS 82 2HB LYS 82 -4.158 13.140 -15.977 617 HB3 LYS 82 3HB LYS 82 -3.770 14.735 -15.343 618 HG2 LYS 82 2HG LYS 82 -1.801 12.622 -16.245 619 HG3 LYS 82 3HG LYS 82 -2.205 14.118 -17.091 620 HD2 LYS 82 2HD LYS 82 -1.256 15.434 -15.211 621 HD3 LYS 82 3HD LYS 82 -0.859 13.934 -14.365 622 HE2 LYS 82 2HE LYS 82 1.123 14.822 -15.460 623 HE3 LYS 82 3HE LYS 82 0.655 13.306 -16.230 624 HZ1 LYS 82 1HZ LYS 82 -0.349 14.566 -18.019 625 HZ2 LYS 82 2HZ LYS 82 1.269 15.015 -17.829 626 HZ3 LYS 82 3HZ LYS 82 0.042 16.022 -17.261 627 H VAL 83 H VAL 83 -3.921 13.207 -11.494 628 HA VAL 83 HA VAL 83 -6.772 13.965 -11.733 629 HB VAL 83 HB VAL 83 -7.310 12.529 -9.761 630 HG11 VAL 83 1HG1 VAL 83 -6.166 10.924 -12.079 631 HG12 VAL 83 2HG1 VAL 83 -7.782 11.626 -11.996 632 HG13 VAL 83 3HG1 VAL 83 -7.330 10.330 -10.890 633 HG21 VAL 83 1HG2 VAL 83 -4.499 11.405 -10.071 634 HG22 VAL 83 2HG2 VAL 83 -5.746 10.767 -8.991 635 HG23 VAL 83 3HG2 VAL 83 -5.091 12.382 -8.724 636 H ASP 84 H ASP 84 -7.540 14.837 -9.491 637 HA ASP 84 HA ASP 84 -5.759 16.996 -8.766 638 HB2 ASP 84 2HB ASP 84 -8.417 16.977 -8.966 639 HB3 ASP 84 3HB ASP 84 -8.364 16.416 -7.297 640 H GLN 85 H GLN 85 -5.604 17.526 -6.248 641 HA GLN 85 HA GLN 85 -3.761 15.640 -5.275 642 HB2 GLN 85 2HB GLN 85 -3.447 17.998 -4.796 643 HB3 GLN 85 3HB GLN 85 -4.947 18.068 -3.880 644 HG2 GLN 85 2HG GLN 85 -3.057 18.074 -2.361 645 HG3 GLN 85 3HG GLN 85 -3.965 16.585 -2.159 646 HE21 GLN 85 1HE2 GLN 85 -1.248 17.133 -1.371 647 HE22 GLN 85 2HE2 GLN 85 -0.251 15.979 -2.180 648 HA PRO 86 HA PRO 86 -6.983 14.315 -1.772 649 HB2 PRO 86 2HB PRO 86 -9.674 14.598 -2.461 650 HB3 PRO 86 3HB PRO 86 -8.785 15.756 -1.451 651 HG2 PRO 86 2HG PRO 86 -9.331 15.894 -4.405 652 HG3 PRO 86 3HG PRO 86 -9.504 17.168 -3.174 653 HD2 PRO 86 2HD PRO 86 -7.357 17.122 -4.751 654 HD3 PRO 86 3HD PRO 86 -7.180 17.522 -3.025 655 H THR 87 H THR 87 -7.845 14.230 -5.201 656 HA THR 87 HA THR 87 -9.041 11.666 -5.298 657 HB THR 87 HB THR 87 -7.702 13.189 -7.583 658 HG1 THR 87 HG1 THR 87 -10.284 13.492 -6.415 659 HG21 THR 87 1HG2 THR 87 -10.050 11.252 -7.607 660 HG22 THR 87 2HG2 THR 87 -8.418 10.879 -8.168 661 HG23 THR 87 3HG2 THR 87 -9.382 12.095 -9.006 662 H LEU 88 H LEU 88 -5.703 12.790 -5.661 663 HA LEU 88 HA LEU 88 -4.420 10.434 -6.512 664 HB2 LEU 88 2HB LEU 88 -3.524 12.828 -4.884 665 HB3 LEU 88 3HB LEU 88 -2.425 11.487 -5.133 666 HG LEU 88 HG LEU 88 -3.679 13.032 -7.436 667 HD11 LEU 88 1HD1 LEU 88 -1.550 14.221 -7.668 668 HD12 LEU 88 2HD1 LEU 88 -0.939 13.451 -6.201 669 HD13 LEU 88 3HD1 LEU 88 -2.303 14.569 -6.112 670 HD21 LEU 88 1HD2 LEU 88 -2.908 10.769 -8.007 671 HD22 LEU 88 2HD2 LEU 88 -1.311 11.130 -7.344 672 HD23 LEU 88 3HD2 LEU 88 -1.895 11.994 -8.768 673 H PHE 89 H PHE 89 -5.081 11.677 -3.238 674 HA PHE 89 HA PHE 89 -4.032 9.472 -1.787 675 HB2 PHE 89 2HB PHE 89 -6.052 11.604 -0.977 676 HB3 PHE 89 3HB PHE 89 -5.368 10.428 0.145 677 HD1 PHE 89 HD1 PHE 89 -4.977 13.705 -1.111 678 HD2 PHE 89 HD2 PHE 89 -2.709 10.298 0.113 679 HE1 PHE 89 HE1 PHE 89 -3.032 15.146 -0.693 680 HE2 PHE 89 HE2 PHE 89 -0.778 11.748 0.530 681 HZ PHE 89 HZ PHE 89 -0.932 14.173 0.129 682 H GLU 90 H GLU 90 -7.201 10.126 -3.166 683 HA GLU 90 HA GLU 90 -8.656 8.035 -1.914 684 HB2 GLU 90 2HB GLU 90 -9.072 9.456 -4.576 685 HB3 GLU 90 3HB GLU 90 -10.216 8.300 -3.907 686 HG2 GLU 90 2HG GLU 90 -9.401 10.894 -2.586 687 HG3 GLU 90 3HG GLU 90 -10.874 10.650 -3.514 688 H LEU 91 H LEU 91 -6.705 8.159 -4.890 689 HA LEU 91 HA LEU 91 -7.229 5.478 -5.750 690 HB2 LEU 91 2HB LEU 91 -4.938 7.368 -6.420 691 HB3 LEU 91 3HB LEU 91 -5.188 5.821 -7.208 692 HG LEU 91 HG LEU 91 -7.103 8.191 -7.350 693 HD11 LEU 91 1HD1 LEU 91 -6.391 8.415 -9.688 694 HD12 LEU 91 2HD1 LEU 91 -5.233 7.099 -9.482 695 HD13 LEU 91 3HD1 LEU 91 -5.021 8.608 -8.593 696 HD21 LEU 91 1HD2 LEU 91 -8.309 6.059 -7.494 697 HD22 LEU 91 2HD2 LEU 91 -7.238 5.520 -8.789 698 HD23 LEU 91 3HD2 LEU 91 -8.316 6.893 -9.047 699 H ILE 92 H ILE 92 -4.745 6.955 -3.672 700 HA ILE 92 HA ILE 92 -3.117 4.675 -3.230 701 HB ILE 92 HB ILE 92 -3.654 7.040 -1.357 702 HG12 ILE 92 2HG1 ILE 92 -1.328 6.555 -3.282 703 HG13 ILE 92 3HG1 ILE 92 -2.633 7.707 -3.525 704 HG21 ILE 92 1HG2 ILE 92 -1.563 6.406 -0.175 705 HG22 ILE 92 2HG2 ILE 92 -1.435 4.963 -1.180 706 HG23 ILE 92 3HG2 ILE 92 -2.785 5.138 -0.059 707 HD11 ILE 92 1HD1 ILE 92 -0.617 8.819 -2.799 708 HD12 ILE 92 2HD1 ILE 92 -0.557 7.831 -1.339 709 HD13 ILE 92 3HD1 ILE 92 -1.878 8.980 -1.578 710 H LEU 93 H LEU 93 -5.935 5.978 -1.478 711 HA LEU 93 HA LEU 93 -6.039 4.080 0.612 712 HB2 LEU 93 2HB LEU 93 -8.139 5.950 -0.547 713 HB3 LEU 93 3HB LEU 93 -8.486 4.905 0.818 714 HG LEU 93 HG LEU 93 -6.378 7.103 0.797 715 HD11 LEU 93 1HD1 LEU 93 -7.876 8.336 2.291 716 HD12 LEU 93 2HD1 LEU 93 -9.088 7.057 2.167 717 HD13 LEU 93 3HD1 LEU 93 -8.661 8.013 0.746 718 HD21 LEU 93 1HD2 LEU 93 -5.728 5.271 2.286 719 HD22 LEU 93 2HD2 LEU 93 -7.302 5.327 3.086 720 HD23 LEU 93 3HD2 LEU 93 -6.190 6.693 3.219 721 H ALA 94 H ALA 94 -7.666 4.234 -2.545 722 HA ALA 94 HA ALA 94 -9.417 2.011 -2.155 723 HB1 ALA 94 1HB ALA 94 -9.871 3.803 -3.777 724 HB2 ALA 94 2HB ALA 94 -9.857 2.227 -4.566 725 HB3 ALA 94 3HB ALA 94 -8.473 3.313 -4.736 726 H ALA 95 H ALA 95 -6.266 2.374 -3.796 727 HA ALA 95 HA ALA 95 -6.103 -0.293 -4.792 728 HB1 ALA 95 1HB ALA 95 -3.767 0.240 -5.293 729 HB2 ALA 95 2HB ALA 95 -3.860 1.687 -4.282 730 HB3 ALA 95 3HB ALA 95 -4.821 1.577 -5.758 731 H ASN 96 H ASN 96 -4.884 1.280 -1.824 732 HA ASN 96 HA ASN 96 -3.544 -0.977 -0.733 733 HB2 ASN 96 2HB ASN 96 -3.216 1.453 -0.051 734 HB3 ASN 96 3HB ASN 96 -4.763 1.379 0.786 735 HD21 ASN 96 1HD2 ASN 96 -3.733 1.844 2.769 736 HD22 ASN 96 2HD2 ASN 96 -2.765 0.678 3.594 737 H TYR 97 H TYR 97 -6.846 0.252 -0.460 738 HA TYR 97 HA TYR 97 -7.889 -1.521 1.494 739 HB2 TYR 97 2HB TYR 97 -9.103 0.503 1.025 740 HB3 TYR 97 3HB TYR 97 -9.178 0.157 -0.696 741 HD1 TYR 97 HD1 TYR 97 -11.286 -0.526 -1.523 742 HD2 TYR 97 HD2 TYR 97 -10.338 -1.393 2.557 743 HE1 TYR 97 HE1 TYR 97 -13.541 -1.460 -1.198 744 HE2 TYR 97 HE2 TYR 97 -12.583 -2.327 2.872 745 HH TYR 97 HH TYR 97 -14.586 -3.243 0.571 746 H LEU 98 H LEU 98 -7.493 -1.783 -1.993 747 HA LEU 98 HA LEU 98 -8.827 -4.410 -2.053 748 HB2 LEU 98 2HB LEU 98 -7.889 -2.581 -4.301 749 HB3 LEU 98 3HB LEU 98 -8.656 -4.142 -4.541 750 HG LEU 98 HG LEU 98 -9.948 -1.689 -3.281 751 HD11 LEU 98 1HD1 LEU 98 -10.528 -3.056 -5.929 752 HD12 LEU 98 2HD1 LEU 98 -9.741 -1.492 -5.703 753 HD13 LEU 98 3HD1 LEU 98 -11.427 -1.697 -5.241 754 HD21 LEU 98 1HD2 LEU 98 -10.780 -3.683 -2.158 755 HD22 LEU 98 2HD2 LEU 98 -11.140 -4.449 -3.706 756 HD23 LEU 98 3HD2 LEU 98 -12.035 -3.013 -3.201 757 H ASP 99 H ASP 99 -5.780 -3.206 -1.567 758 HA ASP 99 HA ASP 99 -3.672 -3.985 -1.565 759 HB2 ASP 99 2HB ASP 99 -5.149 -6.643 -1.577 760 HB3 ASP 99 3HB ASP 99 -3.410 -6.521 -1.332 761 H ILE 100 H ILE 100 -4.887 -3.346 -4.118 762 HA ILE 100 HA ILE 100 -3.591 -4.978 -6.124 763 HB ILE 100 HB ILE 100 -4.831 -2.193 -6.391 764 HG12 ILE 100 2HG1 ILE 100 -6.033 -4.920 -7.045 765 HG13 ILE 100 3HG1 ILE 100 -6.442 -3.954 -5.636 766 HG21 ILE 100 1HG2 ILE 100 -4.886 -2.642 -8.834 767 HG22 ILE 100 2HG2 ILE 100 -4.067 -4.182 -8.574 768 HG23 ILE 100 3HG2 ILE 100 -3.229 -2.669 -8.222 769 HD11 ILE 100 1HD1 ILE 100 -6.969 -3.216 -8.507 770 HD12 ILE 100 2HD1 ILE 100 -7.352 -2.219 -7.101 771 HD13 ILE 100 3HD1 ILE 100 -8.143 -3.778 -7.318 772 H LYS 101 H LYS 101 -1.488 -5.025 -5.411 773 HA LYS 101 HA LYS 101 0.123 -2.944 -4.582 774 HB2 LYS 101 2HB LYS 101 0.710 -5.294 -4.221 775 HB3 LYS 101 3HB LYS 101 0.934 -5.541 -5.949 776 HG2 LYS 101 2HG LYS 101 3.087 -5.363 -4.771 777 HG3 LYS 101 3HG LYS 101 2.886 -4.048 -5.933 778 HD2 LYS 101 2HD LYS 101 2.181 -2.553 -4.037 779 HD3 LYS 101 3HD LYS 101 2.511 -3.876 -2.915 780 HE2 LYS 101 2HE LYS 101 4.558 -2.582 -4.744 781 HE3 LYS 101 3HE LYS 101 4.371 -2.244 -3.025 782 HZ1 LYS 101 1HZ LYS 101 6.147 -3.805 -3.411 783 HZ2 LYS 101 2HZ LYS 101 5.100 -4.864 -4.205 784 HZ3 LYS 101 3HZ LYS 101 4.897 -4.552 -2.560 785 HA PRO 102 HA PRO 102 1.772 -2.468 -9.315 786 HB2 PRO 102 2HB PRO 102 -0.968 -2.752 -10.571 787 HB3 PRO 102 3HB PRO 102 0.631 -3.142 -11.244 788 HG2 PRO 102 2HG PRO 102 -0.940 -5.095 -10.393 789 HG3 PRO 102 3HG PRO 102 0.806 -5.142 -10.053 790 HD2 PRO 102 2HD PRO 102 -1.459 -4.457 -8.203 791 HD3 PRO 102 3HD PRO 102 0.044 -5.347 -7.873 792 H LEU 103 H LEU 103 -1.656 -1.527 -8.752 793 HA LEU 103 HA LEU 103 -1.437 1.102 -9.800 794 HB2 LEU 103 2HB LEU 103 -3.528 -0.381 -9.420 795 HB3 LEU 103 3HB LEU 103 -3.524 0.221 -7.776 796 HG LEU 103 HG LEU 103 -3.710 2.073 -10.195 797 HD11 LEU 103 1HD1 LEU 103 -6.010 0.879 -8.629 798 HD12 LEU 103 2HD1 LEU 103 -5.562 0.495 -10.293 799 HD13 LEU 103 3HD1 LEU 103 -6.131 2.111 -9.891 800 HD21 LEU 103 1HD2 LEU 103 -4.509 2.556 -7.300 801 HD22 LEU 103 2HD2 LEU 103 -4.690 3.701 -8.634 802 HD23 LEU 103 3HD2 LEU 103 -3.083 3.216 -8.103 803 H LEU 104 H LEU 104 -1.375 -0.186 -6.504 804 HA LEU 104 HA LEU 104 -1.328 2.201 -5.043 805 HB2 LEU 104 2HB LEU 104 -1.847 -0.011 -4.100 806 HB3 LEU 104 3HB LEU 104 -0.196 -0.541 -4.382 807 HG LEU 104 HG LEU 104 0.606 1.124 -2.699 808 HD11 LEU 104 1HD1 LEU 104 -1.002 2.245 -1.206 809 HD12 LEU 104 2HD1 LEU 104 -2.336 1.686 -2.216 810 HD13 LEU 104 3HD1 LEU 104 -1.143 2.811 -2.870 811 HD21 LEU 104 1HD2 LEU 104 0.151 -1.207 -2.063 812 HD22 LEU 104 2HD2 LEU 104 -1.509 -0.772 -1.635 813 HD23 LEU 104 3HD2 LEU 104 -0.150 -0.086 -0.742 814 H ASP 105 H ASP 105 1.290 0.227 -6.355 815 HA ASP 105 HA ASP 105 3.530 1.526 -5.252 816 HB2 ASP 105 2HB ASP 105 3.641 -0.715 -6.315 817 HB3 ASP 105 3HB ASP 105 3.266 -0.012 -7.885 818 H VAL 106 H VAL 106 1.889 1.946 -8.383 819 HA VAL 106 HA VAL 106 3.522 3.970 -9.436 820 HB VAL 106 HB VAL 106 0.617 3.267 -10.052 821 HG11 VAL 106 1HG1 VAL 106 2.463 5.080 -11.659 822 HG12 VAL 106 2HG1 VAL 106 1.023 5.590 -10.777 823 HG13 VAL 106 3HG1 VAL 106 0.867 4.525 -12.174 824 HG21 VAL 106 1HG2 VAL 106 2.240 1.464 -10.515 825 HG22 VAL 106 2HG2 VAL 106 3.183 2.562 -11.527 826 HG23 VAL 106 3HG2 VAL 106 1.550 2.095 -12.013 827 H THR 107 H THR 107 0.431 4.211 -7.626 828 HA THR 107 HA THR 107 0.171 7.033 -8.004 829 HB THR 107 HB THR 107 -1.313 5.282 -5.988 830 HG1 THR 107 HG1 THR 107 -1.438 4.600 -8.245 831 HG21 THR 107 1HG2 THR 107 -1.608 7.723 -5.592 832 HG22 THR 107 2HG2 THR 107 -3.096 6.983 -6.182 833 HG23 THR 107 3HG2 THR 107 -2.094 7.935 -7.278 834 H CYS 108 H CYS 108 1.409 5.038 -5.333 835 HA CYS 108 HA CYS 108 1.813 7.108 -3.426 836 HB2 CYS 108 2HB CYS 108 3.275 4.459 -3.767 837 HB3 CYS 108 3HB CYS 108 3.440 5.517 -2.365 838 HG CYS 108 HG CYS 108 0.404 4.267 -3.285 839 H LYS 109 H LYS 109 3.779 5.860 -6.099 840 HA LYS 109 HA LYS 109 6.026 7.588 -5.611 841 HB2 LYS 109 2HB LYS 109 5.251 5.817 -7.958 842 HB3 LYS 109 3HB LYS 109 6.720 6.796 -7.957 843 HG2 LYS 109 2HG LYS 109 7.598 5.619 -6.038 844 HG3 LYS 109 3HG LYS 109 6.079 4.753 -5.802 845 HD2 LYS 109 2HD LYS 109 6.429 3.542 -7.928 846 HD3 LYS 109 3HD LYS 109 7.939 4.423 -8.196 847 HE2 LYS 109 2HE LYS 109 8.948 3.400 -6.245 848 HE3 LYS 109 3HE LYS 109 7.416 2.659 -5.780 849 HZ1 LYS 109 1HZ LYS 109 7.497 1.271 -7.712 850 HZ2 LYS 109 2HZ LYS 109 8.936 1.100 -6.846 851 HZ3 LYS 109 3HZ LYS 109 8.910 2.017 -8.265 852 H THR 110 H THR 110 3.044 7.872 -7.480 853 HA THR 110 HA THR 110 3.756 10.050 -9.155 854 HB THR 110 HB THR 110 1.002 9.210 -8.120 855 HG1 THR 110 HG1 THR 110 2.513 7.901 -9.691 856 HG21 THR 110 1HG2 THR 110 1.680 11.096 -10.420 857 HG22 THR 110 2HG2 THR 110 0.888 11.550 -8.906 858 HG23 THR 110 3HG2 THR 110 0.067 10.481 -10.047 859 H VAL 111 H VAL 111 2.107 9.947 -5.962 860 HA VAL 111 HA VAL 111 1.975 12.761 -5.591 861 HB VAL 111 HB VAL 111 1.498 12.327 -3.211 862 HG11 VAL 111 1HG1 VAL 111 -0.337 12.089 -4.813 863 HG12 VAL 111 2HG1 VAL 111 -0.539 10.965 -3.469 864 HG13 VAL 111 3HG1 VAL 111 0.043 10.377 -5.032 865 HG21 VAL 111 1HG2 VAL 111 2.157 9.413 -3.779 866 HG22 VAL 111 2HG2 VAL 111 1.441 10.030 -2.287 867 HG23 VAL 111 3HG2 VAL 111 3.074 10.511 -2.745 868 H ALA 112 H ALA 112 4.469 10.369 -4.932 869 HA ALA 112 HA ALA 112 6.231 12.038 -3.431 870 HB1 ALA 112 1HB ALA 112 7.882 10.264 -3.799 871 HB2 ALA 112 2HB ALA 112 6.829 9.519 -5.007 872 HB3 ALA 112 3HB ALA 112 6.322 9.592 -3.319 873 H ASN 113 H ASN 113 5.678 11.598 -6.888 874 HA ASN 113 HA ASN 113 8.127 12.783 -7.790 875 HB2 ASN 113 2HB ASN 113 5.526 12.096 -9.179 876 HB3 ASN 113 3HB ASN 113 6.661 13.158 -9.998 877 HD21 ASN 113 1HD2 ASN 113 5.905 9.902 -9.278 878 HD22 ASN 113 2HD2 ASN 113 7.321 9.185 -9.961 879 H MET 114 H MET 114 5.110 14.112 -6.685 880 HA MET 114 HA MET 114 5.403 16.744 -7.801 881 HB2 MET 114 2HB MET 114 3.808 15.878 -5.356 882 HB3 MET 114 3HB MET 114 3.617 17.394 -6.225 883 HG2 MET 114 2HG MET 114 2.929 16.072 -8.243 884 HG3 MET 114 3HG MET 114 2.963 14.622 -7.239 885 HE1 MET 114 1HE MET 114 0.181 15.545 -4.560 886 HE2 MET 114 2HE MET 114 1.896 15.925 -4.426 887 HE3 MET 114 3HE MET 114 1.382 14.351 -5.032 888 H ILE 115 H ILE 115 6.407 15.198 -4.826 889 HA ILE 115 HA ILE 115 7.595 17.685 -3.760 890 HB ILE 115 HB ILE 115 7.775 16.513 -1.593 891 HG12 ILE 115 2HG1 ILE 115 6.409 14.107 -2.905 892 HG13 ILE 115 3HG1 ILE 115 8.135 14.192 -2.582 893 HG21 ILE 115 1HG2 ILE 115 4.980 16.254 -2.799 894 HG22 ILE 115 2HG2 ILE 115 5.674 17.710 -2.086 895 HG23 ILE 115 3HG2 ILE 115 5.350 16.305 -1.071 896 HD11 ILE 115 1HD1 ILE 115 5.967 14.285 -0.491 897 HD12 ILE 115 2HD1 ILE 115 7.710 14.313 -0.196 898 HD13 ILE 115 3HD1 ILE 115 6.959 12.890 -0.915 899 H ARG 116 H ARG 116 8.601 15.503 -5.839 900 HA ARG 116 HA ARG 116 10.641 13.897 -4.935 901 HB2 ARG 116 2HB ARG 116 9.425 13.938 -7.192 902 HB3 ARG 116 3HB ARG 116 10.545 15.197 -7.692 903 HG2 ARG 116 2HG ARG 116 12.435 13.555 -7.313 904 HG3 ARG 116 3HG ARG 116 11.214 12.316 -7.005 905 HD2 ARG 116 2HD ARG 116 10.291 12.680 -9.285 906 HD3 ARG 116 3HD ARG 116 11.543 13.885 -9.589 907 HE ARG 116 HE ARG 116 11.854 10.983 -9.492 908 HH11 ARG 116 1HH1 ARG 116 13.507 14.081 -9.737 909 HH12 ARG 116 2HH1 ARG 116 14.965 13.387 -10.367 910 HH21 ARG 116 1HH2 ARG 116 13.763 10.089 -10.324 911 HH22 ARG 116 2HH2 ARG 116 15.108 11.124 -10.701 912 H GLY 117 H GLY 117 11.733 15.541 -3.434 913 HA2 GLY 117 2HA GLY 117 13.370 17.653 -4.108 914 HA3 GLY 117 3HA GLY 117 13.572 16.617 -2.705 915 H1 SER 2 1H SER 2 18.221 -13.271 17.364 916 H2 SER 2 2H SER 2 19.603 -13.610 16.449 917 H3 SER 2 3H SER 2 18.733 -14.866 17.166 918 HA SER 2 HA SER 2 18.343 -14.685 14.777 919 HB2 SER 2 2HB SER 2 15.942 -14.128 16.572 920 HB3 SER 2 3HB SER 2 15.876 -14.893 14.982 921 HG SER 2 HG SER 2 16.795 -16.688 15.780 922 H LEU 3 H LEU 3 19.396 -12.052 15.471 923 HA LEU 3 HA LEU 3 17.456 -10.058 14.624 924 HB2 LEU 3 2HB LEU 3 20.439 -9.797 15.195 925 HB3 LEU 3 3HB LEU 3 19.323 -8.458 14.971 926 HG LEU 3 HG LEU 3 19.149 -10.459 17.262 927 HD11 LEU 3 1HD1 LEU 3 20.283 -7.645 17.298 928 HD12 LEU 3 2HD1 LEU 3 21.200 -9.148 17.447 929 HD13 LEU 3 3HD1 LEU 3 20.048 -8.698 18.699 930 HD21 LEU 3 1HD2 LEU 3 17.584 -8.861 18.273 931 HD22 LEU 3 2HD2 LEU 3 16.983 -9.457 16.729 932 HD23 LEU 3 3HD2 LEU 3 17.679 -7.837 16.836 933 H VAL 4 H VAL 4 17.018 -9.864 12.476 934 HA VAL 4 HA VAL 4 19.061 -10.198 10.420 935 HB VAL 4 HB VAL 4 17.277 -9.502 8.804 936 HG11 VAL 4 1HG1 VAL 4 15.874 -11.528 9.035 937 HG12 VAL 4 2HG1 VAL 4 16.464 -11.749 10.684 938 HG13 VAL 4 3HG1 VAL 4 17.580 -11.875 9.322 939 HG21 VAL 4 1HG2 VAL 4 15.954 -7.993 10.228 940 HG22 VAL 4 2HG2 VAL 4 15.458 -9.347 11.244 941 HG23 VAL 4 3HG2 VAL 4 14.924 -9.262 9.563 942 H LYS 5 H LYS 5 20.177 -8.574 9.499 943 HA LYS 5 HA LYS 5 20.021 -5.929 10.800 944 HB2 LYS 5 2HB LYS 5 22.362 -7.245 9.348 945 HB3 LYS 5 3HB LYS 5 22.414 -5.755 10.288 946 HG2 LYS 5 2HG LYS 5 21.745 -7.094 12.324 947 HG3 LYS 5 3HG LYS 5 21.901 -8.555 11.348 948 HD2 LYS 5 2HD LYS 5 24.317 -8.038 10.997 949 HD3 LYS 5 3HD LYS 5 24.140 -6.595 12.001 950 HE2 LYS 5 2HE LYS 5 23.408 -8.081 13.892 951 HE3 LYS 5 3HE LYS 5 23.789 -9.478 12.884 952 HZ1 LYS 5 1HZ LYS 5 25.739 -7.382 13.660 953 HZ2 LYS 5 2HZ LYS 5 26.079 -8.818 12.834 954 HZ3 LYS 5 3HZ LYS 5 25.565 -8.868 14.443 955 H LEU 6 H LEU 6 19.504 -4.196 9.611 956 HA LEU 6 HA LEU 6 19.164 -4.495 6.675 957 HB2 LEU 6 2HB LEU 6 17.386 -2.888 8.566 958 HB3 LEU 6 3HB LEU 6 17.111 -3.174 6.856 959 HG LEU 6 HG LEU 6 16.984 -5.311 9.027 960 HD11 LEU 6 1HD1 LEU 6 14.556 -5.288 8.700 961 HD12 LEU 6 2HD1 LEU 6 14.705 -3.950 7.558 962 HD13 LEU 6 3HD1 LEU 6 15.143 -3.720 9.253 963 HD21 LEU 6 1HD2 LEU 6 16.005 -6.768 7.291 964 HD22 LEU 6 2HD2 LEU 6 17.651 -6.286 6.889 965 HD23 LEU 6 3HD2 LEU 6 16.287 -5.514 6.076 966 H GLU 7 H GLU 7 21.072 -3.383 6.075 967 HA GLU 7 HA GLU 7 21.702 -0.776 7.122 968 HB2 GLU 7 2HB GLU 7 22.755 -2.181 4.633 969 HB3 GLU 7 3HB GLU 7 23.305 -0.597 5.177 970 HG2 GLU 7 2HG GLU 7 24.933 -2.116 5.953 971 HG3 GLU 7 3HG GLU 7 23.969 -1.707 7.369 972 H SER 8 H SER 8 20.347 0.812 6.801 973 HA SER 8 HA SER 8 18.525 1.182 4.671 974 HB2 SER 8 2HB SER 8 18.374 3.530 5.646 975 HB3 SER 8 3HB SER 8 18.152 2.230 6.820 976 HG SER 8 HG SER 8 20.061 2.659 7.705 977 H SER 9 H SER 9 18.635 3.538 3.541 978 HA SER 9 HA SER 9 20.613 3.660 1.572 979 HB2 SER 9 2HB SER 9 18.399 4.783 1.404 980 HB3 SER 9 3HB SER 9 18.888 5.945 2.637 981 HG SER 9 HG SER 9 20.613 5.696 0.476 982 H ASP 10 H ASP 10 20.532 4.995 4.811 983 HA ASP 10 HA ASP 10 22.999 6.544 4.539 984 HB2 ASP 10 2HB ASP 10 21.176 6.005 6.922 985 HB3 ASP 10 3HB ASP 10 22.566 7.076 6.958 986 H GLU 11 H GLU 11 22.570 3.349 4.664 987 HA GLU 11 HA GLU 11 23.837 1.544 5.137 988 HB2 GLU 11 2HB GLU 11 25.982 3.642 5.668 989 HB3 GLU 11 3HB GLU 11 26.305 1.913 5.557 990 HG2 GLU 11 2HG GLU 11 25.633 1.868 3.233 991 HG3 GLU 11 3HG GLU 11 25.075 3.535 3.311 992 H LYS 12 H LYS 12 22.384 3.035 7.383 993 HA LYS 12 HA LYS 12 23.824 2.398 9.806 994 HB2 LYS 12 2HB LYS 12 20.914 3.205 9.364 995 HB3 LYS 12 3HB LYS 12 21.676 3.062 10.942 996 HG2 LYS 12 2HG LYS 12 22.536 5.018 8.785 997 HG3 LYS 12 3HG LYS 12 21.462 5.409 10.130 998 HD2 LYS 12 2HD LYS 12 23.267 4.909 11.738 999 HD3 