NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
20596 | 2g46 | 6997 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1H MET 1 0.964 -11.533 -6.249 2 2H MET 1 2H MET 1 0.644 -10.982 -4.675 3 3H MET 1 3H MET 1 1.299 -9.922 -5.829 4 HA MET 1 HA MET 1 -1.075 -9.494 -5.506 5 1HB MET 1 1HB MET 1 0.446 -9.997 -7.868 6 2HB MET 1 2HB MET 1 -1.197 -10.559 -8.181 7 1HG MET 1 1HG MET 1 -1.254 -8.269 -8.777 8 2HG MET 1 2HG MET 1 -1.949 -8.304 -7.156 9 1HE MET 1 1HE MET 1 -0.616 -5.111 -7.260 10 2HE MET 1 2HE MET 1 -1.207 -6.100 -8.595 11 3HE MET 1 3HE MET 1 0.439 -5.466 -8.629 12 H PHE 2 H PHE 2 -0.826 -12.474 -7.476 13 HA PHE 2 HA PHE 2 -3.469 -13.361 -6.711 14 1HB PHE 2 1HB PHE 2 -2.723 -15.416 -7.952 15 2HB PHE 2 2HB PHE 2 -2.424 -13.928 -8.849 16 HD1 PHE 2 HD1 PHE 2 -0.792 -16.382 -6.548 17 HD2 PHE 2 HD2 PHE 2 -0.246 -13.370 -9.562 18 HE1 PHE 2 HE1 PHE 2 1.622 -16.936 -6.665 19 HE2 PHE 2 HE2 PHE 2 2.169 -13.925 -9.678 20 HZ PHE 2 HZ PHE 2 3.103 -15.708 -8.230 21 H ASN 3 H ASN 3 -4.049 -14.970 -5.226 22 HA ASN 3 HA ASN 3 -1.904 -16.225 -3.580 23 1HB ASN 3 1HB ASN 3 -3.716 -14.049 -2.854 24 2HB ASN 3 2HB ASN 3 -3.897 -15.429 -1.772 25 1HD2 ASN 3 1HD2 ASN 3 -1.456 -13.167 -3.102 26 2HD2 ASN 3 2HD2 ASN 3 -0.348 -13.366 -1.832 27 H ASP 4 H ASP 4 -2.554 -18.233 -2.691 28 HA ASP 4 HA ASP 4 -4.453 -19.807 -4.014 29 1HB ASP 4 1HB ASP 4 -4.199 -21.280 -2.010 30 2HB ASP 4 2HB ASP 4 -2.651 -20.633 -2.552 31 H ARG 5 H ARG 5 -4.994 -17.457 -1.481 32 HA ARG 5 HA ARG 5 -7.686 -18.505 -0.847 33 1HB ARG 5 1HB ARG 5 -5.993 -16.148 0.048 34 2HB ARG 5 2HB ARG 5 -7.615 -16.449 0.669 35 1HG ARG 5 1HG ARG 5 -6.397 -18.924 0.906 36 2HG ARG 5 2HG ARG 5 -5.093 -17.805 1.305 37 1HD ARG 5 1HD ARG 5 -7.705 -17.133 2.528 38 2HD ARG 5 2HD ARG 5 -6.965 -18.635 3.115 39 HE ARG 5 HE ARG 5 -5.901 -15.934 3.491 40 1HH1 ARG 5 1HH1 ARG 5 -5.147 -19.323 3.227 41 2HH1 ARG 5 2HH1 ARG 5 -3.668 -19.174 4.109 42 1HH2 ARG 5 1HH2 ARG 5 -3.975 -15.768 4.634 43 2HH2 ARG 5 2HH2 ARG 5 -3.007 -17.179 4.900 44 H VAL 6 H VAL 6 -6.215 -15.735 -2.540 45 HA VAL 6 HA VAL 6 -8.792 -15.270 -3.934 46 HB VAL 6 HB VAL 6 -8.770 -12.882 -3.226 47 1HG1 VAL 6 1HG1 VAL 6 -9.598 -13.236 -1.016 48 2HG1 VAL 6 2HG1 VAL 6 -8.565 -14.646 -0.778 49 3HG1 VAL 6 3HG1 VAL 6 -9.932 -14.731 -1.889 50 1HG2 VAL 6 1HG2 VAL 6 -7.126 -12.771 -1.025 51 2HG2 VAL 6 2HG2 VAL 6 -6.717 -12.126 -2.615 52 3HG2 VAL 6 3HG2 VAL 6 -6.165 -13.734 -2.147 53 H ILE 7 H ILE 7 -8.274 -13.009 -5.293 54 HA ILE 7 HA ILE 7 -5.496 -12.960 -6.280 55 HB ILE 7 HB ILE 7 -6.472 -14.886 -7.441 56 1HG1 ILE 7 1HG1 ILE 7 -6.519 -12.564 -9.378 57 2HG1 ILE 7 2HG1 ILE 7 -5.021 -13.183 -8.683 58 1HG2 ILE 7 1HG2 ILE 7 -8.624 -14.947 -8.151 59 2HG2 ILE 7 2HG2 ILE 7 -8.490 -13.376 -8.939 60 3HG2 ILE 7 3HG2 ILE 7 -8.846 -13.469 -7.215 61 1HD1 ILE 7 1HD1 ILE 7 -6.763 -14.360 -10.754 62 2HD1 ILE 7 2HD1 ILE 7 -6.236 -15.498 -9.514 63 3HD1 ILE 7 3HD1 ILE 7 -5.042 -14.607 -10.458 64 H VAL 8 H VAL 8 -5.214 -11.193 -7.893 65 HA VAL 8 HA VAL 8 -7.131 -8.985 -7.364 66 HB VAL 8 HB VAL 8 -4.704 -8.703 -6.955 67 1HG1 VAL 8 1HG1 VAL 8 -3.174 -9.524 -8.390 68 2HG1 VAL 8 2HG1 VAL 8 -3.837 -8.557 -9.707 69 3HG1 VAL 8 3HG1 VAL 8 -4.495 -10.158 -9.370 70 1HG2 VAL 8 1HG2 VAL 8 -5.732 -7.128 -9.338 71 2HG2 VAL 8 2HG2 VAL 8 -4.381 -6.649 -8.309 72 3HG2 VAL 8 3HG2 VAL 8 -6.011 -6.736 -7.641 73 H LYS 9 H LYS 9 -8.410 -8.130 -8.954 74 HA LYS 9 HA LYS 9 -7.876 -8.858 -11.795 75 1HB LYS 9 1HB LYS 9 -10.490 -9.113 -10.282 76 2HB LYS 9 2HB LYS 9 -10.292 -9.400 -12.009 77 1HG LYS 9 1HG LYS 9 -8.295 -10.960 -10.933 78 2HG LYS 9 2HG LYS 9 -9.574 -11.116 -9.731 79 1HD LYS 9 1HD LYS 9 -11.161 -11.796 -11.468 80 2HD LYS 9 2HD LYS 9 -9.932 -11.559 -12.710 81 1HE LYS 9 1HE LYS 9 -8.513 -13.280 -11.456 82 2HE LYS 9 2HE LYS 9 -9.968 -13.648 -10.511 83 1HZ LYS 9 1HZ LYS 9 -9.762 -15.025 -12.543 84 2HZ LYS 9 2HZ LYS 9 -9.843 -13.614 -13.484 85 3HZ LYS 9 3HZ LYS 9 -11.171 -14.077 -12.533 86 H LYS 10 H LYS 10 -9.130 -5.581 -12.634 87 HA LYS 10 HA LYS 10 -8.377 -6.634 -14.566 88 1HB LYS 10 1HB LYS 10 -6.662 -7.488 -12.289 89 2HB LYS 10 2HB LYS 10 -6.462 -8.385 -13.795 90 1HG LYS 10 1HG LYS 10 -6.338 -5.366 -13.511 91 2HG LYS 10 2HG LYS 10 -4.943 -6.430 -13.692 92 1HD LYS 10 1HD LYS 10 -6.359 -7.251 -15.819 93 2HD LYS 10 2HD LYS 10 -6.977 -5.604 -15.709 94 1HE LYS 10 1HE LYS 10 -5.087 -5.248 -17.035 95 2HE LYS 10 2HE LYS 10 -4.375 -5.041 -15.423 96 1HZ LYS 10 1HZ LYS 10 -3.199 -6.686 -16.886 97 2HZ LYS 10 2HZ LYS 10 -4.584 -7.665 -16.803 98 3HZ LYS 10 3HZ LYS 10 -3.711 -7.309 -15.391 99 H SER 11 H SER 11 -10.709 -7.628 -14.325 100 HA SER 11 HA SER 11 -10.450 -10.618 -14.328 101 1HB SER 11 1HB SER 11 -13.093 -10.150 -13.900 102 2HB SER 11 2HB SER 11 -11.927 -10.264 -12.586 103 HG SER 11 HG SER 11 -12.276 -8.253 -12.175 104 HA PRO 12 HA PRO 12 -11.998 -10.716 -18.431 105 1HB PRO 12 1HB PRO 12 -14.116 -12.509 -18.298 106 2HB PRO 12 2HB PRO 12 -12.410 -12.985 -18.357 107 1HG PRO 12 1HG PRO 12 -14.258 -12.816 -16.035 108 2HG PRO 12 2HG PRO 12 -12.965 -13.976 -16.367 109 1HD PRO 12 1HD PRO 12 -12.717 -11.930 -14.594 110 2HD PRO 12 2HD PRO 12 -11.344 -12.610 -15.491 111 H LEU 13 H LEU 13 -14.243 -9.998 -15.861 112 HA LEU 13 HA LEU 13 -15.720 -8.175 -17.682 113 1HB LEU 13 1HB LEU 13 -16.634 -10.749 -16.624 114 2HB LEU 13 2HB LEU 13 -17.717 -9.431 -16.178 115 HG LEU 13 HG LEU 13 -16.750 -9.485 -18.996 116 1HD1 LEU 13 1HD1 LEU 13 -19.082 -11.222 -18.229 117 2HD1 LEU 13 2HD1 LEU 13 -17.448 -11.883 -18.189 118 3HD1 LEU 13 3HD1 LEU 13 -18.109 -11.257 -19.699 119 1HD2 LEU 13 1HD2 LEU 13 -19.597 -9.180 -18.143 120 2HD2 LEU 13 2HD2 LEU 13 -18.697 -8.304 -19.382 121 3HD2 LEU 13 3HD2 LEU 13 -18.466 -7.909 -17.678 122 H GLY 14 H GLY 14 -13.884 -7.853 -15.345 123 1HA GLY 14 1HA GLY 14 -15.745 -6.260 -13.648 124 2HA GLY 14 2HA GLY 14 -14.595 -7.350 -12.873 125 H GLY 15 H GLY 15 -14.723 -4.419 -12.652 126 1HA GLY 15 1HA GLY 15 -12.619 -3.242 -14.239 127 2HA GLY 15 2HA GLY 15 -13.291 -2.557 -12.760 128 H TYR 16 H TYR 16 -11.792 -2.374 -11.166 129 HA TYR 16 HA TYR 16 -9.549 -4.364 -11.111 130 1HB TYR 16 1HB TYR 16 -9.806 -1.420 -10.526 131 2HB TYR 16 2HB TYR 16 -8.501 -2.346 -9.786 132 HD1 TYR 16 HD1 TYR 16 -6.579 -2.959 -11.030 133 HD2 TYR 16 HD2 TYR 16 -10.063 -1.487 -13.065 134 HE1 TYR 16 HE1 TYR 16 -5.295 -2.850 -13.149 135 HE2 TYR 16 HE2 TYR 16 -8.779 -1.378 -15.184 136 HH TYR 16 HH TYR 16 -6.060 -1.122 -15.671 137 H GLY 17 H GLY 17 -11.571 -5.454 -9.844 138 1HA GLY 17 1HA GLY 17 -11.444 -4.616 -6.977 139 2HA GLY 17 2HA GLY 17 -12.748 -5.574 -7.680 140 H VAL 18 H VAL 18 -12.021 -6.956 -5.673 141 HA VAL 18 HA VAL 18 -9.638 -8.626 -6.382 142 HB VAL 18 HB VAL 18 -11.273 -8.162 -3.868 143 1HG1 VAL 18 1HG1 VAL 18 -10.630 -10.519 -3.888 144 2HG1 VAL 18 2HG1 VAL 18 -9.604 -9.653 -2.745 145 3HG1 VAL 18 3HG1 VAL 18 -8.978 -10.092 -4.334 146 1HG2 VAL 18 1HG2 VAL 18 -9.646 -6.418 -4.470 147 2HG2 VAL 18 2HG2 VAL 18 -8.376 -7.635 -4.586 148 3HG2 VAL 18 3HG2 VAL 18 -9.122 -7.285 -3.026 149 H PHE 19 H PHE 19 -9.873 -10.958 -6.364 150 HA PHE 19 HA PHE 19 -12.683 -11.869 -6.891 151 1HB PHE 19 1HB PHE 19 -10.077 -12.199 -8.205 152 2HB PHE 19 2HB PHE 19 -10.911 -13.732 -7.960 153 HD1 PHE 19 HD1 PHE 19 -12.198 -14.409 -9.771 154 HD2 PHE 19 HD2 PHE 19 -11.915 -10.221 -8.856 155 HE1 PHE 19 HE1 PHE 19 -13.713 -13.892 -11.665 156 HE2 PHE 19 HE2 PHE 19 -13.429 -9.705 -10.751 157 HZ PHE 19 HZ PHE 19 -14.328 -11.541 -12.155 158 H ALA 20 H ALA 20 -13.470 -13.348 -5.452 159 HA ALA 20 HA ALA 20 -11.657 -14.465 -3.403 160 1HB ALA 20 1HB ALA 20 -13.636 -13.695 -2.450 161 2HB ALA 20 2HB ALA 20 -14.090 -15.372 -2.745 162 3HB ALA 20 3HB ALA 20 -14.598 -14.111 -3.868 163 H ARG 21 H ARG 21 -10.496 -16.085 -4.601 164 HA ARG 21 HA ARG 21 -11.644 -18.052 -6.322 165 1HB ARG 21 1HB ARG 21 -9.158 -17.341 -5.417 166 2HB ARG 21 2HB ARG 21 -9.415 -18.839 -4.524 167 1HG ARG 21 1HG ARG 21 -9.526 -20.131 -6.455 168 2HG ARG 21 2HG ARG 21 -10.053 -18.775 -7.453 169 1HD ARG 21 1HD ARG 21 -7.858 -17.873 -7.585 170 2HD ARG 21 2HD ARG 21 -7.290 -18.845 -6.213 171 HE ARG 21 HE ARG 21 -8.309 -20.569 -8.278 172 1HH1 ARG 21 1HH1 ARG 21 -5.609 -18.514 -7.499 173 2HH1 ARG 21 2HH1 ARG 21 -4.502 -19.410 -8.480 174 1HH2 ARG 21 1HH2 ARG 21 -6.854 -21.716 -9.544 175 2HH2 ARG 21 2HH2 ARG 21 -5.199 -21.210 -9.630 176 H LYS 22 H LYS 22 -11.691 -17.659 -2.865 177 HA LYS 22 HA LYS 22 -12.530 -20.431 -2.328 178 1HB LYS 22 1HB LYS 22 -11.425 -18.170 -0.966 179 2HB LYS 22 2HB LYS 22 -12.856 -18.708 -0.101 180 1HG LYS 22 1HG LYS 22 -11.404 -20.205 0.838 181 2HG LYS 22 2HG LYS 22 -11.642 -21.092 -0.669 182 1HD LYS 22 1HD LYS 22 -9.580 -20.511 -1.491 183 2HD LYS 22 2HD LYS 22 -9.599 -18.931 -0.710 184 1HE LYS 22 1HE LYS 22 -8.573 -19.726 1.174 185 2HE LYS 22 2HE LYS 22 -9.510 -21.232 1.156 186 1HZ LYS 22 1HZ LYS 22 -8.190 -21.962 -0.754 187 2HZ LYS 22 2HZ LYS 22 -7.198 -21.668 0.593 188 3HZ LYS 22 3HZ LYS 22 -7.266 -20.539 -0.674 189 H SER 23 H SER 23 -15.987 -19.567 -1.351 190 HA SER 23 HA SER 23 -13.576 -21.218 -0.774 191 1HB SER 23 1HB SER 23 -15.774 -22.221 -1.447 192 2HB SER 23 2HB SER 23 -15.258 -22.753 0.155 193 HG SER 23 HG SER 23 -16.759 -21.527 1.078 194 H PHE 24 H PHE 24 -15.518 -18.695 0.596 195 HA PHE 24 HA PHE 24 -14.033 -18.986 3.174 196 1HB PHE 24 1HB PHE 24 -15.263 -16.664 1.662 197 2HB PHE 24 2HB PHE 24 -14.646 -16.504 3.306 198 HD1 PHE 24 HD1 PHE 24 -13.745 -15.560 0.257 199 HD2 PHE 24 HD2 PHE 24 -12.264 -18.197 3.308 200 HE1 PHE 24 HE1 PHE 24 -11.445 -15.299 -0.633 201 HE2 PHE 24 HE2 PHE 24 -9.965 -17.936 2.417 202 HZ PHE 24 HZ PHE 24 -9.555 -16.487 0.447 203 H GLU 25 H GLU 25 -15.276 -18.271 5.138 204 HA GLU 25 HA GLU 25 -18.156 -19.065 4.913 205 1HB GLU 25 1HB GLU 25 -15.919 -19.669 6.706 206 2HB GLU 25 2HB GLU 25 -17.362 -19.184 7.585 207 1HG GLU 25 1HG GLU 25 -18.638 -20.921 6.628 208 2HG GLU 25 2HG GLU 25 -17.454 -21.226 5.364 209 H LYS 26 H LYS 26 -19.057 -18.107 7.347 210 HA LYS 26 HA LYS 26 -19.203 -15.214 6.823 211 1HB LYS 26 1HB LYS 26 -20.983 -17.070 7.607 212 2HB LYS 26 2HB LYS 26 -20.441 -16.546 9.199 213 1HG LYS 26 1HG LYS 26 -21.044 -14.259 8.737 214 2HG LYS 26 2HG LYS 26 -21.353 -14.629 7.041 215 1HD LYS 26 1HD LYS 26 -23.328 -15.801 7.523 216 2HD LYS 26 2HD LYS 26 -22.866 -16.076 9.203 217 1HE LYS 26 1HE LYS 26 -22.928 -13.255 8.829 218 2HE LYS 26 2HE LYS 26 -24.418 -13.907 8.123 219 1HZ LYS 26 1HZ LYS 26 -24.823 -13.670 10.433 220 2HZ LYS 26 2HZ LYS 26 -23.335 -14.376 10.849 221 3HZ LYS 26 3HZ LYS 26 -24.570 -15.329 10.175 222 H GLY 27 H GLY 27 -17.181 -14.337 7.472 223 1HA GLY 27 1HA GLY 27 -16.243 -13.106 9.396 224 2HA GLY 27 2HA GLY 27 -16.656 -14.489 10.409 225 H GLU 28 H GLU 28 -14.912 -14.158 7.295 226 HA GLU 28 HA GLU 28 -12.678 -15.733 8.535 227 1HB GLU 28 1HB GLU 28 -14.202 -15.879 5.991 228 2HB GLU 28 2HB GLU 28 -12.461 -16.114 5.835 229 1HG GLU 28 1HG GLU 28 -14.252 -17.624 7.763 230 2HG GLU 28 2HG GLU 28 -13.654 -18.259 6.230 231 H LEU 29 H LEU 29 -10.819 -14.555 8.700 232 HA LEU 29 HA LEU 29 -10.510 -11.927 7.550 233 1HB LEU 29 1HB LEU 29 -9.459 -13.150 9.640 234 2HB LEU 29 2HB LEU 29 -8.239 -13.677 8.482 235 HG LEU 29 HG LEU 29 -7.544 -11.583 9.575 236 1HD1 LEU 29 1HD1 LEU 29 -6.833 -10.507 7.626 237 2HD1 LEU 29 2HD1 LEU 29 -8.366 -10.782 6.798 238 3HD1 LEU 29 3HD1 LEU 29 -7.232 -12.115 7.020 239 1HD2 LEU 29 1HD2 LEU 29 -9.409 -9.782 8.324 240 2HD2 LEU 29 2HD2 LEU 29 -9.039 -9.967 10.039 241 3HD2 LEU 29 3HD2 LEU 29 -10.296 -10.956 9.296 242 H VAL 30 H VAL 30 -10.647 -12.037 5.265 243 HA VAL 30 HA VAL 30 -9.292 -13.998 3.649 244 HB VAL 30 HB VAL 30 -10.292 -11.184 3.065 245 1HG1 VAL 30 1HG1 VAL 30 -8.701 -12.713 1.447 246 2HG1 VAL 30 2HG1 VAL 30 -9.884 -11.547 0.852 247 3HG1 VAL 30 3HG1 VAL 30 -10.306 -13.257 0.957 248 1HG2 VAL 30 1HG2 VAL 30 -11.754 -13.692 2.331 249 2HG2 VAL 30 2HG2 VAL 30 -12.396 -12.094 2.714 250 3HG2 VAL 30 3HG2 VAL 30 -11.822 -13.147 4.007 251 H GLU 31 H GLU 31 -8.430 -10.702 4.701 252 HA GLU 31 HA GLU 31 -5.585 -11.271 4.448 253 1HB GLU 31 1HB GLU 31 -6.855 -10.701 2.101 254 2HB GLU 31 2HB GLU 31 -6.419 -9.074 2.624 255 1HG GLU 31 1HG GLU 31 -4.133 -10.598 3.136 256 2HG GLU 31 2HG GLU 31 -4.713 -11.195 1.582 257 H GLU 32 H GLU 32 -4.290 -9.293 5.023 258 HA GLU 32 HA GLU 32 -5.792 -7.012 6.150 259 1HB GLU 32 1HB GLU 32 -4.906 -7.453 8.422 260 2HB GLU 32 2HB GLU 32 -5.878 -8.814 7.862 261 1HG GLU 32 1HG GLU 32 -3.632 -9.784 6.994 262 2HG GLU 32 2HG GLU 32 -2.876 -8.602 8.062 263 H CYS 33 H CYS 33 -4.483 -5.173 6.250 264 HA CYS 33 HA CYS 33 -1.534 -5.507 5.976 265 1HB CYS 33 1HB CYS 33 -3.466 -4.159 4.076 266 2HB CYS 33 2HB CYS 33 -1.756 -3.726 4.102 267 HG CYS 33 HG CYS 33 -1.337 -5.743 2.740 268 H LEU 34 H LEU 34 -0.657 -3.022 5.815 269 HA LEU 34 HA LEU 34 -1.732 -1.709 8.251 270 1HB LEU 34 1HB LEU 34 0.808 -2.152 7.002 271 2HB LEU 34 2HB LEU 34 0.553 -0.410 7.097 272 HG LEU 34 HG LEU 34 0.014 -0.637 9.508 273 1HD1 LEU 34 1HD1 LEU 34 1.080 -3.425 9.521 274 2HD1 LEU 34 2HD1 LEU 34 -0.587 -3.202 8.991 275 3HD1 LEU 34 3HD1 LEU 34 -0.094 -2.667 10.597 276 1HD2 LEU 34 1HD2 LEU 34 2.288 -1.075 10.265 277 2HD2 LEU 34 2HD2 LEU 34 2.356 -0.221 8.723 278 3HD2 LEU 34 3HD2 LEU 34 2.646 -1.960 8.782 279 H CYS 35 H CYS 35 -1.686 0.786 8.143 280 HA CYS 35 HA CYS 35 -2.399 1.868 5.465 281 1HB CYS 35 1HB CYS 35 -4.150 1.724 7.936 282 2HB CYS 35 2HB CYS 35 -4.475 2.855 6.623 283 HG CYS 35 HG CYS 35 -4.215 0.253 5.296 284 H ILE 36 H ILE 36 -3.015 4.374 5.939 285 HA ILE 36 HA ILE 36 -0.943 5.402 7.859 286 HB ILE 36 HB ILE 36 -1.853 6.527 5.185 287 1HG1 ILE 36 1HG1 ILE 36 0.689 5.047 5.930 288 2HG1 ILE 36 2HG1 ILE 36 -0.624 4.392 4.952 289 1HG2 ILE 36 1HG2 ILE 36 -0.937 8.404 6.088 290 2HG2 ILE 36 2HG2 ILE 36 0.602 7.605 5.764 291 3HG2 ILE 36 3HG2 ILE 36 -0.125 7.502 7.368 292 1HD1 ILE 36 1HD1 ILE 36 0.445 7.011 4.064 293 2HD1 ILE 36 2HD1 ILE 36 -0.037 5.610 3.110 294 3HD1 ILE 36 3HD1 ILE 36 1.543 5.642 3.892 295 H VAL 37 H VAL 37 -1.577 7.154 9.159 296 HA VAL 37 HA VAL 37 -4.446 7.996 8.896 297 HB VAL 37 HB VAL 37 -2.658 7.830 11.352 298 1HG1 VAL 37 1HG1 VAL 37 -4.706 9.448 11.223 299 2HG1 VAL 37 2HG1 VAL 37 -4.555 8.385 12.623 300 3HG1 VAL 37 3HG1 VAL 37 -5.666 7.970 11.316 301 1HG2 VAL 37 1HG2 VAL 37 -4.318 5.848 9.933 302 2HG2 VAL 37 2HG2 VAL 37 -4.638 5.958 11.664 303 3HG2 VAL 37 3HG2 VAL 37 -3.010 5.597 11.089 304 H ARG 38 H ARG 38 -4.260 9.962 7.817 305 HA ARG 38 HA ARG 38 -2.481 12.017 9.088 306 1HB ARG 38 1HB ARG 38 -3.258 11.725 6.166 307 2HB ARG 38 2HB ARG 38 -2.102 12.877 6.827 308 1HG ARG 38 1HG ARG 38 -1.754 9.887 7.138 309 2HG ARG 38 2HG ARG 38 -1.112 10.772 5.754 310 1HD ARG 38 1HD ARG 38 -0.173 12.352 7.734 311 2HD ARG 38 2HD ARG 38 -0.221 10.804 8.598 312 HE ARG 38 HE ARG 38 0.859 10.307 6.022 313 1HH1 ARG 38 1HH1 ARG 38 1.656 12.057 8.924 314 2HH1 ARG 38 2HH1 ARG 38 3.361 11.906 8.679 315 1HH2 ARG 38 1HH2 ARG 38 3.077 10.125 5.725 316 2HH2 ARG 38 2HH2 ARG 38 4.162 10.821 6.882 317 H HIS 39 H HIS 39 -3.339 14.249 8.864 318 HA HIS 39 HA HIS 39 -6.233 14.343 9.276 319 1HB HIS 39 1HB HIS 39 -3.870 16.190 9.381 320 2HB HIS 39 2HB HIS 39 -5.481 16.904 9.309 321 HD1 HIS 39 HD1 HIS 39 -4.617 17.639 11.863 322 HD2 HIS 39 HD2 HIS 39 -5.727 13.664 11.267 323 HE1 HIS 39 HE1 HIS 39 -5.069 16.669 14.158 324 H ASN 40 H ASN 40 -7.440 16.209 8.076 325 HA ASN 40 HA ASN 40 -7.558 15.603 5.278 326 1HB ASN 40 1HB ASN 40 -8.576 17.986 6.874 327 2HB ASN 40 2HB ASN 40 -9.190 17.466 5.304 328 1HD2 ASN 40 1HD2 ASN 40 -10.243 17.440 8.322 329 2HD2 ASN 40 2HD2 ASN 40 -10.954 15.902 8.429 330 H ASP 41 H ASP 41 -7.810 18.678 4.684 331 HA ASP 41 HA ASP 41 -6.445 20.387 3.816 332 1HB ASP 41 1HB ASP 41 -5.326 19.672 6.184 333 2HB ASP 41 2HB ASP 41 -4.002 19.259 5.096 334 H ASP 42 H ASP 42 -3.579 20.010 3.183 335 HA ASP 42 HA ASP 42 -3.621 19.239 0.532 336 1HB ASP 42 1HB ASP 42 -1.451 18.787 2.613 337 2HB ASP 42 2HB ASP 42 -1.178 18.835 0.871 338 H TRP 43 H TRP 43 -3.268 17.071 3.329 339 HA TRP 43 HA TRP 43 -2.561 14.679 2.005 340 1HB TRP 43 1HB TRP 43 -2.589 14.907 4.415 341 2HB TRP 43 2HB TRP 43 -4.307 15.298 4.413 342 HD1 TRP 43 HD1 TRP 43 -5.811 13.361 5.005 343 HE1 TRP 43 HE1 TRP 43 -5.679 10.792 4.861 344 HE3 TRP 43 HE3 TRP 43 -1.253 12.838 2.761 345 HZ2 TRP 43 HZ2 TRP 43 -3.881 8.784 3.922 346 HZ3 TRP 43 HZ3 TRP 43 -0.357 10.583 2.252 347 HH2 TRP 43 HH2 TRP 43 -1.664 8.557 2.829 348 H GLY 44 H GLY 44 -5.892 15.661 2.939 349 1HA GLY 44 1HA GLY 44 -7.234 13.614 1.532 350 2HA GLY 44 2HA GLY 44 -7.948 15.178 1.912 351 H THR 45 H THR 45 -5.909 16.666 0.371 352 HA THR 45 HA THR 45 -7.247 16.586 -2.204 353 HB THR 45 HB THR 45 -4.729 17.980 -1.224 354 HG1 THR 45 HG1 THR 45 -6.048 19.380 -0.390 355 1HG2 THR 45 1HG2 THR 45 -4.548 18.913 -3.273 356 2HG2 THR 45 2HG2 THR 45 -6.268 19.301 -3.311 357 3HG2 THR 45 3HG2 THR 45 -5.712 17.709 -3.836 358 H ALA 46 H ALA 46 -3.719 16.363 -1.613 359 HA ALA 46 HA ALA 46 -2.953 15.237 -4.037 360 1HB ALA 46 1HB ALA 46 -1.161 15.746 -2.680 361 2HB ALA 46 2HB ALA 46 -1.252 14.026 -2.297 362 3HB ALA 46 3HB ALA 46 -1.990 15.212 -1.218 363 H LEU 47 H LEU 47 -4.084 13.461 -1.147 364 HA LEU 47 HA LEU 47 -3.963 10.906 -2.638 365 1HB LEU 47 1HB LEU 47 -4.382 11.834 0.191 366 2HB LEU 47 2HB LEU 47 -4.888 10.205 -0.256 367 HG LEU 47 HG LEU 47 -2.566 10.218 0.599 368 1HD1 LEU 47 1HD1 LEU 47 -2.333 9.763 -2.360 369 2HD1 LEU 47 2HD1 LEU 47 -3.449 8.774 -1.419 370 3HD1 LEU 47 3HD1 LEU 47 -1.729 8.774 -1.031 371 1HD2 LEU 47 1HD2 LEU 47 -1.783 11.789 -1.851 372 2HD2 LEU 47 2HD2 LEU 47 -0.847 11.491 -0.386 373 3HD2 LEU 47 3HD2 LEU 47 -2.207 12.614 -0.350 374 H GLU 48 H GLU 48 -6.091 13.252 -2.974 375 HA GLU 48 HA GLU 48 -8.620 12.260 -2.136 376 1HB GLU 48 1HB GLU 48 -9.479 13.790 -3.881 377 2HB GLU 48 2HB GLU 48 -8.152 14.538 -2.997 378 1HG GLU 48 1HG GLU 48 -7.173 14.914 -4.994 379 2HG GLU 48 2HG GLU 48 -6.904 13.178 -5.102 380 H ASP 49 H ASP 49 -8.501 9.926 -2.533 381 HA ASP 49 HA ASP 49 -9.751 9.079 -4.975 382 1HB ASP 49 1HB ASP 49 -7.018 9.607 -5.199 383 2HB ASP 49 2HB ASP 49 -7.081 7.858 -4.986 384 H TYR 50 H TYR 50 -7.135 7.564 -3.057 385 HA TYR 50 HA TYR 50 -9.103 5.453 -2.232 386 1HB TYR 50 1HB TYR 50 -6.072 5.341 -2.478 387 2HB TYR 50 2HB TYR 50 -7.149 3.973 -2.207 388 HD1 TYR 50 HD1 TYR 50 -5.155 5.135 -4.620 389 HD2 TYR 50 HD2 TYR 50 -9.350 4.409 -4.047 390 HE1 TYR 50 HE1 TYR 50 -5.448 4.895 -7.071 391 HE2 TYR 50 HE2 TYR 50 -9.643 4.169 -6.498 392 HH TYR 50 HH TYR 50 -7.809 3.449 -8.507 393 H LEU 51 H LEU 51 -9.367 7.458 -0.546 394 HA LEU 51 HA LEU 51 -7.417 7.039 1.688 395 1HB LEU 51 1HB LEU 51 -9.205 9.301 0.777 396 2HB LEU 51 2HB LEU 51 -8.539 9.281 2.408 397 HG LEU 51 HG LEU 51 -6.938 9.174 -0.167 398 1HD1 LEU 51 1HD1 LEU 51 -6.080 11.368 1.157 399 2HD1 LEU 51 2HD1 LEU 51 -7.755 11.333 1.708 400 3HD1 LEU 51 3HD1 LEU 51 -7.396 11.418 -0.017 401 1HD2 LEU 51 1HD2 LEU 51 -5.683 7.941 1.391 402 2HD2 LEU 51 2HD2 LEU 51 -6.203 8.942 2.745 403 3HD2 LEU 51 3HD2 LEU 51 -5.047 9.575 1.573 404 H PHE 52 H PHE 52 -8.208 5.701 3.247 405 HA PHE 52 HA PHE 52 -11.124 5.394 3.653 406 1HB PHE 52 1HB PHE 52 -8.573 4.049 4.405 407 2HB PHE 52 2HB PHE 52 -9.888 3.902 5.570 408 HD1 PHE 52 HD1 PHE 52 -11.617 2.346 5.222 409 HD2 PHE 52 HD2 PHE 52 -9.110 3.505 1.933 410 HE1 PHE 52 HE1 PHE 52 -12.686 0.619 3.798 411 HE2 PHE 52 HE2 PHE 52 -10.179 1.779 0.509 412 HZ PHE 52 HZ PHE 52 -11.967 0.335 1.442 413 H SER 53 H SER 53 -11.702 7.456 4.541 414 HA SER 53 HA SER 53 -10.172 8.453 6.868 415 1HB SER 53 1HB SER 53 -11.479 10.474 6.459 416 2HB SER 53 2HB SER 53 -10.900 9.862 4.909 417 HG SER 53 HG SER 53 -13.471 9.546 6.051 418 H ARG 54 H ARG 54 -11.051 8.696 8.928 419 HA ARG 54 HA ARG 54 -13.651 7.286 9.417 420 1HB ARG 54 1HB ARG 54 -11.173 6.772 10.414 421 2HB ARG 54 2HB ARG 54 -11.748 7.922 11.621 422 1HG ARG 54 1HG ARG 54 -13.459 6.528 12.332 423 2HG ARG 54 2HG ARG 54 -13.587 5.718 10.771 424 1HD ARG 54 1HD ARG 54 -12.524 4.055 12.027 425 2HD ARG 54 2HD ARG 54 -11.110 4.917 11.393 426 HE ARG 54 HE ARG 54 -11.770 6.327 13.688 427 1HH1 ARG 54 1HH1 ARG 54 -11.111 2.986 12.961 428 2HH1 ARG 54 2HH1 ARG 54 -10.471 2.657 14.534 429 1HH2 ARG 54 1HH2 ARG 54 -10.935 5.873 15.722 430 2HH2 ARG 54 2HH2 ARG 54 -10.371 4.276 16.086 431 H LYS 55 H LYS 55 -14.491 8.274 11.739 432 HA LYS 55 HA LYS 55 -15.157 11.045 11.138 433 1HB LYS 55 1HB LYS 55 -16.232 8.868 12.537 434 2HB LYS 55 2HB LYS 55 -15.840 10.031 13.803 435 1HG LYS 55 1HG LYS 55 -17.329 10.834 11.298 436 2HG LYS 55 2HG LYS 55 -18.167 10.242 12.733 437 1HD LYS 55 1HD LYS 55 -16.218 12.224 13.502 438 2HD LYS 55 2HD LYS 55 -17.257 12.879 12.237 439 1HE LYS 55 1HE LYS 55 -18.478 13.358 14.203 440 2HE LYS 55 2HE LYS 55 -19.200 11.825 13.680 441 1HZ LYS 55 1HZ LYS 55 -17.111 12.272 15.736 442 2HZ LYS 55 2HZ LYS 55 -17.345 10.749 15.022 443 3HZ LYS 55 3HZ LYS 55 -18.600 11.472 15.909 444 H ASN 56 H ASN 56 -12.764 11.653 11.263 445 HA ASN 56 HA ASN 56 -11.439 11.763 13.834 446 1HB ASN 56 1HB ASN 56 -11.752 14.446 13.567 447 2HB ASN 56 2HB ASN 56 -13.303 13.895 12.936 448 1HD2 ASN 56 1HD2 ASN 56 -11.218 12.617 15.593 449 2HD2 ASN 56 2HD2 ASN 56 -12.434 12.680 16.776 450 H MET 57 H MET 57 -10.996 11.206 10.880 451 HA MET 57 HA MET 57 -9.283 13.366 9.919 452 1HB MET 57 1HB MET 57 -7.273 11.920 10.212 453 2HB MET 57 2HB MET 57 -7.946 12.428 11.735 454 1HG MET 57 1HG MET 57 -8.965 9.882 10.619 455 2HG MET 57 2HG MET 57 -7.304 9.892 11.201 456 1HE MET 57 1HE MET 57 -6.764 11.461 13.179 457 2HE MET 57 2HE MET 57 -6.664 9.839 13.866 458 3HE MET 57 3HE MET 57 -7.474 11.127 14.759 459 H SER 58 H SER 58 -7.624 12.010 8.268 460 HA SER 58 HA SER 58 -9.360 10.174 6.660 461 1HB SER 58 1HB SER 58 -8.035 11.427 4.731 462 2HB SER 58 2HB SER 58 -9.466 12.169 5.445 463 HG SER 58 HG SER 58 -8.241 13.716 6.102 464 H ALA 59 H ALA 59 -8.308 8.236 6.363 465 HA ALA 59 HA ALA 59 -5.332 8.197 6.681 466 1HB ALA 59 1HB ALA 59 -5.894 6.551 8.136 467 2HB ALA 59 2HB ALA 59 -6.444 5.593 6.762 468 3HB ALA 59 3HB ALA 59 -7.581 6.627 7.626 469 H MET 60 H MET 60 -4.247 6.418 5.365 470 HA MET 60 HA MET 60 -5.299 6.464 2.568 471 1HB MET 60 1HB MET 60 -2.876 7.150 3.665 472 2HB MET 60 2HB MET 60 -2.566 5.483 3.189 473 1HG MET 60 1HG MET 60 -3.806 7.499 1.307 474 2HG MET 60 2HG MET 60 -2.064 7.269 1.428 475 1HE MET 60 1HE MET 60 -4.168 6.868 -1.088 476 2HE MET 60 2HE MET 60 -3.299 5.577 -1.918 477 3HE MET 60 3HE MET 60 -2.409 6.921 -1.201 478 H ALA 61 H ALA 61 -5.419 4.480 1.379 479 HA ALA 61 HA ALA 61 -5.806 2.077 3.038 480 1HB ALA 61 1HB ALA 61 -6.985 3.139 0.813 481 2HB ALA 61 2HB ALA 61 -7.104 1.434 1.247 482 3HB ALA 61 3HB ALA 61 -5.904 1.962 0.068 483 H LEU 62 H LEU 62 -3.554 1.729 3.677 484 HA LEU 62 HA LEU 62 -1.492 0.609 3.461 485 1HB LEU 62 1HB LEU 62 -0.950 1.473 0.747 486 2HB LEU 62 2HB LEU 62 -1.716 2.777 1.654 487 HG LEU 62 HG LEU 62 -0.037 2.307 3.511 488 1HD1 LEU 62 1HD1 LEU 62 1.882 1.133 1.647 489 2HD1 LEU 62 2HD1 LEU 62 0.508 0.069 1.945 490 3HD1 LEU 62 3HD1 LEU 62 1.484 0.648 3.295 491 1HD2 LEU 62 1HD2 LEU 62 0.125 4.136 1.721 492 2HD2 LEU 62 2HD2 LEU 62 1.273 3.080 0.898 493 3HD2 LEU 62 3HD2 LEU 62 1.634 3.684 2.514 494 H GLY 63 H GLY 63 -3.063 -1.369 3.219 495 1HA GLY 63 1HA GLY 63 -1.998 -3.056 1.141 496 2HA GLY 63 2HA GLY 63 -3.291 -3.497 2.254 497 H PHE 64 H PHE 64 -4.516 -4.469 0.559 498 HA PHE 64 HA PHE 64 -5.307 -2.897 -1.792 499 1HB PHE 64 1HB PHE 64 -5.680 -5.647 -0.662 500 2HB PHE 64 2HB PHE 64 -6.829 -5.101 -1.883 501 HD1 PHE 64 HD1 PHE 64 -3.176 -4.390 -1.466 502 HD2 PHE 64 HD2 PHE 64 -6.242 -6.161 -3.898 503 HE1 PHE 64 HE1 PHE 64 -1.504 -4.848 -3.240 504 HE2 PHE 64 HE2 PHE 64 -4.570 -6.619 -5.672 505 HZ PHE 64 HZ PHE 64 -2.202 -5.963 -5.343 506 H GLY 65 H GLY 65 -6.124 -1.434 0.402 507 1HA GLY 65 1HA GLY 65 -8.906 -2.123 1.059 508 2HA GLY 65 2HA GLY 65 -8.026 -0.707 1.635 509 H ALA 66 H ALA 66 -7.191 -0.157 -1.242 510 HA ALA 66 HA ALA 66 -9.495 1.529 -1.914 511 1HB ALA 66 1HB ALA 66 -7.039 1.079 -3.606 512 2HB ALA 66 2HB ALA 66 -6.900 1.933 -2.069 513 3HB ALA 66 3HB ALA 66 -7.937 2.574 -3.343 514 H ILE 67 H ILE 67 -7.687 -1.082 -3.567 515 HA ILE 67 HA ILE 67 -9.089 -1.352 -5.920 516 HB ILE 67 HB ILE 67 -8.587 -3.850 -5.639 517 1HG1 ILE 67 1HG1 ILE 67 -7.059 -4.303 -3.640 518 2HG1 ILE 67 2HG1 ILE 67 -7.712 -2.837 -2.923 519 1HG2 ILE 67 1HG2 ILE 67 -7.004 -2.177 -6.593 520 2HG2 ILE 67 2HG2 ILE 67 -6.179 -3.488 -5.749 521 3HG2 ILE 67 3HG2 ILE 67 -6.352 -1.912 -4.976 522 1HD1 ILE 67 1HD1 ILE 67 -9.819 -4.552 -3.971 523 2HD1 ILE 67 2HD1 ILE 67 -9.633 -3.866 -2.357 524 3HD1 ILE 67 3HD1 ILE 67 -8.831 -5.380 -2.767 525 H PHE 68 H PHE 68 -10.361 -2.097 -2.731 526 HA PHE 68 HA PHE 68 -12.497 -3.827 -3.492 527 1HB PHE 68 1HB PHE 68 -12.097 -1.782 -1.287 528 2HB PHE 68 2HB PHE 68 -13.502 -2.844 -1.345 529 HD1 PHE 68 HD1 PHE 68 -12.361 -5.368 -2.349 530 HD2 PHE 68 HD2 PHE 68 -10.782 -2.565 0.499 531 HE1 PHE 68 HE1 PHE 68 -11.035 -7.180 -1.301 532 HE2 PHE 68 HE2 PHE 68 -9.457 -4.380 1.547 533 HZ PHE 68 HZ PHE 68 -9.583 -6.687 0.648 534 H ASN 69 H ASN 69 -13.901 -3.272 -5.125 535 HA ASN 69 HA ASN 69 -14.648 -0.486 -5.644 536 1HB ASN 69 1HB ASN 69 -15.453 -3.195 -6.759 537 2HB ASN 69 2HB ASN 69 -16.044 -1.668 -7.415 538 1HD2 ASN 69 1HD2 ASN 69 -13.951 -3.900 -8.316 539 2HD2 ASN 69 2HD2 ASN 69 -12.661 -2.955 -8.890 540 H HIS 70 H HIS 70 -17.221 -0.342 -6.171 541 HA HIS 70 HA HIS 70 -18.575 -0.985 -3.586 542 1HB HIS 70 1HB HIS 70 -18.283 1.365 -4.825 543 2HB HIS 70 2HB HIS 70 -19.700 0.808 -5.714 544 HD1 HIS 70 HD1 HIS 70 -20.256 3.161 -3.994 545 HD2 HIS 70 HD2 HIS 70 -20.395 -0.713 -2.459 546 HE1 HIS 70 HE1 HIS 70 -21.694 3.266 -1.912 547 H SER 71 H SER 71 -19.911 -2.753 -3.660 548 HA SER 71 HA SER 71 -21.252 -3.389 -6.270 549 1HB SER 71 1HB SER 71 -19.467 -4.965 -5.549 550 2HB SER 71 2HB SER 71 -20.318 -5.217 -4.025 551 HG SER 71 HG SER 71 -21.495 -6.618 -5.013 552 H LYS 72 H LYS 72 -23.401 -4.383 -6.052 553 HA LYS 72 HA LYS 72 -25.036 -3.115 -4.014 554 1HB LYS 72 1HB LYS 72 -25.682 -3.623 -6.390 555 2HB LYS 72 2HB LYS 72 -25.660 -5.341 -5.991 556 1HG LYS 72 1HG LYS 72 -27.835 -5.078 -5.416 557 2HG LYS 72 2HG LYS 72 -27.231 -4.247 -3.982 558 1HD LYS 72 1HD LYS 72 -27.597 -2.128 -4.895 559 2HD LYS 72 2HD LYS 72 -27.547 -2.725 -6.554 560 1HE LYS 72 1HE LYS 72 -29.710 -3.895 -4.910 561 2HE LYS 72 2HE LYS 72 -29.871 -2.156 -5.221 562 1HZ LYS 72 1HZ LYS 72 -30.745 -3.719 -7.009 563 2HZ LYS 72 2HZ LYS 72 -29.120 -4.081 -7.348 564 3HZ LYS 72 3HZ LYS 72 -29.691 -2.491 -7.525 565 H ASP 73 H ASP 73 -23.375 -6.163 -4.262 566 HA ASP 73 HA ASP 73 -24.556 -6.980 -1.645 567 1HB ASP 73 1HB ASP 73 -25.676 -8.032 -3.703 568 2HB ASP 73 2HB ASP 73 -24.144 -8.859 -3.989 569 HA PRO 74 HA PRO 74 -19.884 -7.377 -2.090 570 1HB PRO 74 1HB PRO 74 -19.900 -5.890 0.468 571 2HB PRO 74 2HB PRO 74 -18.970 -5.568 -1.005 572 1HG PRO 74 1HG PRO 74 -21.033 -4.024 -0.197 573 2HG PRO 74 2HG PRO 74 -20.600 -4.246 -1.898 574 1HD PRO 74 1HD PRO 74 -22.847 -5.428 -0.345 575 2HD PRO 74 2HD PRO 74 -22.776 -4.949 -2.054 576 H ASN 75 H ASN 75 -19.541 -9.470 -1.433 577 HA ASN 75 HA ASN 75 -20.727 -10.463 1.090 578 1HB ASN 75 1HB ASN 75 -19.061 -11.759 -1.102 579 2HB ASN 75 2HB ASN 75 -19.876 -12.630 0.196 580 1HD2 ASN 75 1HD2 ASN 75 -20.455 -12.928 -2.680 581 2HD2 ASN 75 2HD2 ASN 75 -22.068 -12.450 -2.905 582 H ALA 76 H ALA 76 -18.335 -8.512 0.967 583 HA ALA 76 HA ALA 76 -16.756 -9.889 3.040 584 1HB ALA 76 1HB ALA 76 -16.042 -10.001 0.302 585 2HB ALA 76 2HB ALA 76 -15.040 -10.472 1.675 586 3HB ALA 76 3HB ALA 76 -14.943 -8.831 1.034 587 H ARG 77 H ARG 77 -15.759 -8.379 4.409 588 HA ARG 77 HA ARG 77 -15.791 -5.512 3.541 589 1HB ARG 77 1HB ARG 77 -17.551 -6.762 5.331 590 2HB ARG 77 2HB ARG 77 -16.390 -5.936 6.368 591 1HG ARG 77 1HG ARG 77 -16.784 -3.831 5.181 592 2HG ARG 77 2HG ARG 77 -17.881 -4.643 4.064 593 1HD ARG 77 1HD ARG 77 -19.206 -3.519 5.791 594 2HD ARG 77 2HD ARG 77 -19.315 -5.270 6.054 595 HE ARG 77 HE ARG 77 -17.045 -4.415 7.476 596 1HH1 ARG 77 1HH1 ARG 77 -20.466 -3.766 7.473 597 2HH1 ARG 77 2HH1 ARG 77 -20.509 -3.397 9.162 598 1HH2 ARG 77 1HH2 ARG 77 -17.128 -3.932 9.668 599 2HH2 ARG 77 2HH2 ARG 77 -18.636 -3.490 10.397 600 H HIS 78 H HIS 78 -14.841 -4.492 6.007 601 HA HIS 78 HA HIS 78 -12.274 -5.942 6.485 602 1HB HIS 78 1HB HIS 78 -11.107 -3.748 6.121 603 2HB HIS 78 2HB HIS 78 -11.923 -4.325 4.668 604 HD1 HIS 78 HD1 HIS 78 -14.324 -3.217 4.171 605 HD2 HIS 78 HD2 HIS 78 -12.011 -1.273 7.044 606 HE1 HIS 78 HE1 HIS 78 -15.340 -0.917 4.471 607 H GLU 79 H GLU 79 -11.071 -4.896 8.362 608 HA GLU 79 HA GLU 79 -12.968 -3.642 10.318 609 1HB GLU 79 1HB GLU 79 -12.271 -6.197 10.455 610 2HB GLU 79 2HB GLU 79 -10.776 -5.542 11.124 611 1HG GLU 79 1HG GLU 79 -12.232 -5.971 12.987 612 2HG GLU 79 2HG GLU 79 -12.216 -4.223 12.751 613 H LEU 80 H LEU 80 -11.814 -2.381 12.018 614 HA LEU 80 HA LEU 80 -9.069 -1.510 11.185 615 1HB LEU 80 1HB LEU 80 -11.623 0.011 11.597 616 2HB LEU 80 2HB LEU 80 -10.109 0.804 12.030 617 HG LEU 80 HG LEU 80 -10.564 -0.520 9.345 618 1HD1 LEU 80 1HD1 LEU 80 -12.099 1.202 9.160 619 2HD1 LEU 80 2HD1 LEU 80 -10.629 2.069 8.716 620 3HD1 LEU 80 3HD1 LEU 80 -11.272 2.206 10.352 621 1HD2 LEU 80 1HD2 LEU 80 -8.707 1.431 8.996 622 2HD2 LEU 80 2HD2 LEU 80 -8.295 -0.233 9.411 623 3HD2 LEU 80 3HD2 LEU 80 -8.386 0.994 10.674 624 H THR 81 H THR 81 -7.671 -1.583 12.897 625 HA THR 81 HA THR 81 -8.534 -2.306 15.561 626 HB THR 81 HB THR 81 -6.027 -1.678 15.962 627 HG1 THR 81 HG1 THR 81 -5.487 -0.429 14.317 628 1HG2 THR 81 1HG2 THR 81 -6.959 -3.755 13.965 629 2HG2 THR 81 2HG2 THR 81 -6.668 -3.977 15.691 630 3HG2 THR 81 3HG2 THR 81 -5.313 -3.701 14.596 631 H ALA 82 H ALA 82 -7.112 -0.728 17.286 632 HA ALA 82 HA ALA 82 -8.788 1.497 17.785 633 1HB ALA 82 1HB ALA 82 -6.665 0.146 18.966 634 2HB ALA 82 2HB ALA 82 -7.472 1.560 19.646 635 3HB ALA 82 3HB ALA 82 -6.002 1.757 18.691 636 H GLY 83 H GLY 83 -8.987 2.720 15.800 637 1HA GLY 83 1HA GLY 83 -8.290 4.915 14.951 638 2HA GLY 83 2HA GLY 83 -6.616 4.450 15.257 639 H LEU 84 H LEU 84 -6.767 5.298 12.828 640 HA LEU 84 HA LEU 84 -7.637 3.189 10.940 641 1HB LEU 84 1HB LEU 84 -6.453 5.977 10.711 642 2HB LEU 84 2HB LEU 84 -6.838 4.985 9.306 643 HG LEU 84 HG LEU 84 -8.922 5.433 11.424 644 1HD1 LEU 84 1HD1 LEU 84 -9.126 7.263 9.163 645 2HD1 LEU 84 2HD1 LEU 84 -7.670 7.558 10.113 646 3HD1 LEU 84 3HD1 LEU 84 -9.253 7.602 10.889 647 1HD2 LEU 84 1HD2 LEU 84 -8.775 4.603 8.554 648 2HD2 LEU 84 2HD2 LEU 84 -10.229 5.436 9.102 649 3HD2 LEU 84 3HD2 LEU 84 -9.736 3.926 9.868 650 H LYS 85 H LYS 85 -5.617 2.152 12.511 651 HA LYS 85 HA LYS 85 -3.074 2.523 11.006 652 1HB LYS 85 1HB LYS 85 -3.855 1.202 13.626 653 2HB LYS 85 2HB LYS 85 -2.212 1.174 12.984 654 1HG LYS 85 1HG LYS 85 -2.706 3.815 12.781 655 2HG LYS 85 2HG LYS 85 -3.759 3.438 14.145 656 1HD LYS 85 1HD LYS 85 -1.905 2.480 15.382 657 2HD LYS 85 2HD LYS 85 -0.837 2.644 13.989 658 1HE LYS 85 1HE LYS 85 -0.303 4.735 14.682 659 2HE LYS 85 2HE LYS 85 -2.004 5.212 14.507 660 1HZ LYS 85 1HZ LYS 85 -1.412 5.466 16.795 661 2HZ LYS 85 2HZ LYS 85 -0.721 3.916 16.858 662 3HZ LYS 85 3HZ LYS 85 -2.402 4.090 16.685 663 H ARG 86 H ARG 86 -4.232 -0.421 12.622 664 HA ARG 86 HA ARG 86 -3.311 -2.059 10.384 665 1HB ARG 86 1HB ARG 86 -3.385 -2.427 13.009 666 2HB ARG 86 2HB ARG 86 -5.004 -3.039 12.669 667 1HG ARG 86 1HG ARG 86 -4.167 -4.970 11.862 668 2HG ARG 86 2HG ARG 86 -3.104 -4.099 10.757 669 1HD ARG 86 1HD ARG 86 -1.581 -3.686 12.790 670 2HD ARG 86 2HD ARG 86 -2.551 -4.916 13.621 671 HE ARG 86 HE ARG 86 -1.682 -5.743 10.956 672 1HH1 ARG 86 1HH1 ARG 86 -0.835 -5.554 14.327 673 2HH1 ARG 86 2HH1 ARG 86 0.289 -6.864 14.232 674 1HH2 ARG 86 1HH2 ARG 86 -0.217 -7.442 10.858 675 2HH2 ARG 86 2HH2 ARG 86 0.638 -7.927 12.284 676 H MET 87 H MET 87 -4.560 -2.790 8.714 677 HA MET 87 HA MET 87 -7.529 -2.443 8.915 678 1HB MET 87 1HB MET 87 -5.460 -1.733 6.979 679 2HB MET 87 2HB MET 87 -6.746 -2.676 6.226 680 1HG MET 87 1HG MET 87 -8.373 -1.093 7.434 681 2HG MET 87 2HG MET 87 -6.974 -0.061 7.721 682 1HE MET 87 1HE MET 87 -8.985 -2.061 5.301 683 2HE MET 87 2HE MET 87 -7.482 -2.347 4.423 684 3HE MET 87 3HE MET 87 -8.747 -1.349 3.705 685 H ARG 88 H ARG 88 -8.757 -4.290 8.645 686 HA ARG 88 HA ARG 88 -7.333 -6.764 7.714 687 1HB ARG 88 1HB ARG 88 -9.613 -6.416 9.697 688 2HB ARG 88 2HB ARG 88 -8.818 -7.940 9.302 689 1HG ARG 88 1HG ARG 88 -6.739 -7.195 10.246 690 2HG ARG 88 2HG ARG 88 -7.330 -5.540 10.396 691 1HD ARG 88 1HD ARG 88 -7.652 -6.309 12.582 692 2HD ARG 88 2HD ARG 88 -9.220 -6.732 11.867 693 HE ARG 88 HE ARG 88 -8.591 -9.000 12.060 694 1HH1 ARG 88 1HH1 ARG 88 -5.774 -6.955 12.030 695 2HH1 ARG 88 2HH1 ARG 88 -4.681 -8.272 12.281 696 1HH2 ARG 88 1HH2 ARG 88 -7.153 -10.691 12.385 697 2HH2 ARG 88 2HH2 ARG 88 -5.453 -10.372 12.481 698 H ILE 89 H ILE 89 -8.809 -8.376 6.680 699 HA ILE 89 HA ILE 89 -11.186 -7.097 5.372 700 HB ILE 89 HB ILE 89 -9.047 -8.894 4.171 701 1HG1 ILE 89 1HG1 ILE 89 -9.699 -5.990 3.594 702 2HG1 ILE 89 2HG1 ILE 89 -8.382 -6.512 4.644 703 1HG2 ILE 89 1HG2 ILE 89 -11.432 -7.529 2.884 704 2HG2 ILE 89 2HG2 ILE 89 -11.300 -9.259 3.202 705 3HG2 ILE 89 3HG2 ILE 89 -10.215 -8.490 2.043 706 1HD1 ILE 89 1HD1 ILE 89 -7.069 -7.079 2.886 707 2HD1 ILE 89 2HD1 ILE 89 -8.195 -6.140 1.906 708 3HD1 ILE 89 3HD1 ILE 89 -8.397 -7.886 2.052 709 H PHE 90 H PHE 90 -12.745 -8.221 6.603 710 HA PHE 90 HA PHE 90 -12.502 -11.159 6.926 711 1HB PHE 90 1HB PHE 90 -14.232 -8.919 7.957 712 2HB PHE 90 2HB PHE 90 -14.800 -10.581 8.112 713 HD1 PHE 90 HD1 PHE 90 -12.449 -8.077 9.316 714 HD2 PHE 90 HD2 PHE 90 -13.423 -12.260 9.365 715 HE1 PHE 90 HE1 PHE 90 -10.978 -8.396 11.287 716 HE2 PHE 90 HE2 PHE 90 -11.951 -12.580 11.335 717 HZ PHE 90 HZ PHE 90 -10.729 -10.648 12.297 718 H THR 91 H THR 91 -14.898 -12.208 6.660 719 HA THR 91 HA THR 91 -15.754 -11.492 3.878 720 HB THR 91 HB THR 91 -16.316 -14.211 4.883 721 HG1 THR 91 HG1 THR 91 -13.999 -14.709 4.452 722 1HG2 THR 91 1HG2 THR 91 -15.336 -14.764 2.678 723 2HG2 THR 91 2HG2 THR 91 -14.954 -13.055 2.455 724 3HG2 THR 91 3HG2 THR 91 -16.639 -13.576 2.582 725 H ILE 92 H ILE 92 -17.410 -10.051 4.878 726 HA ILE 92 HA ILE 92 -19.442 -10.984 6.638 727 HB ILE 92 HB ILE 92 -20.721 -9.049 5.594 728 1HG1 ILE 92 1HG1 ILE 92 -18.353 -8.087 4.164 729 2HG1 ILE 92 2HG1 ILE 92 -19.067 -9.518 3.429 730 1HG2 ILE 92 1HG2 ILE 92 -17.853 -8.585 6.459 731 2HG2 ILE 92 2HG2 ILE 92 -19.266 -8.672 7.511 732 3HG2 ILE 92 3HG2 ILE 92 -19.090 -7.329 6.381 733 1HD1 ILE 92 1HD1 ILE 92 -21.160 -8.460 3.130 734 2HD1 ILE 92 2HD1 ILE 92 -19.992 -7.209 2.706 735 3HD1 ILE 92 3HD1 ILE 92 -20.775 -7.186 4.286 736 H LYS 93 H LYS 93 -20.286 -12.883 6.106 737 HA LYS 93 HA LYS 93 -21.965 -14.280 5.136 738 1HB LYS 93 1HB LYS 93 -21.810 -12.571 2.639 739 2HB LYS 93 2HB LYS 93 -23.095 -13.665 3.120 740 1HG LYS 93 1HG LYS 93 -22.446 -10.951 4.267 741 2HG LYS 93 2HG LYS 93 -23.957 -11.516 3.575 742 1HD LYS 93 1HD LYS 93 -24.623 -11.912 5.693 743 2HD LYS 93 2HD LYS 93 -23.524 -13.290 5.668 744 1HE LYS 93 1HE LYS 93 -22.238 -12.284 7.241 745 2HE LYS 93 2HE LYS 93 -21.998 -10.899 6.157 746 1HZ LYS 93 1HZ LYS 93 -24.407 -11.365 7.845 747 2HZ LYS 93 2HZ LYS 93 -24.133 -10.022 6.842 748 3HZ LYS 93 3HZ LYS 93 -23.164 -10.268 8.215 749 HA PRO 94 HA PRO 94 -18.671 -16.865 