LYS 12 3HD LYS 12 24.345 4.468 10.408 1000 HE2 LYS 12 2HE LYS 12 24.272 6.767 9.553 1001 HE3 LYS 12 3HE LYS 12 23.122 7.223 10.812 1002 HZ1 LYS 12 1HZ LYS 12 25.904 6.290 11.282 1003 HZ2 LYS 12 2HZ LYS 12 24.804 6.758 12.476 1004 HZ3 LYS 12 3HZ LYS 12 25.376 7.893 11.365 1005 H VAL 13 H VAL 13 23.903 0.441 10.692 1006 HA VAL 13 HA VAL 13 22.528 -1.815 9.538 1007 HB VAL 13 HB VAL 13 24.427 -1.727 11.937 1008 HG11 VAL 13 1HG1 VAL 13 23.606 -4.097 10.213 1009 HG12 VAL 13 2HG1 VAL 13 23.090 -3.795 11.874 1010 HG13 VAL 13 3HG1 VAL 13 24.787 -4.129 11.527 1011 HG21 VAL 13 1HG2 VAL 13 25.512 -0.817 9.914 1012 HG22 VAL 13 2HG2 VAL 13 25.101 -2.282 9.020 1013 HG23 VAL 13 3HG2 VAL 13 26.226 -2.364 10.378 1014 H PHE 14 H PHE 14 20.367 -1.678 10.041 1015 HA PHE 14 HA PHE 14 19.423 -1.319 12.775 1016 HB2 PHE 14 2HB PHE 14 18.001 -1.683 10.114 1017 HB3 PHE 14 3HB PHE 14 17.136 -1.654 11.648 1018 HD1 PHE 14 HD1 PHE 14 18.532 0.393 9.032 1019 HD2 PHE 14 HD2 PHE 14 17.455 0.390 13.174 1020 HE1 PHE 14 HE1 PHE 14 18.493 2.852 9.034 1021 HE2 PHE 14 HE2 PHE 14 17.419 2.845 13.163 1022 HZ PHE 14 HZ PHE 14 17.939 4.079 11.096 1023 H GLU 15 H GLU 15 20.242 -3.063 13.814 1024 HA GLU 15 HA GLU 15 19.711 -5.810 13.091 1025 HB2 GLU 15 2HB GLU 15 20.656 -4.670 15.756 1026 HB3 GLU 15 3HB GLU 15 20.823 -6.335 15.200 1027 HG2 GLU 15 2HG GLU 15 22.394 -5.625 13.453 1028 HG3 GLU 15 3HG GLU 15 22.166 -3.941 13.911 1029 H ILE 16 H ILE 16 17.548 -6.257 13.075 1030 HA ILE 16 HA ILE 16 15.973 -5.849 15.549 1031 HB ILE 16 HB ILE 16 15.293 -4.168 13.832 1032 HG12 ILE 16 2HG1 ILE 16 13.141 -6.284 14.278 1033 HG13 ILE 16 3HG1 ILE 16 13.638 -5.102 15.476 1034 HG21 ILE 16 1HG2 ILE 16 14.196 -4.835 11.725 1035 HG22 ILE 16 2HG2 ILE 16 14.517 -6.532 12.082 1036 HG23 ILE 16 3HG2 ILE 16 15.860 -5.428 11.784 1037 HD11 ILE 16 1HD1 ILE 16 12.294 -4.535 12.848 1038 HD12 ILE 16 2HD1 ILE 16 12.881 -3.306 13.972 1039 HD13 ILE 16 3HD1 ILE 16 11.601 -4.411 14.465 1040 H GLU 17 H GLU 17 14.363 -7.490 15.917 1041 HA GLU 17 HA GLU 17 15.234 -10.112 15.409 1042 HB2 GLU 17 2HB GLU 17 12.481 -9.182 16.325 1043 HB3 GLU 17 3HB GLU 17 13.109 -10.821 16.490 1044 HG2 GLU 17 2HG GLU 17 14.839 -10.042 18.033 1045 HG3 GLU 17 3HG GLU 17 14.329 -8.370 17.805 1046 H LYS 18 H LYS 18 14.697 -11.631 13.969 1047 HA LYS 18 HA LYS 18 13.902 -11.027 11.381 1048 HB2 LYS 18 2HB LYS 18 15.270 -12.991 11.997 1049 HB3 LYS 18 3HB LYS 18 13.880 -13.717 12.797 1050 HG2 LYS 18 2HG LYS 18 12.717 -13.662 10.484 1051 HG3 LYS 18 3HG LYS 18 14.314 -13.287 9.822 1052 HD2 LYS 18 2HD LYS 18 13.896 -15.703 9.670 1053 HD3 LYS 18 3HD LYS 18 15.204 -15.391 10.815 1054 HE2 LYS 18 2HE LYS 18 13.487 -15.560 12.681 1055 HE3 LYS 18 3HE LYS 18 12.318 -16.087 11.471 1056 HZ1 LYS 18 1HZ LYS 18 13.352 -17.943 12.631 1057 HZ2 LYS 18 2HZ LYS 18 14.878 -17.463 12.084 1058 HZ3 LYS 18 3HZ LYS 18 13.711 -17.977 10.983 1059 H GLU 19 H GLU 19 12.048 -12.365 14.074 1060 HA GLU 19 HA GLU 19 9.671 -13.172 12.903 1061 HB2 GLU 19 2HB GLU 19 9.952 -11.749 15.589 1062 HB3 GLU 19 3HB GLU 19 8.628 -12.806 15.108 1063 HG2 GLU 19 2HG GLU 19 10.194 -14.721 15.024 1064 HG3 GLU 19 3HG GLU 19 11.507 -13.653 15.528 1065 H ILE 20 H ILE 20 10.724 -9.972 13.817 1066 HA ILE 20 HA ILE 20 8.240 -8.589 13.460 1067 HB ILE 20 HB ILE 20 11.084 -7.473 13.608 1068 HG12 ILE 20 2HG1 ILE 20 9.118 -8.071 15.865 1069 HG13 ILE 20 3HG1 ILE 20 10.638 -8.900 15.568 1070 HG21 ILE 20 1HG2 ILE 20 8.424 -6.135 14.179 1071 HG22 ILE 20 2HG2 ILE 20 9.463 -5.833 12.786 1072 HG23 ILE 20 3HG2 ILE 20 10.013 -5.402 14.405 1073 HD11 ILE 20 1HD1 ILE 20 10.843 -7.388 17.423 1074 HD12 ILE 20 2HD1 ILE 20 10.313 -6.030 16.432 1075 HD13 ILE 20 3HD1 ILE 20 11.850 -6.831 16.088 1076 H ALA 21 H ALA 21 11.220 -9.008 11.573 1077 HA ALA 21 HA ALA 21 10.409 -7.431 9.306 1078 HB1 ALA 21 1HB ALA 21 12.484 -8.250 8.283 1079 HB2 ALA 21 2HB ALA 21 12.677 -9.427 9.588 1080 HB3 ALA 21 3HB ALA 21 12.768 -7.699 9.934 1081 H CYS 22 H CYS 22 9.624 -10.620 10.295 1082 HA CYS 22 HA CYS 22 9.183 -11.813 7.724 1083 HB2 CYS 22 2HB CYS 22 8.075 -12.528 10.462 1084 HB3 CYS 22 3HB CYS 22 7.834 -13.505 9.013 1085 HG CYS 22 HG CYS 22 10.892 -13.420 8.847 1086 H MET 23 H MET 23 7.313 -9.662 9.758 1087 HA MET 23 HA MET 23 4.766 -10.021 8.484 1088 HB2 MET 23 2HB MET 23 5.798 -7.555 9.933 1089 HB3 MET 23 3HB MET 23 4.114 -7.938 9.593 1090 HG2 MET 23 2HG MET 23 4.312 -9.926 11.087 1091 HG3 MET 23 3HG MET 23 5.956 -9.414 11.489 1092 HE1 MET 23 1HE MET 23 6.500 -7.025 12.590 1093 HE2 MET 23 2HE MET 23 5.266 -5.938 13.220 1094 HE3 MET 23 3HE MET 23 5.464 -6.122 11.479 1095 H SER 24 H SER 24 7.550 -7.958 7.937 1096 HA SER 24 HA SER 24 6.582 -6.571 5.637 1097 HB2 SER 24 2HB SER 24 8.560 -5.732 6.846 1098 HB3 SER 24 3HB SER 24 9.428 -7.238 6.539 1099 HG SER 24 HG SER 24 8.434 -5.653 4.431 1100 H VAL 25 H VAL 25 5.851 -7.719 3.940 1101 HA VAL 25 HA VAL 25 6.403 -10.400 3.328 1102 HB VAL 25 HB VAL 25 5.343 -8.224 1.458 1103 HG11 VAL 25 1HG1 VAL 25 6.062 -10.181 0.161 1104 HG12 VAL 25 2HG1 VAL 25 4.302 -10.056 0.153 1105 HG13 VAL 25 3HG1 VAL 25 5.098 -11.243 1.188 1106 HG21 VAL 25 1HG2 VAL 25 3.081 -9.012 2.096 1107 HG22 VAL 25 2HG2 VAL 25 3.972 -8.415 3.496 1108 HG23 VAL 25 3HG2 VAL 25 3.800 -10.151 3.240 1109 H THR 26 H THR 26 7.807 -7.392 2.111 1110 HA THR 26 HA THR 26 9.317 -8.442 -0.029 1111 HB THR 26 HB THR 26 9.798 -5.892 1.573 1112 HG1 THR 26 HG1 THR 26 8.490 -5.028 -0.191 1113 HG21 THR 26 1HG2 THR 26 10.589 -6.565 -1.294 1114 HG22 THR 26 2HG2 THR 26 11.709 -6.435 0.065 1115 HG23 THR 26 3HG2 THR 26 10.824 -5.011 -0.488 1116 H ILE 27 H ILE 27 10.383 -7.504 3.298 1117 HA ILE 27 HA ILE 27 13.099 -8.268 2.984 1118 HB ILE 27 HB ILE 27 11.479 -8.046 5.568 1119 HG12 ILE 27 2HG1 ILE 27 13.367 -6.006 4.295 1120 HG13 ILE 27 3HG1 ILE 27 11.610 -5.926 4.216 1121 HG21 ILE 27 1HG2 ILE 27 13.665 -7.840 6.740 1122 HG22 ILE 27 2HG2 ILE 27 14.505 -8.153 5.221 1123 HG23 ILE 27 3HG2 ILE 27 13.500 -9.409 5.945 1124 HD11 ILE 27 1HD1 ILE 27 11.511 -5.685 6.647 1125 HD12 ILE 27 2HD1 ILE 27 12.471 -4.416 5.889 1126 HD13 ILE 27 3HD1 ILE 27 13.275 -5.744 6.726 1127 H LYS 28 H LYS 28 10.244 -9.978 4.264 1128 HA LYS 28 HA LYS 28 11.461 -12.348 5.154 1129 HB2 LYS 28 2HB LYS 28 9.116 -11.687 5.692 1130 HB3 LYS 28 3HB LYS 28 8.654 -11.992 4.019 1131 HG2 LYS 28 2HG LYS 28 9.273 -14.403 4.322 1132 HG3 LYS 28 3HG LYS 28 9.652 -14.061 6.013 1133 HD2 LYS 28 2HD LYS 28 7.434 -15.044 5.872 1134 HD3 LYS 28 3HD LYS 28 7.289 -13.361 6.378 1135 HE2 LYS 28 2HE LYS 28 5.559 -13.823 4.765 1136 HE3 LYS 28 3HE LYS 28 6.737 -12.766 3.988 1137 HZ1 LYS 28 1HZ LYS 28 7.666 -14.658 2.853 1138 HZ2 LYS 28 2HZ LYS 28 6.001 -14.613 2.572 1139 HZ3 LYS 28 3HZ LYS 28 6.638 -15.717 3.675 1140 H ASN 29 H ASN 29 10.081 -11.487 1.969 1141 HA ASN 29 HA ASN 29 10.504 -14.017 0.734 1142 HB2 ASN 29 2HB ASN 29 10.028 -11.259 -0.459 1143 HB3 ASN 29 3HB ASN 29 10.247 -12.687 -1.462 1144 HD21 ASN 29 1HD2 ASN 29 8.773 -14.436 0.471 1145 HD22 ASN 29 2HD2 ASN 29 7.115 -14.021 0.236 1146 H MET 30 H MET 30 12.531 -11.154 1.070 1147 HA MET 30 HA MET 30 14.609 -11.932 -0.709 1148 HB2 MET 30 2HB MET 30 14.594 -10.065 1.700 1149 HB3 MET 30 3HB MET 30 16.025 -10.317 0.706 1150 HG2 MET 30 2HG MET 30 14.856 -9.455 -1.256 1151 HG3 MET 30 3HG MET 30 13.375 -9.270 -0.315 1152 HE1 MET 30 1HE MET 30 13.260 -6.732 -1.222 1153 HE2 MET 30 2HE MET 30 14.787 -6.937 -2.081 1154 HE3 MET 30 3HE MET 30 14.563 -5.567 -0.995 1155 H ILE 31 H ILE 31 14.057 -12.490 2.756 1156 HA ILE 31 HA ILE 31 16.440 -13.899 3.353 1157 HB ILE 31 HB ILE 31 13.686 -14.086 4.675 1158 HG12 ILE 31 2HG1 ILE 31 16.146 -12.480 5.518 1159 HG13 ILE 31 3HG1 ILE 31 14.742 -11.804 4.708 1160 HG21 ILE 31 1HG2 ILE 31 14.844 -15.031 6.654 1161 HG22 ILE 31 2HG2 ILE 31 16.361 -15.055 5.754 1162 HG23 ILE 31 3HG2 ILE 31 15.020 -16.080 5.244 1163 HD11 ILE 31 1HD1 ILE 31 14.783 -13.037 7.458 1164 HD12 ILE 31 2HD1 ILE 31 13.351 -12.403 6.638 1165 HD13 ILE 31 3HD1 ILE 31 14.677 -11.321 7.062 1166 H GLU 32 H GLU 32 13.186 -15.044 2.383 1167 HA GLU 32 HA GLU 32 13.714 -17.832 2.371 1168 HB2 GLU 32 2HB GLU 32 11.620 -16.214 0.856 1169 HB3 GLU 32 3HB GLU 32 11.611 -17.973 0.974 1170 HG2 GLU 32 2HG GLU 32 11.208 -17.899 3.344 1171 HG3 GLU 32 3HG GLU 32 11.479 -16.158 3.403 1172 H ASP 33 H ASP 33 14.105 -15.339 -0.085 1173 HA ASP 33 HA ASP 33 14.437 -16.998 -2.386 1174 HB2 ASP 33 2HB ASP 33 13.797 -14.656 -2.630 1175 HB3 ASP 33 3HB ASP 33 15.261 -14.111 -1.823 1176 H ILE 34 H ILE 34 16.721 -15.403 -0.186 1177 HA ILE 34 HA ILE 34 19.121 -16.496 -1.315 1178 HB ILE 34 HB ILE 34 18.626 -15.340 1.482 1179 HG12 ILE 34 2HG1 ILE 34 19.791 -13.946 -0.980 1180 HG13 ILE 34 3HG1 ILE 34 18.129 -13.762 -0.436 1181 HG21 ILE 34 1HG2 ILE 34 21.269 -15.805 0.040 1182 HG22 ILE 34 2HG2 ILE 34 20.684 -16.699 1.445 1183 HG23 ILE 34 3HG2 ILE 34 21.083 -14.987 1.594 1184 HD11 ILE 34 1HD1 ILE 34 20.599 -12.921 1.080 1185 HD12 ILE 34 2HD1 ILE 34 18.938 -12.781 1.667 1186 HD13 ILE 34 3HD1 ILE 34 19.451 -11.872 0.247 1187 H GLY 35 H GLY 35 16.703 -17.645 0.916 1188 HA2 GLY 35 2HA GLY 35 16.361 -19.828 1.670 1189 HA3 GLY 35 3HA GLY 35 18.007 -20.257 1.218 1190 H GLU 36 H GLU 36 17.623 -17.356 2.962 1191 HA GLU 36 HA GLU 36 17.989 -16.576 5.001 1192 HB2 GLU 36 2HB GLU 36 16.216 -18.122 5.763 1193 HB3 GLU 36 3HB GLU 36 17.411 -19.389 6.014 1194 HG2 GLU 36 2HG GLU 36 18.533 -17.928 7.714 1195 HG3 GLU 36 3HG GLU 36 17.242 -16.746 7.508 1196 H SER 37 H SER 37 20.063 -15.991 4.792 1197 HA SER 37 HA SER 37 22.209 -17.804 5.736 1198 HB2 SER 37 2HB SER 37 23.738 -16.268 4.444 1199 HB3 SER 37 3HB SER 37 22.557 -17.072 3.409 1200 HG SER 37 HG SER 37 22.707 -14.837 2.944 1201 H ASP 38 H ASP 38 24.082 -16.291 6.617 1202 HA ASP 38 HA ASP 38 23.034 -14.677 8.801 1203 HB2 ASP 38 2HB ASP 38 25.941 -15.181 8.028 1204 HB3 ASP 38 3HB ASP 38 25.363 -14.519 9.556 1205 H SER 39 H SER 39 23.924 -14.162 5.585 1206 HA SER 39 HA SER 39 25.084 -11.621 5.543 1207 HB2 SER 39 2HB SER 39 23.235 -12.932 3.494 1208 HB3 SER 39 3HB SER 39 24.224 -11.498 3.189 1209 HG SER 39 HG SER 39 25.656 -13.576 4.230 1210 HA PRO 40 HA PRO 40 21.534 -9.097 6.857 1211 HB2 PRO 40 2HB PRO 40 22.594 -6.632 6.280 1212 HB3 PRO 40 3HB PRO 40 23.139 -7.596 7.668 1213 HG2 PRO 40 2HG PRO 40 24.412 -7.328 4.966 1214 HG3 PRO 40 3HG PRO 40 25.168 -7.267 6.574 1215 HD2 PRO 40 2HD PRO 40 25.229 -9.509 5.059 1216 HD3 PRO 40 3HD PRO 40 25.139 -9.573 6.831 1217 H ILE 41 H ILE 41 19.957 -7.664 5.879 1218 HA ILE 41 HA ILE 41 19.834 -7.804 2.920 1219 HB ILE 41 HB ILE 41 17.534 -7.600 4.938 1220 HG12 ILE 41 2HG1 ILE 41 16.813 -9.840 3.773 1221 HG13 ILE 41 3HG1 ILE 41 18.465 -9.916 3.179 1222 HG21 ILE 41 1HG2 ILE 41 17.373 -7.660 1.905 1223 HG22 ILE 41 2HG2 ILE 41 16.999 -6.283 2.941 1224 HG23 ILE 41 3HG2 ILE 41 15.991 -7.728 3.004 1225 HD11 ILE 41 1HD1 ILE 41 18.144 -11.304 5.149 1226 HD12 ILE 41 2HD1 ILE 41 17.622 -9.900 6.078 1227 HD13 ILE 41 3HD1 ILE 41 19.282 -10.000 5.491 1228 HA PRO 42 HA PRO 42 20.510 -3.311 3.803 1229 HB2 PRO 42 2HB PRO 42 21.652 -3.239 1.047 1230 HB3 PRO 42 3HB PRO 42 22.428 -2.829 2.592 1231 HG2 PRO 42 2HG PRO 42 23.129 -5.026 1.200 1232 HG3 PRO 42 3HG PRO 42 23.144 -4.998 2.980 1233 HD2 PRO 42 2HD PRO 42 21.028 -6.119 1.132 1234 HD3 PRO 42 3HD PRO 42 21.751 -6.845 2.585 1235 H LEU 43 H LEU 43 18.854 -1.964 3.497 1236 HA LEU 43 HA LEU 43 17.181 -2.089 1.050 1237 HB2 LEU 43 2HB LEU 43 16.525 -0.917 3.792 1238 HB3 LEU 43 3HB LEU 43 15.419 -1.045 2.434 1239 HG LEU 43 HG LEU 43 16.610 -3.426 3.916 1240 HD11 LEU 43 1HD1 LEU 43 15.106 -2.204 5.388 1241 HD12 LEU 43 2HD1 LEU 43 14.389 -3.742 4.918 1242 HD13 LEU 43 3HD1 LEU 43 13.830 -2.243 4.167 1243 HD21 LEU 43 1HD2 LEU 43 16.081 -4.006 1.612 1244 HD22 LEU 43 2HD2 LEU 43 14.455 -3.340 1.778 1245 HD23 LEU 43 3HD2 LEU 43 14.923 -4.772 2.700 1246 HA PRO 44 HA PRO 44 19.704 1.835 0.802 1247 HB2 PRO 44 2HB PRO 44 20.417 1.764 -1.798 1248 HB3 PRO 44 3HB PRO 44 21.142 0.634 -0.632 1249 HG2 PRO 44 2HG PRO 44 18.897 0.136 -2.566 1250 HG3 PRO 44 3HG PRO 44 20.322 -0.872 -2.228 1251 HD2 PRO 44 2HD PRO 44 17.849 -1.323 -1.087 1252 HD3 PRO 44 3HD PRO 44 19.382 -1.797 -0.323 1253 H ASN 45 H ASN 45 16.722 0.963 -0.450 1254 HA ASN 45 HA ASN 45 16.091 3.297 -2.028 1255 HB2 ASN 45 2HB ASN 45 15.049 0.999 -2.326 1256 HB3 ASN 45 3HB ASN 45 14.215 1.212 -0.796 1257 HD21 ASN 45 1HD2 ASN 45 13.063 0.749 -3.404 1258 HD22 ASN 45 2HD2 ASN 45 12.036 2.090 -3.753 1259 H VAL 46 H VAL 46 15.247 2.076 1.213 1260 HA VAL 46 HA VAL 46 13.892 4.571 1.943 1261 HB VAL 46 HB VAL 46 12.753 2.463 2.495 1262 HG11 VAL 46 1HG1 VAL 46 13.601 0.871 4.159 1263 HG12 VAL 46 2HG1 VAL 46 15.103 1.790 4.289 1264 HG13 VAL 46 3HG1 VAL 46 14.693 0.985 2.773 1265 HG21 VAL 46 1HG2 VAL 46 12.343 4.395 3.956 1266 HG22 VAL 46 2HG2 VAL 46 13.677 3.910 5.004 1267 HG23 VAL 46 3HG2 VAL 46 12.242 2.890 4.873 1268 H THR 47 H THR 47 14.675 6.033 3.415 1269 HA THR 47 HA THR 47 17.487 6.054 4.053 1270 HB THR 47 HB THR 47 16.965 8.278 5.081 1271 HG1 THR 47 HG1 THR 47 14.614 8.885 4.557 1272 HG21 THR 47 1HG2 THR 47 16.188 9.415 3.028 1273 HG22 THR 47 2HG2 THR 47 15.654 7.872 2.359 1274 HG23 THR 47 3HG2 THR 47 17.374 8.167 2.638 1275 H SER 48 H SER 48 18.053 6.850 6.436 1276 HA SER 48 HA SER 48 17.687 4.499 8.014 1277 HB2 SER 48 2HB SER 48 19.191 5.655 9.660 1278 HB3 SER 48 3HB SER 48 19.835 5.604 8.024 1279 HG SER 48 HG SER 48 19.144 7.766 7.758 1280 H THR 49 H THR 49 16.680 7.900 8.493 1281 HA THR 49 HA THR 49 15.560 7.580 11.074 1282 HB THR 49 HB THR 49 14.384 9.765 10.568 1283 HG1 THR 49 HG1 THR 49 14.983 10.703 8.474 1284 HG21 THR 49 1HG2 THR 49 16.710 9.815 11.425 1285 HG22 THR 49 2HG2 THR 49 16.434 11.128 10.281 1286 HG23 THR 49 3HG2 THR 49 17.327 9.693 9.774 1287 H ILE 50 H ILE 50 14.214 7.254 7.837 1288 HA ILE 50 HA ILE 50 11.469 7.036 8.649 1289 HB ILE 50 HB ILE 50 12.798 6.325 5.994 1290 HG12 ILE 50 2HG1 ILE 50 13.088 8.693 6.527 1291 HG13 ILE 50 3HG1 ILE 50 11.891 8.549 5.245 1292 HG21 ILE 50 1HG2 ILE 50 10.648 5.156 6.198 1293 HG22 ILE 50 2HG2 ILE 50 10.527 6.452 5.007 1294 HG23 ILE 50 3HG2 ILE 50 9.842 6.670 6.618 1295 HD11 ILE 50 1HD1 ILE 50 10.102 8.854 6.942 1296 HD12 ILE 50 2HD1 ILE 50 11.206 10.220 6.817 1297 HD13 ILE 50 3HD1 ILE 50 11.354 9.097 8.166 1298 H LEU 51 H LEU 51 13.967 4.707 7.541 1299 HA LEU 51 HA LEU 51 12.423 2.363 7.777 1300 HB2 LEU 51 2HB LEU 51 14.577 2.449 6.537 1301 HB3 LEU 51 3HB LEU 51 15.448 2.659 8.049 1302 HG LEU 51 HG LEU 51 14.761 0.375 8.775 1303 HD11 LEU 51 1HD1 LEU 51 13.644 -1.177 7.237 1304 HD12 LEU 51 2HD1 LEU 51 13.415 0.127 6.068 1305 HD13 LEU 51 3HD1 LEU 51 12.609 0.193 7.637 1306 HD21 LEU 51 1HD2 LEU 51 16.141 -0.929 7.217 1307 HD22 LEU 51 2HD2 LEU 51 16.889 0.626 7.575 1308 HD23 LEU 51 3HD2 LEU 51 16.068 0.379 6.030 1309 H GLU 52 H GLU 52 14.296 4.195 10.140 1310 HA GLU 52 HA GLU 52 14.391 2.387 12.286 1311 HB2 GLU 52 2HB GLU 52 15.663 4.527 12.204 1312 HB3 GLU 52 3HB GLU 52 14.162 5.435 12.355 1313 HG2 GLU 52 2HG GLU 52 13.807 4.442 14.611 1314 HG3 GLU 52 3HG GLU 52 15.337 3.577 14.453 1315 H LYS 53 H LYS 53 12.029 4.982 11.578 1316 HA LYS 53 HA LYS 53 10.206 4.391 13.656 1317 HB2 LYS 53 2HB LYS 53 9.971 5.965 11.080 1318 HB3 LYS 53 3HB LYS 53 8.541 5.684 12.067 1319 HG2 LYS 53 2HG LYS 53 9.683 6.777 13.993 1320 HG3 LYS 53 3HG LYS 53 11.067 7.128 12.956 1321 HD2 LYS 53 2HD LYS 53 8.230 8.125 12.456 1322 HD3 LYS 53 3HD LYS 53 9.502 9.074 13.229 1323 HE2 LYS 53 2HE LYS 53 9.582 7.994 10.386 1324 HE3 LYS 53 3HE LYS 53 9.269 9.665 10.854 1325 HZ1 LYS 53 1HZ LYS 53 11.462 9.796 11.812 1326 HZ2 LYS 53 2HZ LYS 53 11.567 9.340 10.194 1327 HZ3 LYS 53 3HZ LYS 53 11.780 8.187 11.412 1328 H VAL 54 H VAL 54 10.360 3.281 10.286 1329 HA VAL 54 HA VAL 54 7.926 1.918 10.129 1330 HB VAL 54 HB VAL 54 10.561 1.445 8.662 1331 HG11 VAL 54 1HG1 VAL 54 9.324 0.039 7.034 1332 HG12 VAL 54 2HG1 VAL 54 7.890 0.118 8.060 1333 HG13 VAL 54 3HG1 VAL 54 9.343 -0.693 8.641 1334 HG21 VAL 54 1HG2 VAL 54 9.413 3.584 8.178 1335 HG22 VAL 54 2HG2 VAL 54 7.948 2.708 7.739 1336 HG23 VAL 54 3HG2 VAL 54 9.409 2.530 6.764 1337 H LEU 55 H LEU 55 11.073 0.923 11.342 1338 HA LEU 55 HA LEU 55 10.342 -1.789 11.910 1339 HB2 LEU 55 2HB LEU 55 12.726 -0.102 12.759 1340 HB3 LEU 55 3HB LEU 55 12.550 -1.804 13.159 1341 HG LEU 55 HG LEU 55 12.845 -0.628 10.372 1342 HD11 LEU 55 1HD1 LEU 55 14.953 -1.855 10.296 1343 HD12 LEU 55 2HD1 LEU 55 14.697 -2.428 11.946 1344 HD13 LEU 55 3HD1 LEU 55 14.926 -0.706 11.633 1345 HD21 LEU 55 1HD2 LEU 55 11.284 -2.507 10.256 1346 HD22 LEU 55 2HD2 LEU 55 12.431 -3.544 11.108 1347 HD23 LEU 55 3HD2 LEU 55 12.822 -2.923 9.502 1348 H ASP 56 H ASP 56 10.257 1.239 13.729 1349 HA ASP 56 HA ASP 56 9.972 0.078 16.335 1350 HB2 ASP 56 2HB ASP 56 9.360 2.877 15.297 1351 HB3 ASP 56 3HB ASP 56 9.163 2.426 16.987 1352 H TYR 57 H TYR 57 7.619 1.222 13.915 1353 HA TYR 57 HA TYR 57 5.255 0.692 15.415 1354 HB2 TYR 57 2HB TYR 57 5.257 2.101 13.366 1355 HB3 TYR 57 3HB TYR 57 5.660 0.700 12.386 1356 HD1 TYR 57 HD1 TYR 57 2.958 2.454 14.179 1357 HD2 TYR 57 HD2 TYR 57 3.940 -1.063 11.948 1358 HE1 TYR 57 HE1 TYR 57 0.568 1.951 13.901 1359 HE2 TYR 57 HE2 TYR 57 1.559 -1.556 11.674 1360 HH TYR 57 HH TYR 57 -0.888 0.634 12.314 1361 H CYS 58 H CYS 58 7.201 -1.239 13.165 1362 HA CYS 58 HA CYS 58 5.608 -3.570 13.165 1363 HB2 CYS 58 2HB CYS 58 8.562 -3.145 12.590 1364 HB3 CYS 58 3HB CYS 58 7.722 -4.673 12.314 1365 HG CYS 58 HG CYS 58 8.066 -2.256 10.255 1366 H ARG 59 H ARG 59 8.211 -2.470 15.308 1367 HA ARG 59 HA ARG 59 8.440 -4.766 16.960 1368 HB2 ARG 59 2HB ARG 59 9.020 -1.817 17.476 1369 HB3 ARG 59 3HB ARG 59 9.279 -3.043 18.714 1370 HG2 ARG 59 2HG ARG 59 10.941 -4.163 17.349 1371 HG3 ARG 59 3HG ARG 59 10.625 -3.080 15.992 1372 HD2 ARG 59 2HD ARG 59 11.453 -1.171 17.307 1373 HD3 ARG 59 3HD ARG 59 11.735 -2.234 18.693 1374 HE ARG 59 HE ARG 59 13.227 -3.432 16.839 1375 HH11 ARG 59 1HH1 ARG 59 13.027 -0.032 17.729 1376 HH12 ARG 59 2HH1 ARG 59 14.670 0.306 17.287 1377 HH21 ARG 59 1HH2 ARG 59 15.393 -2.971 16.253 1378 HH22 ARG 59 2HH2 ARG 59 16.006 -1.359 16.452 1379 H HIS 60 H HIS 60 6.366 -1.881 17.091 1380 HA HIS 60 HA HIS 60 5.012 -2.315 19.493 1381 HB2 HIS 60 2HB HIS 60 4.770 -0.212 18.210 1382 HB3 HIS 60 3HB HIS 60 3.941 -1.071 16.914 1383 HD1 HIS 60 HD1 HIS 60 1.443 -1.610 17.266 1384 HD2 HIS 60 HD2 HIS 60 3.202 0.285 20.500 1385 HE1 HIS 60 HE1 HIS 60 -0.444 -1.021 18.793 1386 HE2 HIS 60 HE2 HIS 60 0.632 0.424 20.541 1387 H HIS 61 H HIS 61 4.397 -3.636 16.253 1388 HA HIS 61 HA HIS 61 1.989 -5.018 16.952 1389 HB2 HIS 61 2HB HIS 61 2.552 -4.297 14.608 1390 HB3 HIS 61 3HB HIS 61 3.803 -5.536 14.553 1391 HD1 HIS 61 HD1 HIS 61 3.026 -7.991 14.289 1392 HD2 HIS 61 HD2 HIS 61 -0.108 -5.277 14.486 1393 HE1 HIS 61 HE1 HIS 61 0.972 -9.296 13.686 1394 HE2 HIS 61 HE2 HIS 61 -0.914 -7.647 13.841 1395 H HIS 62 H HIS 62 5.434 -5.890 17.012 1396 HA HIS 62 HA HIS 62 4.930 -8.717 17.415 1397 HB2 HIS 62 2HB HIS 62 7.029 -7.937 16.349 1398 HB3 HIS 62 3HB HIS 62 7.503 -7.141 17.846 1399 HD1 HIS 62 HD1 HIS 62 6.219 -10.698 17.264 1400 HD2 HIS 62 HD2 HIS 62 9.538 -8.720 18.791 1401 HE1 HIS 62 HE1 HIS 62 7.710 -12.489 18.186 1402 HE2 HIS 62 HE2 HIS 62 9.783 -11.282 18.941 1403 H GLN 63 H GLN 63 5.345 -5.914 19.446 1404 HA GLN 63 HA GLN 63 5.532 -7.332 21.958 1405 HB2 GLN 63 2HB GLN 63 4.964 -4.394 21.327 1406 HB3 GLN 63 3HB GLN 63 5.187 -5.031 22.952 1407 HG2 GLN 63 2HG GLN 63 7.275 -5.004 20.753 1408 HG3 GLN 63 3HG GLN 63 7.222 -3.932 22.149 1409 HE21 GLN 63 1HE2 GLN 63 7.823 -7.196 21.070 1410 HE22 GLN 63 2HE2 GLN 63 8.650 -7.724 22.489 1411 H HIS 64 H HIS 64 3.016 -5.827 20.013 1412 HA HIS 64 HA HIS 64 0.893 -7.083 21.627 1413 HB2 HIS 64 2HB HIS 64 0.899 -4.157 20.715 1414 HB3 HIS 64 3HB HIS 64 -0.517 -4.992 21.344 1415 HD1 HIS 64 HD1 HIS 64 -0.813 -4.998 23.843 1416 HD2 HIS 64 HD2 HIS 64 2.991 -3.774 22.726 1417 HE1 HIS 64 HE1 HIS 64 0.271 -4.167 25.943 1418 HE2 HIS 64 HE2 HIS 64 2.630 -3.628 25.277 1419 HA PRO 65 HA PRO 65 0.570 -8.300 17.138 1420 HB2 PRO 65 2HB PRO 65 -1.165 -10.450 17.696 1421 HB3 PRO 65 3HB PRO 65 0.606 -10.551 17.656 1422 HG2 PRO 65 2HG PRO 65 -1.200 -10.230 20.026 1423 HG3 PRO 65 3HG PRO 65 0.252 -11.239 19.844 1424 HD2 PRO 65 2HD PRO 65 0.360 -8.921 21.186 1425 HD3 PRO 65 3HD PRO 65 1.712 -9.429 20.146 1426 H GLY 66 H GLY 66 -2.049 -7.960 19.493 1427 HA2 GLY 66 2HA GLY 66 -4.098 -6.963 19.386 1428 HA3 GLY 66 3HA GLY 66 -3.649 -6.292 17.825 1429 H GLY 67 H GLY 67 -4.150 -7.456 15.919 1430 HA2 GLY 67 2HA GLY 67 -5.129 -9.089 14.577 1431 HA3 GLY 67 3HA GLY 67 -5.550 -10.019 16.008 1432 H SER 68 H SER 68 -7.075 -8.392 17.484 1433 HA SER 68 HA SER 68 -9.570 -8.142 16.049 1434 HB2 SER 68 2HB SER 68 -10.416 -7.507 18.356 1435 HB3 SER 68 3HB SER 68 -9.565 -9.052 18.311 1436 HG SER 68 HG SER 68 -8.629 -8.069 19.983 1437 H GLY 69 H GLY 69 -10.922 -6.076 16.704 1438 HA2 GLY 69 2HA GLY 69 -9.559 -3.687 15.754 1439 HA3 GLY 69 3HA GLY 69 -11.266 -3.852 16.135 1440 H LEU 70 H LEU 70 -8.066 -3.336 17.494 1441 HA LEU 70 HA LEU 70 -8.751 -2.972 20.212 1442 HB2 LEU 70 2HB LEU 70 -6.382 -2.032 18.560 1443 HB3 LEU 70 3HB LEU 70 -6.553 -1.552 20.237 1444 HG LEU 70 HG LEU 70 -6.424 -3.914 20.959 1445 HD11 LEU 70 1HD1 LEU 70 -5.845 -5.720 19.440 1446 HD12 LEU 70 2HD1 LEU 70 -5.968 -4.628 18.058 1447 HD13 LEU 70 3HD1 LEU 70 -7.403 -5.015 19.010 1448 HD21 LEU 70 1HD2 LEU 70 -4.108 -3.109 19.169 1449 HD22 LEU 70 2HD2 LEU 70 -4.046 -4.308 20.467 1450 HD23 LEU 70 3HD2 LEU 70 -4.355 -2.615 20.847 1451 H ASP 71 H ASP 71 -10.538 -1.688 20.453 1452 HA ASP 71 HA ASP 71 -10.725 0.990 19.349 1453 HB2 ASP 71 2HB ASP 71 -12.766 -0.409 19.629 1454 HB3 ASP 71 3HB ASP 71 -12.509 -0.444 21.368 1455 H ASP 72 H ASP 72 -8.651 1.567 20.258 1456 HA ASP 72 HA ASP 72 -8.771 3.218 22.568 1457 HB2 ASP 72 2HB ASP 72 -8.551 1.075 23.787 1458 HB3 ASP 72 3HB ASP 72 -7.151 0.634 22.813 1459 H ILE 73 H ILE 73 -7.584 4.874 21.826 1460 HA ILE 73 HA ILE 73 -5.506 4.534 19.812 1461 HB ILE 73 HB ILE 73 -6.533 7.088 21.145 1462 HG12 ILE 73 2HG1 ILE 73 -7.221 5.935 18.397 1463 HG13 ILE 73 3HG1 ILE 73 -8.278 5.881 19.800 1464 HG21 ILE 73 1HG2 ILE 73 -4.240 7.385 20.250 1465 HG22 ILE 73 2HG2 ILE 73 -5.406 8.317 19.310 1466 HG23 ILE 73 3HG2 ILE 73 -4.773 6.798 18.672 1467 HD11 ILE 73 1HD1 ILE 73 -8.387 8.341 19.783 1468 HD12 ILE 73 2HD1 ILE 73 -8.977 7.609 18.292 1469 HD13 ILE 73 3HD1 ILE 73 -7.382 8.357 18.331 1470 HA PRO 74 HA PRO 74 -2.510 4.488 23.281 1471 HB2 PRO 74 2HB PRO 74 -0.487 3.594 21.335 1472 HB3 PRO 74 3HB PRO 74 -1.212 2.683 22.672 1473 HG2 PRO 74 2HG PRO 74 -1.683 2.084 20.060 1474 HG3 PRO 74 3HG PRO 74 -2.871 1.775 21.349 1475 HD2 PRO 74 2HD PRO 74 -2.755 4.084 19.403 1476 HD3 PRO 74 3HD PRO 74 -4.155 3.105 19.915 1477 HA PRO 75 HA PRO 75 -0.872 8.709 22.577 1478 HB2 PRO 75 2HB PRO 75 1.068 7.675 24.675 1479 HB3 PRO 75 3HB PRO 75 0.222 9.242 24.594 1480 HG2 PRO 75 2HG PRO 75 -0.678 7.375 26.232 1481 HG3 PRO 75 3HG PRO 75 -1.831 8.327 25.265 1482 HD2 PRO 75 2HD PRO 75 -0.911 5.492 24.858 1483 HD3 PRO 75 3HD PRO 75 -2.515 6.212 24.581 1484 H TYR 76 H TYR 76 1.321 5.914 22.819 1485 HA TYR 76 HA TYR 76 3.610 6.976 21.623 1486 HB2 TYR 76 2HB TYR 76 3.810 4.895 22.784 1487 HB3 TYR 76 3HB TYR 76 2.550 4.139 21.817 1488 HD1 TYR 76 HD1 TYR 76 5.997 5.629 21.460 1489 HD2 TYR 76 HD2 TYR 76 3.203 2.728 20.016 1490 HE1 TYR 76 HE1 TYR 76 7.708 4.725 19.944 1491 HE2 TYR 76 HE2 TYR 76 4.915 1.830 18.503 1492 HH TYR 76 HH TYR 76 8.233 2.795 18.680 1493 H ASP 77 H ASP 77 1.011 5.061 20.084 1494 HA ASP 77 HA ASP 77 2.111 5.187 17.457 1495 HB2 ASP 77 2HB ASP 77 -0.706 4.459 18.372 1496 HB3 ASP 77 3HB ASP 77 -0.074 4.189 16.743 1497 H ARG 78 H ARG 78 -0.108 7.236 19.214 1498 HA ARG 78 HA ARG 78 -1.043 8.823 17.050 1499 HB2 ARG 78 2HB ARG 78 -2.143 8.812 19.261 1500 HB3 ARG 78 3HB ARG 78 -0.712 9.523 20.002 1501 HG2 ARG 78 2HG ARG 78 -1.048 11.573 18.629 1502 HG3 ARG 78 3HG ARG 78 -2.499 10.849 17.935 1503 HD2 ARG 78 2HD ARG 78 -3.583 10.828 20.115 1504 HD3 ARG 78 3HD ARG 78 -2.112 11.409 20.895 1505 HE ARG 78 HE ARG 78 -3.817 12.955 19.040 1506 HH11 ARG 78 1HH1 ARG 78 -1.430 12.948 21.632 1507 HH12 ARG 78 2HH1 ARG 78 -1.487 14.671 21.838 1508 HH21 ARG 78 1HH2 ARG 78 -3.837 15.209 19.300 1509 HH22 ARG 78 2HH2 ARG 78 -2.847 15.946 20.522 1510 H ASP 79 H ASP 79 1.643 9.290 19.375 1511 HA ASP 79 HA ASP 79 2.734 11.623 18.158 1512 HB2 ASP 79 2HB ASP 79 3.857 9.634 20.163 1513 HB3 ASP 79 3HB ASP 79 4.848 10.947 19.539 1514 H PHE 80 H PHE 80 3.054 8.242 17.476 1515 HA PHE 80 HA PHE 80 5.441 8.218 15.967 1516 HB2 PHE 80 2HB PHE 80 4.417 6.134 16.751 1517 HB3 PHE 80 3HB PHE 80 2.956 6.447 15.823 1518 HD1 PHE 80 HD1 PHE 80 6.579 5.682 15.518 1519 HD2 PHE 80 HD2 PHE 80 2.790 5.740 13.532 1520 HE1 PHE 80 HE1 PHE 80 7.543 4.489 13.617 1521 HE2 PHE 80 HE2 PHE 80 3.774 4.540 11.622 1522 HZ PHE 80 HZ PHE 80 6.156 3.915 11.666 1523 H CYS 81 H CYS 81 2.050 8.719 15.067 1524 HA CYS 81 HA CYS 81 2.502 9.069 12.262 1525 HB2 CYS 81 2HB CYS 81 0.089 9.781 13.971 1526 HB3 CYS 81 3HB CYS 81 0.106 9.695 12.209 1527 HG CYS 81 HG CYS 81 1.009 6.937 13.970 1528 H LYS 82 H LYS 82 2.957 11.151 14.959 1529 HA LYS 82 HA LYS 82 2.496 13.659 13.598 1530 HB2 LYS 82 2HB LYS 82 3.925 13.095 16.230 1531 HB3 LYS 82 3HB LYS 82 3.557 14.704 15.618 1532 HG2 LYS 82 2HG LYS 82 1.561 12.580 16.438 1533 HG3 LYS 82 3HG LYS 82 1.942 14.066 17.312 1534 HD2 LYS 82 2HD LYS 82 1.033 15.408 15.443 1535 HD3 LYS 82 3HD LYS 82 0.673 13.929 14.545 1536 HE2 LYS 82 2HE LYS 82 -1.348 14.782 15.604 1537 HE3 LYS 82 3HE LYS 82 -0.897 13.241 16.333 1538 HZ1 LYS 82 1HZ LYS 82 0.045 14.434 18.193 1539 HZ2 LYS 82 2HZ LYS 82 -1.566 14.888 17.978 1540 HZ3 LYS 82 3HZ LYS 82 -0.325 15.920 17.481 1541 H VAL 83 H VAL 83 3.746 13.273 11.733 1542 HA VAL 83 HA VAL 83 6.591 14.062 12.021 1543 HB VAL 83 HB VAL 83 7.168 12.686 10.019 1544 HG11 VAL 83 1HG1 VAL 83 6.001 11.008 12.272 1545 HG12 VAL 83 2HG1 VAL 83 7.614 11.718 12.228 1546 HG13 VAL 83 3HG1 VAL 83 7.183 10.453 11.079 1547 HG21 VAL 83 1HG2 VAL 83 4.365 11.524 10.253 1548 HG22 VAL 83 2HG2 VAL 83 5.637 10.929 9.181 1549 HG23 VAL 83 3HG2 VAL 83 4.968 12.541 8.942 1550 H ASP 84 H ASP 84 7.368 14.979 9.796 1551 HA ASP 84 HA ASP 84 5.588 17.159 9.114 1552 HB2 ASP 84 2HB ASP 84 8.236 17.141 9.378 1553 HB3 ASP 84 3HB ASP 84 8.231 16.620 7.699 1554 H GLN 85 H GLN 85 5.478 17.747 6.593 1555 HA GLN 85 HA GLN 85 3.662 15.873 5.551 1556 HB2 GLN 85 2HB GLN 85 3.339 18.232 5.088 1557 HB3 GLN 85 3HB GLN 85 4.859 18.327 4.212 1558 HG2 GLN 85 2HG GLN 85 3.018 18.338 2.636 1559 HG3 GLN 85 3HG GLN 85 3.919 16.841 2.450 1560 HE21 GLN 85 1HE2 GLN 85 1.259 17.312 1.535 1561 HE22 GLN 85 2HE2 GLN 85 0.233 16.196 2.357 1562 HA PRO 86 HA PRO 86 6.934 14.629 2.065 1563 HB2 PRO 86 2HB PRO 86 9.615 14.912 2.799 1564 HB3 PRO 86 3HB PRO 86 8.735 16.090 1.803 1565 HG2 PRO 86 2HG PRO 86 9.231 16.157 4.771 1566 HG3 PRO 86 3HG PRO 86 9.422 17.460 3.574 1567 HD2 PRO 86 2HD PRO 86 7.250 17.380 5.107 1568 HD3 PRO 86 3HD PRO 86 7.098 17.805 3.385 1569 H THR 87 H THR 87 7.764 14.473 5.505 1570 HA THR 87 HA THR 87 8.977 11.912 5.548 1571 HB THR 87 HB THR 87 7.624 13.389 7.855 1572 HG1 THR 87 HG1 THR 87 10.171 13.731 6.640 1573 HG21 THR 87 1HG2 THR 87 9.971 11.454 7.875 1574 HG22 THR 87 2HG2 THR 87 8.332 11.060 8.397 1575 HG23 THR 87 3HG2 THR 87 9.273 12.263 9.278 1576 H LEU 88 H LEU 88 5.629 13.013 5.915 1577 HA LEU 88 HA LEU 88 4.345 10.633 6.693 1578 HB2 LEU 88 2HB LEU 88 3.462 13.059 5.104 1579 HB3 LEU 88 3HB LEU 88 2.365 11.710 5.309 1580 HG LEU 88 HG LEU 88 3.582 13.205 7.665 1581 HD11 LEU 88 1HD1 LEU 88 1.449 14.391 7.896 1582 HD12 LEU 88 2HD1 LEU 88 0.859 13.659 6.401 1583 HD13 LEU 88 3HD1 LEU 88 2.223 14.776 6.358 1584 HD21 LEU 88 1HD2 LEU 88 2.804 10.931 8.171 1585 HD22 LEU 88 2HD2 LEU 88 1.216 11.303 7.491 1586 HD23 LEU 88 3HD2 LEU 88 1.776 12.135 8.945 1587 H PHE 89 H PHE 89 5.035 11.954 3.451 1588 HA PHE 89 HA PHE 89 4.037 9.762 1.948 1589 HB2 PHE 89 2HB PHE 89 6.038 11.931 1.201 1590 HB3 PHE 89 3HB PHE 89 5.384 10.765 0.051 1591 HD1 PHE 89 HD1 PHE 89 4.926 14.009 1.404 1592 HD2 PHE 89 HD2 PHE 89 2.741 10.624 -0.021 1593 HE1 PHE 89 HE1 PHE 89 2.981 15.441 0.974 1594 HE2 PHE 89 HE2 PHE 89 0.808 12.067 -0.446 1595 HZ PHE 89 HZ PHE 89 0.919 14.475 0.050 1596 H GLU 90 H GLU 90 7.180 10.416 3.383 1597 HA GLU 90 HA GLU 90 8.667 8.370 2.091 1598 HB2 GLU 90 2HB GLU 90 9.044 9.725 4.793 1599 HB3 GLU 90 3HB GLU 90 10.208 8.601 4.103 1600 HG2 GLU 90 2HG GLU 90 9.367 11.202 2.815 1601 HG3 GLU 90 3HG GLU 90 10.815 10.989 3.791 1602 H LEU 91 H LEU 91 6.677 8.413 5.040 1603 HA LEU 91 HA LEU 91 7.216 5.722 5.850 1604 HB2 LEU 91 2HB LEU 91 4.901 7.575 6.534 1605 HB3 LEU 91 3HB LEU 91 5.153 6.011 7.290 1606 HG LEU 91 HG LEU 91 7.044 8.393 7.513 1607 HD11 LEU 91 1HD1 LEU 91 6.294 8.556 9.844 1608 HD12 LEU 91 2HD1 LEU 91 5.153 7.232 9.589 1609 HD13 LEU 91 3HD1 LEU 91 4.940 8.761 8.734 1610 HD21 LEU 91 1HD2 LEU 91 8.267 6.270 7.626 1611 HD22 LEU 91 2HD2 LEU 91 7.181 5.691 8.890 1612 HD23 LEU 91 3HD2 LEU 91 8.243 7.068 9.199 1613 H ILE 92 H ILE 92 4.751 7.222 3.764 1614 HA ILE 92 HA ILE 92 3.145 4.938 3.253 1615 HB ILE 92 HB ILE 92 3.686 7.352 1.443 1616 HG12 ILE 92 2HG1 ILE 92 1.338 6.797 3.320 1617 HG13 ILE 92 3HG1 ILE 92 2.630 7.953 3.611 1618 HG21 ILE 92 1HG2 ILE 92 1.621 6.728 0.211 1619 HG22 ILE 92 2HG2 ILE 92 1.491 5.258 1.177 1620 HG23 ILE 92 3HG2 ILE 92 2.857 5.474 0.082 1621 HD11 ILE 92 1HD1 ILE 92 0.614 9.067 2.886 1622 HD12 ILE 92 2HD1 ILE 92 0.583 8.116 1.401 1623 HD13 ILE 92 3HD1 ILE 92 1.890 9.269 1.688 1624 H LEU 93 H LEU 93 5.980 6.298 1.568 1625 HA LEU 93 HA LEU 93 6.134 4.443 -0.561 1626 HB2 LEU 93 2HB LEU 93 8.209 6.287 0.678 1627 HB3 LEU 93 3HB LEU 93 8.574 5.283 -0.714 1628 HG LEU 93 HG LEU 93 6.461 7.475 -0.648 1629 HD11 LEU 93 1HD1 LEU 93 7.981 8.754 -2.080 1630 HD12 LEU 93 2HD1 LEU 93 9.192 7.476 -1.977 1631 HD13 LEU 93 3HD1 LEU 93 8.741 8.386 -0.533 1632 HD21 LEU 93 1HD2 LEU 93 5.835 5.683 -2.200 1633 HD22 LEU 93 2HD2 LEU 93 7.417 5.770 -2.979 1634 HD23 LEU 93 3HD2 LEU 93 6.301 7.136 -3.084 1635 H ALA 94 H ALA 94 7.719 4.552 2.620 1636 HA ALA 94 HA ALA 94 9.487 2.350 2.217 1637 HB1 ALA 94 1HB ALA 94 9.898 4.112 3.883 1638 HB2 ALA 94 2HB ALA 94 9.884 2.521 4.638 1639 HB3 ALA 94 3HB ALA 94 8.490 3.591 4.808 1640 H ALA 95 H ALA 95 6.299 2.652 3.797 1641 HA ALA 95 HA ALA 95 6.151 -0.037 4.743 1642 HB1 ALA 95 1HB ALA 95 3.806 0.467 5.228 1643 HB2 ALA 95 2HB ALA 95 3.899 1.935 4.250 1644 HB3 ALA 95 3HB ALA 95 4.845 1.800 5.733 1645 H ASN 96 H ASN 96 4.942 1.573 1.785 1646 HA ASN 96 HA ASN 96 3.662 -0.690 0.635 1647 HB2 ASN 96 2HB ASN 96 3.268 1.724 -0.006 1648 HB3 ASN 96 3HB ASN 96 4.843 1.738 -0.791 1649 HD21 ASN 96 1HD2 ASN 96 3.787 2.268 -2.762 1650 HD22 ASN 96 2HD2 ASN 96 2.928 1.086 -3.673 1651 H TYR 97 H TYR 97 6.940 0.604 0.429 1652 HA TYR 97 HA TYR 97 8.038 -1.129 -1.532 1653 HB2 TYR 97 2HB TYR 97 9.248 0.893 -1.065 1654 HB3 TYR 97 3HB TYR 97 9.274 0.583 0.663 1655 HD1 TYR 97 HD1 TYR 97 11.357 -0.047 1.560 1656 HD2 TYR 97 HD2 TYR 97 10.542 -1.065 -2.516 1657 HE1 TYR 97 HE1 TYR 97 13.595 -1.039 1.367 1658 HE2 TYR 97 HE2 TYR 97 12.789 -2.057 -2.707 1659 HH TYR 97 HH TYR 97 14.829 -2.309 -1.666 1660 H LEU 98 H LEU 98 7.578 -1.451 1.942 1661 HA LEU 98 HA LEU 98 8.950 -4.064 1.969 1662 HB2 LEU 98 2HB LEU 98 7.969 -2.292 4.241 1663 HB3 LEU 98 3HB LEU 98 8.744 -3.853 4.460 1664 HG LEU 98 HG LEU 98 10.035 -1.365 3.269 1665 HD11 LEU 98 1HD1 LEU 98 10.593 -2.785 5.892 1666 HD12 LEU 98 2HD1 LEU 98 9.795 -1.223 5.691 1667 HD13 LEU 98 3HD1 LEU 98 11.489 -1.407 5.244 1668 HD21 LEU 98 1HD2 LEU 98 10.896 -3.329 2.113 1669 HD22 LEU 98 2HD2 LEU 98 11.243 -4.124 3.649 1670 HD23 LEU 98 3HD2 LEU 98 12.132 -2.673 3.185 1671 H ASP 99 H ASP 99 5.899 -2.892 1.459 1672 HA ASP 99 HA ASP 99 3.797 -3.693 1.415 1673 HB2 ASP 99 2HB ASP 99 5.303 -6.330 1.419 1674 HB3 ASP 99 3HB ASP 99 3.562 -6.239 1.189 1675 H ILE 100 H ILE 100 4.976 -3.084 4.003 1676 HA ILE 100 HA ILE 100 3.666 -4.771 5.950 1677 HB ILE 100 HB ILE 100 4.874 -1.984 6.301 1678 HG12 ILE 100 2HG1 ILE 100 6.095 -4.713 6.908 1679 HG13 ILE 100 3HG1 ILE 100 6.510 -3.716 5.524 1680 HG21 ILE 100 1HG2 ILE 100 4.902 -2.493 8.732 1681 HG22 ILE 100 2HG2 ILE 100 4.100 -4.034 8.422 1682 HG23 ILE 100 3HG2 ILE 100 3.253 -2.520 8.096 1683 HD11 ILE 100 1HD1 ILE 100 7.000 -3.032 8.414 1684 HD12 ILE 100 2HD1 ILE 100 7.388 -2.001 7.035 1685 HD13 ILE 100 3HD1 ILE 100 8.190 -3.558 7.227 1686 H LYS 101 H LYS 101 1.579 -4.823 5.198 1687 HA LYS 101 HA LYS 101 -0.055 -2.755 4.397 1688 HB2 LYS 101 2HB LYS 101 -0.603 -5.105 3.986 1689 HB3 LYS 101 3HB LYS 101 -0.836 -5.392 5.704 1690 HG2 LYS 101 2HG LYS 101 -2.985 -5.233 4.512 1691 HG3 LYS 101 3HG LYS 101 -2.820 -3.937 5.700 1692 HD2 LYS 101 2HD LYS 101 -2.131 -2.393 3.849 1693 HD3 LYS 101 3HD LYS 101 -2.416 -3.700 2.695 1694 HE2 LYS 101 2HE LYS 101 -4.529 -2.518 4.528 1695 HE3 LYS 101 3HE LYS 101 -4.301 -2.088 2.835 1696 HZ1 LYS 101 1HZ LYS 101 -6.054 -3.695 3.070 1697 HZ2 LYS 101 2HZ LYS 101 -5.024 -4.777 3.856 1698 HZ3 LYS 101 3HZ LYS 101 -4.760 -4.385 2.232 1699 HA PRO 102 HA PRO 102 -1.769 -2.384 9.116 1700 HB2 PRO 102 2HB PRO 102 0.954 -2.685 10.402 1701 HB3 PRO 102 3HB PRO 102 -0.653 -3.091 11.050 1702 HG2 PRO 102 2HG PRO 102 0.927 -5.027 10.180 1703 HG3 PRO 102 3HG PRO 102 -0.814 -5.065 9.809 1704 HD2 PRO 102 2HD PRO 102 1.483 -4.335 8.014 1705 HD3 PRO 102 3HD PRO 102 -0.010 -5.224 7.637 1706 H LEU 103 H LEU 103 1.661 -1.405 8.623 1707 HA LEU 103 HA LEU 103 1.406 1.199 9.728 1708 HB2 LEU 103 2HB LEU 103 3.516 -0.256 9.340 1709 HB3 LEU 103 3HB LEU 103 3.527 0.384 7.711 1710 HG LEU 103 HG LEU 103 3.666 2.182 10.173 1711 HD11 LEU 103 1HD1 LEU 103 5.995 1.042 8.611 1712 HD12 LEU 103 2HD1 LEU 103 5.530 0.619 10.261 1713 HD13 LEU 103 3HD1 LEU 103 6.091 2.248 9.900 1714 HD21 LEU 103 1HD2 LEU 103 4.497 2.737 7.301 1715 HD22 LEU 103 2HD2 LEU 103 4.649 3.852 8.663 1716 HD23 LEU 103 3HD2 LEU 103 3.054 3.366 8.098 1717 H LEU 104 H LEU 104 1.418 -0.005 6.401 1718 HA LEU 104 HA LEU 104 1.355 2.414 4.995 1719 HB2 LEU 104 2HB LEU 104 1.916 0.228 4.014 1720 HB3 LEU 104 3HB LEU 104 0.269 -0.328 4.264 1721 HG LEU 104 HG LEU 104 -0.537 1.336 2.591 1722 HD11 LEU 104 1HD1 LEU 104 1.056 2.529 1.150 1723 HD12 LEU 104 2HD1 LEU 104 2.396 1.981 2.163 1724 HD13 LEU 104 3HD1 LEU 104 1.170 3.066 2.826 1725 HD21 LEU 104 1HD2 LEU 104 -0.008 -0.961 1.919 1726 HD22 LEU 104 2HD2 LEU 104 1.657 -0.483 1.558 1727 HD23 LEU 104 3HD2 LEU 104 0.317 0.190 0.627 1728 H ASP 105 H ASP 105 -1.254 0.375 6.223 1729 HA ASP 105 HA ASP 105 -3.490 1.666 5.110 1730 HB2 ASP 105 2HB ASP 105 -3.587 -0.595 6.115 1731 HB3 ASP 105 3HB ASP 105 -3.245 0.069 7.711 1732 H VAL 106 H VAL 106 -1.901 2.045 8.278 1733 HA VAL 106 HA VAL 106 -3.574 4.028 9.353 1734 HB VAL 106 HB VAL 106 -0.674 3.343 9.999 1735 HG11 VAL 106 1HG1 VAL 106 -2.554 5.106 11.619 1736 HG12 VAL 106 2HG1 VAL 106 -1.108 5.647 10.768 1737 HG13 VAL 106 3HG1 VAL 106 -0.962 4.552 12.143 1738 HG21 VAL 106 1HG2 VAL 106 -2.287 1.517 10.399 1739 HG22 VAL 106 2HG2 VAL 106 -3.250 2.584 11.421 1740 HG23 VAL 106 3HG2 VAL 106 -1.620 2.121 11.918 1741 H THR 107 H THR 107 -0.457 4.345 7.599 1742 HA THR 107 HA THR 107 -0.230 7.157 8.045 1743 HB THR 107 HB THR 107 1.295 5.467 6.010 1744 HG1 THR 107 HG1 THR 107 1.401 4.735 8.249 1745 HG21 THR 107 1HG2 THR 107 1.577 7.918 5.670 1746 HG22 THR 107 2HG2 THR 107 3.062 7.177 6.263 1747 HG23 THR 107 3HG2 THR 107 2.037 8.097 7.365 1748 H CYS 108 H CYS 108 -1.413 5.215 5.313 1749 HA CYS 108 HA CYS 108 -1.812 7.324 3.450 1750 HB2 CYS 108 2HB CYS 108 -3.248 4.653 3.714 1751 HB3 CYS 108 3HB CYS 108 -3.398 5.735 2.328 1752 HG CYS 108 HG CYS 108 -0.364 4.507 3.286 1753 H LYS 109 H LYS 109 -3.802 6.006 6.070 1754 HA LYS 109 HA LYS 109 -6.058 7.727 5.588 1755 HB2 LYS 109 2HB LYS 109 -5.296 5.920 7.911 1756 HB3 LYS 109 3HB LYS 109 -6.776 6.883 7.907 1757 HG2 LYS 109 2HG LYS 109 -7.617 5.732 5.960 1758 HG3 LYS 109 3HG LYS 109 -6.082 4.892 5.721 1759 HD2 LYS 109 2HD LYS 109 -6.436 3.638 7.823 1760 HD3 LYS 109 3HD LYS 109 -7.964 4.489 8.084 1761 HE2 LYS 109 2HE LYS 109 -8.920 3.495 6.095 1762 HE3 LYS 109 3HE LYS 109 -7.372 2.780 5.648 1763 HZ1 LYS 109 1HZ LYS 109 -7.476 1.336 7.520 1764 HZ2 LYS 109 2HZ LYS 109 -8.929 1.206 6.666 1765 HZ3 LYS 109 3HZ LYS 109 -8.871 2.085 8.109 1766 H THR 110 H THR 110 -3.106 7.983 7.510 1767 HA THR 110 HA THR 110 -3.851 10.114 9.224 1768 HB THR 110 HB THR 110 -1.080 9.332 8.193 1769 HG1 THR 110 HG1 THR 110 -2.599 7.972 9.722 1770 HG21 THR 110 1HG2 THR 110 -1.800 11.149 10.535 1771 HG22 THR 110 2HG2 THR 110 -0.998 11.648 9.041 1772 HG23 THR 110 3HG2 THR 110 -0.177 10.560 10.164 1773 H VAL 111 H VAL 111 -2.166 10.098 6.059 1774 HA VAL 111 HA VAL 111 -2.048 12.917 5.741 1775 HB VAL 111 HB VAL 111 -1.532 12.510 3.357 1776 HG11 VAL 111 1HG1 VAL 111 0.280 12.278 4.998 1777 HG12 VAL 111 2HG1 VAL 111 0.519 11.176 3.643 1778 HG13 VAL 111 3HG1 VAL 111 -0.083 10.560 5.186 1779 HG21 VAL 111 1HG2 VAL 111 -2.159 9.584 3.912 1780 HG22 VAL 111 2HG2 VAL 111 -1.439 10.216 2.429 1781 HG23 VAL 111 3HG2 VAL 111 -3.083 10.673 2.874 1782 H ALA 112 H ALA 112 -4.510 10.515 4.991 1783 HA ALA 112 HA ALA 112 -6.257 12.196 3.482 1784 HB1 ALA 112 1HB ALA 112 -7.900 10.396 3.781 1785 HB2 ALA 112 2HB ALA 112 -6.860 9.634 4.990 1786 HB3 ALA 112 3HB ALA 112 -6.325 9.751 3.313 1787 H ASN 113 H ASN 113 -5.768 11.687 6.946 1788 HA ASN 113 HA ASN 113 -8.249 12.829 7.823 1789 HB2 ASN 113 2HB ASN 113 -5.667 12.130 9.251 1790 HB3 ASN 113 3HB ASN 113 -6.821 13.172 10.069 1791 HD21 ASN 113 1HD2 ASN 113 -6.050 9.937 9.280 1792 HD22 ASN 113 2HD2 ASN 113 -7.466 9.202 9.946 1793 H MET 114 H MET 114 -5.224 14.222 6.807 1794 HA MET 114 HA MET 114 -5.563 16.818 7.994 1795 HB2 MET 114 2HB MET 114 -3.931 16.039 5.540 1796 HB3 MET 114 3HB MET 114 -3.763 17.535 6.452 1797 HG2 MET 114 2HG MET 114 -3.074 16.170 8.438 1798 HG3 MET 114 3HG MET 114 -3.103 14.740 7.406 1799 HE1 MET 114 1HE MET 114 -0.303 15.734 4.760 1800 HE2 MET 114 2HE MET 114 -2.021 16.095 4.623 1801 HE3 MET 114 3HE MET 114 -1.490 14.513 5.198 1802 H ILE 115 H ILE 115 -6.532 15.322 4.986 1803 HA ILE 115 HA ILE 115 -7.727 17.819 3.925 1804 HB ILE 115 HB ILE 115 -7.815 16.699 1.729 1805 HG12 ILE 115 2HG1 ILE 115 -6.453 14.288 3.035 1806 HG13 ILE 115 3HG1 ILE 115 -8.170 14.355 2.662 1807 HG21 ILE 115 1HG2 ILE 115 -5.057 16.450 3.006 1808 HG22 ILE 115 2HG2 ILE 115 -5.750 17.917 2.311 1809 HG23 ILE 115 3HG2 ILE 115 -5.385 16.540 1.273 1810 HD11 ILE 115 1HD1 ILE 115 -5.946 14.517 0.642 1811 HD12 ILE 115 2HD1 ILE 115 -7.678 14.533 0.301 1812 HD13 ILE 115 3HD1 ILE 115 -6.931 13.102 1.006 1813 H ARG 116 H ARG 116 -8.818 15.690 5.947 1814 HA ARG 116 HA ARG 116 -10.401 13.728 5.053 1815 HB2 ARG 116 2HB ARG 116 -9.620 14.214 7.385 1816 HB3 ARG 116 3HB ARG 116 -10.948 15.352 7.556 1817 HG2 ARG 116 2HG ARG 116 -12.569 13.519 7.332 1818 HG3 ARG 116 3HG ARG 116 -11.256 12.382 7.048 1819 HD2 ARG 116 2HD ARG 116 -10.404 12.779 9.325 1820 HD3 ARG 116 3HD ARG 116 -11.712 13.929 9.623 1821 HE ARG 116 HE ARG 116 -11.917 11.008 9.456 1822 HH11 ARG 116 1HH1 ARG 116 -13.660 14.049 9.774 1823 HH12 ARG 116 2HH1 ARG 116 -15.101 13.290 10.366 1824 HH21 ARG 116 1HH2 ARG 116 -13.795 10.051 10.272 1825 HH22 ARG 116 2HH2 ARG 116 -15.174 11.036 10.644 1826 H GLY 117 H GLY 117 -11.491 16.987 4.728 1827 HA2 GLY 117 2HA GLY 117 -13.462 17.967 4.099 1828 HA3 GLY 117 3HA GLY 117 -13.434 16.668 2.926 Start of MODEL 20 1 H1 SER 2 1H SER 2 -18.184 -15.902 -17.651 2 H2 SER 2 2H SER 2 -17.779 -15.557 -16.052 3 H3 SER 2 3H SER 2 -16.913 -14.840 -17.316 4 HA SER 2 HA SER 2 -18.902 -13.687 -18.033 5 HB2 SER 2 2HB SER 2 -20.872 -13.684 -16.442 6 HB3 SER 2 3HB SER 2 -20.585 -15.245 -17.209 7 HG SER 2 HG SER 2 -20.767 -15.803 -15.150 8 H LEU 3 H LEU 3 -19.417 -11.577 -17.195 9 HA LEU 3 HA LEU 3 -17.321 -10.352 -15.703 10 HB2 LEU 3 2HB LEU 3 -20.046 -9.264 -16.530 11 HB3 LEU 3 3HB LEU 3 -18.702 -8.288 -15.960 12 HG LEU 3 HG LEU 3 -18.644 -9.934 -18.524 13 HD11 LEU 3 1HD1 LEU 3 -18.901 -7.812 -19.729 14 HD12 LEU 3 2HD1 LEU 3 -19.109 -6.949 -18.202 15 HD13 LEU 3 3HD1 LEU 3 -20.303 -8.143 -18.714 16 HD21 LEU 3 1HD2 LEU 3 -16.721 -7.829 -17.479 17 HD22 LEU 3 2HD2 LEU 3 -16.625 -8.643 -19.046 18 HD23 LEU 3 3HD2 LEU 3 -16.421 -9.569 -17.563 19 H VAL 4 H VAL 4 -17.142 -10.427 -13.492 20 HA VAL 4 HA VAL 4 -19.434 -10.900 -11.780 21 HB VAL 4 HB VAL 4 -17.830 -10.679 -9.857 22 HG11 VAL 4 1HG1 VAL 4 -16.630 -12.794 -10.307 23 HG12 VAL 4 2HG1 VAL 4 -16.995 -12.641 -12.028 24 HG13 VAL 4 3HG1 VAL 4 -18.304 -12.866 -10.866 25 HG21 VAL 4 1HG2 VAL 4 -16.200 -9.109 -10.816 26 HG22 VAL 4 2HG2 VAL 4 -15.714 -10.306 -12.017 27 HG23 VAL 4 3HG2 VAL 4 -15.385 -10.589 -10.305 28 H LYS 5 H LYS 5 -20.599 -9.451 -10.768 29 HA LYS 5 HA LYS 5 -20.315 -6.655 -11.537 30 HB2 LYS 5 2HB LYS 5 -22.599 -8.110 -10.130 31 HB3 LYS 5 3HB LYS 5 -22.668 -6.497 -10.839 32 HG2 LYS 5 2HG LYS 5 -22.230 -7.494 -13.086 33 HG3 LYS 5 3HG LYS 5 -22.250 -9.101 -12.354 34 HD2 LYS 5 2HD LYS 5 -24.613 -8.756 -11.672 35 HD3 LYS 5 3HD LYS 5 -24.583 -7.144 -12.396 36 HE2 LYS 5 2HE LYS 5 -24.079 -8.215 -14.610 37 HE3 LYS 5 3HE LYS 5 -24.279 -9.793 -13.848 38 HZ1 LYS 5 1HZ LYS 5 -26.553 -9.200 -13.314 39 HZ2 LYS 5 2HZ LYS 5 -26.279 -9.084 -14.976 40 HZ3 LYS 5 3HZ LYS 5 -26.354 -7.687 -14.036 41 H LEU 6 H LEU 6 -19.230 -5.365 -10.198 42 HA LEU 6 HA LEU 6 -19.337 -5.785 -7.264 43 HB2 LEU 6 2HB LEU 6 -17.120 -4.431 -8.864 44 HB3 LEU 6 3HB LEU 6 -17.124 -4.751 -7.135 45 HG LEU 6 HG LEU 6 -16.946 -6.824 -9.357 46 HD11 LEU 6 1HD1 LEU 6 -14.702 -7.258 -8.507 47 HD12 LEU 6 2HD1 LEU 6 -14.890 -5.983 -7.300 48 HD13 LEU 6 3HD1 LEU 6 -14.879 -5.581 -9.019 49 HD21 LEU 6 1HD2 LEU 6 -18.253 -7.758 -7.513 50 HD22 LEU 6 2HD2 LEU 6 -16.992 -7.314 -6.360 51 HD23 LEU 6 3HD2 LEU 6 -16.670 -8.527 -7.604 52 H GLU 7 H GLU 7 -20.893 -4.409 -6.604 53 HA GLU 7 HA GLU 7 -21.377 -1.862 -7.859 54 HB2 GLU 7 2HB GLU 7 -22.552 -3.078 -5.327 55 HB3 GLU 7 3HB GLU 7 -23.060 -1.534 -5.998 56 HG2 GLU 7 2HG GLU 7 -24.657 -3.243 -6.609 57 HG3 GLU 7 3HG GLU 7 -23.813 -2.692 -8.056 58 H SER 8 H SER 8 -21.121 0.158 -6.918 59 HA SER 8 HA SER 8 -18.809 0.471 -5.156 60 HB2 SER 8 2HB SER 8 -19.126 2.905 -5.830 61 HB3 SER 8 3HB SER 8 -18.826 1.794 -7.164 62 HG SER 8 HG SER 8 -20.743 2.190 -7.932 63 H SER 9 H SER 9 -19.097 2.590 -3.698 64 HA SER 9 HA SER 9 -20.971 2.318 -1.650 65 HB2 SER 9 2HB SER 9 -18.905 3.682 -1.477 66 HB3 SER 9 3HB SER 9 -19.571 4.855 -2.612 67 HG SER 9 HG SER 9 -19.919 4.692 0.041 68 H ASP 10 H ASP 10 -21.153 3.968 -4.742 69 HA ASP 10 HA ASP 10 -23.735 5.217 -4.313 70 HB2 ASP 10 2HB ASP 10 -22.043 4.915 -6.836 71 HB3 ASP 10 3HB ASP 10 -23.474 5.932 -6.691 72 H GLU 11 H GLU 11 -22.897 2.094 -4.777 73 HA GLU 11 HA GLU 11 -23.927 0.180 -5.333 74 HB2 GLU 11 2HB GLU 11 -26.409 1.939 -5.497 75 HB3 GLU 11 3HB GLU 11 -26.433 0.176 -5.494 76 HG2 GLU 11 2HG GLU 11 -25.546 0.103 -3.237 77 HG3 GLU 11 3HG GLU 11 -25.295 1.848 -3.228 78 H LYS 12 H LYS 12 -22.870 2.062 -7.458 79 HA LYS 12 HA LYS 12 -24.372 1.405 -9.844 80 HB2 LYS 12 2HB LYS 12 -21.628 2.706 -9.516 81 HB3 LYS 12 3HB LYS 12 -22.482 2.526 -11.051 82 HG2 LYS 12 2HG LYS 12 -24.372 3.881 -10.073 83 HG3 LYS 12 3HG LYS 12 -23.351 4.182 -8.663 84 HD2 LYS 12 2HD LYS 12 -21.680 5.301 -10.140 85 HD3 LYS 12 3HD LYS 12 -22.722 5.003 -11.533 86 HE2 LYS 12 2HE LYS 12 -24.488 6.393 -10.506 87 HE3 LYS 12 3HE LYS 12 -23.445 6.684 -9.111 88 HZ1 LYS 12 1HZ LYS 12 -21.881 7.809 -10.534 89 HZ2 LYS 12 2HZ LYS 12 -23.407 8.518 -10.688 90 HZ3 LYS 12 3HZ LYS 12 -22.826 7.495 -11.900 91 H VAL 13 H VAL 13 -24.144 -0.353 -11.016 92 HA VAL 13 HA VAL 13 -22.592 -2.563 -10.051 93 HB VAL 13 HB VAL 13 -24.445 -2.327 -12.471 94 HG11 VAL 13 1HG1 VAL 13 -23.384 -4.843 -11.129 95 HG12 VAL 13 2HG1 VAL 13 -22.919 -4.243 -12.722 96 HG13 VAL 13 3HG1 VAL 13 -24.570 -4.790 -12.437 97 HG21 VAL 13 1HG2 VAL 13 -25.597 -1.855 -10.336 98 HG22 VAL 13 2HG2 VAL 13 -25.044 -3.400 -9.683 99 HG23 VAL 13 3HG2 VAL 13 -26.165 -3.367 -11.048 100 H PHE 14 H PHE 14 -20.417 -2.431 -10.495 101 HA PHE 14 HA PHE 14 -19.497 -1.854 -13.233 102 HB2 PHE 14 2HB PHE 14 -17.965 -2.227 -10.621 103 HB3 PHE 14 3HB PHE 14 -17.192 -1.968 -12.187 104 HD1 PHE 14 HD1 PHE 14 -17.756 0.165 -13.484 105 HD2 PHE 14 HD2 PHE 14 -18.737 -0.340 -9.349 106 HE1 PHE 14 HE1 PHE 14 -18.031 2.597 -13.245 107 HE2 PHE 14 HE2 PHE 14 -19.005 2.095 -9.124 108 HZ PHE 14 HZ PHE 14 -18.657 3.557 -11.066 109 H GLU 15 H GLU 15 -20.103 -3.603 -14.366 110 HA GLU 15 HA GLU 15 -19.664 -6.334 -13.576 111 HB2 GLU 15 2HB GLU 15 -20.247 -5.263 -16.370 112 HB3 GLU 15 3HB GLU 15 -20.513 -6.905 -15.783 113 HG2 GLU 15 2HG GLU 15 -22.283 -6.112 -14.286 114 HG3 GLU 15 3HG GLU 15 -21.966 -4.450 -14.777 115 H ILE 16 H ILE 16 -17.434 -6.186 -13.054 116 HA ILE 16 HA ILE 16 -15.477 -5.648 -15.173 117 HB ILE 16 HB ILE 16 -15.176 -4.661 -12.866 118 HG12 ILE 16 2HG1 ILE 16 -12.735 -5.287 -12.595 119 HG13 ILE 16 3HG1 ILE 16 -12.972 -6.569 -13.779 120 HG21 ILE 16 1HG2 ILE 16 -16.071 -6.492 -11.510 121 HG22 ILE 16 2HG2 ILE 16 -14.437 -6.082 -10.987 122 HG23 ILE 16 3HG2 ILE 16 -14.714 -7.525 -11.965 123 HD11 ILE 16 1HD1 ILE 16 -13.304 -3.613 -14.302 124 HD12 ILE 16 2HD1 ILE 16 -13.478 -4.907 -15.493 125 HD13 ILE 16 3HD1 ILE 16 -11.913 -4.601 -14.743 126 H GLU 17 H GLU 17 -14.036 -7.160 -15.873 127 HA GLU 17 HA GLU 17 -14.880 -9.847 -16.110 128 HB2 GLU 17 2HB GLU 17 -13.486 -8.384 -17.699 129 HB3 GLU 17 3HB GLU 17 -12.110 -8.697 -16.660 130 HG2 GLU 17 2HG GLU 17 -13.667 -10.922 -17.977 131 HG3 GLU 17 3HG GLU 17 -12.372 -10.066 -18.804 132 H LYS 18 H LYS 18 -14.175 -11.704 -15.016 133 HA LYS 18 HA LYS 18 -13.873 -11.306 -12.256 134 HB2 LYS 18 2HB LYS 18 -15.129 -13.192 -13.301 135 HB3 LYS 18 3HB LYS 18 -13.600 -13.925 -13.781 136 HG2 LYS 18 2HG LYS 18 -12.972 -14.264 -11.439 137 HG3 LYS 18 3HG LYS 18 -14.394 -13.370 -10.897 138 HD2 LYS 18 2HD LYS 18 -14.819 -15.740 -10.610 139 HD3 LYS 18 3HD LYS 18 -15.850 -15.144 -11.913 140 HE2 LYS 18 2HE LYS 18 -14.932 -17.298 -12.543 141 HE3 LYS 18 3HE LYS 18 -14.194 -16.063 -13.563 142 HZ1 LYS 18 1HZ LYS 18 -12.982 -17.360 -11.193 143 HZ2 LYS 18 2HZ LYS 18 -12.268 -16.104 -12.066 144 HZ3 LYS 18 3HZ LYS 18 -12.545 -17.595 -12.809 145 H GLU 19 H GLU 19 -11.479 -12.254 -14.696 146 HA GLU 19 HA GLU 19 -9.414 -12.954 -12.831 147 HB2 GLU 19 2HB GLU 19 -9.495 -13.834 -15.163 148 HB3 GLU 19 3HB GLU 19 -9.167 -12.219 -15.779 149 HG2 GLU 19 2HG GLU 19 -6.978 -12.234 -14.627 150 HG3 GLU 19 3HG GLU 19 -7.291 -13.875 -14.052 151 H ILE 20 H ILE 20 -10.468 -9.955 -14.333 152 HA ILE 20 HA ILE 20 -8.218 -8.343 -13.506 153 HB ILE 20 HB ILE 20 -11.066 -7.411 -14.130 154 HG12 ILE 20 2HG1 ILE 20 -8.671 -7.760 -15.984 155 HG13 ILE 20 3HG1 ILE 20 -10.181 -8.657 -16.044 156 HG21 ILE 20 1HG2 ILE 20 -10.026 -5.216 -14.607 157 HG22 ILE 20 2HG2 ILE 20 -8.451 -5.852 -14.128 158 HG23 ILE 20 3HG2 ILE 20 -9.745 -5.710 -12.937 159 HD11 ILE 20 1HD1 ILE 20 -9.826 -5.726 -16.659 160 HD12 ILE 20 2HD1 ILE 20 -11.357 -6.604 -16.685 161 HD13 ILE 20 3HD1 ILE 20 -10.072 -7.036 -17.813 162 H ALA 21 H ALA 21 -11.362 -9.213 -12.115 163 HA ALA 21 HA ALA 21 -11.150 -7.701 -9.701 164 HB1 ALA 21 1HB ALA 21 -13.303 -8.563 -10.533 165 HB2 ALA 21 2HB ALA 21 -12.986 -9.122 -8.889 166 HB3 ALA 21 3HB ALA 21 -12.759 -10.219 -10.255 167 H CYS 22 H CYS 22 -9.868 -10.791 -10.750 168 HA CYS 22 HA CYS 22 -8.955 -11.666 -8.173 169 HB2 CYS 22 2HB CYS 22 -8.135 -12.554 -10.960 170 HB3 CYS 22 3HB CYS 22 -7.651 -13.352 -9.461 171 HG CYS 22 HG CYS 22 -10.959 -12.964 -9.764 172 H MET 23 H MET 23 -7.634 -9.615 -10.728 173 HA MET 23 HA MET 23 -4.946 -9.406 -9.836 174 HB2 MET 23 2HB MET 23 -6.695 -7.349 -11.252 175 HB3 MET 23 3HB MET 23 -4.968 -7.149 -10.994 176 HG2 MET 23 2HG MET 23 -4.489 -9.056 -12.420 177 HG3 MET 23 3HG MET 23 -6.211 -9.394 -12.599 178 HE1 MET 23 1HE MET 23 -3.324 -6.800 -13.380 179 HE2 MET 23 2HE MET 23 -4.534 -5.781 -12.597 180 HE3 MET 23 3HE MET 23 -4.198 -5.590 -14.318 181 H SER 24 H SER 24 -7.907 -7.756 -8.873 182 HA SER 24 HA SER 24 -6.777 -6.355 -6.634 183 HB2 SER 24 2HB SER 24 -8.978 -5.715 -7.634 184 HB3 SER 24 3HB SER 24 -9.649 -7.272 -7.148 185 HG SER 24 HG SER 24 -8.474 -5.528 -5.273 186 H VAL 25 H VAL 25 -5.708 -7.566 -5.113 187 HA VAL 25 HA VAL 25 -6.033 -10.374 -4.896 188 HB VAL 25 HB VAL 25 -4.555 -8.517 -2.985 189 HG11 VAL 25 1HG1 VAL 25 -3.237 -10.510 -2.330 190 HG12 VAL 25 2HG1 VAL 25 -4.252 -11.526 -3.354 191 HG13 VAL 25 3HG1 VAL 25 -4.947 -10.716 -1.950 192 HG21 VAL 25 1HG2 VAL 25 -3.731 -8.259 -5.284 193 HG22 VAL 25 2HG2 VAL 25 -3.505 -10.004 -5.426 194 HG23 VAL 25 3HG2 VAL 25 -2.522 -9.076 -4.289 195 H THR 26 H THR 26 -7.211 -7.688 -2.854 196 HA THR 26 HA THR 26 -8.253 -9.190 -0.719 197 HB THR 26 HB THR 26 -9.192 -6.510 -1.824 198 HG1 THR 26 HG1 THR 26 -7.912 -5.737 -0.053 199 HG21 THR 26 1HG2 THR 26 -9.833 -7.765 0.878 200 HG22 THR 26 2HG2 THR 26 -10.994 -7.455 -0.415 201 HG23 THR 26 3HG2 THR 26 -10.208 -6.105 0.406 202 H ILE 27 H ILE 27 -9.865 -8.088 -3.726 203 HA ILE 27 HA ILE 27 -12.404 -9.253 -3.169 204 HB ILE 27 HB ILE 27 -11.171 -8.457 -5.849 205 HG12 ILE 27 2HG1 ILE 27 -13.101 -6.930 -4.032 206 HG13 ILE 27 3HG1 ILE 27 -11.383 -6.583 -4.208 207 HG21 ILE 27 1HG2 ILE 27 -14.091 -9.049 -5.222 208 HG22 ILE 27 2HG2 ILE 27 -13.024 -10.047 -6.210 209 HG23 ILE 27 3HG2 ILE 27 -13.472 -8.431 -6.756 210 HD11 ILE 27 1HD1 ILE 27 -12.686 -5.011 -5.469 211 HD12 ILE 27 2HD1 ILE 27 -13.486 -6.311 -6.345 212 HD13 ILE 27 3HD1 ILE 27 -11.761 -6.028 -6.571 213 H LYS 28 H LYS 28 -9.525 -10.377 -4.920 214 HA LYS 28 HA LYS 28 -10.403 -12.806 -5.976 215 HB2 LYS 28 2HB LYS 28 -8.194 -11.807 -6.487 216 HB3 LYS 28 3HB LYS 28 -7.661 -12.108 -4.839 217 HG2 LYS 28 2HG LYS 28 -7.929 -14.588 -5.276 218 HG3 LYS 28 3HG LYS 28 -8.296 -14.193 -6.958 219 HD2 LYS 28 2HD LYS 28 -5.939 -14.871 -6.678 220 HD3 LYS 28 3HD LYS 28 -6.065 -13.203 -7.246 221 HE2 LYS 28 2HE LYS 28 -4.329 -13.444 -5.508 222 HE3 LYS 28 3HE LYS 28 -5.624 -12.382 -4.960 223 HZ1 LYS 28 1HZ LYS 28 -6.546 -14.289 -3.723 224 HZ2 LYS 28 2HZ LYS 28 -4.987 -13.882 -3.212 225 HZ3 LYS 28 3HZ LYS 28 -5.224 -15.228 -4.204 226 H ASN 29 H ASN 29 -9.013 -12.068 -2.784 227 HA ASN 29 HA ASN 29 -8.913 -14.683 -1.740 228 HB2 ASN 29 2HB ASN 29 -9.118 -12.003 -0.288 229 HB3 ASN 29 3HB ASN 29 -8.807 -13.536 0.521 230 HD21 ASN 29 1HD2 ASN 29 -7.138 -11.176 0.471 231 HD22 ASN 29 2HD2 ASN 29 -5.627 -11.647 -0.219 232 H MET 30 H MET 30 -11.398 -12.145 -1.542 233 HA MET 30 HA MET 30 -13.273 -13.432 0.098 234 HB2 MET 30 2HB MET 30 -13.703 -11.391 -2.132 235 HB3 MET 30 3HB MET 30 -14.970 -11.903 -1.025 236 HG2 MET 30 2HG MET 30 -13.705 -10.999 0.871 237 HG3 MET 30 3HG MET 30 -12.404 -10.514 -0.222 238 HE1 MET 30 1HE MET 30 -12.603 -8.020 0.833 239 HE2 MET 30 2HE MET 30 -13.946 -8.538 1.854 240 HE3 MET 30 3HE MET 30 -14.108 -7.100 0.846 241 H ILE 31 H ILE 31 -12.926 -13.438 -3.452 242 HA ILE 31 HA ILE 31 -15.103 -15.047 -4.162 243 HB ILE 31 HB ILE 31 -12.384 -14.718 -5.529 244 HG12 ILE 31 2HG1 ILE 31 -15.082 -13.431 -6.181 245 HG13 ILE 31 3HG1 ILE 31 -13.765 -12.634 -5.333 246 HG21 ILE 31 1HG2 ILE 31 -13.415 -15.620 -7.594 247 HG22 ILE 31 2HG2 ILE 31 -14.885 -15.997 -6.697 248 HG23 ILE 31 3HG2 ILE 31 -13.378 -16.827 -6.307 249 HD11 ILE 31 1HD1 ILE 31 -13.843 -11.919 -7.633 250 HD12 ILE 31 2HD1 ILE 31 -13.723 -13.585 -8.198 251 HD13 ILE 31 3HD1 ILE 31 -12.364 -12.839 -7.349 252 H GLU 32 H GLU 32 -11.746 -15.937 -3.350 253 HA GLU 32 HA GLU 32 -11.928 -18.724 -3.772 254 HB2 GLU 32 2HB GLU 32 -10.069 -17.123 -1.974 255 HB3 GLU 32 3HB GLU 32 -9.854 -18.833 -2.338 256 HG2 GLU 32 2HG GLU 32 -9.476 -18.350 -4.686 257 HG3 GLU 32 3HG GLU 32 -9.869 -16.646 -4.439 258 H ASP 33 H ASP 33 -12.519 -16.757 -0.860 259 HA ASP 33 HA ASP 33 -12.783 -18.879 1.005 260 HB2 ASP 33 2HB ASP 33 -13.934 -16.056 1.058 261 HB3 ASP 33 3HB ASP 33 -14.064 -17.177 2.412 262 H ILE 34 H ILE 34 -15.145 -17.132 -0.965 263 HA ILE 34 HA ILE 34 -17.460 -18.476 0.041 264 HB ILE 34 HB ILE 34 -17.130 -16.924 -2.579 265 HG12 ILE 34 2HG1 ILE 34 -18.165 -15.888 0.111 266 HG13 ILE 34 3HG1 ILE 34 -16.543 -15.593 -0.500 267 HG21 ILE 34 1HG2 ILE 34 -19.655 -17.635 -1.029 268 HG22 ILE 34 2HG2 ILE 34 -19.161 -18.318 -2.579 269 HG23 ILE 34 3HG2 ILE 34 -19.591 -16.612 -2.467 270 HD11 ILE 34 1HD1 ILE 34 -19.103 -14.654 -1.799 271 HD12 ILE 34 2HD1 ILE 34 -17.464 -14.355 -2.389 272 HD13 ILE 34 3HD1 ILE 34 -17.985 -13.675 -0.848 273 H GLY 35 H GLY 35 -15.112 -19.174 -2.465 274 HA2 GLY 35 2HA GLY 35 -14.756 -21.292 -3.453 275 HA3 GLY 35 3HA GLY 35 -16.414 -21.746 -3.091 276 H GLU 36 H GLU 36 -15.735 -18.679 -4.495 277 HA GLU 36 HA GLU 36 -16.078 -17.635 -6.414 278 HB2 GLU 36 2HB GLU 36 -14.468 -19.271 -7.359 279 HB3 GLU 36 3HB GLU 36 -15.800 -20.363 -7.738 280 HG2 GLU 36 2HG GLU 36 -16.742 -18.614 -9.272 281 HG3 GLU 36 3HG GLU 36 -15.334 -17.604 -8.934 282 H SER 37 H SER 37 -18.092 -16.897 -6.033 283 HA SER 37 HA SER 37 -20.433 -18.533 -6.804 284 HB2 SER 37 2HB SER 37 -21.681 -16.903 -5.306 285 HB3 SER 37 3HB SER 37 -20.492 -17.902 -4.464 286 HG SER 37 HG SER 37 -20.447 -15.597 -3.961 287 H ASP 38 H ASP 38 -22.237 -17.381 -7.768 288 HA ASP 38 HA ASP 38 -21.504 -15.456 -9.805 289 HB2 ASP 38 2HB ASP 38 -23.321 -16.305 -10.900 290 HB3 ASP 38 3HB ASP 38 -23.476 -17.465 -9.599 291 H SER 39 H SER 39 -22.599 -15.327 -6.589 292 HA SER 39 HA SER 39 -24.328 -13.165 -6.498 293 HB2 SER 39 2HB SER 39 -23.690 -13.003 -4.076 294 HB3 SER 39 3HB SER 39 -24.051 -14.649 -4.589 295 HG SER 39 HG SER 39 -21.384 -13.851 -4.750 296 HA PRO 40 HA PRO 40 -21.502 -9.779 -7.528 297 HB2 PRO 40 2HB PRO 40 -23.238 -7.695 -7.118 298 HB3 PRO 40 3HB PRO 40 -23.350 -8.763 -8.529 299 HG2 PRO 40 2HG PRO 40 -24.946 -8.839 -5.989 300 HG3 PRO 40 3HG PRO 40 -25.499 -9.007 -7.672 301 HD2 PRO 40 2HD PRO 40 -25.103 -11.163 -6.062 302 HD3 PRO 40 3HD PRO 40 -24.829 -11.226 -7.821 303 H ILE 41 H ILE 41 -20.032 -8.643 -6.312 304 HA ILE 41 HA ILE 41 -20.457 -8.530 -3.384 305 HB ILE 41 HB ILE 41 -17.816 -8.674 -4.915 306 HG12 ILE 41 2HG1 ILE 41 -19.024 -10.834 -4.986 307 HG13 ILE 41 3HG1 ILE 41 -17.600 -10.972 -3.964 308 HG21 ILE 41 1HG2 ILE 41 -16.744 -8.948 -2.694 309 HG22 ILE 41 2HG2 ILE 41 -18.301 -8.677 -1.911 310 HG23 ILE 41 3HG2 ILE 41 -17.548 -7.383 -2.846 311 HD11 ILE 41 1HD1 ILE 41 -20.461 -10.702 -3.025 312 HD12 ILE 41 2HD1 ILE 41 -19.047 -10.801 -1.970 313 HD13 ILE 41 3HD1 ILE 41 -19.472 -12.161 -3.008 314 HA PRO 42 HA PRO 42 -20.299 -4.030 -4.406 315 HB2 PRO 42 2HB PRO 42 -21.889 -3.184 -2.346 316 HB3 PRO 42 3HB PRO 42 -22.565 -3.871 -3.837 317 HG2 PRO 42 2HG PRO 42 -22.136 -5.202 -1.185 318 HG3 PRO 42 3HG PRO 42 -23.539 -5.293 -2.276 319 HD2 PRO 42 2HD PRO 42 -21.611 -7.239 -2.173 320 HD3 PRO 42 3HD PRO 42 -22.546 -6.882 -3.641 321 H LEU 43 H LEU 43 -18.582 -2.867 -3.750 322 HA LEU 43 HA LEU 43 -17.487 -3.140 -1.025 323 HB2 LEU 43 2HB LEU 43 -16.262 -1.800 -3.478 324 HB3 LEU 43 3HB LEU 43 -15.501 -1.939 -1.908 325 HG LEU 43 HG LEU 43 -14.438 -3.575 -3.247 326 HD11 LEU 43 1HD1 LEU 43 -14.955 -5.720 -2.233 327 HD12 LEU 43 2HD1 LEU 43 -16.514 -5.111 -1.669 328 HD13 LEU 43 3HD1 LEU 43 -15.014 -4.428 -1.036 329 HD21 LEU 43 1HD2 LEU 43 -15.567 -5.244 -4.648 330 HD22 LEU 43 2HD2 LEU 43 -15.974 -3.603 -5.144 331 HD23 LEU 43 3HD2 LEU 43 -17.140 -4.556 -4.223 332 HA PRO 44 HA PRO 44 -19.975 0.737 -0.710 333 HB2 PRO 44 2HB PRO 44 -20.520 0.643 1.949 334 HB3 PRO 44 3HB PRO 44 -21.312 -0.458 0.800 335 HG2 PRO 44 2HG PRO 44 -18.961 -1.005 2.595 336 HG3 PRO 44 3HG PRO 44 -20.404 -2.004 2.302 337 HD2 PRO 44 2HD PRO 44 -18.009 -2.446 1.038 338 HD3 PRO 44 3HD PRO 44 -19.577 -2.851 0.304 339 H ASN 45 H ASN 45 -16.931 -0.019 0.629 340 HA ASN 45 HA ASN 45 -16.336 2.390 2.045 341 HB2 ASN 45 2HB ASN 45 -15.043 0.383 2.499 342 HB3 ASN 45 3HB ASN 45 -14.581 0.220 0.810 343 HD21 ASN 45 1HD2 ASN 45 -14.035 2.018 3.771 344 HD22 ASN 45 2HD2 ASN 45 -12.533 2.727 3.295 345 H VAL 46 H VAL 46 -15.577 1.221 -1.237 346 HA VAL 46 HA VAL 46 -14.324 3.765 -1.968 347 HB VAL 46 HB VAL 46 -13.142 1.674 -2.530 348 HG11 VAL 46 1HG1 VAL 46 -15.462 1.002 -4.367 349 HG12 VAL 46 2HG1 VAL 46 -15.049 0.169 -2.867 350 HG13 VAL 46 3HG1 VAL 46 -13.942 0.108 -4.241 351 HG21 VAL 46 1HG2 VAL 46 -12.628 2.163 -4.905 352 HG22 VAL 46 2HG2 VAL 46 -12.720 3.631 -3.931 353 HG23 VAL 46 3HG2 VAL 46 -14.058 3.197 -4.997 354 H THR 47 H THR 47 -15.187 5.200 -3.405 355 HA THR 47 HA THR 47 -18.029 5.081 -3.950 356 HB THR 47 HB THR 47 -17.637 7.378 -4.936 357 HG1 THR 47 HG1 THR 47 -15.043 7.417 -3.869 358 HG21 THR 47 1HG2 THR 47 -18.225 7.142 -2.552 359 HG22 THR 47 2HG2 THR 47 -17.103 8.485 -2.790 360 HG23 THR 47 3HG2 THR 47 -16.517 6.954 -2.136 361 H SER 48 H SER 48 -18.691 5.978 -6.243 362 HA SER 48 HA SER 48 -18.243 3.831 -8.022 363 HB2 SER 48 2HB SER 48 -19.697 5.172 -9.585 364 HB3 SER 48 3HB SER 48 -20.381 4.938 -7.979 365 HG SER 48 HG SER 48 -19.974 7.030 -7.479 366 H THR 49 H THR 49 -17.236 7.254 -8.195 367 HA THR 49 HA THR 49 -15.987 7.129 -10.710 368 HB THR 49 HB THR 49 -15.501 9.037 -8.384 369 HG1 THR 49 HG1 THR 49 -17.252 9.089 -10.631 370 HG21 THR 49 1HG2 THR 49 -14.654 10.639 -10.082 371 HG22 THR 49 2HG2 THR 49 -14.768 9.387 -11.320 372 HG23 THR 49 3HG2 THR 49 -13.627 9.206 -9.986 373 H ILE 50 H ILE 50 -14.652 6.743 -7.406 374 HA ILE 50 HA ILE 50 -11.926 6.536 -8.255 375 HB ILE 50 HB ILE 50 -13.185 5.715 -5.597 376 HG12 ILE 50 2HG1 ILE 50 -13.476 8.113 -6.043 377 HG13 ILE 50 3HG1 ILE 50 -12.302 7.894 -4.755 378 HG21 ILE 50 1HG2 ILE 50 -10.887 5.822 -4.660 379 HG22 ILE 50 2HG2 ILE 50 -10.242 6.097 -6.278 380 HG23 ILE 50 3HG2 ILE 50 -11.034 4.569 -5.893 381 HD11 ILE 50 1HD1 ILE 50 -11.696 8.589 -7.635 382 HD12 ILE 50 2HD1 ILE 50 -10.485 8.321 -6.374 383 HD13 ILE 50 3HD1 ILE 50 -11.619 9.664 -6.240 384 H LEU 51 H LEU 51 -14.428 4.132 -7.343 385 HA LEU 51 HA LEU 51 -12.851 1.802 -7.588 386 HB2 LEU 51 2HB LEU 51 -15.067 1.802 -6.471 387 HB3 LEU 51 3HB LEU 51 -15.856 2.122 -8.005 388 HG LEU 51 HG LEU 51 -15.155 -0.113 -8.849 389 HD11 LEU 51 1HD1 LEU 51 -14.141 -1.784 -7.375 390 HD12 LEU 51 2HD1 LEU 51 -13.961 -0.578 -6.100 391 HD13 LEU 51 3HD1 LEU 51 -13.071 -0.405 -7.615 392 HD21 LEU 51 1HD2 LEU 51 -17.338 0.105 -7.745 393 HD22 LEU 51 2HD2 LEU 51 -16.607 -0.281 -6.185 394 HD23 LEU 51 3HD2 LEU 51 -16.641 -1.492 -7.471 395 H GLU 52 H GLU 52 -14.800 3.620 -9.932 396 HA GLU 52 HA GLU 52 -14.653 1.915 -12.149 397 HB2 GLU 52 2HB GLU 52 -16.146 3.892 -12.051 398 HB3 GLU 52 3HB GLU 52 -14.753 4.966 -12.099 399 HG2 GLU 52 2HG GLU 52 -14.185 4.188 -14.358 400 HG3 GLU 52 3HG GLU 52 -15.518 3.032 -14.318 401 H LYS 53 H LYS 53 -12.551 4.601 -11.135 402 HA LYS 53 HA LYS 53 -10.792 4.510 -13.362 403 HB2 LYS 53 2HB LYS 53 -10.507 5.774 -10.607 404 HB3 LYS 53 3HB LYS 53 -9.307 5.955 -11.883 405 HG2 LYS 53 2HG LYS 53 -11.078 6.968 -13.344 406 HG3 LYS 53 3HG LYS 53 -12.185 6.904 -11.970 407 HD2 LYS 53 2HD LYS 53 -11.189 9.147 -12.211 408 HD3 LYS 53 3HD LYS 53 -10.710 8.398 -10.685 409 HE2 LYS 53 2HE LYS 53 -8.506 7.873 -11.570 410 HE3 LYS 53 3HE LYS 53 -8.982 8.413 -13.177 411 HZ1 LYS 53 1HZ LYS 53 -8.930 10.188 -10.821 412 HZ2 LYS 53 2HZ LYS 53 -9.127 10.628 -12.441 413 HZ3 LYS 53 3HZ LYS 53 -7.643 10.026 -11.905 414 H VAL 54 H VAL 54 -10.595 3.111 -10.094 415 HA VAL 54 HA VAL 54 -7.922 2.164 -10.329 416 HB VAL 54 HB VAL 54 -10.155 1.333 -8.412 417 HG11 VAL 54 1HG1 VAL 54 -8.395 0.310 -7.004 418 HG12 VAL 54 2HG1 VAL 54 -7.194 0.644 -8.253 419 HG13 VAL 54 3HG1 VAL 54 -8.507 -0.490 -8.573 420 HG21 VAL 54 1HG2 VAL 54 -9.428 3.696 -8.186 421 HG22 VAL 54 2HG2 VAL 54 -7.759 3.170 -7.977 422 HG23 VAL 54 3HG2 VAL 54 -8.974 2.752 -6.766 423 H LEU 55 H LEU 55 -11.118 0.684 -10.965 424 HA LEU 55 HA LEU 55 -10.114 -1.869 -11.813 425 HB2 LEU 55 2HB LEU 55 -12.780 -0.498 -12.359 426 HB3 LEU 55 3HB LEU 55 -12.410 -2.129 -12.899 427 HG LEU 55 HG LEU 55 -12.606 -1.215 -10.002 428 HD11 LEU 55 1HD1 LEU 55 -14.456 -3.010 -11.609 429 HD12 LEU 55 2HD1 LEU 55 -14.787 -1.348 -11.112 430 HD13 LEU 55 3HD1 LEU 55 -14.618 -2.609 -9.894 431 HD21 LEU 55 1HD2 LEU 55 -12.332 -3.586 -9.391 432 HD22 LEU 55 2HD2 LEU 55 -10.903 -2.962 -10.209 433 HD23 LEU 55 3HD2 LEU 55 -12.034 -3.998 -11.083 434 H ASP 56 H ASP 56 -10.592 1.230 -13.393 435 HA ASP 56 HA ASP 56 -10.524 0.326 -16.110 436 HB2 ASP 56 2HB ASP 56 -11.501 2.543 -15.307 437 HB3 ASP 56 3HB ASP 56 -9.859 3.125 -15.070 438 H TYR 57 H TYR 57 -8.111 1.533 -13.806 439 HA TYR 57 HA TYR 57 -5.838 1.308 -15.503 440 HB2 TYR 57 2HB TYR 57 -5.546 2.607 -13.481 441 HB3 TYR 57 3HB TYR 57 -6.100 1.280 -12.458 442 HD1 TYR 57 HD1 TYR 57 -3.246 2.469 -14.568 443 HD2 TYR 57 HD2 TYR 57 -4.569 -0.499 -11.783 444 HE1 TYR 57 HE1 TYR 57 -0.948 1.609 -14.368 445 HE2 TYR 57 HE2 TYR 57 -2.282 -1.336 -11.589 446 HH TYR 57 HH TYR 57 0.407 0.310 -12.663 447 H CYS 58 H CYS 58 -7.434 -0.942 -13.216 448 HA CYS 58 HA CYS 58 -5.583 -3.050 -13.438 449 HB2 CYS 58 2HB CYS 58 -8.541 -3.130 -12.735 450 HB3 CYS 58 3HB CYS 58 -7.444 -4.504 -12.568 451 HG CYS 58 HG CYS 58 -8.065 -2.155 -10.439 452 H ARG 59 H ARG 59 -8.326 -2.140 -15.469 453 HA ARG 59 HA ARG 59 -8.346 -4.354 -17.255 454 HB2 ARG 59 2HB ARG 59 -9.160 -1.438 -17.610 455 HB3 ARG 59 3HB ARG 59 -9.387 -2.648 -18.868 456 HG2 ARG 59 2HG ARG 59 -10.945 -3.887 -17.495 457 HG3 ARG 59 3HG ARG 59 -10.620 -2.844 -16.107 458 HD2 ARG 59 2HD ARG 59 -12.761 -2.298 -17.267 459 HD3 ARG 59 3HD ARG 59 -11.632 -0.943 -17.222 460 HE ARG 59 HE ARG 59 -11.062 -1.502 -19.567 461 HH11 ARG 59 1HH1 ARG 59 -14.146 -2.597 -18.314 462 HH12 ARG 59 2HH1 ARG 59 -14.896 -2.664 -19.879 463 HH21 ARG 59 1HH2 ARG 59 -12.056 -1.559 -21.606 464 HH22 ARG 59 2HH2 ARG 59 -13.709 -2.074 -21.738 465 H HIS 60 H HIS 60 -6.780 -1.169 -17.381 466 HA HIS 60 HA HIS 60 -5.360 -1.318 -19.755 467 HB2 HIS 60 2HB HIS 60 -5.548 0.782 -18.621 468 HB3 HIS 60 3HB HIS 60 -4.873 0.138 -17.135 469 HD1 HIS 60 HD1 HIS 60 -3.795 1.130 -20.630 470 HD2 HIS 60 HD2 HIS 60 -2.189 0.575 -16.835 471 HE1 HIS 60 HE1 HIS 60 -1.440 1.989 -20.756 472 HE2 HIS 60 HE2 HIS 60 -0.583 1.836 -18.397 473 H HIS 61 H HIS 61 -4.359 -2.395 -16.525 474 HA HIS 61 HA HIS 61 -1.717 -3.224 -17.367 475 HB2 HIS 61 2HB HIS 61 -2.364 -2.243 -15.048 476 HB3 HIS 61 3HB HIS 61 -2.993 -3.841 -14.669 477 HD1 HIS 61 HD1 HIS 61 -1.241 -5.742 -14.300 478 HD2 HIS 61 HD2 HIS 61 0.440 -2.040 -15.161 479 HE1 HIS 61 HE1 HIS 61 1.200 -5.964 -13.764 480 HE2 HIS 61 HE2 HIS 61 2.215 -3.804 -14.554 481 H HIS 62 H HIS 62 -4.835 -4.633 -17.263 482 HA HIS 62 HA HIS 62 -4.057 -7.408 -17.038 483 HB2 HIS 62 2HB HIS 62 -6.316 -6.523 -16.367 484 HB3 HIS 62 3HB HIS 62 -6.666 -6.188 -18.057 485 HD1 HIS 62 HD1 HIS 62 -6.402 -8.935 -15.569 486 HD2 HIS 62 HD2 HIS 62 -7.362 -8.486 -19.572 487 HE1 HIS 62 HE1 HIS 62 -7.515 -11.059 -16.252 488 HE2 HIS 62 HE2 HIS 62 -8.305 -10.659 -18.584 489 H GLN 63 H GLN 63 -5.089 -5.217 -19.633 490 HA GLN 63 HA GLN 63 -4.866 -7.122 -21.759 491 HB2 GLN 63 2HB GLN 63 -4.991 -4.071 -21.925 492 HB3 GLN 63 3HB GLN 63 -5.302 -5.200 -23.241 493 HG2 GLN 63 2HG GLN 63 -6.973 -4.826 -20.743 494 HG3 GLN 63 3HG GLN 63 -7.396 -4.325 -22.373 495 HE21 GLN 63 1HE2 GLN 63 -6.547 -6.798 -23.662 496 HE22 GLN 63 2HE2 GLN 63 -7.694 -8.000 -23.207 497 H HIS 64 H HIS 64 -2.770 -4.753 -20.273 498 HA HIS 64 HA HIS 64 -0.460 -5.819 -21.763 499 HB2 HIS 64 2HB HIS 64 -1.017 -2.870 -21.210 500 HB3 HIS 64 3HB HIS 64 0.544 -3.491 -21.739 501 HD1 HIS 64 HD1 HIS 64 0.739 -4.287 -24.185 502 HD2 HIS 64 HD2 HIS 64 -2.980 -2.696 -23.231 503 HE1 HIS 64 HE1 HIS 64 -0.421 -3.926 -26.374 504 HE2 HIS 64 HE2 HIS 64 -2.666 -2.975 -25.780 505 HA PRO 65 HA PRO 65 0.607 -6.476 -17.245 506 HB2 PRO 65 2HB PRO 65 2.825 -7.751 -18.887 507 HB3 PRO 65 3HB PRO 65 2.064 -8.329 -17.386 508 HG2 PRO 65 2HG PRO 65 1.380 -9.429 -19.694 509 HG3 PRO 65 3HG PRO 65 0.123 -9.062 -18.486 510 HD2 PRO 65 2HD PRO 65 0.777 -7.604 -21.034 511 HD3 PRO 65 3HD PRO 65 -0.801 -7.870 -20.255 512 H GLY 66 H GLY 66 2.598 -5.504 -19.996 513 HA2 GLY 66 2HA GLY 66 3.946 -3.398 -18.389 514 HA3 GLY 66 3HA GLY 66 4.572 -4.090 -19.884 515 H GLY 67 H GLY 67 4.281 -2.905 -21.662 516 HA2 GLY 67 2HA GLY 67 3.522 -1.306 -23.140 517 HA3 GLY 67 3HA GLY 67 1.916 -1.658 -22.509 518 H SER 68 H SER 68 4.403 -0.466 -20.343 519 HA SER 68 HA SER 68 3.492 2.238 -19.997 520 HB2 SER 68 2HB SER 68 2.514 0.178 -17.966 521 HB3 SER 68 3HB SER 68 2.257 1.924 -17.915 522 HG SER 68 HG SER 68 1.199 0.069 -19.757 523 H GLY 69 H GLY 69 4.798 3.328 -18.243 524 HA2 GLY 69 2HA GLY 69 6.500 2.055 -16.334 525 HA3 GLY 69 3HA GLY 69 7.307 2.131 -17.837 526 H LEU 70 H LEU 70 8.831 3.510 -17.889 527 HA LEU 70 HA LEU 70 8.659 6.272 -18.316 528 HB2 LEU 70 2HB LEU 70 8.510 6.641 -15.965 529 HB3 LEU 70 3HB LEU 70 9.731 5.430 -15.614 530 HG LEU 70 HG LEU 70 11.459 6.931 -16.595 531 HD11 LEU 70 1HD1 LEU 70 10.185 8.269 -18.138 532 HD12 LEU 70 2HD1 LEU 70 10.951 9.337 -16.965 533 HD13 LEU 70 3HD1 LEU 70 9.228 8.969 -16.832 534 HD21 LEU 70 1HD2 LEU 70 11.548 8.471 -14.677 535 HD22 LEU 70 2HD2 LEU 70 11.076 6.847 -14.189 536 HD23 LEU 70 3HD2 LEU 70 9.858 8.118 -14.309 537 H ASP 71 H ASP 71 10.806 3.732 -17.019 538 HA ASP 71 HA ASP 71 12.312 3.498 -19.462 539 HB2 ASP 71 2HB ASP 71 13.142 2.578 -17.335 540 HB3 ASP 71 3HB ASP 71 11.679 1.626 -17.118 541 H ASP 72 H ASP 72 9.159 3.703 -19.306 542 HA ASP 72 HA ASP 72 8.340 2.015 -21.319 543 HB2 ASP 72 2HB ASP 72 8.798 0.607 -18.898 544 HB3 ASP 72 3HB ASP 72 7.091 0.901 -18.812 545 H ILE 73 H ILE 73 7.635 4.931 -19.453 546 HA ILE 73 HA ILE 73 5.113 4.913 -18.349 547 HB ILE 73 HB ILE 73 6.664 7.269 -19.395 548 HG12 ILE 73 2HG1 ILE 73 5.117 6.982 -16.770 549 HG13 ILE 73 3HG1 ILE 73 6.813 6.635 -16.974 550 HG21 ILE 73 1HG2 ILE 73 4.913 8.988 -19.091 551 HG22 ILE 73 2HG2 ILE 73 3.719 7.729 -18.763 552 HG23 ILE 73 3HG2 ILE 73 4.438 7.857 -20.364 553 HD11 ILE 73 1HD1 ILE 73 5.520 9.362 -17.161 554 HD12 ILE 73 2HD1 ILE 73 7.233 9.033 -17.411 555 HD13 ILE 73 3HD1 ILE 73 6.506 8.742 -15.833 556 HA PRO 74 HA PRO 74 2.214 5.067 -21.814 557 HB2 PRO 74 2HB PRO 74 -0.081 4.461 -20.628 558 HB3 PRO 74 3HB PRO 74 1.227 3.256 -20.665 559 HG2 PRO 74 2HG PRO 74 0.358 5.016 -18.410 560 HG3 PRO 74 3HG PRO 74 0.882 3.319 -18.372 561 HD2 PRO 74 2HD PRO 74 2.525 5.583 -17.832 562 HD3 PRO 74 3HD PRO 74 3.097 3.923 -18.100 563 HA PRO 75 HA PRO 75 0.607 9.351 -21.446 564 HB2 PRO 75 2HB PRO 75 -0.982 9.257 -23.730 565 HB3 PRO 75 3HB PRO 75 0.765 9.568 -23.750 566 HG2 PRO 75 2HG PRO 75 -0.685 6.990 -24.267 567 HG3 PRO 75 3HG PRO 75 0.694 7.698 -25.140 568 HD2 PRO 75 2HD PRO 75 1.025 5.710 -23.344 569 HD3 PRO 75 3HD PRO 75 2.239 6.998 -23.534 570 H TYR 76 H TYR 76 -1.176 6.398 -21.680 571 HA TYR 76 HA TYR 76 -3.825 7.068 -21.233 572 HB2 TYR 76 2HB TYR 76 -2.775 4.802 -21.810 573 HB3 TYR 76 3HB TYR 76 -2.358 4.633 -20.113 574 HD1 TYR 76 HD1 TYR 76 -4.244 4.381 -18.391 575 HD2 TYR 76 HD2 TYR 76 -4.984 4.338 -22.608 576 HE1 TYR 76 HE1 TYR 76 -6.431 3.312 -18.004 577 HE2 TYR 76 HE2 TYR 76 -7.157 3.280 -22.215 578 HH TYR 76 HH TYR 76 -8.547 2.967 -19.072 579 H ASP 77 H ASP 77 -1.328 6.219 -18.838 580 HA ASP 77 HA ASP 77 -3.003 6.583 -16.558 581 HB2 ASP 77 2HB ASP 77 -0.005 6.138 -16.790 582 HB3 ASP 77 3HB ASP 77 -0.842 6.279 -15.246 583 H ARG 78 H ARG 78 -0.954 8.741 -18.352 584 HA ARG 78 HA ARG 78 -0.582 10.784 -16.441 585 HB2 ARG 78 2HB ARG 78 -0.991 11.149 -19.440 586 HB3 ARG 78 3HB ARG 78 -0.229 12.300 -18.349 587 HG2 ARG 78 2HG ARG 78 0.849 9.537 -18.933 588 HG3 ARG 78 3HG ARG 78 1.366 10.988 -19.783 589 HD2 ARG 78 2HD ARG 78 3.015 10.475 -18.113 590 HD3 ARG 78 3HD ARG 78 2.152 11.917 -17.587 591 HE ARG 78 HE ARG 78 1.153 9.419 -16.489 592 HH11 ARG 78 1HH1 ARG 78 3.402 12.087 -15.992 593 HH12 ARG 78 2HH1 ARG 78 3.513 11.827 -14.283 594 HH21 ARG 78 1HH2 ARG 78 1.275 9.145 -14.212 595 HH22 ARG 78 2HH2 ARG 78 2.314 10.172 -13.282 596 H ASP 79 H ASP 79 -3.243 10.118 -18.717 597 HA ASP 79 HA ASP 79 -4.940 12.250 -17.940 598 HB2 ASP 79 2HB ASP 79 -5.578 9.557 -19.220 599 HB3 ASP 79 3HB ASP 79 -6.806 10.792 -18.943 600 H PHE 80 H PHE 80 -4.589 8.918 -16.783 601 HA PHE 80 HA PHE 80 -6.692 8.791 -14.937 602 HB2 PHE 80 2HB PHE 80 -5.420 6.786 -15.582 603 HB3 PHE 80 3HB PHE 80 -3.946 7.442 -14.886 604 HD1 PHE 80 HD1 PHE 80 -7.144 5.787 -14.158 605 HD2 PHE 80 HD2 PHE 80 -3.622 7.475 -12.412 606 HE1 PHE 80 HE1 PHE 80 -7.687 4.754 -12.001 607 HE2 PHE 80 HE2 PHE 80 -4.193 6.432 -10.264 608 HZ PHE 80 HZ PHE 80 -6.231 5.066 -10.061 609 H CYS 81 H CYS 81 -3.428 10.125 -14.634 610 HA CYS 81 HA CYS 81 -3.454 10.469 -11.789 611 HB2 CYS 81 2HB CYS 81 -1.586 11.563 -13.923 612 HB3 CYS 81 3HB CYS 81 -1.303 11.696 -12.186 613 HG CYS 81 HG CYS 81 -1.844 8.564 -13.270 614 H LYS 82 H LYS 82 -5.112 12.199 -14.138 615 HA LYS 82 HA LYS 82 -4.839 14.861 -13.053 616 HB2 LYS 82 2HB LYS 82 -7.005 13.760 -14.895 617 HB3 LYS 82 3HB LYS 82 -6.674 15.461 -14.581 618 HG2 LYS 82 2HG LYS 82 -4.865 13.499 -16.016 619 HG3 LYS 82 3HG LYS 82 -5.779 14.821 -16.745 620 HD2 LYS 82 2HD LYS 82 -4.408 16.470 -15.514 621 HD3 LYS 82 3HD LYS 82 -3.518 15.160 -14.728 622 HE2 LYS 82 2HE LYS 82 -2.242 16.113 -16.606 623 HE3 LYS 82 3HE LYS 82 -2.646 14.424 -16.908 624 HZ1 LYS 82 1HZ LYS 82 -2.990 15.832 -18.852 625 HZ2 LYS 82 2HZ LYS 82 -4.126 16.751 -18.003 626 HZ3 LYS 82 3HZ LYS 82 -4.433 15.125 -18.335 627 H VAL 83 H VAL 83 -5.193 14.487 -10.893 628 HA VAL 83 HA VAL 83 -7.992 14.205 -9.971 629 HB VAL 83 HB VAL 83 -7.096 12.961 -7.938 630 HG11 VAL 83 1HG1 VAL 83 -8.203 11.705 -9.732 631 HG12 VAL 83 2HG1 VAL 83 -6.912 10.751 -9.007 632 HG13 VAL 83 3HG1 VAL 83 -6.664 11.516 -10.579 633 HG21 VAL 83 1HG2 VAL 83 -4.868 11.870 -8.061 634 HG22 VAL 83 2HG2 VAL 83 -4.725 13.628 -8.086 635 HG23 VAL 83 3HG2 VAL 83 -4.539 12.709 -9.582 636 H ASP 84 H ASP 84 -8.345 15.279 -7.878 637 HA ASP 84 HA ASP 84 -6.555 17.524 -7.321 638 HB2 ASP 84 2HB ASP 84 -9.220 17.457 -7.179 639 HB3 ASP 84 3HB ASP 84 -8.938 16.805 -5.571 640 H GLN 85 H GLN 85 -6.103 17.818 -4.764 641 HA GLN 85 HA GLN 85 -4.235 15.805 -4.145 642 HB2 GLN 85 2HB GLN 85 -3.932 18.161 -3.443 643 HB3 GLN 85 3HB GLN 85 -5.271 18.007 -2.314 644 HG2 GLN 85 2HG GLN 85 -3.106 17.877 -1.161 645 HG3 GLN 85 3HG GLN 85 -4.005 16.371 -0.990 646 HE21 GLN 85 1HE2 GLN 85 -3.240 14.502 -2.092 647 HE22 GLN 85 2HE2 GLN 85 -1.628 14.400 -2.684 648 HA PRO 86 HA PRO 86 -7.381 14.187 -0.649 649 HB2 PRO 86 2HB PRO 86 -9.980 15.048 -1.935 650 HB3 PRO 86 3HB PRO 86 -9.548 14.938 -0.211 651 HG2 PRO 86 2HG PRO 86 -9.700 17.311 -1.376 652 HG3 PRO 86 3HG PRO 86 -8.391 16.965 -0.220 653 HD2 PRO 86 2HD PRO 86 -8.288 17.012 -3.234 654 HD3 PRO 86 3HD PRO 86 -7.127 17.665 -2.053 655 H THR 87 H THR 87 -8.482 14.472 -4.016 656 HA THR 87 HA THR 87 -9.638 11.911 -4.311 657 HB THR 87 HB THR 87 -8.482 13.663 -6.523 658 HG1 THR 87 HG1 THR 87 -10.901 13.859 -5.041 659 HG21 THR 87 1HG2 THR 87 -9.227 11.424 -7.284 660 HG22 THR 87 2HG2 THR 87 -10.280 12.695 -7.904 661 HG23 THR 87 3HG2 THR 87 -10.809 11.703 -6.545 662 H LEU 88 H LEU 88 -6.367 13.095 -4.675 663 HA LEU 88 HA LEU 88 -5.162 10.916 -6.020 664 HB2 LEU 88 2HB LEU 88 -4.328 13.392 -5.392 665 HB3 LEU 88 3HB LEU 88 -3.646 12.590 -3.994 666 HG LEU 88 HG LEU 88 -2.979 11.953 -6.899 667 HD11 LEU 88 1HD1 LEU 88 -1.348 13.463 -4.839 668 HD12 LEU 88 2HD1 LEU 88 -2.134 14.137 -6.270 669 HD13 LEU 88 3HD1 LEU 88 -0.806 12.997 -6.456 670 HD21 LEU 88 1HD2 LEU 88 -1.137 10.574 -6.022 671 HD22 LEU 88 2HD2 LEU 88 -2.713 9.958 -5.530 672 HD23 LEU 88 3HD2 LEU 88 -1.717 10.845 -4.374 673 H PHE 89 H PHE 89 -5.593 11.728 -2.578 674 HA PHE 89 HA PHE 89 -4.359 9.396 -1.521 675 HB2 PHE 89 2HB PHE 89 -6.341 11.319 -0.244 676 HB3 PHE 89 3HB PHE 89 -5.496 10.045 0.631 677 HD1 PHE 89 HD1 PHE 89 -2.777 10.122 -0.157 678 HD2 PHE 89 HD2 PHE 89 -5.450 13.423 0.314 679 HE1 PHE 89 HE1 PHE 89 -0.879 11.608 0.278 680 HE2 PHE 89 HE2 PHE 89 -3.538 14.908 0.745 681 HZ PHE 89 HZ PHE 89 -1.247 14.001 0.725 682 H GLU 90 H GLU 90 -7.662 10.103 -2.569 683 HA GLU 90 HA GLU 90 -9.012 7.891 -1.482 684 HB2 GLU 90 2HB GLU 90 -9.511 9.351 -4.111 685 HB3 GLU 90 3HB GLU 90 -10.616 8.173 -3.413 686 HG2 GLU 90 2HG GLU 90 -9.829 10.822 -2.180 687 HG3 GLU 90 3HG GLU 90 -11.357 