3.664 750 1HB PRO 94 1HB PRO 94 -21.056 -18.377 2.710 751 2HB PRO 94 2HB PRO 94 -19.586 -18.980 3.494 752 1HG PRO 94 1HG PRO 94 -21.781 -18.640 4.865 753 2HG PRO 94 2HG PRO 94 -20.242 -18.209 5.561 754 1HD PRO 94 1HD PRO 94 -22.431 -16.474 4.554 755 2HD PRO 94 2HD PRO 94 -21.258 -16.181 5.854 756 H ILE 95 H ILE 95 -17.681 -17.235 1.598 757 HA ILE 95 HA ILE 95 -19.190 -16.097 -0.724 758 HB ILE 95 HB ILE 95 -16.269 -15.991 0.079 759 1HG1 ILE 95 1HG1 ILE 95 -18.326 -13.821 -0.430 760 2HG1 ILE 95 2HG1 ILE 95 -17.858 -14.405 1.167 761 1HG2 ILE 95 1HG2 ILE 95 -17.546 -15.717 -2.563 762 2HG2 ILE 95 2HG2 ILE 95 -15.847 -15.952 -2.155 763 3HG2 ILE 95 3HG2 ILE 95 -16.549 -14.335 -2.108 764 1HD1 ILE 95 1HD1 ILE 95 -16.252 -12.826 -0.818 765 2HD1 ILE 95 2HD1 ILE 95 -15.426 -13.870 0.343 766 3HD1 ILE 95 3HD1 ILE 95 -16.458 -12.559 0.916 767 H ALA 96 H ALA 96 -18.859 -17.156 -2.770 768 HA ALA 96 HA ALA 96 -18.003 -20.001 -2.516 769 1HB ALA 96 1HB ALA 96 -19.604 -18.435 -4.571 770 2HB ALA 96 2HB ALA 96 -20.255 -19.529 -3.350 771 3HB ALA 96 3HB ALA 96 -19.285 -20.167 -4.677 772 H ILE 97 H ILE 97 -16.690 -20.912 -4.297 773 HA ILE 97 HA ILE 97 -14.381 -19.349 -4.928 774 HB ILE 97 HB ILE 97 -15.553 -21.890 -6.120 775 1HG1 ILE 97 1HG1 ILE 97 -13.215 -22.212 -4.461 776 2HG1 ILE 97 2HG1 ILE 97 -14.449 -21.313 -3.579 777 1HG2 ILE 97 1HG2 ILE 97 -13.255 -20.311 -6.894 778 2HG2 ILE 97 2HG2 ILE 97 -13.887 -21.782 -7.633 779 3HG2 ILE 97 3HG2 ILE 97 -12.737 -21.889 -6.301 780 1HD1 ILE 97 1HD1 ILE 97 -14.461 -24.124 -4.507 781 2HD1 ILE 97 2HD1 ILE 97 -15.973 -23.249 -4.747 782 3HD1 ILE 97 3HD1 ILE 97 -15.282 -23.390 -3.130 783 H GLY 98 H GLY 98 -14.339 -17.666 -6.358 784 1HA GLY 98 1HA GLY 98 -14.407 -16.999 -8.728 785 2HA GLY 98 2HA GLY 98 -15.870 -17.968 -8.904 786 H GLU 99 H GLU 99 -15.379 -15.923 -6.093 787 HA GLU 99 HA GLU 99 -17.673 -14.244 -7.028 788 1HB GLU 99 1HB GLU 99 -16.522 -15.121 -4.386 789 2HB GLU 99 2HB GLU 99 -17.493 -13.651 -4.443 790 1HG GLU 99 1HG GLU 99 -18.353 -16.411 -5.350 791 2HG GLU 99 2HG GLU 99 -18.919 -15.569 -3.914 792 H GLU 100 H GLU 100 -17.471 -11.912 -5.923 793 HA GLU 100 HA GLU 100 -14.711 -10.900 -6.526 794 1HB GLU 100 1HB GLU 100 -16.337 -10.158 -8.170 795 2HB GLU 100 2HB GLU 100 -17.480 -9.703 -6.908 796 1HG GLU 100 1HG GLU 100 -16.430 -7.721 -6.500 797 2HG GLU 100 2HG GLU 100 -14.825 -8.426 -6.675 798 H ILE 101 H ILE 101 -13.695 -10.089 -4.742 799 HA ILE 101 HA ILE 101 -15.257 -9.555 -2.290 800 HB ILE 101 HB ILE 101 -12.285 -9.503 -2.933 801 1HG1 ILE 101 1HG1 ILE 101 -13.979 -11.606 -1.555 802 2HG1 ILE 101 2HG1 ILE 101 -13.375 -11.721 -3.208 803 1HG2 ILE 101 1HG2 ILE 101 -13.106 -8.154 -0.917 804 2HG2 ILE 101 2HG2 ILE 101 -11.900 -9.397 -0.579 805 3HG2 ILE 101 3HG2 ILE 101 -13.600 -9.696 -0.217 806 1HD1 ILE 101 1HD1 ILE 101 -11.357 -11.096 -1.118 807 2HD1 ILE 101 2HD1 ILE 101 -11.224 -12.140 -2.533 808 3HD1 ILE 101 3HD1 ILE 101 -12.035 -12.724 -1.080 809 H THR 102 H THR 102 -15.864 -7.539 -1.719 810 HA THR 102 HA THR 102 -14.284 -5.167 -2.492 811 HB THR 102 HB THR 102 -16.446 -4.198 -3.506 812 HG1 THR 102 HG1 THR 102 -18.089 -5.496 -3.751 813 1HG2 THR 102 1HG2 THR 102 -14.427 -5.120 -4.779 814 2HG2 THR 102 2HG2 THR 102 -15.952 -5.088 -5.666 815 3HG2 THR 102 3HG2 THR 102 -15.360 -6.602 -4.983 816 H ILE 103 H ILE 103 -15.578 -3.136 -1.589 817 HA ILE 103 HA ILE 103 -17.144 -3.890 0.841 818 HB ILE 103 HB ILE 103 -15.684 -2.428 2.185 819 1HG1 ILE 103 1HG1 ILE 103 -13.466 -2.010 0.504 820 2HG1 ILE 103 2HG1 ILE 103 -14.870 -1.532 -0.449 821 1HG2 ILE 103 1HG2 ILE 103 -13.662 -3.794 2.134 822 2HG2 ILE 103 2HG2 ILE 103 -14.043 -4.346 0.503 823 3HG2 ILE 103 3HG2 ILE 103 -15.066 -4.825 1.858 824 1HD1 ILE 103 1HD1 ILE 103 -13.767 -0.329 2.035 825 2HD1 ILE 103 2HD1 ILE 103 -15.526 -0.403 1.921 826 3HD1 ILE 103 3HD1 ILE 103 -14.596 0.442 0.683 827 H SER 104 H SER 104 -18.408 -2.071 1.694 828 HA SER 104 HA SER 104 -19.366 -0.286 -0.433 829 1HB SER 104 1HB SER 104 -20.558 -1.600 1.572 830 2HB SER 104 2HB SER 104 -20.211 -0.103 2.439 831 HG SER 104 HG SER 104 -21.737 0.828 1.367 832 H TYR 105 H TYR 105 -20.030 2.009 0.994 833 HA TYR 105 HA TYR 105 -17.353 3.109 1.792 834 1HB TYR 105 1HB TYR 105 -19.593 4.203 0.068 835 2HB TYR 105 2HB TYR 105 -18.316 5.236 0.713 836 HD1 TYR 105 HD1 TYR 105 -15.926 3.610 0.569 837 HD2 TYR 105 HD2 TYR 105 -19.184 3.881 -2.217 838 HE1 TYR 105 HE1 TYR 105 -14.419 2.888 -1.262 839 HE2 TYR 105 HE2 TYR 105 -17.677 3.159 -4.049 840 HH TYR 105 HH TYR 105 -15.267 1.641 -3.953 841 H GLY 106 H GLY 106 -20.542 4.691 1.772 842 1HA GLY 106 1HA GLY 106 -21.604 4.375 4.228 843 2HA GLY 106 2HA GLY 106 -20.166 5.304 4.648 844 H ASP 107 H ASP 107 -21.483 7.094 5.345 845 HA ASP 107 HA ASP 107 -23.551 8.392 3.982 846 1HB ASP 107 1HB ASP 107 -21.263 9.266 5.737 847 2HB ASP 107 2HB ASP 107 -22.369 10.476 5.088 848 H ASP 108 H ASP 108 -20.052 9.108 3.663 849 HA ASP 108 HA ASP 108 -20.469 10.816 1.326 850 1HB ASP 108 1HB ASP 108 -18.368 10.013 3.178 851 2HB ASP 108 2HB ASP 108 -17.779 9.987 1.516 852 H TYR 109 H TYR 109 -18.516 9.975 -0.441 853 HA TYR 109 HA TYR 109 -18.351 8.576 -2.344 854 1HB TYR 109 1HB TYR 109 -18.048 7.093 0.200 855 2HB TYR 109 2HB TYR 109 -18.300 6.082 -1.220 856 HD1 TYR 109 HD1 TYR 109 -16.389 5.409 -2.365 857 HD2 TYR 109 HD2 TYR 109 -16.379 9.175 -0.301 858 HE1 TYR 109 HE1 TYR 109 -14.031 5.774 -3.043 859 HE2 TYR 109 HE2 TYR 109 -14.021 9.540 -0.978 860 HH TYR 109 HH TYR 109 -12.053 8.077 -1.640 861 H TRP 110 H TRP 110 -20.401 8.904 -3.352 862 HA TRP 110 HA TRP 110 -22.730 7.298 -2.555 863 1HB TRP 110 1HB TRP 110 -23.736 8.485 -4.548 864 2HB TRP 110 2HB TRP 110 -23.050 9.570 -3.342 865 HD1 TRP 110 HD1 TRP 110 -21.280 11.231 -4.145 866 HE1 TRP 110 HE1 TRP 110 -19.937 11.560 -6.323 867 HE3 TRP 110 HE3 TRP 110 -22.623 7.004 -6.643 868 HZ2 TRP 110 HZ2 TRP 110 -19.494 10.196 -8.805 869 HZ3 TRP 110 HZ3 TRP 110 -21.737 6.533 -8.896 870 HH2 TRP 110 HH2 TRP 110 -20.174 8.122 -9.990 871 H LEU 111 H LEU 111 -23.705 5.669 -3.868 872 HA LEU 111 HA LEU 111 -21.750 4.085 -5.416 873 1HB LEU 111 1HB LEU 111 -23.148 3.039 -3.701 874 2HB LEU 111 2HB LEU 111 -24.610 3.638 -4.480 875 HG LEU 111 HG LEU 111 -23.343 2.295 -6.538 876 1HD1 LEU 111 1HD1 LEU 111 -21.703 1.123 -5.407 877 2HD1 LEU 111 2HD1 LEU 111 -23.048 -0.001 -5.214 878 3HD1 LEU 111 3HD1 LEU 111 -22.618 1.093 -3.900 879 1HD2 LEU 111 1HD2 LEU 111 -25.315 1.101 -4.569 880 2HD2 LEU 111 2HD2 LEU 111 -25.118 0.663 -6.266 881 3HD2 LEU 111 3HD2 LEU 111 -25.756 2.249 -5.834 882 H SER 112 H SER 112 -25.232 4.471 -6.104 883 HA SER 112 HA SER 112 -24.912 5.957 -8.545 884 1HB SER 112 1HB SER 112 -23.730 4.051 -9.371 885 2HB SER 112 2HB SER 112 -24.873 2.928 -8.633 886 HG SER 112 HG SER 112 -25.182 4.560 -10.901 887 H ARG 113 H ARG 113 -26.864 3.006 -8.272 888 HA ARG 113 HA ARG 113 -29.308 4.657 -8.484 889 1HB ARG 113 1HB ARG 113 -28.516 1.778 -8.866 890 2HB ARG 113 2HB ARG 113 -30.222 2.197 -8.713 891 1HG ARG 113 1HG ARG 113 -30.128 3.643 -10.625 892 2HG ARG 113 2HG ARG 113 -28.366 3.569 -10.672 893 1HD ARG 113 1HD ARG 113 -29.129 0.889 -10.802 894 2HD ARG 113 2HD ARG 113 -30.316 1.720 -11.825 895 HE ARG 113 HE ARG 113 -27.823 2.874 -12.431 896 1HH1 ARG 113 1HH1 ARG 113 -29.302 -0.274 -12.572 897 2HH1 ARG 113 2HH1 ARG 113 -28.345 -0.785 -13.919 898 1HH2 ARG 113 1HH2 ARG 113 -26.593 2.187 -14.179 899 2HH2 ARG 113 2HH2 ARG 113 -26.823 0.596 -14.823 900 HA PRO 114 HA PRO 114 -29.813 4.106 -4.055 901 1HB PRO 114 1HB PRO 114 -32.314 5.289 -3.915 902 2HB PRO 114 2HB PRO 114 -30.790 6.195 -3.913 903 1HG PRO 114 1HG PRO 114 -32.706 5.703 -6.132 904 2HG PRO 114 2HG PRO 114 -31.746 7.144 -5.767 905 1HD PRO 114 1HD PRO 114 -31.102 5.366 -7.727 906 2HD PRO 114 2HD PRO 114 -29.898 6.340 -6.858 907 H ARG 115 H ARG 115 -30.113 1.738 -5.107 908 HA ARG 115 HA ARG 115 -32.957 0.889 -4.668 909 1HB ARG 115 1HB ARG 115 -30.719 -0.423 -6.258 910 2HB ARG 115 2HB ARG 115 -32.407 -0.935 -6.223 911 1HG ARG 115 1HG ARG 115 -31.486 1.799 -7.160 912 2HG ARG 115 2HG ARG 115 -31.808 0.444 -8.243 913 1HD ARG 115 1HD ARG 115 -33.865 1.498 -6.274 914 2HD ARG 115 2HD ARG 115 -33.766 2.037 -7.961 915 HE ARG 115 HE ARG 115 -33.708 -0.831 -7.865 916 1HH1 ARG 115 1HH1 ARG 115 -35.850 1.875 -7.412 917 2HH1 ARG 115 2HH1 ARG 115 -37.259 0.975 -7.856 918 1HH2 ARG 115 1HH2 ARG 115 -35.552 -1.978 -8.438 919 2HH2 ARG 115 2HH2 ARG 115 -37.094 -1.189 -8.432 920 H LEU 116 H LEU 116 -31.097 1.236 -2.478 921 HA LEU 116 HA LEU 116 -30.544 -1.613 -1.721 922 1HB LEU 116 1HB LEU 116 -29.231 1.043 -1.166 923 2HB LEU 116 2HB LEU 116 -28.974 -0.308 -0.061 924 HG LEU 116 HG LEU 116 -28.416 -1.665 -2.210 925 1HD1 LEU 116 1HD1 LEU 116 -28.543 1.158 -3.185 926 2HD1 LEU 116 2HD1 LEU 116 -28.949 -0.338 -4.026 927 3HD1 LEU 116 3HD1 LEU 116 -27.260 0.127 -3.819 928 1HD2 LEU 116 1HD2 LEU 116 -26.060 -0.456 -2.215 929 2HD2 LEU 116 2HD2 LEU 116 -26.600 -1.349 -0.794 930 3HD2 LEU 116 3HD2 LEU 116 -26.742 0.409 -0.837 931 H THR 117 H THR 117 -33.163 -0.636 -1.384 932 HA THR 117 HA THR 117 -33.408 -0.781 1.557 933 HB THR 117 HB THR 117 -34.414 1.553 -0.116 934 HG1 THR 117 HG1 THR 117 -32.823 2.668 0.788 935 1HG2 THR 117 1HG2 THR 117 -35.868 1.972 1.550 936 2HG2 THR 117 2HG2 THR 117 -34.554 1.954 2.726 937 3HG2 THR 117 3HG2 THR 117 -35.393 0.457 2.318 938 H GLN 118 H GLN 118 -35.515 -1.486 2.189 939 HA GLN 118 HA GLN 118 -37.252 -2.381 -0.086 940 1HB GLN 118 1HB GLN 118 -36.074 -4.042 1.468 941 2HB GLN 118 2HB GLN 118 -37.121 -3.443 2.755 942 1HG GLN 118 1HG GLN 118 -38.724 -4.002 0.436 943 2HG GLN 118 2HG GLN 118 -37.729 -5.412 0.797 944 1HE2 GLN 118 1HE2 GLN 118 -37.964 -6.390 2.970 945 2HE2 GLN 118 2HE2 GLN 118 -39.354 -6.096 3.899 946 H ASN 119 H ASN 119 -37.296 0.281 1.359 947 HA ASN 119 HA ASN 119 -40.058 0.094 2.520 948 1HB ASN 119 1HB ASN 119 -37.534 1.402 3.298 949 2HB ASN 119 2HB ASN 119 -38.927 2.482 3.364 950 1HD2 ASN 119 1HD2 ASN 119 -39.299 2.515 5.631 951 2HD2 ASN 119 2HD2 ASN 119 -39.651 1.127 6.543 952 1H GLY 201 1H GLY 201 -29.271 25.908 -6.089 953 2H GLY 201 2H GLY 201 -28.303 25.222 -7.305 954 3H GLY 201 3H GLY 201 -29.318 24.234 -6.367 955 1HA GLY 201 1HA GLY 201 -29.987 26.022 -8.588 956 2HA GLY 201 2HA GLY 201 -30.597 24.407 -8.225 957 H LYS 202 H LYS 202 -30.959 27.821 -7.559 958 HA LYS 202 HA LYS 202 -32.688 29.010 -6.473 959 1HB LYS 202 1HB LYS 202 -34.091 26.424 -7.246 960 2HB LYS 202 2HB LYS 202 -34.912 27.923 -6.812 961 1HG LYS 202 1HG LYS 202 -34.605 28.773 -8.879 962 2HG LYS 202 2HG LYS 202 -32.885 28.387 -8.844 963 1HD LYS 202 1HD LYS 202 -33.321 26.112 -9.559 964 2HD LYS 202 2HD LYS 202 -35.062 26.357 -9.420 965 1HE LYS 202 1HE LYS 202 -34.546 28.367 -11.112 966 2HE LYS 202 2HE LYS 202 -33.177 27.321 -11.534 967 1HZ LYS 202 1HZ LYS 202 -36.022 26.461 -11.357 968 2HZ LYS 202 2HZ LYS 202 -34.708 25.468 -11.774 969 3HZ LYS 202 3HZ LYS 202 -35.173 26.737 -12.802 970 H ALA 203 H ALA 203 -30.976 27.680 -4.669 971 HA ALA 203 HA ALA 203 -32.694 27.449 -2.336 972 1HB ALA 203 1HB ALA 203 -32.610 25.218 -3.905 973 2HB ALA 203 2HB ALA 203 -32.843 25.159 -2.158 974 3HB ALA 203 3HB ALA 203 -31.237 24.906 -2.842 975 HA PRO 204 HA PRO 204 -28.900 28.337 -0.315 976 1HB PRO 204 1HB PRO 204 -29.106 26.849 2.015 977 2HB PRO 204 2HB PRO 204 -29.942 28.389 1.746 978 1HG PRO 204 1HG PRO 204 -30.973 25.606 1.552 979 2HG PRO 204 2HG PRO 204 -31.776 27.069 2.138 980 1HD PRO 204 1HD PRO 204 -32.246 25.982 -0.312 981 2HD PRO 204 2HD PRO 204 -32.404 27.718 0.030 982 H ARG 205 H ARG 205 -27.091 27.451 -1.280 983 HA ARG 205 HA ARG 205 -26.662 24.501 -1.080 984 1HB ARG 205 1HB ARG 205 -26.565 26.243 -3.189 985 2HB ARG 205 2HB ARG 205 -24.870 26.226 -2.700 986 1HG ARG 205 1HG ARG 205 -26.244 23.589 -2.844 987 2HG ARG 205 2HG ARG 205 -25.906 24.390 -4.379 988 1HD ARG 205 1HD ARG 205 -23.549 24.469 -3.923 989 2HD ARG 205 2HD ARG 205 -23.798 24.012 -2.227 990 HE ARG 205 HE ARG 205 -24.939 22.064 -4.058 991 1HH1 ARG 205 1HH1 ARG 205 -21.993 23.145 -2.548 992 2HH1 ARG 205 2HH1 ARG 205 -21.239 21.592 -2.655 993 1HH2 ARG 205 1HH2 ARG 205 -23.938 20.059 -4.185 994 2HH2 ARG 205 2HH2 ARG 205 -22.330 19.857 -3.575 995 H LYS 206 H LYS 206 -24.691 23.701 -0.208 996 HA LYS 206 HA LYS 206 -22.983 25.728 1.201 997 1HB LYS 206 1HB LYS 206 -24.030 23.013 2.075 998 2HB LYS 206 2HB LYS 206 -22.812 23.918 2.973 999 1HG LYS 206 1HG LYS 206 -24.358 25.772 3.291 1000 2HG LYS 206 2HG LYS 206 -25.562 24.988 2.268 1001 1HD LYS 206 1HD LYS 206 -24.477 23.590 4.707 1002 2HD LYS 206 2HD LYS 206 -25.795 24.752 4.851 1003 1HE LYS 206 1HE LYS 206 -26.129 22.760 2.680 1004 2HE LYS 206 2HE LYS 206 -26.194 22.104 4.327 1005 1HZ LYS 206 1HZ LYS 206 -27.752 24.396 3.244 1006 2HZ LYS 206 2HZ LYS 206 -27.710 23.971 4.887 1007 3HZ LYS 206 3HZ LYS 206 -28.368 22.896 3.749 1008 H GLN 207 H GLN 207 -21.146 25.688 -0.102 1009 HA GLN 207 HA GLN 207 -20.152 23.256 -1.356 1010 1HB GLN 207 1HB GLN 207 -19.940 25.848 -1.908 1011 2HB GLN 207 2HB GLN 207 -18.510 25.730 -0.883 1012 1HG GLN 207 1HG GLN 207 -17.487 25.107 -2.828 1013 2HG GLN 207 2HG GLN 207 -18.179 23.529 -2.452 1014 1HE2 GLN 207 1HE2 GLN 207 -19.424 22.654 -4.112 1015 2HE2 GLN 207 2HE2 GLN 207 -20.201 23.550 -5.326 1016 H LEU 208 H LEU 208 -18.830 25.359 1.239 1017 HA LEU 208 HA LEU 208 -16.780 23.438 1.981 1018 1HB LEU 208 1HB LEU 208 -17.171 26.098 2.290 1019 2HB LEU 208 2HB LEU 208 -17.746 25.547 3.863 1020 HG LEU 208 HG LEU 208 -15.245 24.257 3.013 1021 1HD1 LEU 208 1HD1 LEU 208 -14.093 26.091 2.400 1022 2HD1 LEU 208 2HD1 LEU 208 -14.409 26.787 3.990 1023 3HD1 LEU 208 3HD1 LEU 208 -15.517 27.100 2.654 1024 1HD2 LEU 208 1HD2 LEU 208 -14.742 25.382 5.402 1025 2HD2 LEU 208 2HD2 LEU 208 -15.679 23.896 5.244 1026 3HD2 LEU 208 3HD2 LEU 208 -16.504 25.442 5.440 1027 H ALA 209 H ALA 209 -16.728 22.206 3.973 1028 HA ALA 209 HA ALA 209 -19.175 22.008 5.605 1029 1HB ALA 209 1HB ALA 209 -19.419 20.654 3.419 1030 2HB ALA 209 2HB ALA 209 -19.715 19.778 4.921 1031 3HB ALA 209 3HB ALA 209 -18.178 19.587 4.077 1032 H THR 210 H THR 210 -18.441 21.691 7.665 1033 HA THR 210 HA THR 210 -15.701 21.082 8.285 1034 HB THR 210 HB THR 210 -16.891 20.719 10.612 1035 HG1 THR 210 HG1 THR 210 -18.956 20.481 10.198 1036 1HG2 THR 210 1HG2 THR 210 -16.856 23.055 10.954 1037 2HG2 THR 210 2HG2 THR 210 -17.368 23.393 9.300 1038 3HG2 THR 210 3HG2 THR 210 -15.731 22.817 9.617 1039 H LYS 211 H LYS 211 -18.603 19.096 7.967 1040 HA LYS 211 HA LYS 211 -17.177 16.697 8.983 1041 1HB LYS 211 1HB LYS 211 -19.565 17.365 9.571 1042 2HB LYS 211 2HB LYS 211 -19.997 17.011 7.898 1043 1HG LYS 211 1HG LYS 211 -20.141 14.818 8.381 1044 2HG LYS 211 2HG LYS 211 -18.467 14.816 8.935 1045 1HD LYS 211 1HD LYS 211 -19.378 14.321 10.963 1046 2HD LYS 211 2HD LYS 211 -19.722 16.049 11.033 1047 1HE LYS 211 1HE LYS 211 -21.782 14.728 9.495 1048 2HE LYS 211 2HE LYS 211 -21.612 13.941 11.076 1049 1HZ LYS 211 1HZ LYS 211 -21.608 16.890 10.778 1050 2HZ LYS 211 2HZ LYS 211 -21.863 15.975 12.187 1051 3HZ LYS 211 3HZ LYS 211 -23.055 16.023 10.977 1052 H ALA 212 H ALA 212 -16.093 17.753 6.573 1053 HA ALA 212 HA ALA 212 -17.220 16.231 4.315 1054 1HB ALA 212 1HB ALA 212 -16.199 17.948 3.246 1055 2HB ALA 212 2HB ALA 212 -14.632 17.370 3.812 1056 3HB ALA 212 3HB ALA 212 -15.555 18.513 4.788 1057 H ALA 213 H ALA 213 -16.874 14.014 4.792 1058 HA ALA 213 HA ALA 213 -14.072 13.157 5.378 1059 1HB ALA 213 1HB ALA 213 -15.734 12.323 6.908 1060 2HB ALA 213 2HB ALA 213 -15.327 10.970 5.852 1061 3HB ALA 213 3HB ALA 213 -16.816 11.878 5.589 1062 H ARG 214 H ARG 214 -14.011 10.648 4.334 1063 HA ARG 214 HA ARG 214 -14.561 11.031 1.409 1064 1HB ARG 214 1HB ARG 214 -12.160 9.875 2.869 1065 2HB ARG 214 2HB ARG 214 -12.378 9.779 1.121 1066 1HG ARG 214 1HG ARG 214 -12.679 12.343 1.210 1067 2HG ARG 214 2HG ARG 214 -11.996 12.238 2.832 1068 1HD ARG 214 1HD ARG 214 -10.064 12.571 1.542 1069 2HD ARG 214 2HD ARG 214 -10.130 10.799 1.596 1070 HE ARG 214 HE ARG 214 -10.679 10.829 -0.704 1071 1HH1 ARG 214 1HH1 ARG 214 -11.353 13.916 0.756 1072 2HH1 ARG 214 2HH1 ARG 214 -11.791 14.654 -0.745 1073 1HH2 ARG 214 1HH2 ARG 214 -11.253 11.808 -2.640 1074 2HH2 ARG 214 2HH2 ARG 214 -11.736 13.471 -2.655 1075 1HN MLZ 215 1HN MLZ 215 -13.118 8.198 2.992 1076 HA MLZ 215 HA MLZ 215 -15.388 6.564 1.970 1077 1HB MLZ 215 1HB MLZ 215 -12.512 6.248 2.605 1078 2HB MLZ 215 2HB MLZ 215 -13.510 4.849 2.999 1079 1HG MLZ 215 1HG MLZ 215 -13.537 6.250 0.311 1080 2HG MLZ 215 2HG MLZ 215 -14.352 4.743 0.726 1081 1HD MLZ 215 1HD MLZ 215 -11.392 4.935 1.147 1082 2HD MLZ 215 2HD MLZ 215 -12.376 3.524 0.757 1083 1HE MLZ 215 1HE MLZ 215 -11.022 5.373 -1.052 1084 2HE MLZ 215 2HE MLZ 215 -12.747 5.216 -1.436 1085 HZ MLZ 215 HZ MLZ 215 -12.360 2.736 -1.036 1086 1HCM MLZ 215 1HCM MLZ 215 -11.112 2.679 -3.364 1087 2HCM MLZ 215 2HCM MLZ 215 -11.590 4.373 -3.322 1088 3HCM MLZ 215 3HCM MLZ 215 -12.811 3.111 -3.206 1089 H SER 216 H SER 216 -16.917 5.784 3.376 1090 HA SER 216 HA SER 216 -17.998 5.239 5.397 1091 1HB SER 216 1HB SER 216 -16.060 7.143 6.711 1092 2HB SER 216 2HB SER 216 -17.257 7.749 5.566 1093 HG SER 216 HG SER 216 -17.647 7.306 8.072 1094 H ALA 217 H ALA 217 -17.565 4.313 7.635 1095 HA ALA 217 HA ALA 217 -14.924 2.887 7.682 1096 1HB ALA 217 1HB ALA 217 -14.679 3.593 9.841 1097 2HB ALA 217 2HB ALA 217 -16.364 3.249 10.227 1098 3HB ALA 217 3HB ALA 217 -15.931 4.771 9.450 1099 HA PRO 218 HA PRO 218 -17.041 -0.933 8.102 1100 1HB PRO 218 1HB PRO 218 -16.087 -2.037 10.464 1101 2HB PRO 218 2HB PRO 218 -15.200 -2.047 8.930 1102 1HG PRO 218 1HG PRO 218 -14.889 -0.274 11.294 1103 2HG PRO 218 2HG PRO 218 -13.661 -0.919 10.197 1104 1HD PRO 218 1HD PRO 218 -14.568 1.644 10.091 1105 2HD PRO 218 2HD PRO 218 -13.962 0.767 8.671 1106 H ALA 219 H ALA 219 -16.983 0.904 11.154 1107 HA ALA 219 HA ALA 219 -19.883 0.679 11.420 1108 1HB ALA 219 1HB ALA 219 -18.588 -1.521 12.206 1109 2HB ALA 219 2HB ALA 219 -19.970 -0.916 13.119 1110 3HB ALA 219 3HB ALA 219 -18.330 -0.567 13.666 1111 H THR 220 H THR 220 -18.664 3.025 11.292 1112 HA THR 220 HA THR 220 -18.791 4.060 14.075 1113 HB THR 220 HB THR 220 -16.466 4.435 12.149 1114 HG1 THR 220 HG1 THR 220 -15.346 3.320 13.807 1115 1HG2 THR 220 1HG2 THR 220 -16.109 6.348 13.292 1116 2HG2 THR 220 2HG2 THR 220 -15.779 5.348 14.707 1117 3HG2 THR 220 3HG2 THR 220 -17.403 5.978 14.432 1118 H GLY 221 H GLY 221 -20.792 5.023 13.198 1119 1HA GLY 221 1HA GLY 221 -20.621 6.882 10.953 1120 2HA GLY 221 2HA GLY 221 -22.024 6.643 11.994 1121 1H MET 1 1H MET 1 -0.587 -11.644 6.659 1122 2H MET 1 2H MET 1 -0.324 -11.082 5.078 1123 3H MET 1 3H MET 1 -0.955 -10.035 6.258 1124 HA MET 1 HA MET 1 1.401 -9.576 5.861 1125 1HB MET 1 1HB MET 1 -0.036 -10.108 8.269 1126 2HB MET 1 2HB MET 1 1.623 -10.650 8.525 1127 1HG MET 1 1HG MET 1 1.670 -8.363 9.130 1128 2HG MET 1 2HG MET 1 2.314 -8.382 7.488 1129 1HE MET 1 1HE MET 1 0.945 -5.206 7.650 1130 2HE MET 1 2HE MET 1 1.591 -6.194 8.960 1131 3HE MET 1 3HE MET 1 -0.060 -5.581 9.050 1132 H PHE 2 H PHE 2 1.253 -12.567 7.824 1133 HA PHE 2 HA PHE 2 3.881 -13.417 6.971 1134 1HB PHE 2 1HB PHE 2 3.199 -15.488 8.225 1135 2HB PHE 2 2HB PHE 2 2.912 -14.008 9.138 1136 HD1 PHE 2 HD1 PHE 2 1.238 -16.471 6.879 1137 HD2 PHE 2 HD2 PHE 2 0.751 -13.479 9.923 1138 HE1 PHE 2 HE1 PHE 2 -1.164 -17.056 7.071 1139 HE2 PHE 2 HE2 PHE 2 -1.651 -14.065 10.114 1140 HZ PHE 2 HZ PHE 2 -2.609 -15.853 8.688 1141 H ASN 3 H ASN 3 4.435 -15.013 5.460 1142 HA ASN 3 HA ASN 3 2.252 -16.287 3.878 1143 1HB ASN 3 1HB ASN 3 4.013 -14.086 3.104 1144 2HB ASN 3 2HB ASN 3 4.176 -15.459 2.010 1145 1HD2 ASN 3 1HD2 ASN 3 1.751 -13.234 3.429 1146 2HD2 ASN 3 2HD2 ASN 3 0.605 -13.441 2.194 1147 H ASP 4 H ASP 4 2.898 -18.283 2.958 1148 HA ASP 4 HA ASP 4 4.857 -19.839 4.213 1149 1HB ASP 4 1HB ASP 4 4.558 -21.307 2.211 1150 2HB ASP 4 2HB ASP 4 3.020 -20.681 2.806 1151 H ARG 5 H ARG 5 5.287 -17.472 1.675 1152 HA ARG 5 HA ARG 5 7.970 -18.482 0.951 1153 1HB ARG 5 1HB ARG 5 6.220 -16.144 0.121 1154 2HB ARG 5 2HB ARG 5 7.825 -16.422 -0.553 1155 1HG ARG 5 1HG ARG 5 6.631 -18.911 -0.763 1156 2HG ARG 5 2HG ARG 5 5.301 -17.807 -1.114 1157 1HD ARG 5 1HD ARG 5 7.865 -17.096 -2.418 1158 2HD ARG 5 2HD ARG 5 7.125 -18.605 -2.988 1159 HE ARG 5 HE ARG 5 6.015 -15.916 -3.317 1160 1HH1 ARG 5 1HH1 ARG 5 5.313 -19.315 -3.044 1161 2HH1 ARG 5 2HH1 ARG 5 3.804 -19.181 -3.878 1162 1HH2 ARG 5 1HH2 ARG 5 4.052 -15.769 -4.396 1163 2HH2 ARG 5 2HH2 ARG 5 3.094 -17.191 -4.638 1164 H VAL 6 H VAL 6 6.522 -15.737 2.700 1165 HA VAL 6 HA VAL 6 9.134 -15.247 4.015 1166 HB VAL 6 HB VAL 6 9.061 -12.857 3.320 1167 1HG1 VAL 6 1HG1 VAL 6 9.822 -13.191 1.082 1168 2HG1 VAL 6 2HG1 VAL 6 8.800 -14.612 0.871 1169 3HG1 VAL 6 3HG1 VAL 6 10.202 -14.686 1.938 1170 1HG2 VAL 6 1HG2 VAL 6 7.346 -12.757 1.173 1171 2HG2 VAL 6 2HG2 VAL 6 6.980 -12.124 2.778 1172 3HG2 VAL 6 3HG2 VAL 6 6.433 -13.737 2.320 1173 H ILE 7 H ILE 7 8.633 -13.001 5.401 1174 HA ILE 7 HA ILE 7 5.888 -12.989 6.476 1175 HB ILE 7 HB ILE 7 6.927 -14.908 7.596 1176 1HG1 ILE 7 1HG1 ILE 7 7.005 -12.594 9.542 1177 2HG1 ILE 7 2HG1 ILE 7 5.494 -13.229 8.892 1178 1HG2 ILE 7 1HG2 ILE 7 9.099 -14.945 8.236 1179 2HG2 ILE 7 2HG2 ILE 7 8.971 -13.379 9.036 1180 3HG2 ILE 7 3HG2 ILE 7 9.272 -13.461 7.301 1181 1HD1 ILE 7 1HD1 ILE 7 7.316 -14.393 10.901 1182 2HD1 ILE 7 2HD1 ILE 7 6.763 -15.532 9.673 1183 3HD1 ILE 7 3HD1 ILE 7 5.589 -14.660 10.659 1184 H VAL 8 H VAL 8 5.636 -11.234 8.105 1185 HA VAL 8 HA VAL 8 7.507 -9.000 7.526 1186 HB VAL 8 HB VAL 8 5.066 -8.746 7.197 1187 1HG1 VAL 8 1HG1 VAL 8 3.593 -9.591 8.676 1188 2HG1 VAL 8 2HG1 VAL 8 4.286 -8.623 9.976 1189 3HG1 VAL 8 3HG1 VAL 8 4.952 -10.214 9.610 1190 1HG2 VAL 8 1HG2 VAL 8 6.150 -7.168 9.553 1191 2HG2 VAL 8 2HG2 VAL 8 4.761 -6.702 8.570 1192 3HG2 VAL 8 3HG2 VAL 8 6.370 -6.765 7.850 1193 H LYS 9 H LYS 9 8.826 -8.135 9.078 1194 HA LYS 9 HA LYS 9 8.392 -8.881 11.932 1195 1HB LYS 9 1HB LYS 9 10.961 -9.097 10.333 1196 2HB LYS 9 2HB LYS 9 10.821 -9.394 12.065 1197 1HG LYS 9 1HG LYS 9 8.810 -10.975 11.046 1198 2HG LYS 9 2HG LYS 9 10.052 -11.110 9.803 1199 1HD LYS 9 1HD LYS 9 11.702 -11.777 11.485 1200 2HD LYS 9 2HD LYS 9 10.511 -11.561 12.767 1201 1HE LYS 9 1HE LYS 9 9.073 -13.294 11.551 1202 2HE LYS 9 2HE LYS 9 10.503 -13.639 10.558 1203 1HZ LYS 9 1HZ LYS 9 10.378 -15.028 12.589 1204 2HZ LYS 9 2HZ LYS 9 10.472 -13.620 13.534 1205 3HZ LYS 9 3HZ LYS 9 11.775 -14.062 12.539 1206 H LYS 10 H LYS 10 9.638 -5.592 12.742 1207 HA LYS 10 HA LYS 10 8.955 -6.663 14.694 1208 1HB LYS 10 1HB LYS 10 7.178 -7.529 12.471 1209 2HB LYS 10 2HB LYS 10 7.039 -8.435 13.978 1210 1HG LYS 10 1HG LYS 10 6.868 -5.417 13.713 1211 2HG LYS 10 2HG LYS 10 5.493 -6.499 13.933 1212 1HD LYS 10 1HD LYS 10 6.984 -7.312 16.011 1213 2HD LYS 10 2HD LYS 10 7.580 -5.657 15.889 1214 1HE LYS 10 1HE LYS 10 5.729 -5.329 17.276 1215 2HE LYS 10 2HE LYS 10 4.962 -5.124 15.689 1216 1HZ LYS 10 1HZ LYS 10 3.856 -6.791 17.180 1217 2HZ LYS 10 2HZ LYS 10 5.250 -7.751 17.049 1218 3HZ LYS 10 3HZ LYS 10 4.327 -7.401 15.667 1219 H SER 11 H SER 11 11.291 -7.628 14.375 1220 HA SER 11 HA SER 11 11.069 -10.621 14.373 1221 1HB SER 11 1HB SER 11 13.691 -10.118 13.862 1222 2HB SER 11 2HB SER 11 12.485 -10.240 12.585 1223 HG SER 11 HG SER 11 12.795 -8.223 12.173 1224 HA PRO 12 HA PRO 12 12.750 -10.717 18.423 1225 1HB PRO 12 1HB PRO 12 14.884 -12.482 18.213 1226 2HB PRO 12 2HB PRO 12 13.186 -12.980 18.325 1227 1HG PRO 12 1HG PRO 12 14.956 -12.778 15.946 1228 2HG PRO 12 2HG PRO 12 13.689 -13.956 16.314 1229 1HD PRO 12 1HD PRO 12 13.360 -11.905 14.559 1230 2HD PRO 12 2HD PRO 12 12.024 -12.606 15.497 1231 H LEU 13 H LEU 13 14.901 -9.960 15.785 1232 HA LEU 13 HA LEU 13 16.414 -8.126 17.567 1233 1HB LEU 13 1HB LEU 13 17.325 -10.684 16.467 1234 2HB LEU 13 2HB LEU 13 18.377 -9.350 15.994 1235 HG LEU 13 HG LEU 13 17.501 -9.428 18.840 1236 1HD1 LEU 13 1HD1 LEU 13 19.829 -11.133 17.991 1237 2HD1 LEU 13 2HD1 LEU 13 18.203 -11.814 18.001 1238 3HD1 LEU 13 3HD1 LEU 13 18.904 -11.186 19.492 1239 1HD2 LEU 13 1HD2 LEU 13 20.314 -9.084 17.899 1240 2HD2 LEU 13 2HD2 LEU 13 19.444 -8.225 19.169 1241 3HD2 LEU 13 3HD2 LEU 13 19.154 -7.826 17.476 1242 H GLY 14 H GLY 14 14.499 -7.817 15.292 1243 1HA GLY 14 1HA GLY 14 16.285 -6.194 13.543 1244 2HA GLY 14 2HA GLY 14 15.124 -7.294 12.800 1245 H GLY 15 H GLY 15 15.209 -4.361 12.589 1246 1HA GLY 15 1HA GLY 15 13.143 -3.218 14.249 1247 2HA GLY 15 2HA GLY 15 13.758 -2.518 12.752 1248 H TYR 16 H TYR 16 12.206 -2.347 11.207 1249 HA TYR 16 HA TYR 16 9.988 -4.364 11.216 1250 1HB TYR 16 1HB TYR 16 10.191 -1.415 10.639 1251 2HB TYR 16 2HB TYR 16 8.874 -2.352 9.935 1252 HD1 TYR 16 HD1 TYR 16 6.999 -2.997 11.236 1253 HD2 TYR 16 HD2 TYR 16 10.528 -1.490 13.166 1254 HE1 TYR 16 HE1 TYR 16 5.782 -2.913 13.395 1255 HE2 TYR 16 HE2 TYR 16 9.312 -1.406 15.325 1256 HH TYR 16 HH TYR 16 6.606 -1.186 15.901 1257 H GLY 17 H GLY 17 11.986 -5.421 9.881 1258 1HA GLY 17 1HA GLY 17 11.749 -4.575 7.023 1259 2HA GLY 17 2HA GLY 17 13.087 -5.520 7.679 1260 H VAL 18 H VAL 18 12.307 -6.900 5.700 1261 HA VAL 18 HA VAL 18 9.977 -8.607 6.466 1262 HB VAL 18 HB VAL 18 11.525 -8.109 3.903 1263 1HG1 VAL 18 1HG1 VAL 18 10.913 -10.475 3.932 1264 2HG1 VAL 18 2HG1 VAL 18 9.839 -9.617 2.826 1265 3HG1 VAL 18 3HG1 VAL 18 9.270 -10.072 4.433 1266 1HG2 VAL 18 1HG2 VAL 18 9.896 -6.388 4.565 1267 2HG2 VAL 18 2HG2 VAL 18 8.646 -7.621 4.716 1268 3HG2 VAL 18 3HG2 VAL 18 9.337 -7.256 3.135 1269 H PHE 19 H PHE 19 10.241 -10.933 6.431 1270 HA PHE 19 HA PHE 19 13.078 -11.811 6.861 1271 1HB PHE 19 1HB PHE 19 10.519 -12.179 8.257 1272 2HB PHE 19 2HB PHE 19 11.364 -13.701 7.977 1273 HD1 PHE 19 HD1 PHE 19 12.716 -14.369 9.743 1274 HD2 PHE 19 HD2 PHE 19 12.352 -10.182 8.858 1275 HE1 PHE 19 HE1 PHE 19 14.284 -13.842 11.591 1276 HE2 PHE 19 HE2 PHE 19 13.920 -9.655 10.705 1277 HZ PHE 19 HZ PHE 19 14.886 -11.485 12.071 1278 H ALA 20 H ALA 20 13.836 -13.274 5.391 1279 HA ALA 20 HA ALA 20 11.972 -14.403 3.396 1280 1HB ALA 20 1HB ALA 20 13.909 -13.606 2.384 1281 2HB ALA 20 2HB ALA 20 14.393 -15.279 2.656 1282 3HB ALA 20 3HB ALA 20 14.921 -14.016 3.768 1283 H ARG 21 H ARG 21 10.868 -16.044 4.625 1284 HA ARG 21 HA ARG 21 12.097 -18.003 6.297 1285 1HB ARG 21 1HB ARG 21 9.574 -17.321 5.476 1286 2HB ARG 21 2HB ARG 21 9.821 -18.812 4.567 1287 1HG ARG 21 1HG ARG 21 10.010 -20.110 6.488 1288 2HG ARG 21 2HG ARG 21 10.552 -18.752 7.475 1289 1HD ARG 21 1HD ARG 21 8.351 -17.879 7.681 1290 2HD ARG 21 2HD ARG 21 7.752 -18.851 6.324 1291 HE ARG 21 HE ARG 21 8.858 -20.571 8.347 1292 1HH1 ARG 21 1HH1 ARG 21 6.109 -18.546 7.665 1293 2HH1 ARG 21 2HH1 ARG 21 5.046 -19.461 8.676 1294 1HH2 ARG 21 1HH2 ARG 21 7.459 -21.742 9.653 1295 2HH2 ARG 21 2HH2 ARG 21 5.802 -21.257 9.795 1296 H LYS 22 H LYS 22 12.029 -17.596 2.842 1297 HA LYS 22 HA LYS 22 12.890 -20.363 2.272 1298 1HB LYS 22 1HB LYS 22 11.705 -18.089 0.943 1299 2HB LYS 22 2HB LYS 22 13.117 -18.621 0.037 1300 1HG LYS 22 1HG LYS 22 11.654 -20.130 -0.862 1301 2HG LYS 22 2HG LYS 22 11.950 -21.018 0.633 1302 1HD LYS 22 1HD LYS 22 9.908 -20.470 1.523 1303 2HD LYS 22 2HD LYS 22 9.882 -18.885 0.750 1304 1HE LYS 22 1HE LYS 22 8.807 -19.684 -1.105 1305 2HE LYS 22 2HE LYS 22 9.763 -21.179 -1.124 1306 1HZ LYS 22 1HZ LYS 22 8.514 -21.933 0.824 1307 2HZ LYS 22 2HZ LYS 22 7.477 -21.646 -0.489 1308 3HZ LYS 22 3HZ LYS 22 7.571 -20.522 0.780 1309 H SER 23 H SER 23 16.297 -19.443 1.182 1310 HA SER 23 HA SER 23 13.889 -21.122 0.675 1311 1HB SER 23 1HB SER 23 16.118 -22.102 1.271 1312 2HB SER 23 2HB SER 23 15.559 -22.631 -0.315 1313 HG SER 23 HG SER 23 17.015 -21.383 -1.280 1314 H PHE 24 H PHE 24 15.754 -18.569 -0.745 1315 HA PHE 24 HA PHE 24 14.190 -18.871 -3.277 1316 1HB PHE 24 1HB PHE 24 15.439 -16.538 -1.793 1317 2HB PHE 24 2HB PHE 24 14.767 -16.378 -3.415 1318 HD1 PHE 24 HD1 PHE 24 13.954 -15.457 -0.334 1319 HD2 PHE 24 HD2 PHE 24 12.409 -18.100 -3.348 1320 HE1 PHE 24 HE1 PHE 24 11.681 -15.229 0.631 1321 HE2 PHE 24 HE2 PHE 24 10.136 -17.872 -2.383 1322 HZ PHE 24 HZ PHE 24 9.772 -16.436 -0.394 1323 H GLU 25 H GLU 25 15.360 -18.127 -5.274 1324 HA GLU 25 HA GLU 25 18.256 -18.887 -5.147 1325 1HB GLU 25 1HB GLU 25 15.962 -19.507 -6.869 1326 2HB GLU 25 2HB GLU 25 17.378 -19.003 -7.792 1327 1HG GLU 25 1HG GLU 25 18.716 -20.736 -6.884 1328 2HG GLU 25 2HG GLU 25 17.568 -21.056 -5.585 1329 H LYS 26 H LYS 26 19.066 -17.907 -7.602 1330 HA LYS 26 HA LYS 26 19.194 -15.015 -7.071 1331 1HB LYS 26 1HB LYS 26 20.970 -16.845 -7.921 1332 2HB LYS 26 2HB LYS 26 20.370 -16.321 -9.494 1333 1HG LYS 26 1HG LYS 26 20.961 -14.029 -9.039 1334 2HG LYS 26 2HG LYS 26 21.327 -14.403 -7.355 1335 1HD LYS 26 1HD LYS 26 23.300 -15.547 -7.905 1336 2HD LYS 26 2HD LYS 26 22.789 -15.821 -9.571 1337 1HE LYS 26 1HE LYS 26 22.828 -13.001 -9.186 1338 2HE LYS 26 2HE LYS 26 24.348 -13.638 -8.530 1339 1HZ LYS 26 1HZ LYS 26 24.675 -13.385 -10.852 1340 2HZ LYS 26 2HZ LYS 26 23.184 -14.108 -11.223 1341 3HZ LYS 26 3HZ LYS 26 24.451 -15.048 -10.594 1342 H GLY 27 H GLY 27 17.141 -14.161 -7.650 1343 1HA GLY 27 1HA GLY 27 16.127 -12.933 -9.537 1344 2HA GLY 27 2HA GLY 27 16.524 -14.306 -10.570 1345 H GLU 28 H GLU 28 14.877 -14.011 -7.399 1346 HA GLU 28 HA GLU 28 12.624 -15.609 -8.575 1347 1HB GLU 28 1HB GLU 28 14.232 -15.748 -6.082 1348 2HB GLU 28 2HB GLU 28 12.500 -16.003 -5.871 1349 1HG GLU 28 1HG GLU 28 14.245 -17.483 -7.863 1350 2HG GLU 28 2HG GLU 28 13.705 -18.132 -6.314 1351 H LEU 29 H LEU 29 10.744 -14.452 -8.676 1352 HA LEU 29 HA LEU 29 10.441 -11.834 -7.503 1353 1HB LEU 29 1HB LEU 29 9.340 -13.061 -9.564 1354 2HB LEU 29 2HB LEU 29 8.163 -13.609 -8.369 1355 HG LEU 29 HG LEU 29 7.407 -11.519 -9.430 1356 1HD1 LEU 29 1HD1 LEU 29 6.747 -10.460 -7.454 1357 2HD1 LEU 29 2HD1 LEU 29 8.309 -10.719 -6.677 1358 3HD1 LEU 29 3HD1 LEU 29 7.185 -12.065 -6.868 1359 1HD2 LEU 29 1HD2 LEU 29 9.289 -9.699 -8.231 1360 2HD2 LEU 29 2HD2 LEU 29 8.867 -9.882 -9.933 1361 3HD2 LEU 29 3HD2 LEU 29 10.159 -10.858 -9.236 1362 H VAL 30 H VAL 30 10.653 -11.952 -5.223 1363 HA VAL 30 HA VAL 30 9.375 -13.937 -3.574 1364 HB VAL 30 HB VAL 30 10.358 -11.114 -3.009 1365 1HG1 VAL 30 1HG1 VAL 30 8.840 -12.669 -1.348 1366 2HG1 VAL 30 2HG1 VAL 30 10.026 -11.491 -0.786 1367 3HG1 VAL 30 3HG1 VAL 30 10.466 -13.195 -0.913 1368 1HG2 VAL 30 1HG2 VAL 30 11.875 -13.606 -2.335 1369 2HG2 VAL 30 2HG2 VAL 30 12.483 -11.998 -2.730 1370 3HG2 VAL 30 3HG2 VAL 30 11.882 -13.052 -4.009 1371 H GLU 31 H GLU 31 8.439 -10.648 -4.582 1372 HA GLU 31 HA GLU 31 5.611 -11.253 -4.241 1373 1HB GLU 31 1HB GLU 31 6.949 -10.678 -1.933 1374 2HB GLU 31 2HB GLU 31 6.476 -9.054 -2.434 1375 1HG GLU 31 1HG GLU 31 4.193 -10.604 -2.881 1376 2HG GLU 31 2HG GLU 31 4.831 -11.200 -1.348 1377 H GLU 32 H GLU 32 4.273 -9.290 -4.765 1378 HA GLU 32 HA GLU 32 5.711 -6.984 -5.928 1379 1HB GLU 32 1HB GLU 32 4.758 -7.427 -8.173 1380 2HB GLU 32 2HB GLU 32 5.764 -8.778 -7.651 1381 1HG GLU 32 1HG GLU 32 3.559 -9.780 -6.716 1382 2HG GLU 32 2HG GLU 32 2.754 -8.603 -7.753 1383 H CYS 33 H CYS 33 4.376 -5.162 -5.978 1384 HA CYS 33 HA CYS 33 1.442 -5.535 -5.611 1385 1HB CYS 33 1HB CYS 33 3.417 -4.170 -3.767 1386 2HB CYS 33 2HB CYS 33 1.702 -3.759 -3.736 1387 HG CYS 33 HG CYS 33 1.352 -5.786 -2.371 1388 H LEU 34 H LEU 34 0.540 -3.061 -5.410 1389 HA LEU 34 HA LEU 34 1.520 -1.724 -7.873 1390 1HB LEU 34 1HB LEU 34 -0.973 -2.205 -6.545 1391 2HB LEU 34 2HB LEU 34 -0.743 -0.459 -6.641 1392 HG LEU 34 HG LEU 34 -0.279 -0.669 -9.068 1393 1HD1 LEU 34 1HD1 LEU 34 -1.310 -3.470 -9.061 1394 2HD1 LEU 34 2HD1 LEU 34 0.370 -3.228 -8.583 1395 3HD1 LEU 34 3HD1 LEU 34 -0.181 -2.692 -10.170 1396 1HD2 LEU 34 1HD2 LEU 34 -2.570 -1.131 -9.754 1397 2HD2 LEU 34 2HD2 LEU 34 -2.599 -0.286 -8.207 1398 3HD2 LEU 34 3HD2 LEU 34 -2.870 -2.027 -8.265 1399 H CYS 35 H CYS 35 1.446 0.769 -7.752 1400 HA CYS 35 HA CYS 35 2.231 1.849 -5.093 1401 1HB CYS 35 1HB CYS 35 3.904 1.737 -7.620 1402 2HB CYS 35 2HB CYS 35 4.257 2.868 -6.313 1403 HG CYS 35 HG CYS 35 4.072 0.256 -4.991 1404 H ILE 36 H ILE 36 2.798 4.365 -5.578 1405 HA ILE 36 HA ILE 36 0.655 5.376 -7.423 1406 HB ILE 36 HB ILE 36 1.637 6.500 -4.774 1407 1HG1 ILE 36 1HG1 ILE 36 -0.909 4.991 -5.443 1408 2HG1 ILE 36 2HG1 ILE 36 0.443 4.348 -4.512 1409 1HG2 ILE 36 1HG2 ILE 36 0.669 8.370 -5.637 1410 2HG2 ILE 36 2HG2 ILE 36 -0.848 7.549 -5.268 1411 3HG2 ILE 36 3HG2 ILE 36 -0.173 7.464 -6.895 1412 1HD1 ILE 36 1HD1 ILE 36 -0.630 6.950 -3.578 1413 2HD1 ILE 36 2HD1 ILE 36 -0.099 5.551 -2.646 1414 3HD1 ILE 36 3HD1 ILE 36 -1.704 5.566 -3.377 1415 H VAL 37 H VAL 37 1.227 7.140 -8.734 1416 HA VAL 37 HA VAL 37 4.092 8.017 -8.560 1417 HB VAL 37 HB VAL 37 2.227 7.839 -10.957 1418 1HG1 VAL 37 1HG1 VAL 37 4.257 9.482 -10.886 1419 2HG1 VAL 37 2HG1 VAL 37 4.075 8.424 -12.286 1420 3HG1 VAL 37 3HG1 VAL 37 5.233 8.019 -11.018 1421 1HG2 VAL 37 1HG2 VAL 37 3.956 5.872 -9.601 1422 2HG2 VAL 37 2HG2 VAL 37 4.219 5.993 -11.341 1423 3HG2 VAL 37 3HG2 VAL 37 2.615 5.610 -10.716 1424 H ARG 38 H ARG 38 3.916 9.976 -7.465 1425 HA ARG 38 HA ARG 38 2.072 12.014 -8.669 1426 1HB ARG 38 1HB ARG 38 2.945 11.719 -5.775 1427 2HB ARG 38 2HB ARG 38 1.754 12.859 -6.393 1428 1HG ARG 38 1HG ARG 38 1.434 9.867 -6.707 1429 2HG ARG 38 2HG ARG 38 0.826 10.737 -5.299 1430 1HD ARG 38 1HD ARG 38 -0.196 12.314 -7.240 1431 2HD ARG 38 2HD ARG 38 -0.157 10.770 -8.113 1432 HE ARG 38 HE ARG 38 -1.148 10.249 -5.505 1433 1HH1 ARG 38 1HH1 ARG 38 -2.058 12.001 -8.373 1434 2HH1 ARG 38 2HH1 ARG 38 -3.752 11.827 -8.073 1435 1HH2 ARG 38 1HH2 ARG 38 -3.352 10.037 -5.138 1436 2HH2 ARG 38 2HH2 ARG 38 -4.482 10.724 -6.257 1437 H HIS 39 H HIS 39 2.908 14.256 -8.462 1438 HA HIS 39 HA HIS 39 5.786 14.387 -8.967 1439 1HB HIS 39 1HB HIS 39 3.398 16.205 -8.987 1440 2HB HIS 39 2HB HIS 39 5.001 16.939 -8.964 1441 HD1 HIS 39 HD1 HIS 39 4.047 17.674 -11.485 1442 HD2 HIS 39 HD2 HIS 39 5.224 13.711 -10.943 1443 HE1 HIS 39 HE1 HIS 39 4.437 16.720 -13.798 1444 H ASN 40 H ASN 40 7.008 16.264 -7.797 1445 HA ASN 40 HA ASN 40 7.223 15.647 -5.007 1446 1HB ASN 40 1HB ASN 40 8.160 18.049 -6.623 1447 2HB ASN 40 2HB ASN 40 8.830 17.530 -5.077 1448 1HD2 ASN 40 1HD2 ASN 40 9.786 17.530 -8.127 1449 2HD2 ASN 40 2HD2 ASN 40 10.512 16.002 -8.264 1450 H ASP 41 H ASP 41 7.456 18.722 -4.407 1451 HA ASP 41 HA ASP 41 6.098 20.412 -3.489 1452 1HB ASP 41 1HB ASP 41 4.913 19.691 -5.822 1453 2HB ASP 41 2HB ASP 41 3.630 19.257 -4.693 1454 H ASP 42 H ASP 42 3.259 19.995 -2.765 1455 HA ASP 42 HA ASP 42 3.396 19.212 -0.120 1456 1HB ASP 42 1HB ASP 42 1.166 18.743 -2.133 1457 2HB ASP 42 2HB ASP 42 0.949 18.779 -0.383 1458 H TRP 43 H TRP 43 2.980 17.052 -2.915 1459 HA TRP 43 HA TRP 43 2.346 14.646 -1.580 1460 1HB TRP 43 1HB TRP 43 2.293 14.884 -3.990 1461 2HB TRP 43 2HB TRP 43 4.005 15.297 -4.040 1462 HD1 TRP 43 HD1 TRP 43 5.514 13.382 -4.689 1463 HE1 TRP 43 HE1 TRP 43 5.418 10.811 -4.552 1464 HE3 TRP 43 HE3 TRP 43 1.037 12.792 -2.303 1465 HZ2 TRP 43 HZ2 TRP 43 3.677 8.777 -3.566 1466 HZ3 TRP 43 HZ3 TRP 43 0.185 10.525 -1.776 1467 HH2 TRP 43 HH2 TRP 43 1.498 8.517 -2.404 1468 H GLY 44 H GLY 44 5.632 15.670 -2.616 1469 1HA GLY 44 1HA GLY 44 7.046 13.638 -1.263 1470 2HA GLY 44 2HA GLY 44 7.728 15.214 -1.662 1471 H THR 45 H THR 45 5.721 16.668 -0.044 1472 HA THR 45 HA THR 45 7.140 16.593 2.486 1473 HB THR 45 HB THR 45 4.575 17.960 1.593 1474 HG1 THR 45 HG1 THR 45 5.850 19.380 0.724 1475 1HG2 