10.458 -2.976 688 H LEU 91 H LEU 91 -7.042 8.189 -4.407 689 HA LEU 91 HA LEU 91 -7.502 5.594 -5.483 690 HB2 LEU 91 2HB LEU 91 -5.075 7.403 -5.816 691 HB3 LEU 91 3HB LEU 91 -5.459 6.021 -6.831 692 HG LEU 91 HG LEU 91 -7.111 8.574 -6.635 693 HD11 LEU 91 1HD1 LEU 91 -5.269 7.612 -8.846 694 HD12 LEU 91 2HD1 LEU 91 -4.988 8.976 -7.760 695 HD13 LEU 91 3HD1 LEU 91 -6.313 9.036 -8.919 696 HD21 LEU 91 1HD2 LEU 91 -7.494 6.169 -8.456 697 HD22 LEU 91 2HD2 LEU 91 -8.410 7.676 -8.525 698 HD23 LEU 91 3HD2 LEU 91 -8.537 6.638 -7.109 699 H ILE 92 H ILE 92 -5.092 6.905 -3.219 700 HA ILE 92 HA ILE 92 -3.504 4.570 -2.875 701 HB ILE 92 HB ILE 92 -3.964 6.888 -0.924 702 HG12 ILE 92 2HG1 ILE 92 -1.773 6.468 -3.013 703 HG13 ILE 92 3HG1 ILE 92 -3.063 7.661 -3.090 704 HG21 ILE 92 1HG2 ILE 92 -1.836 6.228 0.157 705 HG22 ILE 92 2HG2 ILE 92 -1.721 4.829 -0.913 706 HG23 ILE 92 3HG2 ILE 92 -3.033 4.933 0.262 707 HD11 ILE 92 1HD1 ILE 92 -2.108 8.782 -1.117 708 HD12 ILE 92 2HD1 ILE 92 -0.995 8.713 -2.480 709 HD13 ILE 92 3HD1 ILE 92 -0.783 7.617 -1.116 710 H LEU 93 H LEU 93 -6.372 5.818 -1.199 711 HA LEU 93 HA LEU 93 -6.489 3.939 0.925 712 HB2 LEU 93 2HB LEU 93 -8.610 5.753 -0.303 713 HB3 LEU 93 3HB LEU 93 -8.912 4.770 1.121 714 HG LEU 93 HG LEU 93 -6.838 6.998 0.953 715 HD11 LEU 93 1HD1 LEU 93 -8.326 8.297 2.401 716 HD12 LEU 93 2HD1 LEU 93 -9.537 7.014 2.339 717 HD13 LEU 93 3HD1 LEU 93 -9.113 7.902 0.873 718 HD21 LEU 93 1HD2 LEU 93 -7.726 5.355 3.347 719 HD22 LEU 93 2HD2 LEU 93 -6.620 6.732 3.387 720 HD23 LEU 93 3HD2 LEU 93 -6.160 5.263 2.534 721 H ALA 94 H ALA 94 -8.029 4.100 -2.275 722 HA ALA 94 HA ALA 94 -9.677 1.777 -1.987 723 HB1 ALA 94 1HB ALA 94 -10.237 3.588 -3.555 724 HB2 ALA 94 2HB ALA 94 -10.109 2.043 -4.393 725 HB3 ALA 94 3HB ALA 94 -8.801 3.226 -4.514 726 H ALA 95 H ALA 95 -6.451 2.380 -3.347 727 HA ALA 95 HA ALA 95 -6.102 -0.222 -4.500 728 HB1 ALA 95 1HB ALA 95 -3.785 0.432 -4.849 729 HB2 ALA 95 2HB ALA 95 -3.977 1.813 -3.761 730 HB3 ALA 95 3HB ALA 95 -4.861 1.758 -5.286 731 H ASN 96 H ASN 96 -5.338 1.207 -1.352 732 HA ASN 96 HA ASN 96 -3.892 -1.066 -0.326 733 HB2 ASN 96 2HB ASN 96 -3.550 1.225 0.587 734 HB3 ASN 96 3HB ASN 96 -5.218 1.266 1.147 735 HD21 ASN 96 1HD2 ASN 96 -4.424 1.675 3.274 736 HD22 ASN 96 2HD2 ASN 96 -3.781 0.409 4.255 737 H TYR 97 H TYR 97 -7.251 0.049 -0.248 738 HA TYR 97 HA TYR 97 -8.316 -1.857 1.575 739 HB2 TYR 97 2HB TYR 97 -9.534 0.193 1.116 740 HB3 TYR 97 3HB TYR 97 -9.604 -0.157 -0.606 741 HD1 TYR 97 HD1 TYR 97 -11.663 -0.935 -1.431 742 HD2 TYR 97 HD2 TYR 97 -10.701 -1.728 2.661 743 HE1 TYR 97 HE1 TYR 97 -13.863 -1.976 -1.119 744 HE2 TYR 97 HE2 TYR 97 -12.905 -2.775 2.969 745 HH TYR 97 HH TYR 97 -14.926 -3.637 0.408 746 H LEU 98 H LEU 98 -8.135 -1.786 -1.975 747 HA LEU 98 HA LEU 98 -9.355 -4.427 -2.265 748 HB2 LEU 98 2HB LEU 98 -8.377 -2.405 -4.321 749 HB3 LEU 98 3HB LEU 98 -9.173 -3.918 -4.721 750 HG LEU 98 HG LEU 98 -10.437 -1.596 -3.207 751 HD11 LEU 98 1HD1 LEU 98 -11.841 -1.298 -5.202 752 HD12 LEU 98 2HD1 LEU 98 -10.945 -2.570 -6.038 753 HD13 LEU 98 3HD1 LEU 98 -10.132 -1.073 -5.571 754 HD21 LEU 98 1HD2 LEU 98 -12.546 -2.869 -3.369 755 HD22 LEU 98 2HD2 LEU 98 -11.339 -3.709 -2.402 756 HD23 LEU 98 3HD2 LEU 98 -11.664 -4.239 -4.053 757 H ASP 99 H ASP 99 -6.277 -3.223 -1.758 758 HA ASP 99 HA ASP 99 -4.182 -4.016 -1.792 759 HB2 ASP 99 2HB ASP 99 -5.402 -5.998 -0.711 760 HB3 ASP 99 3HB ASP 99 -5.337 -6.791 -2.279 761 H ILE 100 H ILE 100 -5.320 -3.043 -4.206 762 HA ILE 100 HA ILE 100 -4.018 -4.509 -6.379 763 HB ILE 100 HB ILE 100 -5.434 -1.801 -6.512 764 HG12 ILE 100 2HG1 ILE 100 -6.504 -4.606 -7.061 765 HG13 ILE 100 3HG1 ILE 100 -6.979 -3.556 -5.736 766 HG21 ILE 100 1HG2 ILE 100 -4.652 -3.736 -8.739 767 HG22 ILE 100 2HG2 ILE 100 -3.863 -2.197 -8.391 768 HG23 ILE 100 3HG2 ILE 100 -5.534 -2.220 -8.955 769 HD11 ILE 100 1HD1 ILE 100 -7.504 -3.021 -8.653 770 HD12 ILE 100 2HD1 ILE 100 -8.026 -2.031 -7.287 771 HD13 ILE 100 3HD1 ILE 100 -8.657 -3.662 -7.483 772 H LYS 101 H LYS 101 -1.984 -4.420 -5.383 773 HA LYS 101 HA LYS 101 -0.484 -2.143 -4.773 774 HB2 LYS 101 2HB LYS 101 0.503 -4.863 -5.702 775 HB3 LYS 101 3HB LYS 101 1.498 -3.627 -4.934 776 HG2 LYS 101 2HG LYS 101 0.115 -3.773 -2.897 777 HG3 LYS 101 3HG LYS 101 -0.867 -5.035 -3.656 778 HD2 LYS 101 2HD LYS 101 1.133 -6.484 -3.837 779 HD3 LYS 101 3HD LYS 101 2.124 -5.219 -3.102 780 HE2 LYS 101 2HE LYS 101 0.693 -5.377 -1.051 781 HE3 LYS 101 3HE LYS 101 -0.143 -6.748 -1.794 782 HZ1 LYS 101 1HZ LYS 101 2.764 -6.604 -1.226 783 HZ2 LYS 101 2HZ LYS 101 1.950 -7.936 -1.876 784 HZ3 LYS 101 3HZ LYS 101 1.632 -7.434 -0.292 785 HA PRO 102 HA PRO 102 1.069 -2.369 -9.619 786 HB2 PRO 102 2HB PRO 102 -1.829 -2.762 -10.457 787 HB3 PRO 102 3HB PRO 102 -0.340 -3.142 -11.354 788 HG2 PRO 102 2HG PRO 102 -1.667 -5.088 -10.141 789 HG3 PRO 102 3HG PRO 102 0.112 -5.050 -10.082 790 HD2 PRO 102 2HD PRO 102 -1.862 -4.391 -7.932 791 HD3 PRO 102 3HD PRO 102 -0.233 -5.087 -7.792 792 H LEU 103 H LEU 103 -2.133 -1.240 -8.438 793 HA LEU 103 HA LEU 103 -1.904 1.320 -9.769 794 HB2 LEU 103 2HB LEU 103 -4.098 0.093 -9.393 795 HB3 LEU 103 3HB LEU 103 -3.973 0.471 -7.689 796 HG LEU 103 HG LEU 103 -5.502 1.947 -9.265 797 HD11 LEU 103 1HD1 LEU 103 -5.205 2.516 -6.931 798 HD12 LEU 103 2HD1 LEU 103 -5.156 3.975 -7.916 799 HD13 LEU 103 3HD1 LEU 103 -3.658 3.292 -7.275 800 HD21 LEU 103 1HD2 LEU 103 -4.397 3.862 -10.291 801 HD22 LEU 103 2HD2 LEU 103 -3.792 2.366 -10.978 802 HD23 LEU 103 3HD2 LEU 103 -2.817 3.254 -9.808 803 H LEU 104 H LEU 104 -1.665 0.077 -6.464 804 HA LEU 104 HA LEU 104 -1.518 2.425 -4.995 805 HB2 LEU 104 2HB LEU 104 -1.795 0.173 -4.016 806 HB3 LEU 104 3HB LEU 104 -0.155 -0.246 -4.475 807 HG LEU 104 HG LEU 104 0.702 1.500 -2.883 808 HD11 LEU 104 1HD1 LEU 104 -2.195 1.798 -2.029 809 HD12 LEU 104 2HD1 LEU 104 -1.212 3.015 -2.848 810 HD13 LEU 104 3HD1 LEU 104 -0.790 2.501 -1.218 811 HD21 LEU 104 1HD2 LEU 104 0.273 0.230 -0.837 812 HD22 LEU 104 2HD2 LEU 104 0.558 -0.851 -2.197 813 HD23 LEU 104 3HD2 LEU 104 -1.087 -0.596 -1.606 814 H ASP 105 H ASP 105 1.064 0.586 -6.588 815 HA ASP 105 HA ASP 105 3.241 2.077 -5.516 816 HB2 ASP 105 2HB ASP 105 3.393 -0.312 -6.328 817 HB3 ASP 105 3HB ASP 105 3.246 0.271 -7.983 818 H VAL 106 H VAL 106 1.534 2.125 -8.662 819 HA VAL 106 HA VAL 106 3.048 4.134 -9.937 820 HB VAL 106 HB VAL 106 0.110 3.370 -10.311 821 HG11 VAL 106 1HG1 VAL 106 0.189 4.532 -12.508 822 HG12 VAL 106 2HG1 VAL 106 1.799 5.147 -12.125 823 HG13 VAL 106 3HG1 VAL 106 0.410 5.661 -11.169 824 HG21 VAL 106 1HG2 VAL 106 1.712 1.565 -10.820 825 HG22 VAL 106 2HG2 VAL 106 2.575 2.624 -11.937 826 HG23 VAL 106 3HG2 VAL 106 0.915 2.131 -12.290 827 H THR 107 H THR 107 0.218 4.337 -7.806 828 HA THR 107 HA THR 107 -0.130 7.172 -7.952 829 HB THR 107 HB THR 107 -1.155 5.238 -5.816 830 HG1 THR 107 HG1 THR 107 -1.680 4.849 -8.176 831 HG21 THR 107 1HG2 THR 107 -2.999 6.867 -5.548 832 HG22 THR 107 2HG2 THR 107 -2.234 7.937 -6.726 833 HG23 THR 107 3HG2 THR 107 -1.441 7.615 -5.181 834 H CYS 108 H CYS 108 1.724 5.006 -5.876 835 HA CYS 108 HA CYS 108 2.565 6.911 -3.922 836 HB2 CYS 108 2HB CYS 108 3.737 4.232 -4.764 837 HB3 CYS 108 3HB CYS 108 4.394 5.200 -3.447 838 HG CYS 108 HG CYS 108 1.103 4.418 -3.309 839 H LYS 109 H LYS 109 3.805 5.899 -7.094 840 HA LYS 109 HA LYS 109 6.196 7.482 -6.995 841 HB2 LYS 109 2HB LYS 109 4.791 5.883 -9.110 842 HB3 LYS 109 3HB LYS 109 5.775 7.213 -9.703 843 HG2 LYS 109 2HG LYS 109 7.065 5.171 -9.730 844 HG3 LYS 109 3HG LYS 109 7.747 6.280 -8.539 845 HD2 LYS 109 2HD LYS 109 6.638 4.996 -6.724 846 HD3 LYS 109 3HD LYS 109 5.953 3.896 -7.925 847 HE2 LYS 109 2HE LYS 109 8.278 3.255 -8.598 848 HE3 LYS 109 3HE LYS 109 8.900 4.290 -7.311 849 HZ1 LYS 109 1HZ LYS 109 7.700 2.926 -5.704 850 HZ2 LYS 109 2HZ LYS 109 8.793 2.001 -6.601 851 HZ3 LYS 109 3HZ LYS 109 7.144 1.927 -6.950 852 H THR 110 H THR 110 2.856 8.102 -7.941 853 HA THR 110 HA THR 110 3.190 10.500 -9.374 854 HB THR 110 HB THR 110 0.814 9.631 -7.660 855 HG1 THR 110 HG1 THR 110 1.716 8.399 -9.678 856 HG21 THR 110 1HG2 THR 110 0.927 11.686 -9.909 857 HG22 THR 110 2HG2 THR 110 0.639 12.036 -8.203 858 HG23 THR 110 3HG2 THR 110 -0.547 11.112 -9.126 859 H VAL 111 H VAL 111 2.600 9.956 -5.874 860 HA VAL 111 HA VAL 111 2.799 12.732 -5.166 861 HB VAL 111 HB VAL 111 2.887 11.954 -2.786 862 HG11 VAL 111 1HG1 VAL 111 0.598 11.049 -2.706 863 HG12 VAL 111 2HG1 VAL 111 0.666 10.689 -4.433 864 HG13 VAL 111 3HG1 VAL 111 0.727 12.362 -3.877 865 HG21 VAL 111 1HG2 VAL 111 4.110 9.834 -3.069 866 HG22 VAL 111 2HG2 VAL 111 2.747 9.138 -3.948 867 HG23 VAL 111 3HG2 VAL 111 2.575 9.558 -2.239 868 H ALA 112 H ALA 112 5.088 10.039 -5.300 869 HA ALA 112 HA ALA 112 7.186 11.159 -3.786 870 HB1 ALA 112 1HB ALA 112 7.049 8.764 -4.314 871 HB2 ALA 112 2HB ALA 112 8.607 9.438 -4.800 872 HB3 ALA 112 3HB ALA 112 7.366 9.109 -6.015 873 H ASN 113 H ASN 113 6.477 11.278 -7.265 874 HA ASN 113 HA ASN 113 8.852 12.538 -8.138 875 HB2 ASN 113 2HB ASN 113 6.071 12.408 -9.377 876 HB3 ASN 113 3HB ASN 113 7.446 13.146 -10.197 877 HD21 ASN 113 1HD2 ASN 113 5.790 10.727 -10.814 878 HD22 ASN 113 2HD2 ASN 113 6.933 9.450 -11.033 879 H MET 114 H MET 114 5.856 13.832 -6.841 880 HA MET 114 HA MET 114 6.360 16.565 -7.643 881 HB2 MET 114 2HB MET 114 4.267 15.422 -5.745 882 HB3 MET 114 3HB MET 114 4.305 17.084 -6.324 883 HG2 MET 114 2HG MET 114 4.045 16.226 -8.659 884 HG3 MET 114 3HG MET 114 3.871 14.599 -8.002 885 HE1 MET 114 1HE MET 114 1.822 13.950 -6.270 886 HE2 MET 114 2HE MET 114 0.527 15.076 -5.873 887 HE3 MET 114 3HE MET 114 2.160 15.368 -5.275 888 H ILE 115 H ILE 115 7.237 14.606 -4.915 889 HA ILE 115 HA ILE 115 7.913 16.981 -3.277 890 HB ILE 115 HB ILE 115 8.233 15.449 -1.382 891 HG12 ILE 115 2HG1 ILE 115 7.399 13.208 -3.288 892 HG13 ILE 115 3HG1 ILE 115 9.028 13.463 -2.684 893 HG21 ILE 115 1HG2 ILE 115 5.893 14.833 -1.044 894 HG22 ILE 115 2HG2 ILE 115 5.570 14.969 -2.771 895 HG23 ILE 115 3HG2 ILE 115 5.992 16.405 -1.833 896 HD11 ILE 115 1HD1 ILE 115 6.634 12.771 -0.993 897 HD12 ILE 115 2HD1 ILE 115 8.299 12.962 -0.433 898 HD13 ILE 115 3HD1 ILE 115 7.888 11.652 -1.539 899 H ARG 116 H ARG 116 9.436 15.103 -5.553 900 HA ARG 116 HA ARG 116 12.030 14.722 -4.452 901 HB2 ARG 116 2HB ARG 116 11.134 15.105 -7.342 902 HB3 ARG 116 3HB ARG 116 12.792 14.721 -6.886 903 HG2 ARG 116 2HG ARG 116 12.039 12.598 -5.890 904 HG3 ARG 116 3HG ARG 116 10.374 12.980 -6.325 905 HD2 ARG 116 2HD ARG 116 11.301 11.423 -7.944 906 HD3 ARG 116 3HD ARG 116 11.013 12.982 -8.720 907 HE ARG 116 HE ARG 116 13.711 12.368 -7.713 908 HH11 ARG 116 1HH1 ARG 116 11.599 12.874 -10.492 909 HH12 ARG 116 2HH1 ARG 116 12.918 13.016 -11.606 910 HH21 ARG 116 1HH2 ARG 116 15.414 12.520 -9.212 911 HH22 ARG 116 2HH2 ARG 116 15.074 12.816 -10.886 912 H GLY 117 H GLY 117 12.698 16.528 -3.326 913 HA2 GLY 117 2HA GLY 117 12.829 19.180 -4.517 914 HA3 GLY 117 3HA GLY 117 13.373 18.708 -2.912 915 H1 SER 2 1H SER 2 18.479 -15.746 17.229 916 H2 SER 2 2H SER 2 18.050 -15.331 15.654 917 H3 SER 2 3H SER 2 17.179 -14.704 16.954 918 HA SER 2 HA SER 2 19.123 -13.516 17.708 919 HB2 SER 2 2HB SER 2 21.089 -13.389 16.092 920 HB3 SER 2 3HB SER 2 20.880 -14.955 16.872 921 HG SER 2 HG SER 2 21.005 -15.615 14.869 922 H LEU 3 H LEU 3 19.632 -11.383 16.890 923 HA LEU 3 HA LEU 3 17.530 -10.135 15.434 924 HB2 LEU 3 2HB LEU 3 20.260 -9.048 16.244 925 HB3 LEU 3 3HB LEU 3 18.900 -8.072 15.711 926 HG LEU 3 HG LEU 3 18.903 -9.750 18.256 927 HD11 LEU 3 1HD1 LEU 3 19.181 -7.646 19.482 928 HD12 LEU 3 2HD1 LEU 3 19.340 -6.758 17.964 929 HD13 LEU 3 3HD1 LEU 3 20.559 -7.952 18.426 930 HD21 LEU 3 1HD2 LEU 3 16.950 -7.636 17.288 931 HD22 LEU 3 2HD2 LEU 3 16.889 -8.477 18.843 932 HD23 LEU 3 3HD2 LEU 3 16.656 -9.379 17.349 933 H VAL 4 H VAL 4 17.335 -10.174 13.233 934 HA VAL 4 HA VAL 4 19.613 -10.630 11.491 935 HB VAL 4 HB VAL 4 17.972 -10.410 9.596 936 HG11 VAL 4 1HG1 VAL 4 16.801 -12.540 10.055 937 HG12 VAL 4 2HG1 VAL 4 17.196 -12.395 11.768 938 HG13 VAL 4 3HG1 VAL 4 18.484 -12.602 10.581 939 HG21 VAL 4 1HG2 VAL 4 16.344 -8.863 10.601 940 HG22 VAL 4 2HG2 VAL 4 15.892 -10.077 11.799 941 HG23 VAL 4 3HG2 VAL 4 15.533 -10.349 10.090 942 H LYS 5 H LYS 5 20.748 -9.159 10.469 943 HA LYS 5 HA LYS 5 20.444 -6.374 11.266 944 HB2 LYS 5 2HB LYS 5 22.721 -7.780 9.805 945 HB3 LYS 5 3HB LYS 5 22.779 -6.175 10.532 946 HG2 LYS 5 2HG LYS 5 22.406 -7.201 12.775 947 HG3 LYS 5 3HG LYS 5 22.425 -8.800 12.023 948 HD2 LYS 5 2HD LYS 5 24.766 -8.405 11.277 949 HD3 LYS 5 3HD LYS 5 24.738 -6.818 12.055 950 HE2 LYS 5 2HE LYS 5 24.293 -7.977 14.243 951 HE3 LYS 5 3HE LYS 5 24.513 -9.522 13.416 952 HZ1 LYS 5 1HZ LYS 5 26.768 -8.870 12.871 953 HZ2 LYS 5 2HZ LYS 5 26.519 -8.792 14.541 954 HZ3 LYS 5 3HZ LYS 5 26.551 -7.374 13.626 955 H LEU 6 H LEU 6 19.319 -5.087 9.962 956 HA LEU 6 HA LEU 6 19.380 -5.467 7.025 957 HB2 LEU 6 2HB LEU 6 17.182 -4.155 8.685 958 HB3 LEU 6 3HB LEU 6 17.153 -4.453 6.952 959 HG LEU 6 HG LEU 6 17.038 -6.556 9.150 960 HD11 LEU 6 1HD1 LEU 6 14.781 -6.998 8.334 961 HD12 LEU 6 2HD1 LEU 6 14.938 -5.707 7.141 962 HD13 LEU 6 3HD1 LEU 6 14.954 -5.326 8.863 963 HD21 LEU 6 1HD2 LEU 6 18.323 -7.449 7.269 964 HD22 LEU 6 2HD2 LEU 6 17.036 -7.005 6.146 965 HD23 LEU 6 3HD2 LEU 6 16.751 -8.238 7.378 966 H GLU 7 H GLU 7 20.927 -4.072 6.364 967 HA GLU 7 HA GLU 7 21.398 -1.530 7.634 968 HB2 GLU 7 2HB GLU 7 22.534 -2.696 5.060 969 HB3 GLU 7 3HB GLU 7 23.036 -1.154 5.744 970 HG2 GLU 7 2HG GLU 7 24.677 -2.823 6.310 971 HG3 GLU 7 3HG GLU 7 23.828 -2.348 7.779 972 H SER 8 H SER 8 21.086 0.496 6.735 973 HA SER 8 HA SER 8 18.744 0.806 5.016 974 HB2 SER 8 2HB SER 8 19.039 3.231 5.717 975 HB3 SER 8 3HB SER 8 18.789 2.099 7.045 976 HG SER 8 HG SER 8 20.691 2.563 7.788 977 H SER 9 H SER 9 18.983 2.959 3.596 978 HA SER 9 HA SER 9 20.825 2.729 1.514 979 HB2 SER 9 2HB SER 9 18.743 4.068 1.370 980 HB3 SER 9 3HB SER 9 19.409 5.242 2.509 981 HG SER 9 HG SER 9 19.650 5.268 -0.088 982 H ASP 10 H ASP 10 21.042 4.344 4.621 983 HA ASP 10 HA ASP 10 23.600 5.638 4.144 984 HB2 ASP 10 2HB ASP 10 21.948 5.287 6.686 985 HB3 ASP 10 3HB ASP 10 23.372 6.313 6.544 986 H GLU 11 H GLU 11 22.809 2.496 4.576 987 HA GLU 11 HA GLU 11 23.872 0.583 5.070 988 HB2 GLU 11 2HB GLU 11 26.343 2.357 5.243 989 HB3 GLU 11 3HB GLU 11 26.378 0.595 5.227 990 HG2 GLU 11 2HG GLU 11 25.458 0.538 2.975 991 HG3 GLU 11 3HG GLU 11 25.241 2.287 2.979 992 H LYS 12 H LYS 12 22.838 2.435 7.246 993 HA LYS 12 HA LYS 12 24.379 1.760 9.597 994 HB2 LYS 12 2HB LYS 12 21.615 3.031 9.321 995 HB3 LYS 12 3HB LYS 12 22.494 2.850 10.841 996 HG2 LYS 12 2HG LYS 12 24.353 4.235 9.840 997 HG3 LYS 12 3HG LYS 12 23.302 4.541 8.455 998 HD2 LYS 12 2HD LYS 12 21.649 5.622 9.978 999 HD3 LYS 12 3HD LYS 12 22.725 5.324 11.345 1000 HE2 LYS 12 2HE LYS 12 24.443 6.757 10.315 1001 HE3 LYS 12 3HE LYS 12 23.393 7.031 8.922 1002 HZ1 LYS 12 1HZ LYS 12 21.809 8.112 10.371 1003 HZ2 LYS 12 2HZ LYS 12 23.316 8.865 10.488 1004 HZ3 LYS 12 3HZ LYS 12 22.791 7.830 11.714 1005 H VAL 13 H VAL 13 24.195 -0.029 10.735 1006 HA VAL 13 HA VAL 13 22.637 -2.236 9.783 1007 HB VAL 13 HB VAL 13 24.517 -2.013 12.184 1008 HG11 VAL 13 1HG1 VAL 13 23.458 -4.518 10.825 1009 HG12 VAL 13 2HG1 VAL 13 23.003 -3.939 12.429 1010 HG13 VAL 13 3HG1 VAL 13 24.656 -4.474 12.123 1011 HG21 VAL 13 1HG2 VAL 13 25.643 -1.508 10.040 1012 HG22 VAL 13 2HG2 VAL 13 25.097 -3.051 9.380 1013 HG23 VAL 13 3HG2 VAL 13 26.230 -3.023 10.731 1014 H PHE 14 H PHE 14 20.487 -2.167 10.266 1015 HA PHE 14 HA PHE 14 19.602 -1.600 13.018 1016 HB2 PHE 14 2HB PHE 14 18.042 -1.947 10.418 1017 HB3 PHE 14 3HB PHE 14 17.282 -1.733 11.994 1018 HD1 PHE 14 HD1 PHE 14 17.836 0.382 13.337 1019 HD2 PHE 14 HD2 PHE 14 18.767 -0.020 9.180 1020 HE1 PHE 14 HE1 PHE 14 18.070 2.822 13.148 1021 HE2 PHE 14 HE2 PHE 14 18.996 2.423 9.004 1022 HZ PHE 14 HZ PHE 14 18.655 3.843 10.983 1023 H GLU 15 H GLU 15 20.210 -3.345 14.152 1024 HA GLU 15 HA GLU 15 19.826 -6.079 13.336 1025 HB2 GLU 15 2HB GLU 15 20.410 -5.013 16.137 1026 HB3 GLU 15 3HB GLU 15 20.693 -6.647 15.543 1027 HG2 GLU 15 2HG GLU 15 22.432 -5.804 14.011 1028 HG3 GLU 15 3HG GLU 15 22.122 -4.162 14.573 1029 H ILE 16 H ILE 16 17.568 -5.924 12.831 1030 HA ILE 16 HA ILE 16 15.637 -5.460 14.996 1031 HB ILE 16 HB ILE 16 15.280 -4.452 12.708 1032 HG12 ILE 16 2HG1 ILE 16 12.846 -5.128 12.454 1033 HG13 ILE 16 3HG1 ILE 16 13.122 -6.412 13.627 1034 HG21 ILE 16 1HG2 ILE 16 16.194 -6.250 11.323 1035 HG22 ILE 16 2HG2 ILE 16 14.549 -5.855 10.822 1036 HG23 ILE 16 3HG2 ILE 16 14.854 -7.307 11.777 1037 HD11 ILE 16 1HD1 ILE 16 13.404 -3.456 14.166 1038 HD12 ILE 16 2HD1 ILE 16 13.606 -4.757 15.344 1039 HD13 ILE 16 3HD1 ILE 16 12.031 -4.468 14.608 1040 H GLU 17 H GLU 17 14.224 -6.999 15.700 1041 HA GLU 17 HA GLU 17 15.117 -9.672 15.902 1042 HB2 GLU 17 2HB GLU 17 13.737 -8.256 17.538 1043 HB3 GLU 17 3HB GLU 17 12.346 -8.578 16.521 1044 HG2 GLU 17 2HG GLU 17 13.967 -10.800 17.769 1045 HG3 GLU 17 3HG GLU 17 12.669 -9.980 18.629 1046 H LYS 18 H LYS 18 14.381 -11.548 14.829 1047 HA LYS 18 HA LYS 18 14.054 -11.105 12.069 1048 HB2 LYS 18 2HB LYS 18 15.351 -12.990 13.064 1049 HB3 LYS 18 3HB LYS 18 13.839 -13.752 13.552 1050 HG2 LYS 18 2HG LYS 18 13.187 -14.076 11.214 1051 HG3 LYS 18 3HG LYS 18 14.583 -13.147 10.663 1052 HD2 LYS 18 2HD LYS 18 15.056 -15.505 10.351 1053 HD3 LYS 18 3HD LYS 18 16.091 -14.892 11.643 1054 HE2 LYS 18 2HE LYS 18 15.239 -17.063 12.293 1055 HE3 LYS 18 3HE LYS 18 14.457 -15.852 13.309 1056 HZ1 LYS 18 1HZ LYS 18 13.292 -17.192 10.930 1057 HZ2 LYS 18 2HZ LYS 18 12.535 -15.961 11.794 1058 HZ3 LYS 18 3HZ LYS 18 12.854 -17.441 12.542 1059 H GLU 19 H GLU 19 11.698 -12.109 14.525 1060 HA GLU 19 HA GLU 19 9.615 -12.806 12.681 1061 HB2 GLU 19 2HB GLU 19 9.709 -13.681 15.018 1062 HB3 GLU 19 3HB GLU 19 9.364 -12.067 15.630 1063 HG2 GLU 19 2HG GLU 19 7.177 -12.097 14.496 1064 HG3 GLU 19 3HG GLU 19 7.510 -13.713 13.871 1065 H ILE 20 H ILE 20 10.660 -9.814 14.184 1066 HA ILE 20 HA ILE 20 8.385 -8.217 13.410 1067 HB ILE 20 HB ILE 20 11.232 -7.266 14.012 1068 HG12 ILE 20 2HG1 ILE 20 8.865 -7.666 15.893 1069 HG13 ILE 20 3HG1 ILE 20 10.382 -8.553 15.916 1070 HG21 ILE 20 1HG2 ILE 20 10.181 -5.089 14.527 1071 HG22 ILE 20 2HG2 ILE 20 8.603 -5.732 14.071 1072 HG23 ILE 20 3HG2 ILE 20 9.873 -5.566 12.858 1073 HD11 ILE 20 1HD1 ILE 20 10.013 -5.635 16.587 1074 HD12 ILE 20 2HD1 ILE 20 11.553 -6.500 16.573 1075 HD13 ILE 20 3HD1 ILE 20 10.293 -6.962 17.715 1076 H ALA 21 H ALA 21 11.519 -9.037 11.963 1077 HA ALA 21 HA ALA 21 11.251 -7.504 9.566 1078 HB1 ALA 21 1HB ALA 21 13.427 -8.353 10.357 1079 HB2 ALA 21 2HB ALA 21 13.091 -8.895 8.713 1080 HB3 ALA 21 3HB ALA 21 12.897 -10.011 10.068 1081 H CYS 22 H CYS 22 10.032 -10.626 10.609 1082 HA CYS 22 HA CYS 22 9.072 -11.488 8.045 1083 HB2 CYS 22 2HB CYS 22 8.307 -12.410 10.839 1084 HB3 CYS 22 3HB CYS 22 7.809 -13.200 9.343 1085 HG CYS 22 HG CYS 22 11.118 -12.795 9.581 1086 H MET 23 H MET 23 7.787 -9.455 10.633 1087 HA MET 23 HA MET 23 5.075 -9.280 9.798 1088 HB2 MET 23 2HB MET 23 6.818 -7.214 11.209 1089 HB3 MET 23 3HB MET 23 5.086 -7.035 10.982 1090 HG2 MET 23 2HG MET 23 4.656 -8.963 12.395 1091 HG3 MET 23 3HG MET 23 6.385 -9.280 12.542 1092 HE1 MET 23 1HE MET 23 3.475 -6.740 13.408 1093 HE2 MET 23 2HE MET 23 4.652 -5.695 12.610 1094 HE3 MET 23 3HE MET 23 4.350 -5.525 14.338 1095 H SER 24 H SER 24 7.998 -7.581 8.806 1096 HA SER 24 HA SER 24 6.813 -6.170 6.601 1097 HB2 SER 24 2HB SER 24 9.023 -5.515 7.571 1098 HB3 SER 24 3HB SER 24 9.705 -7.058 7.053 1099 HG SER 24 HG SER 24 8.473 -5.312 5.219 1100 H VAL 25 H VAL 25 5.732 -7.381 5.086 1101 HA VAL 25 HA VAL 25 6.084 -10.179 4.828 1102 HB VAL 25 HB VAL 25 4.560 -8.313 2.963 1103 HG11 VAL 25 1HG1 VAL 25 3.249 -10.309 2.303 1104 HG12 VAL 25 2HG1 VAL 25 4.291 -11.330 3.298 1105 HG13 VAL 25 3HG1 VAL 25 4.956 -10.493 1.894 1106 HG21 VAL 25 1HG2 VAL 25 3.769 -8.090 5.278 1107 HG22 VAL 25 2HG2 VAL 25 3.563 -9.839 5.404 1108 HG23 VAL 25 3HG2 VAL 25 2.552 -8.909 4.294 1109 H THR 26 H THR 26 7.211 -7.462 2.797 1110 HA THR 26 HA THR 26 8.224 -8.939 0.621 1111 HB THR 26 HB THR 26 9.148 -6.258 1.736 1112 HG1 THR 26 HG1 THR 26 7.836 -5.487 -0.015 1113 HG21 THR 26 1HG2 THR 26 9.758 -7.479 -0.989 1114 HG22 THR 26 2HG2 THR 26 10.936 -7.166 0.288 1115 HG23 THR 26 3HG2 THR 26 10.117 -5.819 -0.508 1116 H ILE 27 H ILE 27 9.875 -7.832 3.610 1117 HA ILE 27 HA ILE 27 12.420 -8.956 3.009 1118 HB ILE 27 HB ILE 27 11.219 -8.206 5.715 1119 HG12 ILE 27 2HG1 ILE 27 13.104 -6.632 3.892 1120 HG13 ILE 27 3HG1 ILE 27 11.386 -6.309 4.097 1121 HG21 ILE 27 1HG2 ILE 27 14.137 -8.757 5.038 1122 HG22 ILE 27 2HG2 ILE 27 13.097 -9.776 6.032 1123 HG23 ILE 27 3HG2 ILE 27 13.536 -8.162 6.589 1124 HD11 ILE 27 1HD1 ILE 27 12.688 -4.737 5.361 1125 HD12 ILE 27 2HD1 ILE 27 13.517 -6.039 6.208 1126 HD13 ILE 27 3HD1 ILE 27 11.792 -5.778 6.464 1127 H LYS 28 H LYS 28 9.584 -10.138 4.789 1128 HA LYS 28 HA LYS 28 10.511 -12.567 5.800 1129 HB2 LYS 28 2HB LYS 28 8.299 -11.595 6.365 1130 HB3 LYS 28 3HB LYS 28 7.739 -11.889 4.724 1131 HG2 LYS 28 2HG LYS 28 8.052 -14.371 5.137 1132 HG3 LYS 28 3HG LYS 28 8.436 -13.982 6.815 1133 HD2 LYS 28 2HD LYS 28 6.085 -14.693 6.565 1134 HD3 LYS 28 3HD LYS 28 6.194 -13.025 7.138 1135 HE2 LYS 28 2HE LYS 28 4.440 -13.314 5.409 1136 HE3 LYS 28 3HE LYS 28 5.694 -12.194 4.877 1137 HZ1 LYS 28 1HZ LYS 28 6.690 -14.074 3.623 1138 HZ2 LYS 28 2HZ LYS 28 5.145 -13.658 3.096 1139 HZ3 LYS 28 3HZ LYS 28 5.363 -15.028 4.053 1140 H ASN 29 H ASN 29 9.060 -11.811 2.635 1141 HA ASN 29 HA ASN 29 8.978 -14.418 1.562 1142 HB2 ASN 29 2HB ASN 29 9.114 -11.716 0.146 1143 HB3 ASN 29 3HB ASN 29 8.819 -13.240 -0.685 1144 HD21 ASN 29 1HD2 ASN 29 7.114 -10.897 -0.545 1145 HD22 ASN 29 2HD2 ASN 29 5.622 -11.403 0.160 1146 H MET 30 H MET 30 11.418 -11.842 1.371 1147 HA MET 30 HA MET 30 13.289 -13.071 -0.317 1148 HB2 MET 30 2HB MET 30 13.709 -11.066 1.943 1149 HB3 MET 30 3HB MET 30 14.977 -11.539 0.818 1150 HG2 MET 30 2HG MET 30 13.688 -10.616 -1.051 1151 HG3 MET 30 3HG MET 30 12.384 -10.172 0.058 1152 HE1 MET 30 1HE MET 30 12.539 -7.654 -0.954 1153 HE2 MET 30 2HE MET 30 13.891 -8.124 -1.988 1154 HE3 MET 30 3HE MET 30 14.028 -6.707 -0.948 1155 H ILE 31 H ILE 31 12.995 -13.134 3.236 1156 HA ILE 31 HA ILE 31 15.192 -14.739 3.893 1157 HB ILE 31 HB ILE 31 12.491 -14.447 5.308 1158 HG12 ILE 31 2HG1 ILE 31 15.189 -13.143 5.936 1159 HG13 ILE 31 3HG1 ILE 31 13.852 -12.347 5.119 1160 HG21 ILE 31 1HG2 ILE 31 13.561 -15.363 7.349 1161 HG22 ILE 31 2HG2 ILE 31 15.023 -15.712 6.425 1162 HG23 ILE 31 3HG2 ILE 31 13.521 -16.555 6.046 1163 HD11 ILE 31 1HD1 ILE 31 13.952 -11.663 7.427 1164 HD12 ILE 31 2HD1 ILE 31 13.861 -13.338 7.971 1165 HD13 ILE 31 3HD1 ILE 31 12.482 -12.597 7.152 1166 H GLU 32 H GLU 32 11.825 -15.644 3.122 1167 HA GLU 32 HA GLU 32 12.042 -18.432 3.518 1168 HB2 GLU 32 2HB GLU 32 10.122 -16.829 1.777 1169 HB3 GLU 32 3HB GLU 32 9.934 -18.549 2.119 1170 HG2 GLU 32 2HG GLU 32 9.645 -18.098 4.497 1171 HG3 GLU 32 3HG GLU 32 9.980 -16.384 4.249 1172 H ASP 33 H ASP 33 12.541 -16.430 0.613 1173 HA ASP 33 HA ASP 33 12.781 -18.526 -1.276 1174 HB2 ASP 33 2HB ASP 33 13.860 -15.676 -1.328 1175 HB3 ASP 33 3HB ASP 33 14.015 -16.780 -2.691 1176 H ILE 34 H ILE 34 15.182 -16.779 0.664 1177 HA ILE 34 HA ILE 34 17.495 -18.072 -0.426 1178 HB ILE 34 HB ILE 34 17.208 -16.574 2.231 1179 HG12 ILE 34 2HG1 ILE 34 18.193 -15.485 -0.456 1180 HG13 ILE 34 3HG1 ILE 34 16.584 -15.204 0.195 1181 HG21 ILE 34 1HG2 ILE 34 19.714 -17.247 0.636 1182 HG22 ILE 34 2HG2 ILE 34 19.246 -17.949 2.186 1183 HG23 ILE 34 3HG2 ILE 34 19.664 -16.239 2.085 1184 HD11 ILE 34 1HD1 ILE 34 19.166 -14.288 1.465 1185 HD12 ILE 34 2HD1 ILE 34 17.539 -13.999 2.087 1186 HD13 ILE 34 3HD1 ILE 34 18.034 -13.294 0.549 1187 H GLY 35 H GLY 35 15.220 -18.852 2.115 1188 HA2 GLY 35 2HA GLY 35 14.931 -20.952 3.142 1189 HA3 GLY 35 3HA GLY 35 16.566 -21.406 2.681 1190 H GLU 36 H GLU 36 15.844 -18.364 4.170 1191 HA GLU 36 HA GLU 36 16.262 -17.327 6.086 1192 HB2 GLU 36 2HB GLU 36 14.686 -19.008 7.020 1193 HB3 GLU 36 3HB GLU 36 16.035 -20.087 7.363 1194 HG2 GLU 36 2HG GLU 36 16.972 -18.356 8.916 1195 HG3 GLU 36 3HG GLU 36 15.553 -17.352 8.609 1196 H SER 37 H SER 37 18.285 -16.588 5.643 1197 HA SER 37 HA SER 37 20.641 -18.225 6.389 1198 HB2 SER 37 2HB SER 37 21.871 -16.575 4.900 1199 HB3 SER 37 3HB SER 37 20.668 -17.555 4.055 1200 HG SER 37 HG SER 37 20.620 -15.258 3.575 1201 H ASP 38 H ASP 38 22.463 -17.021 7.329 1202 HA ASP 38 HA ASP 38 21.653 -15.144 9.391 1203 HB2 ASP 38 2HB ASP 38 23.588 -15.742 10.493 1204 HB3 ASP 38 3HB ASP 38 23.571 -17.094 9.383 1205 H SER 39 H SER 39 22.710 -14.952 6.167 1206 HA SER 39 HA SER 39 24.421 -12.772 6.095 1207 HB2 SER 39 2HB SER 39 23.791 -12.576 3.685 1208 HB3 SER 39 3HB SER 39 24.127 -14.238 4.162 1209 HG SER 39 HG SER 39 21.482 -13.497 4.416 1210 HA PRO 40 HA PRO 40 21.588 -9.431 7.220 1211 HB2 PRO 40 2HB PRO 40 23.308 -7.330 6.809 1212 HB3 PRO 40 3HB PRO 40 23.449 -8.418 8.205 1213 HG2 PRO 40 2HG PRO 40 24.993 -8.460 5.630 1214 HG3 PRO 40 3HG PRO 40 25.584 -8.632 7.299 1215 HD2 PRO 40 2HD PRO 40 25.183 -10.782 5.695 1216 HD3 PRO 40 3HD PRO 40 24.925 -10.857 7.453 1217 H ILE 41 H ILE 41 20.090 -8.291 6.036 1218 HA ILE 41 HA ILE 41 20.471 -8.156 3.099 1219 HB ILE 41 HB ILE 41 17.860 -8.347 4.678 1220 HG12 ILE 41 2HG1 ILE 41 19.092 -10.491 4.701 1221 HG13 ILE 41 3HG1 ILE 41 17.651 -10.633 3.706 1222 HG21 ILE 41 1HG2 ILE 41 16.741 -8.613 2.477 1223 HG22 ILE 41 2HG2 ILE 41 18.278 -8.316 1.663 1224 HG23 ILE 41 3HG2 ILE 41 17.530 -7.039 2.625 1225 HD11 ILE 41 1HD1 ILE 41 20.487 -10.321 2.711 1226 HD12 ILE 41 2HD1 ILE 41 19.054 -10.422 1.684 1227 HD13 ILE 41 3HD1 ILE 41 19.514 -11.789 2.696 1228 HA PRO 42 HA PRO 42 20.284 -3.667 4.174 1229 HB2 PRO 42 2HB PRO 42 21.837 -2.779 2.105 1230 HB3 PRO 42 3HB PRO 42 22.542 -3.496 3.568 1231 HG2 PRO 42 2HG PRO 42 22.064 -4.770 0.897 1232 HG3 PRO 42 3HG PRO 42 23.490 -4.880 1.955 1233 HD2 PRO 42 2HD PRO 42 21.559 -6.829 1.852 1234 HD3 PRO 42 3HD PRO 42 22.528 -6.501 3.306 1235 H LEU 43 H LEU 43 18.522 -2.533 3.576 1236 HA LEU 43 HA LEU 43 17.401 -2.761 0.857 1237 HB2 LEU 43 2HB LEU 43 16.197 -1.470 3.345 1238 HB3 LEU 43 3HB LEU 43 15.415 -1.594 1.783 1239 HG LEU 43 HG LEU 43 14.391 -3.262 3.116 1240 HD11 LEU 43 1HD1 LEU 43 14.916 -5.386 2.062 1241 HD12 LEU 43 2HD1 LEU 43 16.460 -4.753 1.486 1242 HD13 LEU 43 3HD1 LEU 43 14.945 -4.075 0.883 1243 HD21 LEU 43 1HD2 LEU 43 15.559 -4.936 4.477 1244 HD22 LEU 43 2HD2 LEU 43 15.959 -3.297 4.988 1245 HD23 LEU 43 3HD2 LEU 43 17.117 -4.227 4.035 1246 HA PRO 44 HA PRO 44 19.836 1.149 0.546 1247 HB2 PRO 44 2HB PRO 44 20.342 1.088 -2.120 1248 HB3 PRO 44 3HB PRO 44 21.161 -0.020 -0.996 1249 HG2 PRO 44 2HG PRO 44 18.783 -0.562 -2.756 1250 HG3 PRO 44 3HG PRO 44 20.239 -1.552 -2.505 1251 HD2 PRO 44 2HD PRO 44 17.874 -2.033 -1.203 1252 HD3 PRO 44 3HD PRO 44 19.459 -2.431 -0.503 1253 H ASN 45 H ASN 45 16.783 0.363 -0.768 1254 HA ASN 45 HA ASN 45 16.129 2.785 -2.132 1255 HB2 ASN 45 2HB ASN 45 14.847 0.770 -2.586 1256 HB3 ASN 45 3HB ASN 45 14.427 0.575 -0.889 1257 HD21 ASN 45 1HD2 ASN 45 13.764 2.375 -3.819 1258 HD22 ASN 45 2HD2 ASN 45 12.275 3.071 -3.290 1259 H VAL 46 H VAL 46 15.440 1.566 1.149 1260 HA VAL 46 HA VAL 46 14.181 4.092 1.932 1261 HB VAL 46 HB VAL 46 13.025 1.982 2.487 1262 HG11 VAL 46 1HG1 VAL 46 15.381 1.311 4.278 1263 HG12 VAL 46 2HG1 VAL 46 14.951 0.492 2.775 1264 HG13 VAL 46 3HG1 VAL 46 13.867 0.405 4.167 1265 HG21 VAL 46 1HG2 VAL 46 12.547 2.441 4.875 1266 HG22 VAL 46 2HG2 VAL 46 12.606 3.920 3.915 1267 HG23 VAL 46 3HG2 VAL 46 13.966 3.488 4.955 1268 H THR 47 H THR 47 15.055 5.514 3.373 1269 HA THR 47 HA THR 47 17.906 5.422 3.869 1270 HB THR 47 HB THR 47 17.502 7.697 4.894 1271 HG1 THR 47 HG1 THR 47 14.911 7.790 3.898 1272 HG21 THR 47 1HG2 THR 47 18.042 7.506 2.494 1273 HG22 THR 47 2HG2 THR 47 16.910 8.829 2.780 1274 HG23 THR 47 3HG2 THR 47 16.327 7.303 2.114 1275 H SER 48 H SER 48 18.575 6.325 6.181 1276 HA SER 48 HA SER 48 18.181 4.121 7.919 1277 HB2 SER 48 2HB SER 48 19.659 5.424 9.487 1278 HB3 SER 48 3HB SER 48 20.319 5.221 7.866 1279 HG SER 48 HG SER 48 19.797 7.334 7.400 1280 H THR 49 H THR 49 17.148 7.528 8.156 1281 HA THR 49 HA THR 49 15.941 7.348 10.692 1282 HB THR 49 HB THR 49 15.398 9.286 8.406 1283 HG1 THR 49 HG1 THR 49 17.165 9.348 10.643 1284 HG21 THR 49 1HG2 THR 49 14.537 10.836 10.140 1285 HG22 THR 49 2HG2 THR 49 14.686 9.564 11.352 1286 HG23 THR 49 3HG2 THR 49 13.536 9.386 10.025 1287 H ILE 50 H ILE 50 14.560 7.012 7.400 1288 HA ILE 50 HA ILE 50 11.852 6.759 8.288 1289 HB ILE 50 HB ILE 50 13.076 5.984 5.600 1290 HG12 ILE 50 2HG1 ILE 50 13.356 8.384 6.078 1291 HG13 ILE 50 3HG1 ILE 50 12.168 8.169 4.802 1292 HG21 ILE 50 1HG2 ILE 50 10.763 6.087 4.701 1293 HG22 ILE 50 2HG2 ILE 50 10.143 6.335 6.334 1294 HG23 ILE 50 3HG2 ILE 50 10.941 4.818 5.915 1295 HD11 ILE 50 1HD1 ILE 50 11.589 8.819 7.698 1296 HD12 ILE 50 2HD1 ILE 50 10.368 8.555 6.449 1297 HD13 ILE 50 3HD1 ILE 50 11.484 9.911 6.318 1298 H LEU 51 H LEU 51 14.360 4.391 7.301 1299 HA LEU 51 HA LEU 51 12.816 2.042 7.553 1300 HB2 LEU 51 2HB LEU 51 15.012 2.081 6.400 1301 HB3 LEU 51 3HB LEU 51 15.823 2.392 7.926 1302 HG LEU 51 HG LEU 51 15.156 0.139 8.753 1303 HD11 LEU 51 1HD1 LEU 51 14.140 -1.525 7.272 1304 HD12 LEU 51 2HD1 LEU 51 13.928 -0.303 6.015 1305 HD13 LEU 51 3HD1 LEU 51 13.059 -0.160 7.546 1306 HD21 LEU 51 1HD2 LEU 51 17.321 0.395 7.624 1307 HD22 LEU 51 2HD2 LEU 51 16.574 0.021 6.068 1308 HD23 LEU 51 3HD2 LEU 51 16.639 -1.206 7.338 1309 H GLU 52 H GLU 52 14.780 3.861 9.888 1310 HA GLU 52 HA GLU 52 14.674 2.123 12.084 1311 HB2 GLU 52 2HB GLU 52 16.157 4.112 12.020 1312 HB3 GLU 52 3HB GLU 52 14.756 5.175 12.099 1313 HG2 GLU 52 2HG GLU 52 14.191 4.314 14.334 1314 HG3 GLU 52 3HG GLU 52 15.543 3.189 14.262 1315 H LYS 53 H LYS 53 12.545 4.812 11.138 1316 HA LYS 53 HA LYS 53 10.818 4.687 13.383 1317 HB2 LYS 53 2HB LYS 53 10.464 5.960 10.638 1318 HB3 LYS 53 3HB LYS 53 9.291 6.124 11.940 1319 HG2 LYS 53 2HG LYS 53 11.077 7.167 13.359 1320 HG3 LYS 53 3HG LYS 53 12.160 7.109 11.966 1321 HD2 LYS 53 2HD LYS 53 11.157 9.350 12.208 1322 HD3 LYS 53 3HD LYS 53 10.629 8.592 10.703 1323 HE2 LYS 53 2HE LYS 53 8.457 8.078 11.644 1324 HE3 LYS 53 3HE LYS 53 8.983 8.569 13.252 1325 HZ1 LYS 53 1HZ LYS 53 8.875 10.430 10.958 1326 HZ2 LYS 53 2HZ LYS 53 9.084 10.808 12.592 1327 HZ3 LYS 53 3HZ LYS 53 7.600 10.214 12.047 1328 H VAL 54 H VAL 54 10.584 3.303 10.111 1329 HA VAL 54 HA VAL 54 7.926 2.321 10.383 1330 HB VAL 54 HB VAL 54 10.136 1.542 8.416 1331 HG11 VAL 54 1HG1 VAL 54 8.367 0.510 7.026 1332 HG12 VAL 54 2HG1 VAL 54 7.181 0.814 8.300 1333 HG13 VAL 54 3HG1 VAL 54 8.516 -0.306 8.584 1334 HG21 VAL 54 1HG2 VAL 54 9.372 3.897 8.234 1335 HG22 VAL 54 2HG2 VAL 54 7.707 3.350 8.047 1336 HG23 VAL 54 3HG2 VAL 54 8.906 2.965 6.810 1337 H LEU 55 H LEU 55 11.150 0.858 10.936 1338 HA LEU 55 HA LEU 55 10.190 -1.716 11.762 1339 HB2 LEU 55 2HB LEU 55 12.847 -0.319 12.287 1340 HB3 LEU 55 3HB LEU 55 12.506 -1.961 12.812 1341 HG LEU 55 HG LEU 55 12.651 -1.006 9.923 1342 HD11 LEU 55 1HD1 LEU 55 14.545 -2.793 11.488 1343 HD12 LEU 55 2HD1 LEU 55 14.846 -1.123 11.005 1344 HD13 LEU 55 3HD1 LEU 55 14.682 -2.374 9.777 1345 HD21 LEU 55 1HD2 LEU 55 12.400 -3.374 9.289 1346 HD22 LEU 55 2HD2 LEU 55 10.973 -2.776 10.128 1347 HD23 LEU 55 3HD2 LEU 55 12.124 -3.808 10.980 1348 H ASP 56 H ASP 56 10.652 1.356 13.375 1349 HA ASP 56 HA ASP 56 10.647 0.425 16.083 1350 HB2 ASP 56 2HB ASP 56 11.566 2.662 15.216 1351 HB3 ASP 56 3HB ASP 56 9.905 3.223 15.100 1352 H TYR 57 H TYR 57 8.178 1.641 13.838 1353 HA TYR 57 HA TYR 57 5.941 1.376 15.574 1354 HB2 TYR 57 2HB TYR 57 5.592 2.692 13.574 1355 HB3 TYR 57 3HB TYR 57 6.143 1.388 12.525 1356 HD1 TYR 57 HD1 TYR 57 3.312 2.515 14.701 1357 HD2 TYR 57 HD2 TYR 57 4.619 -0.401 11.854 1358 HE1 TYR 57 HE1 TYR 57 1.020 1.636 14.522 1359 HE2 TYR 57 HE2 TYR 57 2.337 -1.256 11.682 1360 HH TYR 57 HH TYR 57 -0.350 0.359 12.837 1361 H CYS 58 H CYS 58 7.519 -0.833 13.237 1362 HA CYS 58 HA CYS 58 5.696 -2.966 13.470 1363 HB2 CYS 58 2HB CYS 58 8.641 -3.003 12.711 1364 HB3 CYS 58 3HB CYS 58 7.550 -4.382 12.541 1365 HG CYS 58 HG CYS 58 8.120 -1.998 10.440 1366 H ARG 59 H ARG 59 8.472 -2.045 15.458 1367 HA ARG 59 HA ARG 59 8.543 -4.281 17.216 1368 HB2 ARG 59 2HB ARG 59 9.345 -1.365 17.594 1369 HB3 ARG 59 3HB ARG 59 9.598 -2.584 18.836 1370 HG2 ARG 59 2HG ARG 59 11.152 -3.792 17.436 1371 HG3 ARG 59 3HG ARG 59 10.795 -2.747 16.056 1372 HD2 ARG 59 2HD ARG 59 12.944 -2.179 17.187 1373 HD3 ARG 59 3HD ARG 59 11.800 -0.839 17.174 1374 HE ARG 59 HE ARG 59 11.294 -1.386 19.523 1375 HH11 ARG 59 1HH1 ARG 59 14.353 -2.534 18.234 1376 HH12 ARG 59 2HH1 ARG 59 15.118 -2.617 19.784 1377 HH21 ARG 59 1HH2 ARG 59 12.314 -1.476 21.549 1378 HH22 ARG 59 2HH2 ARG 59 13.961 -2.015 21.659 1379 H HIS 60 H HIS 60 6.943 -1.118 17.400 1380 HA HIS 60 HA HIS 60 5.564 -1.310 19.798 1381 HB2 HIS 60 2HB HIS 60 5.712 0.804 18.686 1382 HB3 HIS 60 3HB HIS 60 5.012 0.176 17.204 1383 HD1 HIS 60 HD1 HIS 60 3.977 1.103 20.740 1384 HD2 HIS 60 HD2 HIS 60 2.320 0.587 16.963 1385 HE1 HIS 60 HE1 HIS 60 1.611 1.933 20.912 1386 HE2 HIS 60 HE2 HIS 60 0.726 1.826 18.562 1387 H HIS 61 H HIS 61 4.526 -2.356 16.574 1388 HA HIS 61 HA HIS 61 1.908 -3.222 17.441 1389 HB2 HIS 61 2HB HIS 61 2.501 -2.189 15.135 1390 HB3 HIS 61 3HB HIS 61 3.156 -3.766 14.714 1391 HD1 HIS 61 HD1 HIS 61 1.437 -5.692 14.333 1392 HD2 HIS 61 HD2 HIS 61 -0.305 -2.037 15.274 1393 HE1 HIS 61 HE1 HIS 61 -1.001 -5.955 13.837 1394 HE2 HIS 61 HE2 HIS 61 -2.050 -3.827 14.650 1395 H HIS 62 H HIS 62 5.032 -4.600 17.277 1396 HA HIS 62 HA HIS 62 4.275 -7.380 17.033 1397 HB2 HIS 62 2HB HIS 62 6.516 -6.473 16.348 1398 HB3 HIS 62 3HB HIS 62 6.887 -6.148 18.035 1399 HD1 HIS 62 HD1 HIS 62 6.625 -8.868 15.521 1400 HD2 HIS 62 HD2 HIS 62 7.580 -8.473 19.534 1401 HE1 HIS 62 HE1 HIS 62 7.757 -10.992 16.176 1402 HE2 HIS 62 HE2 HIS 62 8.530 -10.629 18.514 1403 H GLN 63 H GLN 63 5.320 -5.201 19.634 1404 HA GLN 63 HA GLN 63 5.152 -7.135 21.743 1405 HB2 GLN 63 2HB GLN 63 5.242 -4.084 21.962 1406 HB3 GLN 63 3HB GLN 63 5.587 -5.231 23.254 1407 HG2 GLN 63 2HG GLN 63 7.224 -4.794 20.741 1408 HG3 GLN 63 3HG GLN 63 7.660 -4.302 22.374 1409 HE21 GLN 63 1HE2 GLN 63 6.853 -6.799 23.646 1410 HE22 GLN 63 2HE2 GLN 63 8.003 -7.985 23.167 1411 H HIS 64 H HIS 64 2.999 -4.789 20.311 1412 HA HIS 64 HA HIS 64 0.727 -5.904 21.825 1413 HB2 HIS 64 2HB HIS 64 1.234 -2.933 21.331 1414 HB3 HIS 64 3HB HIS 64 -0.306 -3.588 21.881 1415 HD1 HIS 64 HD1 HIS 64 -0.418 -4.472 24.313 1416 HD2 HIS 64 HD2 HIS 64 3.233 -2.765 23.312 1417 HE1 HIS 64 HE1 HIS 64 0.785 -4.142 26.482 1418 HE2 HIS 64 HE2 HIS 64 2.907 -2.945 25.861 1419 HA PRO 65 HA PRO 65 -0.384 -6.468 17.315 1420 HB2 PRO 65 2HB PRO 65 -2.577 -7.805 18.944 1421 HB3 PRO 65 3HB PRO 65 -1.816 -8.343 17.427 1422 HG2 PRO 65 2HG PRO 65 -1.105 -9.475 19.715 1423 HG3 PRO 65 3HG PRO 65 0.134 -9.078 18.500 1424 HD2 PRO 65 2HD PRO 65 -0.498 -7.672 21.079 1425 HD3 PRO 65 3HD PRO 65 1.070 -7.905 20.272 1426 H GLY 66 H GLY 66 -2.373 -5.553 20.095 1427 HA2 GLY 66 2HA GLY 66 -3.679 -3.372 18.539 1428 HA3 GLY 66 3HA GLY 66 -4.337 -4.107 20.000 1429 H GLY 67 H GLY 67 -3.928 -3.125 21.905 1430 HA2 GLY 67 2HA GLY 67 -2.997 -1.783 23.531 1431 HA3 GLY 67 3HA GLY 67 -1.453 -2.031 22.732 1432 H SER 68 H SER 68 -4.123 -0.642 21.103 1433 HA SER 68 HA SER 68 -3.139 2.107 21.309 1434 HB2 SER 68 2HB SER 68 -3.571 0.458 18.740 1435 HB3 SER 68 3HB SER 68 -3.206 2.175 18.775 1436 HG SER 68 HG SER 68 -1.493 0.166 19.861 1437 H GLY 69 H GLY 69 -5.138 3.520 20.362 1438 HA2 GLY 69 2HA GLY 69 -7.783 2.613 20.587 1439 HA3 GLY 69 3HA GLY 69 -7.337 3.324 22.100 1440 H LEU 70 H LEU 70 -8.345 4.027 18.740 1441 HA LEU 70 HA LEU 70 -9.336 6.656 19.466 1442 HB2 LEU 70 2HB LEU 70 -8.399 6.510 17.067 1443 HB3 LEU 70 3HB LEU 70 -9.555 5.239 16.729 1444 HG LEU 70 HG LEU 70 -11.418 6.851 17.184 1445 HD11 LEU 70 1HD1 LEU 70 -10.240 8.378 18.669 1446 HD12 LEU 70 2HD1 LEU 70 -10.990 9.247 17.335 1447 HD13 LEU 70 3HD1 LEU 70 -9.248 8.952 17.325 1448 HD21 LEU 70 1HD2 LEU 70 -11.279 8.140 15.092 1449 HD22 LEU 70 2HD2 LEU 70 -10.754 6.475 14.851 1450 HD23 