THR 45 1HG2 THR 45 4.448 18.884 3.650 1476 2HG2 THR 45 2HG2 THR 45 6.163 19.294 3.635 1477 3HG2 THR 45 3HG2 THR 45 5.643 17.696 4.171 1478 H ALA 46 H ALA 46 3.599 16.328 2.007 1479 HA ALA 46 HA ALA 46 2.924 15.183 4.448 1480 1HB ALA 46 1HB ALA 46 1.084 15.676 3.152 1481 2HB ALA 46 2HB ALA 46 1.183 13.960 2.757 1482 3HB ALA 46 3HB ALA 46 1.873 15.159 1.662 1483 H LEU 47 H LEU 47 3.988 13.434 1.516 1484 HA LEU 47 HA LEU 47 3.943 10.872 3.001 1485 1HB LEU 47 1HB LEU 47 4.258 11.817 0.163 1486 2HB LEU 47 2HB LEU 47 4.799 10.193 0.584 1487 HG LEU 47 HG LEU 47 2.452 10.179 -0.196 1488 1HD1 LEU 47 1HD1 LEU 47 2.319 9.709 2.767 1489 2HD1 LEU 47 2HD1 LEU 47 3.417 8.738 1.787 1490 3HD1 LEU 47 3HD1 LEU 47 1.685 8.718 1.453 1491 1HD2 LEU 47 1HD2 LEU 47 1.728 11.730 2.285 1492 2HD2 LEU 47 2HD2 LEU 47 0.749 11.426 0.850 1493 3HD2 LEU 47 3HD2 LEU 47 2.093 12.566 0.776 1494 H GLU 48 H GLU 48 6.050 13.238 3.284 1495 HA GLU 48 HA GLU 48 8.565 12.285 2.353 1496 1HB GLU 48 1HB GLU 48 9.460 13.818 4.077 1497 2HB GLU 48 2HB GLU 48 8.095 14.553 3.240 1498 1HG GLU 48 1HG GLU 48 7.176 14.905 5.269 1499 2HG GLU 48 2HG GLU 48 6.937 13.162 5.379 1500 H ASP 49 H ASP 49 8.487 9.949 2.742 1501 HA ASP 49 HA ASP 49 9.826 9.106 5.139 1502 1HB ASP 49 1HB ASP 49 7.095 9.600 5.454 1503 2HB ASP 49 2HB ASP 49 7.173 7.852 5.230 1504 H TYR 50 H TYR 50 7.169 7.567 3.300 1505 HA TYR 50 HA TYR 50 9.135 5.485 2.401 1506 1HB TYR 50 1HB TYR 50 6.115 5.333 2.744 1507 2HB TYR 50 2HB TYR 50 7.200 3.980 2.432 1508 HD1 TYR 50 HD1 TYR 50 5.270 5.107 4.914 1509 HD2 TYR 50 HD2 TYR 50 9.453 4.436 4.203 1510 HE1 TYR 50 HE1 TYR 50 5.645 4.860 7.352 1511 HE2 TYR 50 HE2 TYR 50 9.827 4.189 6.642 1512 HH TYR 50 HH TYR 50 8.067 3.438 8.705 1513 H LEU 51 H LEU 51 9.321 7.500 0.716 1514 HA LEU 51 HA LEU 51 7.303 7.067 -1.454 1515 1HB LEU 51 1HB LEU 51 9.092 9.347 -0.591 1516 2HB LEU 51 2HB LEU 51 8.374 9.326 -2.200 1517 HG LEU 51 HG LEU 51 6.859 9.187 0.425 1518 1HD1 LEU 51 1HD1 LEU 51 5.932 11.376 -0.860 1519 2HD1 LEU 51 2HD1 LEU 51 7.588 11.364 -1.465 1520 3HD1 LEU 51 3HD1 LEU 51 7.284 11.437 0.271 1521 1HD2 LEU 51 1HD2 LEU 51 5.570 7.945 -1.098 1522 2HD2 LEU 51 2HD2 LEU 51 6.033 8.959 -2.463 1523 3HD2 LEU 51 3HD2 LEU 51 4.907 9.571 -1.252 1524 H PHE 52 H PHE 52 8.060 5.745 -3.043 1525 HA PHE 52 HA PHE 52 10.965 5.475 -3.547 1526 1HB PHE 52 1HB PHE 52 8.408 4.101 -4.223 1527 2HB PHE 52 2HB PHE 52 9.688 3.978 -5.430 1528 HD1 PHE 52 HD1 PHE 52 11.446 2.441 -5.144 1529 HD2 PHE 52 HD2 PHE 52 9.032 3.554 -1.770 1530 HE1 PHE 52 HE1 PHE 52 12.582 0.722 -3.764 1531 HE2 PHE 52 HE2 PHE 52 10.167 1.836 -0.390 1532 HZ PHE 52 HZ PHE 52 11.942 0.419 -1.386 1533 H SER 53 H SER 53 11.483 7.552 -4.438 1534 HA SER 53 HA SER 53 9.874 8.535 -6.716 1535 1HB SER 53 1HB SER 53 11.168 10.572 -6.337 1536 2HB SER 53 2HB SER 53 10.646 9.947 -4.773 1537 HG SER 53 HG SER 53 13.183 9.667 -5.998 1538 H ARG 54 H ARG 54 10.683 8.797 -8.798 1539 HA ARG 54 HA ARG 54 13.285 7.429 -9.381 1540 1HB ARG 54 1HB ARG 54 10.780 6.882 -10.297 1541 2HB ARG 54 2HB ARG 54 11.301 8.045 -11.517 1542 1HG ARG 54 1HG ARG 54 13.006 6.677 -12.289 1543 2HG ARG 54 2HG ARG 54 13.195 5.861 -10.737 1544 1HD ARG 54 1HD ARG 54 12.113 4.191 -11.966 1545 2HD ARG 54 2HD ARG 54 10.709 5.032 -11.283 1546 HE ARG 54 HE ARG 54 11.278 6.460 -13.591 1547 1HH1 ARG 54 1HH1 ARG 54 10.684 3.109 -12.860 1548 2HH1 ARG 54 2HH1 ARG 54 9.998 2.778 -14.412 1549 1HH2 ARG 54 1HH2 ARG 54 10.383 6.005 -15.600 1550 2HH2 ARG 54 2HH2 ARG 54 9.828 4.403 -15.953 1551 H LYS 55 H LYS 55 14.038 8.430 -11.719 1552 HA LYS 55 HA LYS 55 14.694 11.210 -11.137 1553 1HB LYS 55 1HB LYS 55 15.745 9.052 -12.576 1554 2HB LYS 55 2HB LYS 55 15.296 10.216 -13.822 1555 1HG LYS 55 1HG LYS 55 16.854 11.026 -11.361 1556 2HG LYS 55 2HG LYS 55 17.653 10.452 -12.825 1557 1HD LYS 55 1HD LYS 55 15.655 12.412 -13.521 1558 2HD LYS 55 2HD LYS 55 16.727 13.074 -12.286 1559 1HE LYS 55 1HE LYS 55 17.878 13.578 -14.288 1560 2HE LYS 55 2HE LYS 55 18.635 12.051 -13.796 1561 1HZ LYS 55 1HZ LYS 55 16.476 12.481 -15.782 1562 2HZ LYS 55 2HZ LYS 55 16.751 10.957 -15.083 1563 3HZ LYS 55 3HZ LYS 55 17.968 11.701 -16.006 1564 H ASN 56 H ASN 56 12.282 11.790 -11.171 1565 HA ASN 56 HA ASN 56 10.875 11.886 -13.700 1566 1HB ASN 56 1HB ASN 56 11.166 14.585 -13.430 1567 2HB ASN 56 2HB ASN 56 12.741 14.043 -12.854 1568 1HD2 ASN 56 1HD2 ASN 56 10.587 12.751 -15.448 1569 2HD2 ASN 56 2HD2 ASN 56 11.762 12.834 -16.669 1570 H MET 57 H MET 57 10.540 11.320 -10.746 1571 HA MET 57 HA MET 57 8.825 13.451 -9.710 1572 1HB MET 57 1HB MET 57 6.804 11.991 -9.947 1573 2HB MET 57 2HB MET 57 7.445 12.520 -11.491 1574 1HG MET 57 1HG MET 57 8.528 9.970 -10.418 1575 2HG MET 57 2HG MET 57 6.845 9.943 -10.943 1576 1HE MET 57 1HE MET 57 6.227 11.528 -12.899 1577 2HE MET 57 2HE MET 57 6.125 9.909 -13.590 1578 3HE MET 57 3HE MET 57 6.890 11.210 -14.502 1579 H SER 58 H SER 58 7.236 12.067 -8.014 1580 HA SER 58 HA SER 58 9.047 10.247 -6.471 1581 1HB SER 58 1HB SER 58 7.767 11.478 -4.494 1582 2HB SER 58 2HB SER 58 9.167 12.238 -5.251 1583 HG SER 58 HG SER 58 7.903 13.772 -5.861 1584 H ALA 59 H ALA 59 8.029 8.294 -6.150 1585 HA ALA 59 HA ALA 59 5.045 8.220 -6.373 1586 1HB ALA 59 1HB ALA 59 5.580 6.588 -7.853 1587 2HB ALA 59 2HB ALA 59 6.186 5.631 -6.501 1588 3HB ALA 59 3HB ALA 59 7.281 6.683 -7.397 1589 H MET 60 H MET 60 4.024 6.421 -5.032 1590 HA MET 60 HA MET 60 5.165 6.466 -2.269 1591 1HB MET 60 1HB MET 60 2.701 7.130 -3.285 1592 2HB MET 60 2HB MET 60 2.426 5.457 -2.807 1593 1HG MET 60 1HG MET 60 3.702 7.480 -0.956 1594 2HG MET 60 2HG MET 60 1.959 7.228 -1.021 1595 1HE MET 60 1HE MET 60 4.149 6.842 1.424 1596 2HE MET 60 2HE MET 60 3.322 5.537 2.275 1597 3HE MET 60 3HE MET 60 2.393 6.872 1.593 1598 H ALA 61 H ALA 61 5.347 4.479 -1.097 1599 HA ALA 61 HA ALA 61 5.715 2.088 -2.773 1600 1HB ALA 61 1HB ALA 61 6.949 3.157 -0.583 1601 2HB ALA 61 2HB ALA 61 7.075 1.455 -1.030 1602 3HB ALA 61 3HB ALA 61 5.906 1.963 0.190 1603 H LEU 62 H LEU 62 3.445 1.717 -3.345 1604 HA LEU 62 HA LEU 62 1.405 0.570 -3.067 1605 1HB LEU 62 1HB LEU 62 0.940 1.417 -0.333 1606 2HB LEU 62 2HB LEU 62 1.661 2.733 -1.258 1607 HG LEU 62 HG LEU 62 -0.071 2.250 -3.062 1608 1HD1 LEU 62 1HD1 LEU 62 -1.915 1.044 -1.143 1609 2HD1 LEU 62 2HD1 LEU 62 -0.538 -0.002 -1.491 1610 3HD1 LEU 62 3HD1 LEU 62 -1.564 0.572 -2.806 1611 1HD2 LEU 62 1HD2 LEU 62 -0.198 4.069 -1.259 1612 2HD2 LEU 62 2HD2 LEU 62 -1.306 2.996 -0.406 1613 3HD2 LEU 62 3HD2 LEU 62 -1.725 3.603 -2.007 1614 H GLY 63 H GLY 63 3.007 -1.389 -2.884 1615 1HA GLY 63 1HA GLY 63 2.030 -3.098 -0.782 1616 2HA GLY 63 2HA GLY 63 3.293 -3.519 -1.937 1617 H PHE 64 H PHE 64 4.584 -4.482 -0.288 1618 HA PHE 64 HA PHE 64 5.427 -2.909 2.043 1619 1HB PHE 64 1HB PHE 64 5.800 -5.651 0.890 1620 2HB PHE 64 2HB PHE 64 6.981 -5.095 2.076 1621 HD1 PHE 64 HD1 PHE 64 3.308 -4.429 1.780 1622 HD2 PHE 64 HD2 PHE 64 6.472 -6.172 4.103 1623 HE1 PHE 64 HE1 PHE 64 1.700 -4.915 3.604 1624 HE2 PHE 64 HE2 PHE 64 4.865 -6.659 5.928 1625 HZ PHE 64 HZ PHE 64 2.479 -6.030 5.678 1626 H GLY 65 H GLY 65 6.158 -1.428 -0.168 1627 1HA GLY 65 1HA GLY 65 8.926 -2.079 -0.917 1628 2HA GLY 65 2HA GLY 65 8.011 -0.671 -1.458 1629 H ALA 66 H ALA 66 7.261 -0.145 1.446 1630 HA ALA 66 HA ALA 66 9.565 1.567 2.053 1631 1HB ALA 66 1HB ALA 66 7.169 1.079 3.820 1632 2HB ALA 66 2HB ALA 66 6.970 1.938 2.292 1633 3HB ALA 66 3HB ALA 66 8.040 2.586 3.536 1634 H ILE 67 H ILE 67 7.844 -1.073 3.751 1635 HA ILE 67 HA ILE 67 9.324 -1.336 6.056 1636 HB ILE 67 HB ILE 67 8.843 -3.836 5.781 1637 1HG1 ILE 67 1HG1 ILE 67 7.259 -4.302 3.829 1638 2HG1 ILE 67 2HG1 ILE 67 7.870 -2.825 3.097 1639 1HG2 ILE 67 1HG2 ILE 67 7.270 -2.190 6.791 1640 2HG2 ILE 67 2HG2 ILE 67 6.437 -3.508 5.968 1641 3HG2 ILE 67 3HG2 ILE 67 6.564 -1.927 5.196 1642 1HD1 ILE 67 1HD1 ILE 67 10.030 -4.518 4.070 1643 2HD1 ILE 67 2HD1 ILE 67 9.786 -3.828 2.466 1644 3HD1 ILE 67 3HD1 ILE 67 9.016 -5.354 2.894 1645 H PHE 68 H PHE 68 10.501 -2.051 2.824 1646 HA PHE 68 HA PHE 68 12.682 -3.758 3.508 1647 1HB PHE 68 1HB PHE 68 12.186 -1.708 1.327 1648 2HB PHE 68 2HB PHE 68 13.605 -2.752 1.335 1649 HD1 PHE 68 HD1 PHE 68 12.528 -5.296 2.363 1650 HD2 PHE 68 HD2 PHE 68 10.824 -2.500 -0.420 1651 HE1 PHE 68 HE1 PHE 68 11.192 -7.119 1.349 1652 HE2 PHE 68 HE2 PHE 68 9.488 -4.327 -1.434 1653 HZ PHE 68 HZ PHE 68 9.672 -6.636 -0.549 1654 H ASN 69 H ASN 69 14.130 -3.192 5.097 1655 HA ASN 69 HA ASN 69 14.859 -0.398 5.606 1656 1HB ASN 69 1HB ASN 69 15.734 -3.102 6.681 1657 2HB ASN 69 2HB ASN 69 16.326 -1.570 7.325 1658 1HD2 ASN 69 1HD2 ASN 69 14.292 -3.829 8.282 1659 2HD2 ASN 69 2HD2 ASN 69 13.009 -2.907 8.903 1660 H HIS 70 H HIS 70 17.446 -0.227 6.051 1661 HA HIS 70 HA HIS 70 18.724 -0.842 3.421 1662 1HB HIS 70 1HB HIS 70 18.442 1.500 4.679 1663 2HB HIS 70 2HB HIS 70 19.895 0.958 5.519 1664 HD1 HIS 70 HD1 HIS 70 20.366 3.325 3.793 1665 HD2 HIS 70 HD2 HIS 70 20.504 -0.540 2.237 1666 HE1 HIS 70 HE1 HIS 70 21.735 3.457 1.667 1667 H SER 71 H SER 71 20.084 -2.592 3.444 1668 HA SER 71 HA SER 71 21.517 -3.221 6.006 1669 1HB SER 71 1HB SER 71 19.729 -4.817 5.335 1670 2HB SER 71 2HB SER 71 20.533 -5.051 3.783 1671 HG SER 71 HG SER 71 21.758 -6.442 4.727 1672 H LYS 72 H LYS 72 23.669 -4.188 5.714 1673 HA LYS 72 HA LYS 72 25.222 -2.891 3.631 1674 1HB LYS 72 1HB LYS 72 25.950 -3.401 5.982 1675 2HB LYS 72 2HB LYS 72 25.937 -5.117 5.576 1676 1HG LYS 72 1HG LYS 72 28.088 -4.824 4.933 1677 2HG LYS 72 2HG LYS 72 27.428 -3.996 3.524 1678 1HD LYS 72 1HD LYS 72 27.797 -1.875 4.434 1679 2HD LYS 72 2HD LYS 72 27.808 -2.480 6.091 1680 1HE LYS 72 1HE LYS 72 29.931 -3.616 4.372 1681 2HE LYS 72 2HE LYS 72 30.081 -1.877 4.687 1682 1HZ LYS 72 1HZ LYS 72 31.031 -3.436 6.439 1683 2HZ LYS 72 2HZ LYS 72 29.422 -3.820 6.827 1684 3HZ LYS 72 3HZ LYS 72 29.979 -2.224 6.993 1685 H ASP 73 H ASP 73 23.607 -5.961 3.917 1686 HA ASP 73 HA ASP 73 24.720 -6.748 1.261 1687 1HB ASP 73 1HB ASP 73 25.913 -7.798 3.276 1688 2HB ASP 73 2HB ASP 73 24.400 -8.644 3.607 1689 HA PRO 74 HA PRO 74 20.064 -7.208 1.853 1690 1HB PRO 74 1HB PRO 74 19.979 -5.711 -0.697 1691 2HB PRO 74 2HB PRO 74 19.093 -5.406 0.806 1692 1HG PRO 74 1HG PRO 74 21.110 -3.834 -0.060 1693 2HG PRO 74 2HG PRO 74 20.734 -4.069 1.652 1694 1HD PRO 74 1HD PRO 74 22.944 -5.215 0.023 1695 2HD PRO 74 2HD PRO 74 22.923 -4.744 1.736 1696 H ASN 75 H ASN 75 19.716 -9.305 1.196 1697 HA ASN 75 HA ASN 75 20.842 -10.270 -1.367 1698 1HB ASN 75 1HB ASN 75 19.263 -11.596 0.872 1699 2HB ASN 75 2HB ASN 75 20.047 -12.451 -0.456 1700 1HD2 ASN 75 1HD2 ASN 75 20.722 -12.754 2.398 1701 2HD2 ASN 75 2HD2 ASN 75 22.335 -12.257 2.573 1702 H ALA 76 H ALA 76 18.431 -8.350 -1.158 1703 HA ALA 76 HA ALA 76 16.804 -9.738 -3.185 1704 1HB ALA 76 1HB ALA 76 16.179 -9.869 -0.427 1705 2HB ALA 76 2HB ALA 76 15.140 -10.347 -1.769 1706 3HB ALA 76 3HB ALA 76 15.043 -8.711 -1.118 1707 H ARG 77 H ARG 77 15.745 -8.234 -4.515 1708 HA ARG 77 HA ARG 77 15.769 -5.371 -3.635 1709 1HB ARG 77 1HB ARG 77 17.486 -6.591 -5.486 1710 2HB ARG 77 2HB ARG 77 16.282 -5.775 -6.482 1711 1HG ARG 77 1HG ARG 77 16.688 -3.670 -5.298 1712 2HG ARG 77 2HG ARG 77 17.831 -4.473 -4.220 1713 1HD ARG 77 1HD ARG 77 19.085 -3.326 -5.984 1714 2HD ARG 77 2HD ARG 77 19.207 -5.074 -6.259 1715 HE ARG 77 HE ARG 77 16.882 -4.242 -7.603 1716 1HH1 ARG 77 1HH1 ARG 77 20.293 -3.549 -7.707 1717 2HH1 ARG 77 2HH1 ARG 77 20.277 -3.173 -9.394 1718 1HH2 ARG 77 1HH2 ARG 77 16.889 -3.747 -9.794 1719 2HH2 ARG 77 2HH2 ARG 77 18.367 -3.283 -10.569 1720 H HIS 78 H HIS 78 14.727 -4.352 -6.065 1721 HA HIS 78 HA HIS 78 12.165 -5.832 -6.466 1722 1HB HIS 78 1HB HIS 78 10.983 -3.655 -6.055 1723 2HB HIS 78 2HB HIS 78 11.852 -4.227 -4.632 1724 HD1 HIS 78 HD1 HIS 78 14.254 -3.092 -4.207 1725 HD2 HIS 78 HD2 HIS 78 11.826 -1.165 -6.995 1726 HE1 HIS 78 HE1 HIS 78 15.231 -0.778 -4.529 1727 H GLU 79 H GLU 79 10.889 -4.793 -8.299 1728 HA GLU 79 HA GLU 79 12.707 -3.507 -10.309 1729 1HB GLU 79 1HB GLU 79 12.037 -6.070 -10.436 1730 2HB GLU 79 2HB GLU 79 10.514 -5.431 -11.053 1731 1HG GLU 79 1HG GLU 79 11.914 -5.834 -12.964 1732 2HG GLU 79 2HG GLU 79 11.884 -4.087 -12.719 1733 H LEU 80 H LEU 80 11.483 -2.253 -11.965 1734 HA LEU 80 HA LEU 80 8.756 -1.420 -11.039 1735 1HB LEU 80 1HB LEU 80 11.276 0.134 -11.527 1736 2HB LEU 80 2HB LEU 80 9.738 0.910 -11.907 1737 HG LEU 80 HG LEU 80 10.296 -0.420 -9.244 1738 1HD1 LEU 80 1HD1 LEU 80 11.815 1.321 -9.101 1739 2HD1 LEU 80 2HD1 LEU 80 10.350 2.167 -8.606 1740 3HD1 LEU 80 3HD1 LEU 80 10.938 2.319 -10.261 1741 1HD2 LEU 80 1HD2 LEU 80 8.428 1.505 -8.827 1742 2HD2 LEU 80 2HD2 LEU 80 8.023 -0.162 -9.236 1743 3HD2 LEU 80 3HD2 LEU 80 8.058 1.072 -10.496 1744 H THR 81 H THR 81 7.304 -1.504 -12.707 1745 HA THR 81 HA THR 81 8.092 -2.207 -15.397 1746 HB THR 81 HB THR 81 5.564 -1.606 -15.718 1747 HG1 THR 81 HG1 THR 81 5.062 -0.371 -14.050 1748 1HG2 THR 81 1HG2 THR 81 6.585 -3.680 -13.762 1749 2HG2 THR 81 2HG2 THR 81 6.242 -3.898 -15.478 1750 3HG2 THR 81 3HG2 THR 81 4.919 -3.643 -14.340 1751 H ALA 82 H ALA 82 6.594 -0.637 -17.072 1752 HA ALA 82 HA ALA 82 8.225 1.611 -17.613 1753 1HB ALA 82 1HB ALA 82 6.081 0.240 -18.735 1754 2HB ALA 82 2HB ALA 82 6.849 1.667 -19.432 1755 3HB ALA 82 3HB ALA 82 5.409 1.842 -18.429 1756 H GLY 83 H GLY 83 8.472 2.828 -15.631 1757 1HA GLY 83 1HA GLY 83 7.777 5.010 -14.749 1758 2HA GLY 83 2HA GLY 83 6.100 4.526 -15.004 1759 H LEU 84 H LEU 84 6.317 5.365 -12.576 1760 HA LEU 84 HA LEU 84 7.275 3.259 -10.728 1761 1HB LEU 84 1HB LEU 84 6.064 6.030 -10.446 1762 2HB LEU 84 2HB LEU 84 6.507 5.036 -9.059 1763 HG LEU 84 HG LEU 84 8.515 5.521 -11.242 1764 1HD1 LEU 84 1HD1 LEU 84 8.769 7.344 -8.980 1765 2HD1 LEU 84 2HD1 LEU 84 7.279 7.624 -9.881 1766 3HD1 LEU 84 3HD1 LEU 84 8.836 7.692 -10.708 1767 1HD2 LEU 84 1HD2 LEU 84 8.470 4.677 -8.372 1768 2HD2 LEU 84 2HD2 LEU 84 9.896 5.530 -8.963 1769 3HD2 LEU 84 3HD2 LEU 84 9.398 4.017 -9.720 1770 H LYS 85 H LYS 85 5.218 2.203 -12.238 1771 HA LYS 85 HA LYS 85 2.720 2.536 -10.650 1772 1HB LYS 85 1HB LYS 85 3.432 1.236 -13.300 1773 2HB LYS 85 2HB LYS 85 1.812 1.185 -12.606 1774 1HG LYS 85 1HG LYS 85 2.279 3.831 -12.406 1775 2HG LYS 85 2HG LYS 85 3.292 3.474 -13.805 1776 1HD LYS 85 1HD LYS 85 1.412 2.497 -14.987 1777 2HD LYS 85 2HD LYS 85 0.387 2.642 -13.559 1778 1HE LYS 85 1HE LYS 85 -0.195 4.729 -14.225 1779 2HE LYS 85 2HE LYS 85 1.504 5.226 -14.103 1780 1HZ LYS 85 1HZ LYS 85 0.836 5.483 -16.369 1781 2HZ LYS 85 2HZ LYS 85 0.163 3.924 -16.417 1782 3HZ LYS 85 3HZ LYS 85 1.846 4.119 -16.297 1783 H ARG 86 H ARG 86 3.862 -0.386 -12.316 1784 HA ARG 86 HA ARG 86 3.034 -2.045 -10.058 1785 1HB ARG 86 1HB ARG 86 3.028 -2.401 -12.685 1786 2HB ARG 86 2HB ARG 86 4.665 -2.994 -12.401 1787 1HG ARG 86 1HG ARG 86 3.878 -4.939 -11.576 1788 2HG ARG 86 2HG ARG 86 2.840 -4.086 -10.433 1789 1HD ARG 86 1HD ARG 86 1.247 -3.683 -12.414 1790 2HD ARG 86 2HD ARG 86 2.206 -4.898 -13.282 1791 HE ARG 86 HE ARG 86 1.432 -5.747 -10.594 1792 1HH1 ARG 86 1HH1 ARG 86 0.475 -5.554 -13.936 1793 2HH1 ARG 86 2HH1 ARG 86 -0.629 -6.879 -13.811 1794 1HH2 ARG 86 1HH2 ARG 86 -0.007 -7.464 -10.457 1795 2HH2 ARG 86 2HH2 ARG 86 -0.901 -7.954 -11.857 1796 H MET 87 H MET 87 4.340 -2.771 -8.434 1797 HA MET 87 HA MET 87 7.300 -2.383 -8.727 1798 1HB MET 87 1HB MET 87 5.287 -1.707 -6.721 1799 2HB MET 87 2HB MET 87 6.609 -2.636 -6.015 1800 1HG MET 87 1HG MET 87 8.179 -1.026 -7.265 1801 2HG MET 87 2HG MET 87 6.757 -0.012 -7.504 1802 1HE MET 87 1HE MET 87 8.867 -1.997 -5.159 1803 2HE MET 87 2HE MET 87 7.397 -2.306 -4.235 1804 3HE MET 87 3HE MET 87 8.672 -1.296 -3.553 1805 H ARG 88 H ARG 88 8.560 -4.215 -8.505 1806 HA ARG 88 HA ARG 88 7.198 -6.711 -7.540 1807 1HB ARG 88 1HB ARG 88 9.408 -6.326 -9.594 1808 2HB ARG 88 2HB ARG 88 8.645 -7.861 -9.181 1809 1HG ARG 88 1HG ARG 88 6.528 -7.138 -10.053 1810 2HG ARG 88 2HG ARG 88 7.093 -5.475 -10.214 1811 1HD ARG 88 1HD ARG 88 7.354 -6.231 -12.414 1812 2HD ARG 88 2HD ARG 88 8.949 -6.637 -11.752 1813 HE ARG 88 HE ARG 88 8.343 -8.912 -11.935 1814 1HH1 ARG 88 1HH1 ARG 88 5.503 -6.903 -11.804 1815 2HH1 ARG 88 2HH1 ARG 88 4.419 -8.232 -12.027 1816 1HH2 ARG 88 1HH2 ARG 88 6.915 -10.620 -12.222 1817 2HH2 ARG 88 2HH2 ARG 88 5.210 -10.321 -12.261 1818 H ILE 89 H ILE 89 8.726 -8.309 -6.561 1819 HA ILE 89 HA ILE 89 11.128 -7.005 -5.325 1820 HB ILE 89 HB ILE 89 9.051 -8.835 -4.064 1821 1HG1 ILE 89 1HG1 ILE 89 9.685 -5.925 -3.495 1822 2HG1 ILE 89 2HG1 ILE 89 8.341 -6.460 -4.504 1823 1HG2 ILE 89 1HG2 ILE 89 11.458 -7.445 -2.847 1824 2HG2 ILE 89 2HG2 ILE 89 11.338 -9.175 -3.169 1825 3HG2 ILE 89 3HG2 ILE 89 10.281 -8.425 -1.973 1826 1HD1 ILE 89 1HD1 ILE 89 7.093 -7.050 -2.708 1827 2HD1 ILE 89 2HD1 ILE 89 8.238 -6.101 -1.760 1828 3HD1 ILE 89 3HD1 ILE 89 8.456 -7.844 -1.921 1829 H PHE 90 H PHE 90 12.658 -8.105 -6.613 1830 HA PHE 90 HA PHE 90 12.438 -11.040 -6.947 1831 1HB PHE 90 1HB PHE 90 14.110 -8.777 -8.015 1832 2HB PHE 90 2HB PHE 90 14.695 -10.431 -8.195 1833 HD1 PHE 90 HD1 PHE 90 12.275 -7.952 -9.312 1834 HD2 PHE 90 HD2 PHE 90 13.299 -12.123 -9.411 1835 HE1 PHE 90 HE1 PHE 90 10.745 -8.282 -11.236 1836 HE2 PHE 90 HE2 PHE 90 11.769 -12.452 -11.335 1837 HZ PHE 90 HZ PHE 90 10.492 -10.532 -12.248 1838 H THR 91 H THR 91 14.859 -12.065 -6.756 1839 HA THR 91 HA THR 91 15.793 -11.349 -3.998 1840 HB THR 91 HB THR 91 16.357 -14.058 -5.040 1841 HG1 THR 91 HG1 THR 91 14.063 -14.586 -4.531 1842 1HG2 THR 91 1HG2 THR 91 15.461 -14.633 -2.798 1843 2HG2 THR 91 2HG2 THR 91 15.067 -12.931 -2.552 1844 3HG2 THR 91 3HG2 THR 91 16.751 -13.430 -2.741 1845 H ILE 92 H ILE 92 17.388 -9.871 -5.041 1846 HA ILE 92 HA ILE 92 19.383 -10.781 -6.874 1847 HB ILE 92 HB ILE 92 20.674 -8.837 -5.862 1848 1HG1 ILE 92 1HG1 ILE 92 18.341 -7.911 -4.352 1849 2HG1 ILE 92 2HG1 ILE 92 19.096 -9.336 -3.647 1850 1HG2 ILE 92 1HG2 ILE 92 17.774 -8.404 -6.633 1851 2HG2 ILE 92 2HG2 ILE 92 19.154 -8.470 -7.730 1852 3HG2 ILE 92 3HG2 ILE 92 18.997 -7.134 -6.588 1853 1HD1 ILE 92 1HD1 ILE 92 21.185 -8.253 -3.409 1854 2HD1 ILE 92 2HD1 ILE 92 20.015 -7.018 -2.943 1855 3HD1 ILE 92 3HD1 ILE 92 20.747 -6.978 -4.547 1856 H LYS 93 H LYS 93 20.290 -12.686 -6.386 1857 HA LYS 93 HA LYS 93 21.999 -14.056 -5.465 1858 1HB LYS 93 1HB LYS 93 21.901 -12.358 -2.959 1859 2HB LYS 93 2HB LYS 93 23.184 -13.434 -3.483 1860 1HG LYS 93 1HG LYS 93 22.463 -10.723 -4.600 1861 2HG LYS 93 2HG LYS 93 24.003 -11.271 -3.959 1862 1HD LYS 93 1HD LYS 93 24.606 -11.650 -6.099 1863 2HD LYS 93 2HD LYS 93 23.525 -13.041 -6.046 1864 1HE LYS 93 1HE LYS 93 22.177 -12.045 -7.573 1865 2HE LYS 93 2HE LYS 93 21.954 -10.667 -6.478 1866 1HZ LYS 93 1HZ LYS 93 24.314 -11.096 -8.241 1867 2HZ LYS 93 2HZ LYS 93 24.055 -9.761 -7.224 1868 3HZ LYS 93 3HZ LYS 93 23.047 -10.014 -8.566 1869 HA PRO 94 HA PRO 94 18.758 -16.669 -3.888 1870 1HB PRO 94 1HB PRO 94 21.215 -18.174 -3.025 1871 2HB PRO 94 2HB PRO 94 19.728 -18.793 -3.775 1872 1HG PRO 94 1HG PRO 94 21.902 -18.434 -5.222 1873 2HG PRO 94 2HG PRO 94 20.315 -18.005 -5.869 1874 1HD PRO 94 1HD PRO 94 22.509 -16.242 -4.911 1875 2HD PRO 94 2HD PRO 94 21.292 -15.955 -6.171 1876 H ILE 95 H ILE 95 17.866 -17.076 -1.808 1877 HA ILE 95 HA ILE 95 19.434 -15.930 0.470 1878 HB ILE 95 HB ILE 95 16.487 -15.857 -0.240 1879 1HG1 ILE 95 1HG1 ILE 95 18.534 -13.665 0.214 1880 2HG1 ILE 95 2HG1 ILE 95 18.021 -14.247 -1.370 1881 1HG2 ILE 95 1HG2 ILE 95 17.845 -15.578 2.358 1882 2HG2 ILE 95 2HG2 ILE 95 16.137 -15.833 2.007 1883 3HG2 ILE 95 3HG2 ILE 95 16.817 -14.207 1.944 1884 1HD1 ILE 95 1HD1 ILE 95 16.461 -12.694 0.673 1885 2HD1 ILE 95 2HD1 ILE 95 15.610 -13.741 -0.463 1886 3HD1 ILE 95 3HD1 ILE 95 16.608 -12.416 -1.063 1887 H ALA 96 H ALA 96 19.183 -17.003 2.519 1888 HA ALA 96 HA ALA 96 18.354 -19.857 2.280 1889 1HB ALA 96 1HB ALA 96 20.003 -18.281 4.290 1890 2HB ALA 96 2HB ALA 96 20.627 -19.361 3.043 1891 3HB ALA 96 3HB ALA 96 19.708 -20.017 4.398 1892 H ILE 97 H ILE 97 17.111 -20.792 4.098 1893 HA ILE 97 HA ILE 97 14.803 -19.261 4.810 1894 HB ILE 97 HB ILE 97 16.045 -21.792 5.952 1895 1HG1 ILE 97 1HG1 ILE 97 13.658 -22.136 4.367 1896 2HG1 ILE 97 2HG1 ILE 97 14.852 -21.218 3.450 1897 1HG2 ILE 97 1HG2 ILE 97 13.753 -20.245 6.806 1898 2HG2 ILE 97 2HG2 ILE 97 14.427 -21.712 7.518 1899 3HG2 ILE 97 3HG2 ILE 97 13.236 -21.827 6.222 1900 1HD1 ILE 97 1HD1 ILE 97 14.929 -24.033 4.364 1901 2HD1 ILE 97 2HD1 ILE 97 16.437 -23.140 4.559 1902 3HD1 ILE 97 3HD1 ILE 97 15.697 -23.282 2.965 1903 H GLY 98 H GLY 98 14.787 -17.584 6.248 1904 1HA GLY 98 1HA GLY 98 14.923 -16.927 8.618 1905 2HA GLY 98 2HA GLY 98 16.403 -17.878 8.742 1906 H GLU 99 H GLU 99 15.800 -15.826 5.961 1907 HA GLU 99 HA GLU 99 18.099 -14.122 6.828 1908 1HB GLU 99 1HB GLU 99 16.871 -15.001 4.220 1909 2HB GLU 99 2HB GLU 99 17.829 -13.522 4.253 1910 1HG GLU 99 1HG GLU 99 18.754 -16.277 5.127 1911 2HG GLU 99 2HG GLU 99 19.259 -15.424 3.670 1912 H GLU 100 H GLU 100 17.832 -11.790 5.742 1913 HA GLU 100 HA GLU 100 15.079 -10.815 6.437 1914 1HB GLU 100 1HB GLU 100 16.748 -10.061 8.030 1915 2HB GLU 100 2HB GLU 100 17.845 -9.586 6.734 1916 1HG GLU 100 1HG GLU 100 16.759 -7.615 6.371 1917 2HG GLU 100 2HG GLU 100 15.168 -8.342 6.594 1918 H ILE 101 H ILE 101 13.996 -10.009 4.690 1919 HA ILE 101 HA ILE 101 15.472 -9.448 2.192 1920 HB ILE 101 HB ILE 101 12.523 -9.433 2.930 1921 1HG1 ILE 101 1HG1 ILE 101 14.197 -11.509 1.488 1922 2HG1 ILE 101 2HG1 ILE 101 13.648 -11.638 3.159 1923 1HG2 ILE 101 1HG2 ILE 101 13.261 -8.066 0.894 1924 2HG2 ILE 101 2HG2 ILE 101 12.061 -9.322 0.589 1925 3HG2 ILE 101 3HG2 ILE 101 13.752 -9.598 0.172 1926 1HD1 ILE 101 1HD1 ILE 101 11.557 -11.030 1.138 1927 2HD1 ILE 101 2HD1 ILE 101 11.482 -12.081 2.551 1928 3HD1 ILE 101 3HD1 ILE 101 12.253 -12.649 1.070 1929 H THR 102 H THR 102 16.040 -7.420 1.609 1930 HA THR 102 HA THR 102 14.452 -5.072 2.444 1931 HB THR 102 HB THR 102 16.634 -4.079 3.393 1932 HG1 THR 102 HG1 THR 102 18.299 -5.357 3.579 1933 1HG2 THR 102 1HG2 THR 102 14.668 -5.032 4.726 1934 2HG2 THR 102 2HG2 THR 102 16.220 -4.984 5.564 1935 3HG2 THR 102 3HG2 THR 102 15.625 -6.504 4.893 1936 H ILE 103 H ILE 103 15.692 -3.020 1.510 1937 HA ILE 103 HA ILE 103 17.188 -3.743 -0.972 1938 HB ILE 103 HB ILE 103 15.668 -2.294 -2.261 1939 1HG1 ILE 103 1HG1 ILE 103 13.499 -1.911 -0.509 1940 2HG1 ILE 103 2HG1 ILE 103 14.928 -1.420 0.402 1941 1HG2 ILE 103 1HG2 ILE 103 13.665 -3.686 -2.152 1942 2HG2 ILE 103 2HG2 ILE 103 14.106 -4.240 -0.537 1943 3HG2 ILE 103 3HG2 ILE 103 15.090 -4.700 -1.926 1944 1HD1 ILE 103 1HD1 ILE 103 13.730 -0.221 -2.040 1945 2HD1 ILE 103 2HD1 ILE 103 15.492 -0.272 -1.983 1946 3HD1 ILE 103 3HD1 ILE 103 14.593 0.556 -0.712 1947 H SER 104 H SER 104 18.401 -1.905 -1.857 1948 HA SER 104 HA SER 104 19.405 -0.117 0.247 1949 1HB SER 104 1HB SER 104 20.548 -1.408 -1.802 1950 2HB SER 104 2HB SER 104 20.155 0.088 -2.650 1951 HG SER 104 HG SER 104 21.702 1.034 -1.623 1952 H TYR 105 H TYR 105 19.994 2.192 -1.190 1953 HA TYR 105 HA TYR 105 17.280 3.260 -1.896 1954 1HB TYR 105 1HB TYR 105 19.560 4.376 -0.241 1955 2HB TYR 105 2HB TYR 105 18.250 5.396 -0.839 1956 HD1 TYR 105 HD1 TYR 105 15.886 3.740 -0.625 1957 HD2 TYR 105 HD2 TYR 105 19.229 4.039 2.055 1958 HE1 TYR 105 HE1 TYR 105 14.448 2.991 1.250 1959 HE2 TYR 105 HE2 TYR 105 17.791 3.290 3.932 1960 HH TYR 105 HH TYR 105 15.397 1.742 3.906 1961 H GLY 106 H GLY 106 20.448 4.877 -1.980 1962 1HA GLY 106 1HA GLY 106 21.435 4.591 -4.464 1963 2HA GLY 106 2HA GLY 106 19.972 5.503 -4.832 1964 H ASP 107 H ASP 107 21.244 7.314 -5.561 1965 HA ASP 107 HA ASP 107 23.338 8.631 -4.258 1966 1HB ASP 107 1HB ASP 107 20.983 9.484 -5.936 1967 2HB ASP 107 2HB ASP 107 22.095 10.704 -5.317 1968 H ASP 108 H ASP 108 19.843 9.302 -3.824 1969 HA ASP 108 HA ASP 108 20.314 11.005 -1.494 1970 1HB ASP 108 1HB ASP 108 18.164 10.184 -3.282 1971 2HB ASP 108 2HB ASP 108 17.629 10.144 -1.602 1972 H TYR 109 H TYR 109 18.439 10.143 0.337 1973 HA TYR 109 HA TYR 109 18.341 8.724 2.231 1974 1HB TYR 109 1HB TYR 109 17.976 7.246 -0.308 1975 2HB TYR 109 2HB TYR 109 18.286 6.229 1.100 1976 HD1 TYR 109 HD1 TYR 109 16.420 5.531 2.301 1977 HD2 TYR 109 HD2 TYR 109 16.298 9.306 0.256 1978 HE1 TYR 109 HE1 TYR 109 14.082 5.863 3.055 1979 HE2 TYR 109 HE2 TYR 109 13.959 9.639 1.010 1980 HH TYR 109 HH TYR 109 12.032 8.148 1.728 1981 H TRP 110 H TRP 110 20.420 9.075 3.175 1982 HA TRP 110 HA TRP 110 22.741 7.499 2.296 1983 1HB TRP 110 1HB TRP 110 23.795 8.690 4.262 1984 2HB TRP 110 2HB TRP 110 23.058 9.771 3.083 1985 HD1 TRP 110 HD1 TRP 110 21.294 11.406 3.950 1986 HE1 TRP 110 HE1 TRP 110 20.018 11.709 6.171 1987 HE3 TRP 110 HE3 TRP 110 22.769 7.186 6.384 1988 HZ2 TRP 110 HZ2 TRP 110 19.672 10.329 8.660 1989 HZ3 TRP 110 HZ3 TRP 110 21.962 6.694 8.661 1990 HH2 TRP 110 HH2 TRP 110 20.415 8.258 9.813 1991 H LEU 111 H LEU 111 23.777 5.877 3.569 1992 HA LEU 111 HA LEU 111 21.894 4.261 5.171 1993 1HB LEU 111 1HB LEU 111 23.248 3.240 3.407 1994 2HB LEU 111 2HB LEU 111 24.727 3.854 4.142 1995 HG LEU 111 HG LEU 111 23.544 2.487 6.234 1996 1HD1 LEU 111 1HD1 LEU 111 21.883 1.299 5.151 1997 2HD1 LEU 111 2HD1 LEU 111 23.235 0.193 4.909 1998 3HD1 LEU 111 3HD1 LEU 111 22.748 1.287 3.614 1999 1HD2 LEU 111 1HD2 LEU 111 25.466 1.327 4.196 2000 2HD2 LEU 111 2HD2 LEU 111 25.329 0.878 5.897 2001 3HD2 LEU 111 3HD2 LEU 111 25.933 2.474 5.452 2002 H SER 112 H SER 112 25.390 4.688 5.749 2003 HA SER 112 HA SER 112 25.131 6.159 8.206 2004 1HB SER 112 1HB SER 112 24.000 4.235 9.061 2005 2HB SER 112 2HB SER 112 25.132 3.131 8.281 2006 HG SER 112 HG SER 112 25.494 4.756 10.546 2007 H ARG 113 H ARG 113 27.107 3.233 7.855 2008 HA ARG 113 HA ARG 113 29.540 4.916 7.998 2009 1HB ARG 113 1HB ARG 113 28.795 2.024 8.392 2010 2HB ARG 113 2HB ARG 113 30.490 2.466 8.186 2011 1HG ARG 113 1HG ARG 113 30.439 3.902 10.106 2012 2HG ARG 113 2HG ARG 113 28.681 3.806 10.210 2013 1HD ARG 113 1HD ARG 113 29.481 1.135 10.303 2014 2HD ARG 113 2HD ARG 113 30.690 1.976 11.291 2015 HE ARG 113 HE ARG 113 28.203 3.096 11.982 2016 1HH1 ARG 113 1HH1 ARG 113 29.725 -0.034 12.061 2017 2HH1 ARG 113 2HH1 ARG 113 28.819 -0.562 13.435 2018 1HH2 ARG 113 1HH2 ARG 113 27.039 2.387 13.766 2019 2HH2 ARG 113 2HH2 ARG 113 27.309 0.796 14.395 2020 HA PRO 114 HA PRO 114 29.908 4.389 3.552 2021 1HB PRO 114 1HB PRO 114 32.387 5.604 3.338 2022 2HB PRO 114 2HB PRO 114 30.854 6.491 3.389 2023 1HG PRO 114 1HG PRO 114 32.846 6.014 5.543 2024 2HG PRO 114 2HG PRO 114 31.857 7.443 5.216 2025 1HD PRO 114 1HD PRO 114 31.298 5.649 7.187 2026 2HD PRO 114 2HD PRO 114 30.055 6.612 6.362 2027 H ARG 115 H ARG 115 30.271 2.021 4.583 2028 HA ARG 115 HA ARG 115 33.110 1.210 4.049 2029 1HB ARG 115 1HB ARG 115 30.940 -0.137 5.703 2030 2HB ARG 115 2HB ARG 115 32.632 -0.628 5.613 2031 1HG ARG 115 1HG ARG 115 31.708 2.090 6.592 2032 2HG ARG 115 2HG ARG 115 32.081 0.735 7.657 2033 1HD ARG 115 1HD ARG 115 34.061 1.823 5.628 2034 2HD ARG 115 2HD ARG 115 34.010 2.354 7.319 2035 HE ARG 115 HE ARG 115 33.984 -0.515 7.213 2036 1HH1 ARG 115 1HH1 ARG 115 36.077 2.220 6.704 2037 2HH1 ARG 115 2HH1 ARG 115 37.510 1.336 7.097 2038 1HH2 ARG 115 1HH2 ARG 115 35.859 -1.641 7.720 2039 2HH2 ARG 115 2HH2 ARG 115 37.391 -0.833 7.669 2040 H LEU 116 H LEU 116 31.176 1.543 1.922 2041 HA LEU 116 HA LEU 116 30.634 -1.311 1.169 2042 1HB LEU 116 1HB LEU 116 29.270 1.332 0.669 2043 2HB LEU 116 2HB LEU 116 28.996 -0.017 -0.433 2044 HG LEU 116 HG LEU 116 28.524 -1.390 1.726 2045 1HD1 LEU 116 1HD1 LEU 116 28.647 1.429 2.709 2046 2HD1 LEU 116 2HD1 LEU 116 29.098 -0.065 3.530 2047 3HD1 LEU 116 3HD1 LEU 116 27.398 0.380 3.380 2048 1HD2 LEU 116 1HD2 LEU 116 26.155 -0.211 1.813 2049 2HD2 LEU 116 2HD2 LEU 116 26.660 -1.091 0.370 2050 3HD2 LEU 116 3HD2 LEU 116 26.781 0.668 0.417 2051 H THR 117 H THR 117 33.228 -0.298 0.753 2052 HA THR 117 HA THR 117 33.381 -0.428 -2.195 2053 HB THR 117 HB THR 117 34.411 1.911 -0.544 2054 HG1 THR 117 HG1 THR 117 32.778 3.010 -1.391 2055 1HG2 THR 117 1HG2 THR 117 35.805 2.356 -2.254 2056 2HG2 THR 117 2HG2 THR 117 34.454 2.326 -3.387 2057 3HG2 THR 117 3HG2 THR 117 35.325 0.838 -3.014 2058 H GLN 118 H GLN 118 35.475 -1.104 -2.898 2059 HA GLN 118 HA GLN 118 37.294 -1.986 -0.684 2060 1HB GLN 118 1HB GLN 118 36.089 -3.655 -2.207 2061 2HB GLN 118 2HB GLN 118 37.086 -3.038 -3.524 2062 1HG GLN 118 1HG GLN 118 38.769 -3.586 -1.260 2063 2HG GLN 118 2HG GLN 118 37.781 -5.008 -1.595 2064 1HE2 GLN 118 1HE2 GLN 118 37.958 -5.973 -3.780 2065 2HE2 GLN 118 2HE2 GLN 118 39.314 -5.657 -4.751 2066 H ASN 119 H ASN 119 37.260 0.682 -2.117 2067 HA ASN 119 HA ASN 119 39.984 0.535 -3.367 2068 1HB ASN 119 1HB ASN 119 37.421 1.813 -4.058 2069 2HB ASN 119 2HB ASN 119 38.797 2.912 -4.162 2070 1HD2 ASN 119 1HD2 ASN 119 39.097 2.959 -6.441 2071 2HD2 ASN 119 2HD2 ASN 119 39.436 1.580 -7.370 2072 1H GLY 201 1H GLY 201 29.161 26.174 5.706 2073 2H GLY 201 2H GLY 201 28.242 25.471 6.948 2074 3H GLY 201 3H GLY 201 29.237 24.499 5.974 2075 1HA GLY 201 1HA GLY 201 29.956 26.286 8.181 2076 2HA GLY 201 2HA GLY 201 30.573 24.680 7.791 2077 H LYS 202 H LYS 202 30.872 28.101 7.129 2078 HA LYS 202 HA LYS 202 32.550 29.317 5.994 2079 1HB LYS 202 1HB LYS 202 34.009 26.745 6.710 2080 2HB LYS 202 2HB LYS 202 34.797 28.256 6.257 2081 1HG LYS 202 1HG LYS 202 34.546 29.094 8.337 2082 2HG LYS 202 2HG LYS 202 32.830 28.687 8.354 2083 1HD LYS 202 1HD LYS 202 33.318 26.414 9.045 2084 2HD LYS 202 2HD LYS 202 35.050 26.681 8.851 2085 1HE LYS 202 1HE LYS 202 34.564 28.677 10.568 2086 2HE LYS 202 2HE LYS 202 33.222 27.613 11.029 2087 1HZ LYS 202 1HZ LYS 202 36.070 26.789 10.757 2088 2HZ LYS 202 2HZ LYS 202 34.783 25.778 11.211 2089 3HZ LYS 202 3HZ LYS 202 35.266 27.048 12.230 2090 H ALA 203 H ALA 203 30.797 27.973 4.240 2091 HA ALA 203 HA ALA 203 32.442 27.774 1.852 2092 1HB ALA 203 1HB ALA 203 32.436 25.535 3.412 2093 2HB ALA 203 2HB ALA 203 32.614 25.486 1.658 2094 3HB ALA 203 3HB ALA 203 31.034 25.211 2.393 2095 HA PRO 204 HA PRO 204 28.574 28.623 -0.042 2096 1HB PRO 204 1HB PRO 204 28.724 27.148 -2.385 2097 2HB PRO 204 2HB PRO 204 29.548 28.697 -2.135 2098 1HG PRO 204 1HG PRO 204 30.620 25.926 -1.987 2099 2HG PRO 204 2HG PRO 204 31.386 27.402 -2.591 2100 1HD PRO 204 1HD PRO 204 31.947 26.310 -0.163 2101 2HD PRO 204 2HD PRO 204 32.074 28.049 -0.502 2102 H ARG 205 H ARG 205 26.809 27.710 0.977 2103 HA ARG 205 HA ARG 205 26.410 24.756 0.776 2104 1HB ARG 205 1HB ARG 205 26.359 26.487 2.895 2105 2HB ARG 205 2HB ARG 205 24.650 26.452 2.461 2106 1HG ARG 205 1HG ARG 205 26.060 23.831 2.549 2107 2HG ARG 205 2HG ARG 205 25.762 24.621 4.097 2108 1HD ARG 205 1HD ARG 205 23.391 24.673 3.718 2109 2HD ARG 205 2HD ARG 205 23.591 24.227 2.013 2110 HE ARG 205 HE ARG 205 24.814 22.284 3.796 2111 1HH1 ARG 205 1HH1 ARG 205 21.808 23.335 2.387 2112 2HH1 ARG 205 2HH1 ARG 205 21.077 21.772 2.511 2113 1HH2 ARG 205 1HH2 ARG 205 23.843 20.266 3.946 2114 2HH2 ARG 205 2HH2 ARG 205 22.218 20.047 3.387 2115 H LYS 206 H LYS 206 24.423 23.936 -0.036 2116 HA LYS 206 HA LYS 206 22.645 25.947 -1.380 2117 1HB LYS 206 1HB LYS 206 23.697 23.249 -2.300 2118 2HB LYS 206 2HB LYS 206 22.439 24.143 -3.154 2119 1HG LYS 206 1HG LYS 206 23.951 26.017 -3.512 2120 2HG LYS 206 2HG LYS 206 25.197 25.243 -2.532 2121 1HD LYS 206 1HD LYS 206 24.051 23.842 -4.942 2122 2HD LYS 206 2HD LYS 206 25.350 25.022 -5.122 2123 1HE LYS 206 1HE LYS 206 25.778 23.025 -2.973 2124 2HE LYS 206 2HE LYS 206 25.798 22.377 -4.624 2125 1HZ LYS 206 1HZ LYS 206 27.361 24.683 -3.581 2126 2HZ LYS 206 2HZ LYS 206 27.272 24.265 -5.224 2127 3HZ LYS 206 3HZ LYS 206 27.980 23.194 -4.113 2128 H GLN 207 H GLN 207 20.851 25.878 -0.019 2129 HA GLN 207 HA GLN 207 19.929 23.428 1.255 2130 1HB GLN 207 1HB GLN 207 19.702 26.015 1.826 2131 2HB GLN 207 2HB GLN 207 18.242 25.883 0.847 2132 1HG GLN 207 1HG GLN 207 17.289 25.240 2.821 2133 2HG GLN 207 2HG GLN 207 17.988 23.672 2.415 2134 1HE2 GLN 207 1HE2 GLN 207 19.297 22.806 4.030 2135 2HE2 GLN 207 2HE2 GLN 207 20.101 23.706 5.223 2136 H LEU 208 H LEU 208 18.498 25.526 -1.286 2137 HA LEU 208 HA LEU 208 16.449 23.583 -1.971 2138 1HB LEU 208 1HB LEU 208 16.796 26.248 -2.279 2139 2HB LEU 208 2HB LEU 208 17.328 25.711 -3.873 2140 HG LEU 208 HG LEU 208 14.872 24.386 -2.949 2141 1HD1 LEU 208 1HD1 LEU 208 13.716 26.203 -2.291 2142 2HD1 LEU 208 2HD1 LEU 208 13.973 26.910 -3.887 2143 3HD1 LEU 208 3HD1 LEU 208 15.119 27.232 -2.585 2144 1HD2 LEU 208 1HD2 LEU 208 14.278 25.515 -5.316 2145 2HD2 LEU 208 2HD2 LEU 208 15.238 24.041 -5.194 2146 3HD2 LEU 208 3HD2 LEU 208 16.037 25.598 -5.410 2147 H ALA 209 H ALA 209 16.348 22.359 -3.965 2148 HA ALA 209 HA ALA 209 18.743 22.199 -5.676 2149 1HB ALA 209 1HB ALA 209 19.074 20.838 -3.506 2150 2HB ALA 209 2HB ALA 209 19.333 19.972 -5.021 2151 3HB ALA 209 3HB ALA 209 17.826 19.759 -4.129 2152 H THR 210 H THR 210 17.947 21.881 -7.714 2153 HA THR 210 HA THR 210 15.197 21.240 -8.248 2154 HB THR 210 HB THR 210 16.316 20.902 -10.613 2155 HG1 THR 210 HG1 THR 210 18.396 20.688 -10.267 2156 1HG2 THR 210 1HG2 THR 210 16.241 23.239 -10.943 2157 2HG2 THR 210 2HG2 THR 210 16.801 23.576 -9.306 2158 3HG2 THR 210 3HG2 THR 210 15.163 22.981 -9.571 2159 H LYS 211 H LYS 211 18.132 19.289 -8.033 2160 HA LYS 211 HA LYS 211 16.704 16.876 -9.014 2161 1HB LYS 211 1HB LYS 211 19.064 17.578 -9.675 2162 2HB LYS 211 2HB LYS 211 19.553 17.222 -8.019 2163 1HG LYS 211 1HG LYS 211 19.708 15.033 -8.516 2164 2HG LYS 211 2HG LYS 211 18.018 15.012 -9.016 2165 1HD LYS 211 1HD LYS 211 18.870 14.537 -11.075 2166 2HD LYS 211 2HD LYS 211 19.189 16.270 -11.148 2167 1HE LYS 211 1HE LYS 211 21.314 14.968 -9.683 2168 2HE LYS 211 2HE LYS 211 21.103 14.186 -11.261 2169 1HZ LYS 211 1HZ LYS 211 21.072 17.133 -10.949 2170 2HZ LYS 211 2HZ LYS 211 21.293 16.228 -12.369 2171 3HZ LYS 211 3HZ LYS 211 22.523 16.285 -11.199 2172 H ALA 212 H ALA 212 15.685 17.909 -6.565 2173 HA ALA 212 HA ALA 212 16.903 16.392 -4.351 2174 1HB ALA 212 1HB ALA 212 15.895 18.091 -3.242 2175 2HB ALA 212 2HB ALA 212 14.318 17.496 -3.760 2176 3HB ALA 212 3HB ALA 212 15.195 18.654 -4.760 2177 H ALA 213 H ALA 213 16.568 14.173 -4.828 2178 HA ALA 213 HA ALA 213 13.761 13.283 -5.327 2179 1HB ALA 213 1HB ALA 213 15.382 12.476 -6.914 2180 2HB ALA 213 2HB ALA 213 15.027 11.114 -5.852 2181 3HB ALA 213 3HB ALA 213 16.512 12.039 -5.632 2182 H ARG 214 H ARG 214 13.764 10.769 -4.294 2183 HA ARG 214 HA ARG 214 14.403 11.146 -1.387 2184 1HB ARG 214 1HB ARG 214 11.971 9.966 -2.774 2185 2HB ARG 214 2HB ARG 214 12.246 9.865 -1.035 2186 1HG ARG 214 1HG ARG 214 12.512 12.433 -1.121 2187 2HG ARG 214 2HG ARG 214 11.779 12.327 -2.721 2188 1HD ARG 214 1HD ARG 214 9.886 12.630 -1.368 2189 2HD ARG 214 2HD ARG 214 9.972 10.860 -1.432 2190 HE ARG 214 HE ARG 214 10.594 10.886 0.849 2191 1HH1 ARG 214 1HH1 ARG 214 11.182 13.988 -0.617 2192 2HH1 ARG 214 2HH1 ARG 214 11.659 14.725 0.872 2193 1HH2 ARG 214 1HH2 ARG 214 11.217 11.864 2.770 2194 2HH2 ARG 214 2HH2 ARG 214 11.680 13.533 2.777 2195 1HN MLZ 215 1HN MLZ 215 12.950 8.305 -2.940 2196 HA MLZ 215 HA MLZ 215 15.267 6.692 -1.996 2197 1HB MLZ 215 1HB MLZ 215 12.375 6.343 -2.538 2198 2HB MLZ 215 2HB MLZ 215 13.378 4.959 -2.971 2199 1HG MLZ 215 1HG MLZ 215 13.475 6.348 -0.278 2200 2HG MLZ 215 2HG MLZ 215 14.294 4.853 -0.727 2201 1HD MLZ 215 1HD MLZ 215 11.320 5.010 -1.051 2202 2HD MLZ 215 2HD MLZ 215 12.334 3.610 -0.700 2203 1HE MLZ 215 1HE MLZ 215 11.016 5.434 1.161 2204 2HE MLZ 215 2HE MLZ 