LEU 70 3HD2 LEU 70 -9.558 7.768 14.962 1451 H ASP 71 H ASP 71 -10.755 3.987 17.461 1452 HA ASP 71 HA ASP 71 -11.759 2.863 19.978 1453 HB2 ASP 71 2HB ASP 71 -13.019 2.554 17.763 1454 HB3 ASP 71 3HB ASP 71 -11.687 1.536 17.237 1455 H ASP 72 H ASP 72 -9.050 2.956 17.729 1456 HA ASP 72 HA ASP 72 -7.313 1.651 19.538 1457 HB2 ASP 72 2HB ASP 72 -8.260 0.032 17.419 1458 HB3 ASP 72 3HB ASP 72 -6.529 0.182 17.294 1459 H ILE 73 H ILE 73 -7.009 4.583 18.268 1460 HA ILE 73 HA ILE 73 -4.320 5.110 17.590 1461 HB ILE 73 HB ILE 73 -6.419 6.751 19.049 1462 HG12 ILE 73 2HG1 ILE 73 -5.055 7.088 16.360 1463 HG13 ILE 73 3HG1 ILE 73 -6.709 6.573 16.665 1464 HG21 ILE 73 1HG2 ILE 73 -4.979 8.816 18.990 1465 HG22 ILE 73 2HG2 ILE 73 -3.583 7.799 18.632 1466 HG23 ILE 73 3HG2 ILE 73 -4.444 7.612 20.155 1467 HD11 ILE 73 1HD1 ILE 73 -5.589 9.338 17.218 1468 HD12 ILE 73 2HD1 ILE 73 -7.245 8.819 17.544 1469 HD13 ILE 73 3HD1 ILE 73 -6.651 8.882 15.887 1470 HA PRO 74 HA PRO 74 -2.309 5.006 21.808 1471 HB2 PRO 74 2HB PRO 74 0.190 4.424 20.995 1472 HB3 PRO 74 3HB PRO 74 -1.089 3.195 20.929 1473 HG2 PRO 74 2HG PRO 74 0.099 4.790 18.710 1474 HG3 PRO 74 3HG PRO 74 -0.466 3.109 18.714 1475 HD2 PRO 74 2HD PRO 74 -1.925 5.374 17.799 1476 HD3 PRO 74 3HD PRO 74 -2.562 3.734 18.039 1477 HA PRO 75 HA PRO 75 -0.552 9.261 21.661 1478 HB2 PRO 75 2HB PRO 75 1.032 9.155 23.936 1479 HB3 PRO 75 3HB PRO 75 -0.722 9.419 23.970 1480 HG2 PRO 75 2HG PRO 75 0.802 6.877 24.438 1481 HG3 PRO 75 3HG PRO 75 -0.595 7.532 25.318 1482 HD2 PRO 75 2HD PRO 75 -0.874 5.559 23.480 1483 HD3 PRO 75 3HD PRO 75 -2.126 6.805 23.712 1484 H TYR 76 H TYR 76 1.287 6.329 21.856 1485 HA TYR 76 HA TYR 76 3.927 7.064 21.418 1486 HB2 TYR 76 2HB TYR 76 2.919 4.777 21.973 1487 HB3 TYR 76 3HB TYR 76 2.491 4.619 20.280 1488 HD1 TYR 76 HD1 TYR 76 4.348 4.377 18.549 1489 HD2 TYR 76 HD2 TYR 76 5.138 4.331 22.758 1490 HE1 TYR 76 HE1 TYR 76 6.523 3.304 18.130 1491 HE2 TYR 76 HE2 TYR 76 7.305 3.264 22.336 1492 HH TYR 76 HH TYR 76 8.664 2.969 19.199 1493 H ASP 77 H ASP 77 1.436 6.203 19.017 1494 HA ASP 77 HA ASP 77 3.091 6.631 16.737 1495 HB2 ASP 77 2HB ASP 77 0.116 6.104 16.985 1496 HB3 ASP 77 3HB ASP 77 0.920 6.318 15.431 1497 H ARG 78 H ARG 78 1.029 8.731 18.570 1498 HA ARG 78 HA ARG 78 0.605 10.789 16.687 1499 HB2 ARG 78 2HB ARG 78 1.053 11.126 19.682 1500 HB3 ARG 78 3HB ARG 78 0.255 12.277 18.616 1501 HG2 ARG 78 2HG ARG 78 -0.770 9.489 19.178 1502 HG3 ARG 78 3HG ARG 78 -1.290 10.919 20.062 1503 HD2 ARG 78 2HD ARG 78 -2.968 10.404 18.417 1504 HD3 ARG 78 3HD ARG 78 -2.141 11.874 17.903 1505 HE ARG 78 HE ARG 78 -1.121 9.413 16.742 1506 HH11 ARG 78 1HH1 ARG 78 -3.432 12.043 16.315 1507 HH12 ARG 78 2HH1 ARG 78 -3.551 11.815 14.599 1508 HH21 ARG 78 1HH2 ARG 78 -1.249 9.177 14.466 1509 HH22 ARG 78 2HH2 ARG 78 -2.321 10.198 13.561 1510 H ASP 79 H ASP 79 3.314 10.129 18.902 1511 HA ASP 79 HA ASP 79 4.958 12.303 18.113 1512 HB2 ASP 79 2HB ASP 79 5.635 9.629 19.402 1513 HB3 ASP 79 3HB ASP 79 6.852 10.866 19.103 1514 H PHE 80 H PHE 80 4.620 8.984 16.947 1515 HA PHE 80 HA PHE 80 6.706 8.887 15.072 1516 HB2 PHE 80 2HB PHE 80 5.469 6.863 15.730 1517 HB3 PHE 80 3HB PHE 80 3.978 7.504 15.057 1518 HD1 PHE 80 HD1 PHE 80 7.186 5.891 14.282 1519 HD2 PHE 80 HD2 PHE 80 3.617 7.551 12.596 1520 HE1 PHE 80 HE1 PHE 80 7.708 4.884 12.104 1521 HE2 PHE 80 HE2 PHE 80 4.166 6.532 10.432 1522 HZ PHE 80 HZ PHE 80 6.217 5.196 10.188 1523 H CYS 81 H CYS 81 3.428 10.188 14.844 1524 HA CYS 81 HA CYS 81 3.394 10.576 12.004 1525 HB2 CYS 81 2HB CYS 81 1.547 11.606 14.189 1526 HB3 CYS 81 3HB CYS 81 1.233 11.764 12.461 1527 HG CYS 81 HG CYS 81 1.830 8.623 13.488 1528 H LYS 82 H LYS 82 5.061 12.288 14.358 1529 HA LYS 82 HA LYS 82 4.746 14.962 13.314 1530 HB2 LYS 82 2HB LYS 82 6.958 13.864 15.096 1531 HB3 LYS 82 3HB LYS 82 6.598 15.566 14.815 1532 HG2 LYS 82 2HG LYS 82 4.837 13.555 16.247 1533 HG3 LYS 82 3HG LYS 82 5.753 14.869 16.986 1534 HD2 LYS 82 2HD LYS 82 4.346 16.529 15.806 1535 HD3 LYS 82 3HD LYS 82 3.441 15.223 15.030 1536 HE2 LYS 82 2HE LYS 82 2.213 16.143 16.958 1537 HE3 LYS 82 3HE LYS 82 2.646 14.455 17.237 1538 HZ1 LYS 82 1HZ LYS 82 3.046 15.834 19.183 1539 HZ2 LYS 82 2HZ LYS 82 4.111 16.807 18.302 1540 HZ3 LYS 82 3HZ LYS 82 4.494 15.188 18.596 1541 H VAL 83 H VAL 83 5.048 14.580 11.138 1542 HA VAL 83 HA VAL 83 7.834 14.358 10.160 1543 HB VAL 83 HB VAL 83 6.910 13.140 8.122 1544 HG11 VAL 83 1HG1 VAL 83 8.054 11.854 9.864 1545 HG12 VAL 83 2HG1 VAL 83 6.746 10.912 9.158 1546 HG13 VAL 83 3HG1 VAL 83 6.539 11.653 10.747 1547 HG21 VAL 83 1HG2 VAL 83 4.696 12.032 8.271 1548 HG22 VAL 83 2HG2 VAL 83 4.541 13.789 8.323 1549 HG23 VAL 83 3HG2 VAL 83 4.388 12.848 9.809 1550 H ASP 84 H ASP 84 8.142 15.452 8.074 1551 HA ASP 84 HA ASP 84 6.344 17.706 7.573 1552 HB2 ASP 84 2HB ASP 84 9.009 17.651 7.415 1553 HB3 ASP 84 3HB ASP 84 8.715 17.021 5.798 1554 H GLN 85 H GLN 85 5.829 18.032 5.040 1555 HA GLN 85 HA GLN 85 3.992 16.000 4.409 1556 HB2 GLN 85 2HB GLN 85 3.655 18.358 3.726 1557 HB3 GLN 85 3HB GLN 85 4.980 18.224 2.578 1558 HG2 GLN 85 2HG GLN 85 2.805 18.078 1.450 1559 HG3 GLN 85 3HG GLN 85 3.713 16.576 1.268 1560 HE21 GLN 85 1HE2 GLN 85 2.974 14.702 2.372 1561 HE22 GLN 85 2HE2 GLN 85 1.375 14.587 2.992 1562 HA PRO 86 HA PRO 86 7.104 14.442 0.866 1563 HB2 PRO 86 2HB PRO 86 9.717 15.322 2.106 1564 HB3 PRO 86 3HB PRO 86 9.251 15.221 0.393 1565 HG2 PRO 86 2HG PRO 86 9.407 17.584 1.575 1566 HG3 PRO 86 3HG PRO 86 8.078 17.236 0.439 1567 HD2 PRO 86 2HD PRO 86 8.030 17.258 3.455 1568 HD3 PRO 86 3HD PRO 86 6.842 17.910 2.302 1569 H THR 87 H THR 87 8.293 14.713 4.217 1570 HA THR 87 HA THR 87 9.456 12.153 4.474 1571 HB THR 87 HB THR 87 8.306 13.859 6.726 1572 HG1 THR 87 HG1 THR 87 10.637 14.134 5.162 1573 HG21 THR 87 1HG2 THR 87 9.075 11.622 7.475 1574 HG22 THR 87 2HG2 THR 87 10.143 12.889 8.080 1575 HG23 THR 87 3HG2 THR 87 10.644 11.900 6.707 1576 H LEU 88 H LEU 88 6.174 13.299 4.879 1577 HA LEU 88 HA LEU 88 5.013 11.102 6.232 1578 HB2 LEU 88 2HB LEU 88 4.139 13.567 5.641 1579 HB3 LEU 88 3HB LEU 88 3.450 12.775 4.241 1580 HG LEU 88 HG LEU 88 2.825 12.091 7.145 1581 HD11 LEU 88 1HD1 LEU 88 1.150 13.609 5.128 1582 HD12 LEU 88 2HD1 LEU 88 1.948 14.275 6.555 1583 HD13 LEU 88 3HD1 LEU 88 0.637 13.116 6.746 1584 HD21 LEU 88 1HD2 LEU 88 0.990 10.704 6.275 1585 HD22 LEU 88 2HD2 LEU 88 2.564 10.113 5.749 1586 HD23 LEU 88 3HD2 LEU 88 1.541 11.005 4.623 1587 H PHE 89 H PHE 89 5.368 11.935 2.788 1588 HA PHE 89 HA PHE 89 4.128 9.591 1.752 1589 HB2 PHE 89 2HB PHE 89 6.048 11.540 0.439 1590 HB3 PHE 89 3HB PHE 89 5.194 10.263 -0.422 1591 HD1 PHE 89 HD1 PHE 89 2.495 10.317 0.376 1592 HD2 PHE 89 HD2 PHE 89 5.139 13.632 -0.038 1593 HE1 PHE 89 HE1 PHE 89 0.587 11.799 -0.024 1594 HE2 PHE 89 HE2 PHE 89 3.224 15.117 -0.442 1595 HZ PHE 89 HZ PHE 89 0.937 14.201 -0.431 1596 H GLU 90 H GLU 90 7.451 10.345 2.710 1597 HA GLU 90 HA GLU 90 8.800 8.157 1.576 1598 HB2 GLU 90 2HB GLU 90 9.349 9.607 4.201 1599 HB3 GLU 90 3HB GLU 90 10.447 8.444 3.469 1600 HG2 GLU 90 2HG GLU 90 9.603 11.095 2.283 1601 HG3 GLU 90 3HG GLU 90 11.167 10.726 3.009 1602 H LEU 91 H LEU 91 6.890 8.404 4.541 1603 HA LEU 91 HA LEU 91 7.395 5.805 5.582 1604 HB2 LEU 91 2HB LEU 91 4.954 7.582 5.970 1605 HB3 LEU 91 3HB LEU 91 5.365 6.192 6.962 1606 HG LEU 91 HG LEU 91 6.984 8.766 6.779 1607 HD11 LEU 91 1HD1 LEU 91 5.189 7.747 9.003 1608 HD12 LEU 91 2HD1 LEU 91 4.876 9.123 7.942 1609 HD13 LEU 91 3HD1 LEU 91 6.217 9.182 9.081 1610 HD21 LEU 91 1HD2 LEU 91 7.425 6.341 8.561 1611 HD22 LEU 91 2HD2 LEU 91 8.326 7.859 8.633 1612 HD23 LEU 91 3HD2 LEU 91 8.442 6.837 7.203 1613 H ILE 92 H ILE 92 4.932 7.112 3.372 1614 HA ILE 92 HA ILE 92 3.365 4.766 3.028 1615 HB ILE 92 HB ILE 92 3.766 7.113 1.099 1616 HG12 ILE 92 2HG1 ILE 92 1.612 6.637 3.217 1617 HG13 ILE 92 3HG1 ILE 92 2.889 7.845 3.288 1618 HG21 ILE 92 1HG2 ILE 92 1.631 6.438 0.042 1619 HG22 ILE 92 2HG2 ILE 92 1.547 5.026 1.095 1620 HG23 ILE 92 3HG2 ILE 92 2.841 5.160 -0.097 1621 HD11 ILE 92 1HD1 ILE 92 1.887 8.979 1.348 1622 HD12 ILE 92 2HD1 ILE 92 0.798 8.877 2.726 1623 HD13 ILE 92 3HD1 ILE 92 0.578 7.796 1.350 1624 H LEU 93 H LEU 93 6.191 6.061 1.317 1625 HA LEU 93 HA LEU 93 6.298 4.209 -0.829 1626 HB2 LEU 93 2HB LEU 93 8.423 6.022 0.390 1627 HB3 LEU 93 3HB LEU 93 8.707 5.063 -1.053 1628 HG LEU 93 HG LEU 93 6.615 7.266 -0.816 1629 HD11 LEU 93 1HD1 LEU 93 8.066 8.609 -2.257 1630 HD12 LEU 93 2HD1 LEU 93 9.294 7.339 -2.237 1631 HD13 LEU 93 3HD1 LEU 93 8.881 8.195 -0.749 1632 HD21 LEU 93 1HD2 LEU 93 7.486 5.667 -3.244 1633 HD22 LEU 93 2HD2 LEU 93 6.366 7.033 -3.249 1634 HD23 LEU 93 3HD2 LEU 93 5.935 5.546 -2.409 1635 H ALA 94 H ALA 94 7.884 4.351 2.349 1636 HA ALA 94 HA ALA 94 9.554 2.052 2.007 1637 HB1 ALA 94 1HB ALA 94 10.121 3.847 3.587 1638 HB2 ALA 94 2HB ALA 94 10.018 2.294 4.414 1639 HB3 ALA 94 3HB ALA 94 8.703 3.465 4.564 1640 H ALA 95 H ALA 95 6.347 2.603 3.441 1641 HA ALA 95 HA ALA 95 6.042 -0.015 4.563 1642 HB1 ALA 95 1HB ALA 95 3.724 0.609 4.952 1643 HB2 ALA 95 2HB ALA 95 3.885 2.003 3.876 1644 HB3 ALA 95 3HB ALA 95 4.790 1.945 5.388 1645 H ASN 96 H ASN 96 5.246 1.435 1.439 1646 HA ASN 96 HA ASN 96 3.767 -0.825 0.421 1647 HB2 ASN 96 2HB ASN 96 3.391 1.459 -0.465 1648 HB3 ASN 96 3HB ASN 96 5.054 1.533 -1.042 1649 HD21 ASN 96 1HD2 ASN 96 4.211 1.964 -3.149 1650 HD22 ASN 96 2HD2 ASN 96 3.584 0.697 -4.138 1651 H TYR 97 H TYR 97 7.108 0.317 0.277 1652 HA TYR 97 HA TYR 97 8.165 -1.553 -1.579 1653 HB2 TYR 97 2HB TYR 97 9.365 0.507 -1.102 1654 HB3 TYR 97 3HB TYR 97 9.466 0.126 0.611 1655 HD1 TYR 97 HD1 TYR 97 11.549 -0.637 1.385 1656 HD2 TYR 97 HD2 TYR 97 10.523 -1.380 -2.699 1657 HE1 TYR 97 HE1 TYR 97 13.756 -1.644 1.018 1658 HE2 TYR 97 HE2 TYR 97 12.734 -2.397 -3.064 1659 HH TYR 97 HH TYR 97 14.812 -3.269 -0.544 1660 H LEU 98 H LEU 98 8.055 -1.528 1.974 1661 HA LEU 98 HA LEU 98 9.304 -4.160 2.209 1662 HB2 LEU 98 2HB LEU 98 8.337 -2.176 4.309 1663 HB3 LEU 98 3HB LEU 98 9.160 -3.686 4.672 1664 HG LEU 98 HG LEU 98 10.367 -1.328 3.168 1665 HD11 LEU 98 1HD1 LEU 98 11.801 -1.038 5.144 1666 HD12 LEU 98 2HD1 LEU 98 10.931 -2.327 5.980 1667 HD13 LEU 98 3HD1 LEU 98 10.095 -0.834 5.540 1668 HD21 LEU 98 1HD2 LEU 98 12.496 -2.577 3.282 1669 HD22 LEU 98 2HD2 LEU 98 11.283 -3.418 2.323 1670 HD23 LEU 98 3HD2 LEU 98 11.642 -3.965 3.962 1671 H ASP 99 H ASP 99 6.208 -2.973 1.787 1672 HA ASP 99 HA ASP 99 4.124 -3.780 1.841 1673 HB2 ASP 99 2HB ASP 99 5.330 -5.735 0.706 1674 HB3 ASP 99 3HB ASP 99 5.303 -6.554 2.263 1675 H ILE 100 H ILE 100 5.287 -2.835 4.245 1676 HA ILE 100 HA ILE 100 4.038 -4.349 6.415 1677 HB ILE 100 HB ILE 100 5.424 -1.624 6.560 1678 HG12 ILE 100 2HG1 ILE 100 6.536 -4.424 7.055 1679 HG13 ILE 100 3HG1 ILE 100 6.976 -3.352 5.735 1680 HG21 ILE 100 1HG2 ILE 100 4.700 -3.595 8.776 1681 HG22 ILE 100 2HG2 ILE 100 3.890 -2.060 8.461 1682 HG23 ILE 100 3HG2 ILE 100 5.571 -2.074 8.996 1683 HD11 ILE 100 1HD1 ILE 100 7.545 -2.846 8.649 1684 HD12 ILE 100 2HD1 ILE 100 8.036 -1.837 7.287 1685 HD13 ILE 100 3HD1 ILE 100 8.683 -3.465 7.455 1686 H LYS 101 H LYS 101 1.984 -4.274 5.461 1687 HA LYS 101 HA LYS 101 0.454 -2.005 4.893 1688 HB2 LYS 101 2HB LYS 101 -0.489 -4.747 5.804 1689 HB3 LYS 101 3HB LYS 101 -1.509 -3.512 5.069 1690 HG2 LYS 101 2HG LYS 101 -0.163 -3.620 3.006 1691 HG3 LYS 101 3HG LYS 101 0.847 -4.880 3.732 1692 HD2 LYS 101 2HD LYS 101 -1.138 -6.352 3.932 1693 HD3 LYS 101 3HD LYS 101 -2.151 -5.088 3.226 1694 HE2 LYS 101 2HE LYS 101 -0.752 -5.215 1.148 1695 HE3 LYS 101 3HE LYS 101 0.106 -6.587 1.862 1696 HZ1 LYS 101 1HZ LYS 101 -2.815 -6.458 1.350 1697 HZ2 LYS 101 2HZ LYS 101 -1.979 -7.793 1.968 1698 HZ3 LYS 101 3HZ LYS 101 -1.695 -7.271 0.384 1699 HA PRO 102 HA PRO 102 -1.014 -2.299 9.758 1700 HB2 PRO 102 2HB PRO 102 1.902 -2.674 10.544 1701 HB3 PRO 102 3HB PRO 102 0.430 -3.073 11.462 1702 HG2 PRO 102 2HG PRO 102 1.749 -4.997 10.209 1703 HG3 PRO 102 3HG PRO 102 -0.031 -4.971 10.182 1704 HD2 PRO 102 2HD PRO 102 1.899 -4.279 8.001 1705 HD3 PRO 102 3HD PRO 102 0.272 -4.983 7.887 1706 H LEU 103 H LEU 103 2.155 -1.123 8.543 1707 HA LEU 103 HA LEU 103 1.917 1.419 9.905 1708 HB2 LEU 103 2HB LEU 103 4.117 0.223 9.482 1709 HB3 LEU 103 3HB LEU 103 3.964 0.620 7.784 1710 HG LEU 103 HG LEU 103 5.497 2.096 9.356 1711 HD11 LEU 103 1HD1 LEU 103 5.160 2.689 7.034 1712 HD12 LEU 103 2HD1 LEU 103 5.102 4.137 8.036 1713 HD13 LEU 103 3HD1 LEU 103 3.606 3.437 7.406 1714 HD21 LEU 103 1HD2 LEU 103 4.383 3.984 10.422 1715 HD22 LEU 103 2HD2 LEU 103 3.806 2.472 11.099 1716 HD23 LEU 103 3HD2 LEU 103 2.803 3.364 9.952 1717 H LEU 104 H LEU 104 1.642 0.212 6.590 1718 HA LEU 104 HA LEU 104 1.445 2.572 5.147 1719 HB2 LEU 104 2HB LEU 104 1.725 0.340 4.130 1720 HB3 LEU 104 3HB LEU 104 0.105 -0.110 4.627 1721 HG LEU 104 HG LEU 104 -0.822 1.638 3.076 1722 HD11 LEU 104 1HD1 LEU 104 2.046 1.992 2.150 1723 HD12 LEU 104 2HD1 LEU 104 1.063 3.185 3.004 1724 HD13 LEU 104 3HD1 LEU 104 0.608 2.675 1.381 1725 HD21 LEU 104 1HD2 LEU 104 -0.419 0.399 1.004 1726 HD22 LEU 104 2HD2 LEU 104 -0.667 -0.699 2.358 1727 HD23 LEU 104 3HD2 LEU 104 0.964 -0.420 1.738 1728 H ASP 105 H ASP 105 -1.091 0.691 6.766 1729 HA ASP 105 HA ASP 105 -3.304 2.169 5.743 1730 HB2 ASP 105 2HB ASP 105 -3.421 -0.230 6.530 1731 HB3 ASP 105 3HB ASP 105 -3.252 0.337 8.191 1732 H VAL 106 H VAL 106 -1.549 2.192 8.869 1733 HA VAL 106 HA VAL 106 -3.065 4.171 10.191 1734 HB VAL 106 HB VAL 106 -0.111 3.438 10.514 1735 HG11 VAL 106 1HG1 VAL 106 -0.175 4.575 12.724 1736 HG12 VAL 106 2HG1 VAL 106 -1.799 5.172 12.373 1737 HG13 VAL 106 3HG1 VAL 106 -0.430 5.716 11.401 1738 HG21 VAL 106 1HG2 VAL 106 -1.686 1.608 11.022 1739 HG22 VAL 106 2HG2 VAL 106 -2.543 2.644 12.166 1740 HG23 VAL 106 3HG2 VAL 106 -0.874 2.163 12.487 1741 H THR 107 H THR 107 -0.269 4.432 8.021 1742 HA THR 107 HA THR 107 0.042 7.271 8.188 1743 HB THR 107 HB THR 107 1.056 5.374 6.016 1744 HG1 THR 107 HG1 THR 107 1.627 4.961 8.358 1745 HG21 THR 107 1HG2 THR 107 2.876 7.027 5.737 1746 HG22 THR 107 2HG2 THR 107 2.118 8.075 6.939 1747 HG23 THR 107 3HG2 THR 107 1.305 7.760 5.403 1748 H CYS 108 H CYS 108 -1.825 5.102 6.120 1749 HA CYS 108 HA CYS 108 -2.716 7.026 4.204 1750 HB2 CYS 108 2HB CYS 108 -3.843 4.321 5.023 1751 HB3 CYS 108 3HB CYS 108 -4.532 5.300 3.729 1752 HG CYS 108 HG CYS 108 -1.233 4.554 3.536 1753 H LYS 109 H LYS 109 -3.881 5.971 7.386 1754 HA LYS 109 HA LYS 109 -6.297 7.525 7.343 1755 HB2 LYS 109 2HB LYS 109 -4.838 5.914 9.415 1756 HB3 LYS 109 3HB LYS 109 -5.828 7.227 10.039 1757 HG2 LYS 109 2HG LYS 109 -7.106 5.180 10.066 1758 HG3 LYS 109 3HG LYS 109 -7.807 6.289 8.884 1759 HD2 LYS 109 2HD LYS 109 -6.718 5.017 7.056 1760 HD3 LYS 109 3HD LYS 109 -5.997 3.923 8.240 1761 HE2 LYS 109 2HE LYS 109 -8.304 3.246 8.949 1762 HE3 LYS 109 3HE LYS 109 -8.959 4.282 7.679 1763 HZ1 LYS 109 1HZ LYS 109 -7.781 2.931 6.041 1764 HZ2 LYS 109 2HZ LYS 109 -8.846 1.991 6.956 1765 HZ3 LYS 109 3HZ LYS 109 -7.187 1.930 7.269 1766 H THR 110 H THR 110 -2.945 8.165 8.228 1767 HA THR 110 HA THR 110 -3.282 10.538 9.700 1768 HB THR 110 HB THR 110 -0.920 9.717 7.942 1769 HG1 THR 110 HG1 THR 110 -1.776 8.445 9.946 1770 HG21 THR 110 1HG2 THR 110 -1.029 11.745 10.216 1771 HG22 THR 110 2HG2 THR 110 -0.772 12.120 8.510 1772 HG23 THR 110 3HG2 THR 110 0.441 11.200 9.402 1773 H VAL 111 H VAL 111 -2.753 10.043 6.187 1774 HA VAL 111 HA VAL 111 -2.998 12.825 5.514 1775 HB VAL 111 HB VAL 111 -3.115 12.068 3.130 1776 HG11 VAL 111 1HG1 VAL 111 -0.815 11.196 3.000 1777 HG12 VAL 111 2HG1 VAL 111 -0.848 10.815 4.724 1778 HG13 VAL 111 3HG1 VAL 111 -0.941 12.492 4.190 1779 HG21 VAL 111 1HG2 VAL 111 -4.306 9.929 3.415 1780 HG22 VAL 111 2HG2 VAL 111 -2.919 9.245 4.264 1781 HG23 VAL 111 3HG2 VAL 111 -2.782 9.681 2.557 1782 H ALA 112 H ALA 112 -5.250 10.099 5.652 1783 HA ALA 112 HA ALA 112 -7.395 11.205 4.196 1784 HB1 ALA 112 1HB ALA 112 -7.223 8.805 4.698 1785 HB2 ALA 112 2HB ALA 112 -8.777 9.458 5.226 1786 HB3 ALA 112 3HB ALA 112 -7.505 9.135 6.409 1787 H ASN 113 H ASN 113 -6.632 11.279 7.661 1788 HA ASN 113 HA ASN 113 -8.989 12.497 8.607 1789 HB2 ASN 113 2HB ASN 113 -6.169 12.412 9.762 1790 HB3 ASN 113 3HB ASN 113 -7.531 13.123 10.628 1791 HD21 ASN 113 1HD2 ASN 113 -5.839 10.750 11.238 1792 HD22 ASN 113 2HD2 ASN 113 -6.948 9.444 11.460 1793 H MET 114 H MET 114 -6.034 13.868 7.276 1794 HA MET 114 HA MET 114 -6.574 16.577 8.120 1795 HB2 MET 114 2HB MET 114 -4.504 15.505 6.155 1796 HB3 MET 114 3HB MET 114 -4.556 17.151 6.775 1797 HG2 MET 114 2HG MET 114 -4.234 16.252 9.079 1798 HG3 MET 114 3HG MET 114 -4.062 14.639 8.391 1799 HE1 MET 114 1HE MET 114 -2.035 14.030 6.617 1800 HE2 MET 114 2HE MET 114 -0.752 15.173 6.221 1801 HE3 MET 114 3HE MET 114 -2.394 15.461 5.647 1802 H ILE 115 H ILE 115 -7.416 14.645 5.341 1803 HA ILE 115 HA ILE 115 -8.163 17.023 3.752 1804 HB ILE 115 HB ILE 115 -8.495 15.509 1.838 1805 HG12 ILE 115 2HG1 ILE 115 -7.620 13.256 3.708 1806 HG13 ILE 115 3HG1 ILE 115 -9.254 13.497 3.115 1807 HG21 ILE 115 1HG2 ILE 115 -6.148 14.887 1.459 1808 HG22 ILE 115 2HG2 ILE 115 -5.809 15.041 3.184 1809 HG23 ILE 115 3HG2 ILE 115 -6.252 16.466 2.242 1810 HD11 ILE 115 1HD1 ILE 115 -6.857 12.852 1.400 1811 HD12 ILE 115 2HD1 ILE 115 -8.526 13.034 0.852 1812 HD13 ILE 115 3HD1 ILE 115 -8.096 11.713 1.936 1813 H ARG 116 H ARG 116 -9.639 15.104 6.040 1814 HA ARG 116 HA ARG 116 -12.250 14.739 4.982 1815 HB2 ARG 116 2HB ARG 116 -11.330 15.084 7.866 1816 HB3 ARG 116 3HB ARG 116 -12.984 14.684 7.412 1817 HG2 ARG 116 2HG ARG 116 -12.217 12.581 6.394 1818 HG3 ARG 116 3HG ARG 116 -10.549 12.981 6.801 1819 HD2 ARG 116 2HD ARG 116 -11.418 11.391 8.418 1820 HD3 ARG 116 3HD ARG 116 -11.151 12.945 9.213 1821 HE ARG 116 HE ARG 116 -13.851 12.292 8.231 1822 HH11 ARG 116 1HH1 ARG 116 -11.727 12.789 11.009 1823 HH12 ARG 116 2HH1 ARG 116 -13.044 12.883 12.138 1824 HH21 ARG 116 1HH2 ARG 116 -15.552 12.401 9.738 1825 HH22 ARG 116 2HH2 ARG 116 -15.198 12.664 11.418 1826 H GLY 117 H GLY 117 -12.943 16.543 3.903 1827 HA2 GLY 117 2HA GLY 117 -13.145 19.163 5.138 1828 HA3 GLY 117 3HA GLY 117 -13.708 18.701 3.539
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