215 12.754 5.297 1.488 2205 HZ MLZ 215 HZ MLZ 215 12.386 2.814 1.090 2206 1HCM MLZ 215 1HCM MLZ 215 11.212 2.730 3.453 2207 2HCM MLZ 215 2HCM MLZ 215 11.668 4.433 3.403 2208 3HCM MLZ 215 3HCM MLZ 215 12.902 3.184 3.242 2209 H SER 216 H SER 216 16.758 5.943 -3.451 2210 HA SER 216 HA SER 216 17.782 5.415 -5.509 2211 1HB SER 216 1HB SER 216 15.780 7.301 -6.752 2212 2HB SER 216 2HB SER 216 17.005 7.917 -5.643 2213 HG SER 216 HG SER 216 17.319 7.489 -8.163 2214 H ALA 217 H ALA 217 17.289 4.494 -7.737 2215 HA ALA 217 HA ALA 217 14.665 3.035 -7.706 2216 1HB ALA 217 1HB ALA 217 14.342 3.747 -9.853 2217 2HB ALA 217 2HB ALA 217 16.019 3.425 -10.295 2218 3HB ALA 217 3HB ALA 217 15.592 4.939 -9.497 2219 HA PRO 218 HA PRO 218 16.815 -0.757 -8.212 2220 1HB PRO 218 1HB PRO 218 15.799 -1.863 -10.547 2221 2HB PRO 218 2HB PRO 218 14.962 -1.890 -8.985 2222 1HG PRO 218 1HG PRO 218 14.553 -0.112 -11.330 2223 2HG PRO 218 2HG PRO 218 13.369 -0.776 -10.197 2224 1HD PRO 218 1HD PRO 218 14.248 1.797 -10.109 2225 2HD PRO 218 2HD PRO 218 13.698 0.907 -8.674 2226 H ALA 219 H ALA 219 16.635 1.092 -11.252 2227 HA ALA 219 HA ALA 219 19.528 0.905 -11.611 2228 1HB ALA 219 1HB ALA 219 18.236 -1.307 -12.366 2229 2HB ALA 219 2HB ALA 219 19.580 -0.681 -13.320 2230 3HB ALA 219 3HB ALA 219 17.920 -0.350 -13.813 2231 H THR 220 H THR 220 18.286 3.235 -11.433 2232 HA THR 220 HA THR 220 18.310 4.284 -14.214 2233 HB THR 220 HB THR 220 16.043 4.621 -12.213 2234 HG1 THR 220 HG1 THR 220 14.884 3.499 -13.840 2235 1HG2 THR 220 1HG2 THR 220 15.626 6.534 -13.335 2236 2HG2 THR 220 2HG2 THR 220 15.263 5.536 -14.743 2237 3HG2 THR 220 3HG2 THR 220 16.887 6.185 -14.517 2238 H GLY 221 H GLY 221 20.326 5.268 -13.397 2239 1HA GLY 221 1HA GLY 221 20.204 7.114 -11.140 2240 2HA GLY 221 2HA GLY 221 21.576 6.897 -12.226 2241 1HN SAH 301 1HN SAH 301 -10.513 -1.052 -7.994 2242 2HN SAH 301 2HN SAH 301 -9.142 -0.594 -8.889 2243 HA SAH 301 HA SAH 301 -9.898 1.820 -8.238 2244 1HB SAH 301 1HB SAH 301 -11.402 -0.123 -6.552 2245 2HB SAH 301 2HB SAH 301 -10.716 1.263 -5.706 2246 1HG SAH 301 1HG SAH 301 -13.126 1.295 -7.003 2247 2HG SAH 301 2HG SAH 301 -12.053 1.918 -8.257 2248 1H5* SAH 301 1H5* SAH 301 -14.423 2.674 -6.390 2249 2H5* SAH 301 2H5* SAH 301 -14.161 3.974 -5.228 2250 H4* SAH 301 H4* SAH 301 -13.535 5.220 -7.508 2251 H3* SAH 301 H3* SAH 301 -15.718 5.108 -5.611 2252 *HO3 SAH 301 *HO3 SAH 301 -15.870 7.357 -6.667 2253 H2* SAH 301 H2* SAH 301 -17.506 4.867 -6.934 2254 *HO2 SAH 301 *HO2 SAH 301 -17.997 6.442 -8.335 2255 H1* SAH 301 H1* SAH 301 -16.353 4.742 -9.564 2256 H8 SAH 301 H8 SAH 301 -16.110 1.744 -7.242 2257 1HN6 SAH 301 1HN6 SAH 301 -21.824 0.247 -8.809 2258 2HN6 SAH 301 2HN6 SAH 301 -20.716 0.128 -7.461 2259 H2 SAH 301 H2 SAH 301 -20.864 4.231 -10.724 2260 1HN SAH 302 1HN SAH 302 10.804 -1.023 8.083 2261 2HN SAH 302 2HN SAH 302 9.462 -0.589 9.026 2262 HA SAH 302 HA SAH 302 10.170 1.837 8.365 2263 1HB SAH 302 1HB SAH 302 11.639 -0.081 6.619 2264 2HB SAH 302 2HB SAH 302 10.909 1.300 5.802 2265 1HG SAH 302 1HG SAH 302 13.360 1.357 7.021 2266 2HG SAH 302 2HG SAH 302 12.321 1.961 8.311 2267 1H5* SAH 302 1H5* SAH 302 14.619 2.755 6.373 2268 2H5* SAH 302 2H5* SAH 302 14.304 4.056 5.227 2269 H4* SAH 302 H4* SAH 302 13.737 5.285 7.531 2270 H3* SAH 302 H3* SAH 302 15.859 5.208 5.565 2271 *HO3 SAH 302 *HO3 SAH 302 16.018 7.454 6.624 2272 H2* SAH 302 H2* SAH 302 17.691 4.984 6.829 2273 *HO2 SAH 302 *HO2 SAH 302 18.207 6.559 8.220 2274 H1* SAH 302 H1* SAH 302 16.625 4.833 9.494 2275 H8 SAH 302 H8 SAH 302 16.343 1.841 7.166 2276 1HN6 SAH 302 1HN6 SAH 302 22.124 0.410 8.542 2277 2HN6 SAH 302 2HN6 SAH 302 20.975 0.283 7.229 2278 H2 SAH 302 H2 SAH 302 21.176 4.374 10.506 Start of MODEL 2 1 1H MET 1 1H MET 1 -2.711 -9.925 -4.945 2 2H MET 1 2H MET 1 -1.246 -9.199 -5.404 3 3H MET 1 3H MET 1 -1.237 -10.686 -4.583 4 HA MET 1 HA MET 1 -2.404 -10.278 -7.289 5 1HB MET 1 1HB MET 1 0.317 -10.764 -6.219 6 2HB MET 1 2HB MET 1 -0.152 -11.800 -7.558 7 1HG MET 1 1HG MET 1 0.638 -10.031 -8.773 8 2HG MET 1 2HG MET 1 -1.012 -9.470 -8.524 9 1HE MET 1 1HE MET 1 0.757 -6.405 -8.601 10 2HE MET 1 2HE MET 1 -0.840 -6.460 -7.853 11 3HE MET 1 3HE MET 1 -0.452 -7.551 -9.185 12 H PHE 2 H PHE 2 -1.692 -12.815 -8.177 13 HA PHE 2 HA PHE 2 -3.759 -14.483 -7.271 14 1HB PHE 2 1HB PHE 2 -2.499 -16.231 -8.478 15 2HB PHE 2 2HB PHE 2 -2.416 -14.708 -9.360 16 HD1 PHE 2 HD1 PHE 2 -0.550 -17.112 -7.288 17 HD2 PHE 2 HD2 PHE 2 -0.345 -13.409 -9.455 18 HE1 PHE 2 HE1 PHE 2 1.925 -17.173 -7.155 19 HE2 PHE 2 HE2 PHE 2 2.131 -13.470 -9.322 20 HZ PHE 2 HZ PHE 2 3.266 -15.351 -8.172 21 H ASN 3 H ASN 3 -4.005 -15.795 -5.500 22 HA ASN 3 HA ASN 3 -1.625 -16.724 -3.993 23 1HB ASN 3 1HB ASN 3 -2.224 -14.495 -3.091 24 2HB ASN 3 2HB ASN 3 -3.876 -15.050 -2.826 25 1HD2 ASN 3 1HD2 ASN 3 -4.172 -15.511 -0.642 26 2HD2 ASN 3 2HD2 ASN 3 -3.028 -16.263 0.361 27 H ASP 4 H ASP 4 -2.246 -18.410 -2.392 28 HA ASP 4 HA ASP 4 -4.231 -20.234 -3.414 29 1HB ASP 4 1HB ASP 4 -2.770 -20.095 -0.749 30 2HB ASP 4 2HB ASP 4 -3.562 -21.528 -1.404 31 H ARG 5 H ARG 5 -5.869 -18.215 -3.204 32 HA ARG 5 HA ARG 5 -7.937 -18.921 -1.394 33 1HB ARG 5 1HB ARG 5 -5.750 -17.413 -0.255 34 2HB ARG 5 2HB ARG 5 -7.207 -16.419 -0.231 35 1HG ARG 5 1HG ARG 5 -8.287 -18.717 0.622 36 2HG ARG 5 2HG ARG 5 -6.637 -18.989 1.177 37 1HD ARG 5 1HD ARG 5 -8.274 -16.503 1.796 38 2HD ARG 5 2HD ARG 5 -8.015 -17.851 2.919 39 HE ARG 5 HE ARG 5 -5.486 -17.002 1.878 40 1HH1 ARG 5 1HH1 ARG 5 -8.031 -15.954 4.009 41 2HH1 ARG 5 2HH1 ARG 5 -6.970 -14.999 4.985 42 1HH2 ARG 5 1HH2 ARG 5 -4.129 -15.756 3.160 43 2HH2 ARG 5 2HH2 ARG 5 -4.777 -14.886 4.510 44 H VAL 6 H VAL 6 -6.283 -16.320 -3.117 45 HA VAL 6 HA VAL 6 -8.796 -15.566 -4.477 46 HB VAL 6 HB VAL 6 -8.462 -13.158 -3.741 47 1HG1 VAL 6 1HG1 VAL 6 -8.878 -14.886 -1.317 48 2HG1 VAL 6 2HG1 VAL 6 -10.019 -14.960 -2.660 49 3HG1 VAL 6 3HG1 VAL 6 -9.753 -13.437 -1.813 50 1HG2 VAL 6 1HG2 VAL 6 -7.106 -12.785 -1.711 51 2HG2 VAL 6 2HG2 VAL 6 -6.108 -13.370 -3.042 52 3HG2 VAL 6 3HG2 VAL 6 -6.588 -14.470 -1.749 53 H ILE 7 H ILE 7 -8.068 -13.340 -5.777 54 HA ILE 7 HA ILE 7 -5.261 -13.416 -6.645 55 HB ILE 7 HB ILE 7 -6.222 -15.337 -7.829 56 1HG1 ILE 7 1HG1 ILE 7 -6.000 -12.956 -9.697 57 2HG1 ILE 7 2HG1 ILE 7 -4.629 -13.861 -9.055 58 1HG2 ILE 7 1HG2 ILE 7 -8.333 -15.358 -8.642 59 2HG2 ILE 7 2HG2 ILE 7 -8.112 -13.813 -9.464 60 3HG2 ILE 7 3HG2 ILE 7 -8.562 -13.848 -7.759 61 1HD1 ILE 7 1HD1 ILE 7 -6.255 -14.478 -11.335 62 2HD1 ILE 7 2HD1 ILE 7 -6.474 -15.750 -10.132 63 3HD1 ILE 7 3HD1 ILE 7 -4.856 -15.360 -10.719 64 H VAL 8 H VAL 8 -4.881 -11.701 -8.336 65 HA VAL 8 HA VAL 8 -6.637 -9.389 -7.806 66 HB VAL 8 HB VAL 8 -4.180 -9.212 -7.690 67 1HG1 VAL 8 1HG1 VAL 8 -2.849 -10.204 -9.211 68 2HG1 VAL 8 2HG1 VAL 8 -3.621 -9.319 -10.527 69 3HG1 VAL 8 3HG1 VAL 8 -4.296 -10.853 -9.980 70 1HG2 VAL 8 1HG2 VAL 8 -5.657 -7.711 -9.846 71 2HG2 VAL 8 2HG2 VAL 8 -3.945 -7.393 -9.560 72 3HG2 VAL 8 3HG2 VAL 8 -5.116 -7.140 -8.267 73 H LYS 9 H LYS 9 -8.297 -8.936 -9.140 74 HA LYS 9 HA LYS 9 -7.969 -9.290 -12.054 75 1HB LYS 9 1HB LYS 9 -10.073 -10.590 -10.318 76 2HB LYS 9 2HB LYS 9 -10.224 -10.465 -12.071 77 1HG LYS 9 1HG LYS 9 -7.920 -11.564 -12.204 78 2HG LYS 9 2HG LYS 9 -8.111 -11.936 -10.493 79 1HD LYS 9 1HD LYS 9 -9.631 -13.578 -10.905 80 2HD LYS 9 2HD LYS 9 -10.455 -12.627 -12.141 81 1HE LYS 9 1HE LYS 9 -8.541 -13.134 -13.707 82 2HE LYS 9 2HE LYS 9 -7.902 -14.235 -12.475 83 1HZ LYS 9 1HZ LYS 9 -10.484 -14.376 -13.918 84 2HZ LYS 9 2HZ LYS 9 -10.262 -15.177 -12.436 85 3HZ LYS 9 3HZ LYS 9 -9.293 -15.577 -13.772 86 H LYS 10 H LYS 10 -10.011 -6.331 -12.198 87 HA LYS 10 HA LYS 10 -8.813 -6.580 -14.178 88 1HB LYS 10 1HB LYS 10 -7.116 -7.079 -11.975 89 2HB LYS 10 2HB LYS 10 -6.721 -8.310 -13.175 90 1HG LYS 10 1HG LYS 10 -6.893 -5.334 -13.739 91 2HG LYS 10 2HG LYS 10 -5.392 -6.227 -13.492 92 1HD LYS 10 1HD LYS 10 -5.453 -7.127 -15.577 93 2HD LYS 10 2HD LYS 10 -7.185 -7.443 -15.485 94 1HE LYS 10 1HE LYS 10 -7.702 -5.490 -16.551 95 2HE LYS 10 2HE LYS 10 -6.489 -4.573 -15.638 96 1HZ LYS 10 1HZ LYS 10 -5.692 -4.706 -17.852 97 2HZ LYS 10 2HZ LYS 10 -6.053 -6.361 -17.970 98 3HZ LYS 10 3HZ LYS 10 -4.785 -5.838 -16.969 99 H SER 11 H SER 11 -10.942 -8.365 -13.784 100 HA SER 11 HA SER 11 -10.009 -11.049 -14.627 101 1HB SER 11 1HB SER 11 -12.112 -11.706 -13.873 102 2HB SER 11 2HB SER 11 -11.937 -10.217 -12.948 103 HG SER 11 HG SER 11 -13.863 -10.015 -13.926 104 HA PRO 12 HA PRO 12 -11.150 -10.983 -18.889 105 1HB PRO 12 1HB PRO 12 -13.948 -11.940 -18.468 106 2HB PRO 12 2HB PRO 12 -12.676 -12.608 -19.506 107 1HG PRO 12 1HG PRO 12 -13.393 -13.761 -17.191 108 2HG PRO 12 2HG PRO 12 -11.734 -13.807 -17.797 109 1HD PRO 12 1HD PRO 12 -12.884 -12.238 -15.567 110 2HD PRO 12 2HD PRO 12 -11.229 -12.839 -15.795 111 H LEU 13 H LEU 13 -11.313 -8.833 -19.485 112 HA LEU 13 HA LEU 13 -12.301 -6.738 -19.951 113 1HB LEU 13 1HB LEU 13 -14.406 -8.859 -20.235 114 2HB LEU 13 2HB LEU 13 -14.900 -7.172 -20.378 115 HG LEU 13 HG LEU 13 -14.304 -8.132 -22.583 116 1HD1 LEU 13 1HD1 LEU 13 -13.297 -6.195 -23.278 117 2HD1 LEU 13 2HD1 LEU 13 -12.028 -6.297 -22.058 118 3HD1 LEU 13 3HD1 LEU 13 -13.627 -5.696 -21.619 119 1HD2 LEU 13 1HD2 LEU 13 -12.616 -9.751 -21.666 120 2HD2 LEU 13 2HD2 LEU 13 -11.516 -8.394 -21.420 121 3HD2 LEU 13 3HD2 LEU 13 -12.026 -8.832 -23.051 122 H GLY 14 H GLY 14 -11.828 -6.877 -17.272 123 1HA GLY 14 1HA GLY 14 -14.274 -5.611 -16.134 124 2HA GLY 14 2HA GLY 14 -13.453 -6.866 -15.210 125 H GLY 15 H GLY 15 -13.714 -4.323 -14.134 126 1HA GLY 15 1HA GLY 15 -11.331 -2.726 -14.646 127 2HA GLY 15 2HA GLY 15 -12.485 -2.478 -13.336 128 H TYR 16 H TYR 16 -10.428 -2.152 -12.038 129 HA TYR 16 HA TYR 16 -8.938 -4.654 -11.458 130 1HB TYR 16 1HB TYR 16 -8.595 -1.721 -11.150 131 2HB TYR 16 2HB TYR 16 -7.896 -2.698 -9.859 132 HD1 TYR 16 HD1 TYR 16 -6.105 -4.303 -10.310 133 HD2 TYR 16 HD2 TYR 16 -7.772 -1.883 -13.443 134 HE1 TYR 16 HE1 TYR 16 -4.193 -4.886 -11.776 135 HE2 TYR 16 HE2 TYR 16 -5.859 -2.467 -14.910 136 HH TYR 16 HH TYR 16 -3.192 -3.331 -14.194 137 H GLY 17 H GLY 17 -10.290 -5.907 -10.157 138 1HA GLY 17 1HA GLY 17 -10.971 -4.745 -7.494 139 2HA GLY 17 2HA GLY 17 -12.168 -5.706 -8.367 140 H VAL 18 H VAL 18 -12.031 -7.212 -6.443 141 HA VAL 18 HA VAL 18 -9.532 -8.877 -6.548 142 HB VAL 18 HB VAL 18 -11.623 -8.383 -4.401 143 1HG1 VAL 18 1HG1 VAL 18 -9.086 -10.021 -4.149 144 2HG1 VAL 18 2HG1 VAL 18 -10.660 -10.751 -4.469 145 3HG1 VAL 18 3HG1 VAL 18 -10.387 -9.864 -2.969 146 1HG2 VAL 18 1HG2 VAL 18 -9.565 -7.480 -3.208 147 2HG2 VAL 18 2HG2 VAL 18 -10.126 -6.526 -4.582 148 3HG2 VAL 18 3HG2 VAL 18 -8.728 -7.587 -4.757 149 H PHE 19 H PHE 19 -9.745 -11.062 -7.021 150 HA PHE 19 HA PHE 19 -12.496 -12.022 -7.704 151 1HB PHE 19 1HB PHE 19 -9.935 -12.095 -8.957 152 2HB PHE 19 2HB PHE 19 -10.346 -13.756 -8.531 153 HD1 PHE 19 HD1 PHE 19 -11.586 -14.974 -10.073 154 HD2 PHE 19 HD2 PHE 19 -12.026 -10.702 -9.939 155 HE1 PHE 19 HE1 PHE 19 -13.159 -15.076 -11.988 156 HE2 PHE 19 HE2 PHE 19 -13.599 -10.805 -11.854 157 HZ PHE 19 HZ PHE 19 -14.163 -12.992 -12.882 158 H ALA 20 H ALA 20 -13.302 -13.865 -6.677 159 HA ALA 20 HA ALA 20 -11.709 -14.865 -4.360 160 1HB ALA 20 1HB ALA 20 -13.992 -15.620 -3.612 161 2HB ALA 20 2HB ALA 20 -14.657 -14.938 -5.097 162 3HB ALA 20 3HB ALA 20 -13.901 -13.883 -3.903 163 H ARG 21 H ARG 21 -10.427 -16.453 -5.507 164 HA ARG 21 HA ARG 21 -11.458 -18.435 -7.291 165 1HB ARG 21 1HB ARG 21 -9.033 -17.704 -6.041 166 2HB ARG 21 2HB ARG 21 -9.320 -19.375 -5.557 167 1HG ARG 21 1HG ARG 21 -9.187 -20.169 -7.725 168 2HG ARG 21 2HG ARG 21 -9.754 -18.653 -8.426 169 1HD ARG 21 1HD ARG 21 -7.626 -17.901 -8.687 170 2HD ARG 21 2HD ARG 21 -7.215 -18.311 -7.011 171 HE ARG 21 HE ARG 21 -7.426 -20.771 -8.304 172 1HH1 ARG 21 1HH1 ARG 21 -5.584 -17.854 -8.770 173 2HH1 ARG 21 2HH1 ARG 21 -4.246 -18.683 -9.485 174 1HH2 ARG 21 1HH2 ARG 21 -5.676 -21.825 -9.237 175 2HH2 ARG 21 2HH2 ARG 21 -4.295 -20.913 -9.749 176 H LYS 22 H LYS 22 -11.551 -18.101 -3.818 177 HA LYS 22 HA LYS 22 -12.516 -20.877 -3.417 178 1HB LYS 22 1HB LYS 22 -11.295 -18.685 -1.892 179 2HB LYS 22 2HB LYS 22 -12.578 -19.507 -1.023 180 1HG LYS 22 1HG LYS 22 -11.518 -21.620 -1.209 181 2HG LYS 22 2HG LYS 22 -10.381 -21.015 -2.413 182 1HD LYS 22 1HD LYS 22 -9.072 -20.936 -0.513 183 2HD LYS 22 2HD LYS 22 -9.747 -19.316 -0.495 184 1HE LYS 22 1HE LYS 22 -10.082 -20.117 1.723 185 2HE LYS 22 2HE LYS 22 -11.651 -20.375 0.941 186 1HZ LYS 22 1HZ LYS 22 -10.946 -22.407 2.015 187 2HZ LYS 22 2HZ LYS 22 -9.451 -22.362 1.210 188 3HZ LYS 22 3HZ LYS 22 -10.880 -22.621 0.331 189 H SER 23 H SER 23 -15.819 -19.774 -2.133 190 HA SER 23 HA SER 23 -13.410 -21.466 -1.568 191 1HB SER 23 1HB SER 23 -16.005 -22.304 -0.502 192 2HB SER 23 2HB SER 23 -16.047 -22.060 -2.248 193 HG SER 23 HG SER 23 -14.895 -24.036 -0.820 194 H PHE 24 H PHE 24 -15.559 -19.085 -0.252 195 HA PHE 24 HA PHE 24 -14.301 -19.477 2.443 196 1HB PHE 24 1HB PHE 24 -15.228 -17.056 0.875 197 2HB PHE 24 2HB PHE 24 -14.777 -16.962 2.563 198 HD1 PHE 24 HD1 PHE 24 -13.578 -16.468 -0.644 199 HD2 PHE 24 HD2 PHE 24 -12.449 -18.324 3.062 200 HE1 PHE 24 HE1 PHE 24 -11.191 -16.311 -1.293 201 HE2 PHE 24 HE2 PHE 24 -10.061 -18.167 2.412 202 HZ PHE 24 HZ PHE 24 -9.433 -17.160 0.234 203 H GLU 25 H GLU 25 -15.650 -18.843 4.280 204 HA GLU 25 HA GLU 25 -18.529 -19.473 3.799 205 1HB GLU 25 1HB GLU 25 -16.690 -20.583 5.451 206 2HB GLU 25 2HB GLU 25 -17.325 -19.334 6.519 207 1HG GLU 25 1HG GLU 25 -19.656 -20.220 5.657 208 2HG GLU 25 2HG GLU 25 -18.736 -21.673 5.281 209 H LYS 26 H LYS 26 -20.009 -18.278 5.454 210 HA LYS 26 HA LYS 26 -19.710 -15.434 5.076 211 1HB LYS 26 1HB LYS 26 -21.855 -16.566 5.121 212 2HB LYS 26 2HB LYS 26 -21.541 -17.099 6.753 213 1HG LYS 26 1HG LYS 26 -21.591 -14.845 7.602 214 2HG LYS 26 2HG LYS 26 -21.652 -14.188 5.967 215 1HD LYS 26 1HD LYS 26 -23.856 -15.171 5.611 216 2HD LYS 26 2HD LYS 26 -23.786 -15.970 7.182 217 1HE LYS 26 1HE LYS 26 -23.325 -13.049 7.283 218 2HE LYS 26 2HE LYS 26 -24.957 -13.528 6.781 219 1HZ LYS 26 1HZ LYS 26 -23.543 -14.753 9.088 220 2HZ LYS 26 2HZ LYS 26 -25.186 -14.896 8.683 221 3HZ LYS 26 3HZ LYS 26 -24.578 -13.417 9.257 222 H GLY 27 H GLY 27 -17.549 -15.180 6.166 223 1HA GLY 27 1HA GLY 27 -17.256 -13.778 8.347 224 2HA GLY 27 2HA GLY 27 -17.738 -15.276 9.141 225 H GLU 28 H GLU 28 -15.633 -14.894 6.290 226 HA GLU 28 HA GLU 28 -13.432 -16.133 7.907 227 1HB GLU 28 1HB GLU 28 -14.418 -16.516 5.082 228 2HB GLU 28 2HB GLU 28 -12.759 -16.934 5.510 229 1HG GLU 28 1HG GLU 28 -13.901 -18.182 7.528 230 2HG GLU 28 2HG GLU 28 -15.321 -18.144 6.489 231 H LEU 29 H LEU 29 -11.248 -15.452 7.272 232 HA LEU 29 HA LEU 29 -11.165 -12.614 6.430 233 1HB LEU 29 1HB LEU 29 -10.021 -13.745 8.471 234 2HB LEU 29 2HB LEU 29 -8.882 -14.406 7.301 235 HG LEU 29 HG LEU 29 -8.087 -12.282 8.329 236 1HD1 LEU 29 1HD1 LEU 29 -8.683 -11.667 5.455 237 2HD1 LEU 29 2HD1 LEU 29 -7.698 -13.076 5.848 238 3HD1 LEU 29 3HD1 LEU 29 -7.175 -11.467 6.347 239 1HD2 LEU 29 1HD2 LEU 29 -9.968 -10.654 6.731 240 2HD2 LEU 29 2HD2 LEU 29 -9.309 -10.356 8.339 241 3HD2 LEU 29 3HD2 LEU 29 -10.676 -11.453 8.134 242 H VAL 30 H VAL 30 -10.564 -12.058 4.375 243 HA VAL 30 HA VAL 30 -9.615 -14.188 2.540 244 HB VAL 30 HB VAL 30 -10.503 -11.305 2.144 245 1HG1 VAL 30 1HG1 VAL 30 -10.190 -13.498 0.077 246 2HG1 VAL 30 2HG1 VAL 30 -8.965 -12.264 0.373 247 3HG1 VAL 30 3HG1 VAL 30 -10.561 -11.799 -0.214 248 1HG2 VAL 30 1HG2 VAL 30 -11.961 -13.681 2.711 249 2HG2 VAL 30 2HG2 VAL 30 -12.242 -13.293 1.013 250 3HG2 VAL 30 3HG2 VAL 30 -12.605 -12.102 2.261 251 H GLU 31 H GLU 31 -8.643 -10.909 3.608 252 HA GLU 31 HA GLU 31 -5.820 -11.585 3.465 253 1HB GLU 31 1HB GLU 31 -6.652 -11.357 1.048 254 2HB GLU 31 2HB GLU 31 -6.891 -9.644 1.394 255 1HG GLU 31 1HG GLU 31 -4.717 -9.708 0.487 256 2HG GLU 31 2HG GLU 31 -4.425 -9.702 2.227 257 H GLU 32 H GLU 32 -4.510 -9.871 4.308 258 HA GLU 32 HA GLU 32 -5.879 -7.341 5.080 259 1HB GLU 32 1HB GLU 32 -5.095 -7.706 7.426 260 2HB GLU 32 2HB GLU 32 -6.219 -8.963 6.908 261 1HG GLU 32 1HG GLU 32 -4.124 -10.291 6.202 262 2HG GLU 32 2HG GLU 32 -3.214 -9.130 7.169 263 H CYS 33 H CYS 33 -4.375 -5.611 5.413 264 HA CYS 33 HA CYS 33 -1.479 -6.230 5.107 265 1HB CYS 33 1HB CYS 33 -3.261 -5.373 3.047 266 2HB CYS 33 2HB CYS 33 -2.186 -4.025 3.415 267 HG CYS 33 HG CYS 33 -0.293 -6.155 3.203 268 H LEU 34 H LEU 34 -0.736 -3.518 4.628 269 HA LEU 34 HA LEU 34 -1.269 -2.375 7.325 270 1HB LEU 34 1HB LEU 34 0.915 -2.516 5.383 271 2HB LEU 34 2HB LEU 34 0.685 -0.886 6.016 272 HG LEU 34 HG LEU 34 2.241 -2.192 7.426 273 1HD1 LEU 34 1HD1 LEU 34 1.340 -1.487 9.466 274 2HD1 LEU 34 2HD1 LEU 34 -0.304 -1.920 8.997 275 3HD1 LEU 34 3HD1 LEU 34 0.463 -0.490 8.305 276 1HD2 LEU 34 1HD2 LEU 34 0.012 -3.920 8.386 277 2HD2 LEU 34 2HD2 LEU 34 1.741 -4.257 8.314 278 3HD2 LEU 34 3HD2 LEU 34 0.763 -4.349 6.850 279 H CYS 35 H CYS 35 -1.206 0.163 7.256 280 HA CYS 35 HA CYS 35 -2.514 1.313 4.858 281 1HB CYS 35 1HB CYS 35 -3.767 0.762 7.529 282 2HB CYS 35 2HB CYS 35 -4.244 2.232 6.680 283 HG CYS 35 HG CYS 35 -5.058 0.762 4.677 284 H ILE 36 H ILE 36 -2.460 3.672 4.908 285 HA ILE 36 HA ILE 36 -0.313 4.710 6.697 286 HB ILE 36 HB ILE 36 -1.754 5.985 4.343 287 1HG1 ILE 36 1HG1 ILE 36 0.938 4.597 4.322 288 2HG1 ILE 36 2HG1 ILE 36 -0.555 3.785 3.851 289 1HG2 ILE 36 1HG2 ILE 36 -0.644 7.712 5.474 290 2HG2 ILE 36 2HG2 ILE 36 0.564 7.193 4.298 291 3HG2 ILE 36 3HG2 ILE 36 0.681 6.661 5.975 292 1HD1 ILE 36 1HD1 ILE 36 -0.807 5.067 1.936 293 2HD1 ILE 36 2HD1 ILE 36 0.952 5.028 2.045 294 3HD1 ILE 36 3HD1 ILE 36 0.064 6.441 2.616 295 H VAL 37 H VAL 37 -0.691 6.908 7.685 296 HA VAL 37 HA VAL 37 -3.563 7.539 8.181 297 HB VAL 37 HB VAL 37 -1.448 7.010 10.302 298 1HG1 VAL 37 1HG1 VAL 37 -2.861 8.493 11.370 299 2HG1 VAL 37 2HG1 VAL 37 -3.750 6.997 11.655 300 3HG1 VAL 37 3HG1 VAL 37 -4.238 8.079 10.349 301 1HG2 VAL 37 1HG2 VAL 37 -3.741 5.381 9.212 302 2HG2 VAL 37 2HG2 VAL 37 -3.125 5.113 10.842 303 3HG2 VAL 37 3HG2 VAL 37 -2.064 4.892 9.451 304 H ARG 38 H ARG 38 -3.517 9.639 7.399 305 HA ARG 38 HA ARG 38 -1.335 11.447 8.389 306 1HB ARG 38 1HB ARG 38 -2.777 11.039 5.855 307 2HB ARG 38 2HB ARG 38 -2.600 12.731 6.315 308 1HG ARG 38 1HG ARG 38 -0.360 10.694 6.115 309 2HG ARG 38 2HG ARG 38 -0.665 12.009 4.982 310 1HD ARG 38 1HD ARG 38 0.455 13.454 6.314 311 2HD ARG 38 2HD ARG 38 -0.526 13.025 7.705 312 HE ARG 38 HE ARG 38 1.399 10.951 7.003 313 1HH1 ARG 38 1HH1 ARG 38 0.932 13.955 8.701 314 2HH1 ARG 38 2HH1 ARG 38 2.231 13.661 9.804 315 1HH2 ARG 38 1HH2 ARG 38 3.080 10.592 8.446 316 2HH2 ARG 38 2HH2 ARG 38 3.439 11.772 9.663 317 H HIS 39 H HIS 39 -2.614 13.879 7.881 318 HA HIS 39 HA HIS 39 -5.026 13.780 9.663 319 1HB HIS 39 1HB HIS 39 -2.583 15.576 9.647 320 2HB HIS 39 2HB HIS 39 -4.050 15.991 10.534 321 HD1 HIS 39 HD1 HIS 39 -0.961 14.094 10.840 322 HD2 HIS 39 HD2 HIS 39 -4.781 13.840 12.489 323 HE1 HIS 39 HE1 HIS 39 -0.762 12.608 12.882 324 H ASN 40 H ASN 40 -5.772 13.796 7.143 325 HA ASN 40 HA ASN 40 -6.862 15.028 5.445 326 1HB ASN 40 1HB ASN 40 -6.988 17.015 7.744 327 2HB ASN 40 2HB ASN 40 -8.089 16.952 6.368 328 1HD2 ASN 40 1HD2 ASN 40 -9.360 14.834 6.142 329 2HD2 ASN 40 2HD2 ASN 40 -9.803 14.021 7.565 330 H ASP 41 H ASP 41 -6.860 17.993 5.322 331 HA ASP 41 HA ASP 41 -5.588 19.716 4.345 332 1HB ASP 41 1HB ASP 41 -3.278 18.264 5.691 333 2HB ASP 41 2HB ASP 41 -3.337 19.965 5.240 334 H ASP 42 H ASP 42 -2.693 19.195 3.522 335 HA ASP 42 HA ASP 42 -2.977 18.642 0.825 336 1HB ASP 42 1HB ASP 42 -0.778 18.113 2.830 337 2HB ASP 42 2HB ASP 42 -0.533 17.799 1.112 338 H TRP 43 H TRP 43 -2.888 16.293 3.453 339 HA TRP 43 HA TRP 43 -2.399 13.935 1.892 340 1HB TRP 43 1HB TRP 43 -2.202 14.062 4.333 341 2HB TRP 43 2HB TRP 43 -3.913 14.453 4.476 342 HD1 TRP 43 HD1 TRP 43 -5.397 12.493 5.016 343 HE1 TRP 43 HE1 TRP 43 -5.272 9.935 4.719 344 HE3 TRP 43 HE3 TRP 43 -0.973 12.115 2.497 345 HZ2 TRP 43 HZ2 TRP 43 -3.525 7.989 3.569 346 HZ3 TRP 43 HZ3 TRP 43 -0.109 9.899 1.812 347 HH2 TRP 43 HH2 TRP 43 -1.374 7.836 2.343 348 H GLY 44 H GLY 44 -5.434 15.528 2.919 349 1HA GLY 44 1HA GLY 44 -7.192 13.607 1.723 350 2HA GLY 44 2HA GLY 44 -7.631 15.264 2.138 351 H THR 45 H THR 45 -5.728 16.606 0.497 352 HA THR 45 HA THR 45 -7.117 16.635 -2.022 353 HB THR 45 HB THR 45 -4.405 17.704 -1.152 354 HG1 THR 45 HG1 THR 45 -5.516 19.214 -0.230 355 1HG2 THR 45 1HG2 THR 45 -5.519 17.583 -3.726 356 2HG2 THR 45 2HG2 THR 45 -4.179 18.606 -3.207 357 3HG2 THR 45 3HG2 THR 45 -5.829 19.229 -3.173 358 H ALA 46 H ALA 46 -3.655 15.863 -1.472 359 HA ALA 46 HA ALA 46 -3.160 14.667 -3.975 360 1HB ALA 46 1HB ALA 46 -1.517 15.331 -2.187 361 2HB ALA 46 2HB ALA 46 -1.215 13.715 -2.828 362 3HB ALA 46 3HB ALA 46 -2.007 13.910 -1.264 363 H LEU 47 H LEU 47 -3.830 12.915 -0.908 364 HA LEU 47 HA LEU 47 -4.477 10.478 -2.460 365 1HB LEU 47 1HB LEU 47 -4.301 11.131 0.505 366 2HB LEU 47 2HB LEU 47 -4.636 9.522 -0.124 367 HG LEU 47 HG LEU 47 -2.301 9.540 0.312 368 1HD1 LEU 47 1HD1 LEU 47 -2.014 10.319 -2.535 369 2HD1 LEU 47 2HD1 LEU 47 -3.192 9.051 -2.201 370 3HD1 LEU 47 3HD1 LEU 47 -1.511 8.841 -1.713 371 1HD2 LEU 47 1HD2 LEU 47 -1.712 11.946 -1.337 372 2HD2 LEU 47 2HD2 LEU 47 -0.910 11.350 0.116 373 3HD2 LEU 47 3HD2 LEU 47 -2.438 12.216 0.247 374 H GLU 48 H GLU 48 -6.359 12.418 -3.042 375 HA GLU 48 HA GLU 48 -8.636 12.330 -1.233 376 1HB GLU 48 1HB GLU 48 -9.717 13.510 -3.154 377 2HB GLU 48 2HB GLU 48 -8.143 14.203 -2.764 378 1HG GLU 48 1HG GLU 48 -7.610 13.893 -4.938 379 2HG GLU 48 2HG GLU 48 -7.545 12.169 -4.574 380 H ASP 49 H ASP 49 -7.370 9.934 -3.198 381 HA ASP 49 HA ASP 49 -10.059 8.679 -3.531 382 1HB ASP 49 1HB ASP 49 -9.163 7.765 -5.661 383 2HB ASP 49 2HB ASP 49 -9.112 9.526 -5.667 384 H TYR 50 H TYR 50 -9.980 6.328 -3.374 385 HA TYR 50 HA TYR 50 -9.266 4.319 -2.339 386 1HB TYR 50 1HB TYR 50 -6.542 5.458 -3.079 387 2HB TYR 50 2HB TYR 50 -6.944 3.758 -2.860 388 HD1 TYR 50 HD1 TYR 50 -9.214 3.110 -4.317 389 HD2 TYR 50 HD2 TYR 50 -6.305 6.118 -5.290 390 HE1 TYR 50 HE1 TYR 50 -9.868 2.970 -6.703 391 HE2 TYR 50 HE2 TYR 50 -6.960 5.977 -7.677 392 HH TYR 50 HH TYR 50 -9.004 3.467 -8.876 393 H LEU 51 H LEU 51 -9.333 6.979 -0.806 394 HA LEU 51 HA LEU 51 -7.430 6.244 1.392 395 1HB LEU 51 1HB LEU 51 -7.281 8.456 0.032 396 2HB LEU 51 2HB LEU 51 -8.733 8.934 0.913 397 HG LEU 51 HG LEU 51 -7.370 8.211 3.030 398 1HD1 LEU 51 1HD1 LEU 51 -4.907 9.140 1.884 399 2HD1 LEU 51 2HD1 LEU 51 -5.478 7.754 0.955 400 3HD1 LEU 51 3HD1 LEU 51 -5.228 7.607 2.694 401 1HD2 LEU 51 1HD2 LEU 51 -7.517 10.679 1.489 402 2HD2 LEU 51 2HD2 LEU 51 -6.033 10.600 2.445 403 3HD2 LEU 51 3HD2 LEU 51 -7.605 10.446 3.236 404 H PHE 52 H PHE 52 -8.425 5.481 3.204 405 HA PHE 52 HA PHE 52 -11.341 5.865 3.581 406 1HB PHE 52 1HB PHE 52 -9.157 4.269 4.966 407 2HB PHE 52 2HB PHE 52 -10.837 4.260 5.500 408 HD1 PHE 52 HD1 PHE 52 -12.365 2.765 4.531 409 HD2 PHE 52 HD2 PHE 52 -8.725 3.711 2.455 410 HE1 PHE 52 HE1 PHE 52 -12.901 1.060 2.813 411 HE2 PHE 52 HE2 PHE 52 -9.262 2.006 0.737 412 HZ PHE 52 HZ PHE 52 -11.350 0.680 0.916 413 H SER 53 H SER 53 -11.992 7.660 4.720 414 HA SER 53 HA SER 53 -10.045 9.010 6.510 415 1HB SER 53 1HB SER 53 -12.633 9.673 5.127 416 2HB SER 53 2HB SER 53 -12.081 10.685 6.457 417 HG SER 53 HG SER 53 -10.430 9.989 4.275 418 H ARG 54 H ARG 54 -10.310 9.121 8.717 419 HA ARG 54 HA ARG 54 -12.641 7.658 9.891 420 1HB ARG 54 1HB ARG 54 -9.968 7.250 10.135 421 2HB ARG 54 2HB ARG 54 -10.213 8.385 11.462 422 1HG ARG 54 1HG ARG 54 -12.003 6.938 12.363 423 2HG ARG 54 2HG ARG 54 -11.740 5.797 11.042 424 1HD ARG 54 1HD ARG 54 -10.248 4.808 12.470 425 2HD ARG 54 2HD ARG 54 -9.184 6.165 12.042 426 HE ARG 54 HE ARG 54 -11.094 6.900 14.104 427 1HH1 ARG 54 1HH1 ARG 54 -8.076 5.272 13.511 428 2HH1 ARG 54 2HH1 ARG 54 -7.485 5.549 15.113 429 1HH2 ARG 54 1HH2 ARG 54 -10.306 7.248 16.177 430 2HH2 ARG 54 2HH2 ARG 54 -8.737 6.659 16.612 431 H LYS 55 H LYS 55 -13.154 8.560 12.199 432 HA LYS 55 HA LYS 55 -13.751 11.410 11.939 433 1HB LYS 55 1HB LYS 55 -14.140 9.405 14.199 434 2HB LYS 55 2HB LYS 55 -14.932 10.976 14.084 435 1HG LYS 55 1HG LYS 55 -15.236 9.347 11.660 436 2HG LYS 55 2HG LYS 55 -15.949 8.604 13.092 437 1HD LYS 55 1HD LYS 55 -16.510 11.466 12.946 438 2HD LYS 55 2HD LYS 55 -17.113 10.600 11.533 439 1HE LYS 55 1HE LYS 55 -18.891 10.453 13.118 440 2HE LYS 55 2HE LYS 55 -18.062 8.890 13.260 441 1HZ LYS 55 1HZ LYS 55 -16.634 9.985 14.989 442 2HZ LYS 55 2HZ LYS 55 -18.255 9.766 15.447 443 3HZ LYS 55 3HZ LYS 55 -17.708 11.300 14.964 444 H ASN 56 H ASN 56 -11.493 12.152 11.908 445 HA ASN 56 HA ASN 56 -9.960 11.886 14.431 446 1HB ASN 56 1HB ASN 56 -11.469 13.775 14.801 447 2HB ASN 56 2HB ASN 56 -9.840 14.401 14.555 448 1HD2 ASN 56 1HD2 ASN 56 -12.960 13.870 12.869 449 2HD2 ASN 56 2HD2 ASN 56 -12.707 15.067 11.691 450 H MET 57 H MET 57 -9.812 11.357 11.341 451 HA MET 57 HA MET 57 -7.713 13.069 10.336 452 1HB MET 57 1HB MET 57 -5.800 11.721 10.819 453 2HB MET 57 2HB MET 57 -6.687 11.835 12.333 454 1HG MET 57 1HG MET 57 -7.795 9.612 11.047 455 2HG MET 57 2HG MET 57 -6.066 9.496 10.732 456 1HE MET 57 1HE MET 57 -4.536 9.858 14.270 457 2HE MET 57 2HE MET 57 -5.274 11.305 13.582 458 3HE MET 57 3HE MET 57 -4.375 10.196 12.546 459 H SER 58 H SER 58 -6.306 10.828 8.992 460 HA SER 58 HA SER 58 -8.447 9.483 7.452 461 1HB SER 58 1HB SER 58 -6.386 11.077 5.957 462 2HB SER 58 2HB SER 58 -8.007 10.613 5.446 463 HG SER 58 HG SER 58 -8.867 12.190 6.651 464 H ALA 59 H ALA 59 -7.486 7.904 5.867 465 HA ALA 59 HA ALA 59 -4.642 7.194 6.335 466 1HB ALA 59 1HB ALA 59 -5.544 5.946 8.093 467 2HB ALA 59 2HB ALA 59 -5.680 4.779 6.777 468 3HB ALA 59 3HB ALA 59 -7.088 5.721 7.270 469 H MET 60 H MET 60 -3.858 5.653 4.723 470 HA MET 60 HA MET 60 -5.543 5.616 2.252 471 1HB MET 60 1HB MET 60 -3.324 6.651 2.107 472 2HB MET 60 2HB MET 60 -2.578 5.209 2.794 473 1HG MET 60 1HG MET 60 -2.289 5.182 0.373 474 2HG MET 60 2HG MET 60 -3.398 3.894 0.841 475 1HE MET 60 1HE MET 60 -3.693 7.878 -0.682 476 2HE MET 60 2HE MET 60 -3.703 6.922 -2.164 477 3HE MET 60 3HE MET 60 -2.451 6.654 -0.950 478 H ALA 61 H ALA 61 -5.604 3.596 0.994 479 HA ALA 61 HA ALA 61 -5.776 1.218 2.725 480 1HB ALA 61 1HB ALA 61 -6.355 0.399 0.188 481 2HB ALA 61 2HB ALA 61 -6.617 2.134 0.021 482 3HB ALA 61 3HB ALA 61 -7.525 1.217 1.223 483 H LEU 62 H LEU 62 -3.590 0.675 3.200 484 HA LEU 62 HA LEU 62 -1.524 -0.392 2.824 485 1HB LEU 62 1HB LEU 62 -0.895 0.600 0.249 486 2HB LEU 62 2HB LEU 62 -1.897 1.835 1.010 487 HG LEU 62 HG LEU 62 -0.413 1.656 3.048 488 1HD1 LEU 62 1HD1 LEU 62 0.529 -0.611 1.685 489 2HD1 LEU 62 2HD1 LEU 62 1.199 0.085 3.161 490 3HD1 LEU 62 3HD1 LEU 62 1.845 0.559 1.589 491 1HD2 LEU 62 1HD2 LEU 62 1.162 2.361 0.566 492 2HD2 LEU 62 2HD2 LEU 62 1.253 3.109 2.159 493 3HD2 LEU 62 3HD2 LEU 62 -0.169 3.362 1.146 494 H GLY 63 H GLY 63 -3.018 -2.388 2.497 495 1HA GLY 63 1HA GLY 63 -1.989 -3.930 0.330 496 2HA GLY 63 2HA GLY 63 -3.327 -4.417 1.366 497 H PHE 64 H PHE 64 -4.926 -5.039 -0.007 498 HA PHE 64 HA PHE 64 -5.381 -3.596 -2.546 499 1HB PHE 64 1HB PHE 64 -6.657 -6.012 -1.208 500 2HB PHE 64 2HB PHE 64 -7.012 -5.477 -2.850 501 HD1 PHE 64 HD1 PHE 64 -4.351 -6.792 -0.619 502 HD2 PHE 64 HD2 PHE 64 -5.505 -5.913 -4.662 503 HE1 PHE 64 HE1 PHE 64 -2.377 -8.039 -1.452 504 HE2 PHE 64 HE2 PHE 64 -3.530 -7.162 -5.496 505 HZ PHE 64 HZ PHE 64 -1.967 -8.224 -3.890 506 H GLY 65 H GLY 65 -5.952 -2.069 -0.136 507 1HA GLY 65 1HA GLY 65 -8.837 -2.142 0.302 508 2HA GLY 65 2HA GLY 65 -7.722 -0.943 0.954 509 H ALA 66 H ALA 66 -6.690 -0.612 -1.944 510 HA ALA 66 HA ALA 66 -8.612 1.524 -2.637 511 1HB ALA 66 1HB ALA 66 -5.928 0.655 -3.771 512 2HB ALA 66 2HB ALA 66 -6.173 1.905 -2.552 513 3HB ALA 66 3HB ALA 66 -6.772 2.145 -4.193 514 H ILE 67 H ILE 67 -7.105 -1.289 -4.280 515 HA ILE 67 HA ILE 67 -8.401 -1.047 -6.768 516 HB ILE 67 HB ILE 67 -8.010 -3.557 -6.849 517 1HG1 ILE 67 1HG1 ILE 67 -6.432 -3.886 -4.550 518 2HG1 ILE 67 2HG1 ILE 67 -7.920 -3.131 -3.978 519 1HG2 ILE 67 1HG2 ILE 67 -5.893 -1.594 -5.995 520 2HG2 ILE 67 2HG2 ILE 67 -6.202 -2.261 -7.599 521 3HG2 ILE 67 3HG2 ILE 67 -5.477 -3.272 -6.348 522 1HD1 ILE 67 1HD1 ILE 67 -8.795 -5.219 -4.035 523 2HD1 ILE 67 2HD1 ILE 67 -7.488 -5.832 -5.047 524 3HD1 ILE 67 3HD1 ILE 67 -8.856 -4.997 -5.784 525 H PHE 68 H PHE 68 -9.812 -1.921 -3.716 526 HA PHE 68 HA PHE 68 -11.905 -3.637 -4.369 527 1HB PHE 68 1HB PHE 68 -11.520 -1.307 -2.517 528 2HB PHE 68 2HB PHE 68 -13.126 -2.020 -2.631 529 HD1 PHE 68 HD1 PHE 68 -10.597 -2.037 -0.493 530 HD2 PHE 68 HD2 PHE 68 -12.582 -4.868 -3.042 531 HE1 PHE 68 HE1 PHE 68 -9.872 -3.885 0.994 532 HE2 PHE 68 HE2 PHE 68 -11.856 -6.715 -1.555 533 HZ PHE 68 HZ PHE 68 -10.502 -6.223 0.463 534 H ASN 69 H ASN 69 -13.749 -3.482 -5.614 535 HA ASN 69 HA ASN 69 -14.203 -0.949 -7.106 536 1HB ASN 69 1HB ASN 69 -15.354 -3.753 -7.378 537 2HB ASN 69 2HB ASN 69 -15.554 -2.447 -8.545 538 1HD2 ASN 69 1HD2 ASN 69 -14.416 -4.414 -9.832 539 2HD2 ASN 69 2HD2 ASN 69 -12.723 -4.307 -9.914 540 H HIS 70 H HIS 70 -16.892 -1.237 -7.715 541 HA HIS 70 HA HIS 70 -18.190 -0.664 -5.084 542 1HB HIS 70 1HB HIS 70 -18.228 1.114 -6.771 543 2HB HIS 70 2HB HIS 70 -18.873 -0.001 -7.974 544 HD1 HIS 70 HD1 HIS 70 -21.264 0.620 -8.331 545 HD2 HIS 70 HD2 HIS 70 -20.238 0.730 -4.291 546 HE1 HIS 70 HE1 HIS 70 -23.395 1.140 -7.064 547 H SER 71 H SER 71 -20.363 -1.577 -4.736 548 HA SER 71 HA SER 71 -21.521 -3.520 -6.534 549 1HB SER 71 1HB SER 71 -19.378 -4.622 -5.728 550 2HB SER 71 2HB SER 71 -20.058 -4.602 -4.101 551 HG SER 71 HG SER 71 -21.377 -5.747 -6.326 552 H LYS 72 H LYS 72 -23.650 -3.649 -5.956 553 HA LYS 72 HA LYS 72 -24.752 -2.310 -3.698 554 1HB LYS 72 1HB LYS 72 -25.605 -3.549 -6.032 555 2HB LYS 72 2HB LYS 72 -26.286 -4.583 -4.776 556 1HG LYS 72 1HG LYS 72 -27.963 -3.011 -4.861 557 2HG LYS 72 2HG LYS 72 -26.901 -2.188 -3.720 558 1HD LYS 72 1HD LYS 72 -25.849 -0.978 -5.622 559 2HD LYS 72 2HD LYS 72 -26.984 -1.758 -6.722 560 1HE LYS 72 1HE LYS 72 -28.198 -0.393 -4.372 561 2HE LYS 72 2HE LYS 72 -27.480 0.660 -5.606 562 1HZ LYS 72 1HZ LYS 72 -29.754 0.111 -6.203 563 2HZ LYS 72 2HZ LYS 72 -29.418 -1.549 -6.084 564 3HZ LYS 72 3HZ LYS 72 -28.683 -0.619 -7.300 565 H ASP 73 H ASP 73 -23.822 -5.703 -4.189 566 HA ASP 73 HA ASP 73 -24.355 -6.185 -1.275 567 1HB ASP 73 1HB ASP 73 -25.005 -7.636 -3.783 568 2HB ASP 73 2HB ASP 73 -24.424 -8.651 -2.464 569 HA PRO 74 HA PRO 74 -19.824 -6.685 -2.194 570 1HB PRO 74 1HB PRO 74 -19.078 -5.768 0.329 571 2HB PRO 74 2HB PRO 74 -19.198 -4.749 -1.115 572 1HG PRO 74 1HG PRO 74 -21.107 -5.089 1.135 573 2HG PRO 74 2HG PRO 74 -20.720 -3.645 0.191 574 1HD PRO 74 1HD PRO 74 -22.991 -5.088 -0.168 575 2HD PRO 74 2HD PRO 74 -22.202 -4.184 -1.478 576 H ASN 75 H ASN 75 -19.862 -8.958 -2.074 577 HA ASN 75 HA ASN 75 -20.743 -10.569 0.063 578 1HB ASN 75 1HB ASN 75 -18.419 -10.998 -1.852 579 2HB ASN 75 2HB ASN 75 -19.310 -12.268 -1.013 580 1HD2 ASN 75 1HD2 ASN 75 -21.121 -13.089 -2.095 581 2HD2 ASN 75 2HD2 ASN 75 -21.874 -12.343 -3.421 582 H ALA 76 H ALA 76 -17.869 -8.610 -0.177 583 HA ALA 76 HA ALA 76 -16.950 -9.725 2.451 584 1HB ALA 76 1HB ALA 76 -15.196 -10.480 1.200 585 2HB ALA 76 2HB ALA 76 -14.683 -8.793 1.155 586 3HB ALA 76 3HB ALA 76 -15.634 -9.462 -0.172 587 H ARG 77 H ARG 77 -15.624 -8.125 3.689 588 HA ARG 77 HA ARG 77 -16.048 -5.282 2.898 589 1HB ARG 77 1HB ARG 77 -17.959 -6.095 4.295 590 2HB ARG 77 2HB ARG 77 -16.815 -6.527 5.565 591 1HG ARG 77 1HG ARG 77 -16.174 -4.229 5.878 592 2HG ARG 77 2HG ARG 77 -17.048 -3.728 4.430 593 1HD ARG 77 1HD ARG 77 -19.188 -4.297 5.481 594 2HD ARG 77 2HD ARG 77 -18.344 -4.918 6.912 595 HE ARG 77 HE ARG 77 -17.343 -2.335 6.547 596 1HH1 ARG 77 1HH1 ARG 77 -20.476 -3.779 7.011 597 2HH1 ARG 77 2HH1 ARG 77 -21.122 -2.386 7.806 598 1HH2 ARG 77 1HH2 ARG 77 -18.205 -0.538 7.581 599 2HH2 ARG 77 2HH2 ARG 77 -19.849 -0.564 8.127 600 H HIS 78 H HIS 78 -14.602 -3.821 4.067 601 HA HIS 78 HA HIS 78 -12.072 -5.138 4.844 602 1HB HIS 78 1HB HIS 78 -11.237 -2.803 4.706 603 2HB HIS 78 2HB HIS 78 -12.160 -3.227 3.265 604 HD1 HIS 78 HD1 HIS 78 -14.439 -2.065 2.913 605 HD2 HIS 78 HD2 HIS 78 -12.535 -0.931 6.444 606 HE1 HIS 78 HE1 HIS 78 -15.706 -0.059 3.797 607 H GLU 79 H GLU 79 -10.923 -4.263 6.825 608 HA GLU 79 HA GLU 79 -12.731 -3.276 8.971 609 1HB GLU 79 1HB GLU 79 -12.599 -5.882 8.691 610 2HB GLU 79 2HB GLU 79 -10.996 -5.708 9.404 611 1HG GLU 79 1HG GLU 79 -12.685 -6.163 11.144 612 2HG GLU 79 2HG GLU 79 -11.988 -4.557 11.351 613 H LEU 80 H LEU 80 -11.476 -2.586 10.895 614 HA LEU 80 HA LEU 80 -8.605 -2.002 10.240 615 1HB LEU 80 1HB LEU 80 -10.836 -0.353 11.450 616 2HB LEU 80 2HB LEU 80 -9.145 0.097 11.673 617 HG LEU 80 HG LEU 80 -10.226 -0.482 8.920 618 1HD1 LEU 80 1HD1 LEU 80 -10.129 2.296 10.086 619 2HD1 LEU 80 2HD1 LEU 80 -11.581 1.306 10.236 620 3HD1 LEU 80 3HD1 LEU 80 -10.968 1.737 8.639 621 1HD2 LEU 80 1HD2 LEU 80 -8.386 1.050 8.288 622 2HD2 LEU 80 2HD2 LEU 80 -7.790 -0.315 9.233 623 3HD2 LEU 80 3HD2 LEU 80 -7.988 1.264 9.993 624 H THR 81 H THR 81 -7.139 -2.128 12.011 625 HA THR 81 HA THR 81 -7.873 -3.962 14.140 626 HB THR 81 HB THR 81 -5.457 -3.117 14.858 627 HG1 THR 81 HG1 THR 81 -4.894 -1.508 13.646 628 1HG2 THR 81 1HG2 THR 81 -4.608 -4.874 13.616 629 2HG2 THR 81 2HG2 THR 81 -5.493 -4.411 12.162 630 3HG2 THR 81 3HG2 THR 81 -6.330 -5.231 13.480 631 H ALA 82 H ALA 82 -9.712 -2.237 14.729 632 HA ALA 82 HA ALA 82 -10.529 -0.692 16.318 633 1HB ALA 82 1HB ALA 82 -9.347 -0.891 18.487 634 2HB ALA 82 2HB ALA 82 -7.970 -1.630 17.670 635 3HB ALA 82 3HB ALA 82 -9.518 -2.474 17.728 636 H GLY 83 H GLY 83 -8.925 0.460 14.204 637 1HA GLY 83 1HA GLY 83 -8.504 3.071 15.138 638 2HA GLY 83 2HA GLY 83 -6.944 2.261 15.272 639 H LEU 84 H LEU 84 -5.771 3.039 13.567 640 HA LEU 84 HA LEU 84 -6.926 2.679 10.828 641 1HB LEU 84 1HB LEU 84 -6.524 5.096 12.216 642 2HB LEU 84 2HB LEU 84 -5.162 4.989 11.101 643 HG LEU 84 HG LEU 84 -6.699 4.640 9.221 644 1HD1 LEU 84 1HD1 LEU 84 -8.592 4.227 11.429 645 2HD1 LEU 84 2HD1 LEU 84 -8.668 3.653 9.764 646 3HD1 LEU 84 3HD1 LEU 84 -9.218 5.281 10.161 647 1HD2 LEU 84 1HD2 LEU 84 -7.171 6.869 9.004 648 2HD2 LEU 84 2HD2 LEU 84 -6.243 6.997 10.498 649 3HD2 LEU 84 3HD2 LEU 84 -8.005 6.947 10.556 650 H LYS 85 H LYS 85 -4.822 1.309 12.641 651 HA LYS 85 HA LYS 85 -2.290 1.816 11.254 652 1HB LYS 85 1HB LYS 85 -3.109 -0.344 13.232 653 2HB LYS 85 2HB LYS 85 -1.464 0.179 12.874 654 1HG LYS 85 1HG LYS 85 -3.616 1.975 14.032 655 2HG LYS 85 2HG LYS 85 -2.367 1.174 14.986 656 1HD LYS 85 1HD LYS 85 -0.823 2.706 14.400 657 2HD LYS 85 2HD LYS 85 -1.248 2.592 12.695 658 1HE LYS 85 1HE LYS 85 -3.309 4.016 13.263 659 2HE LYS 85 2HE LYS 85 -2.525 4.334 14.822 660 1HZ LYS 85 1HZ LYS 85 -1.835 6.003 13.248 661 2HZ LYS 85 2HZ LYS 85 -1.383 4.820 12.116 662 3HZ LYS 85 3HZ LYS 85 -0.513 4.985 13.565 663 H ARG 86 H ARG 86 -4.048 -1.267 11.806 664 HA ARG 86 HA ARG 86 -2.977 -2.227 9.188 665 1HB ARG 86 1HB ARG 86 -3.705 -3.370 11.842 666 2HB ARG 86 2HB ARG 86 -3.975 -4.411 10.445 667 1HG ARG 86 1HG ARG 86 -1.579 -3.798 9.739 668 2HG ARG 86 2HG ARG 86 -1.384 -3.165 11.374 669 1HD ARG 86 1HD ARG 86 -2.517 -5.631 11.860 670 2HD ARG 86 2HD ARG 86 -1.487 -5.963 10.455 671 HE ARG 86 HE ARG 86 0.104 -4.377 12.077 672 1HH1 ARG 86 1HH1 ARG 86 -1.696 -7.321 12.538 673 2HH1 ARG 86 2HH1 ARG 86 -0.616 -7.920 13.749 674 1HH2 ARG 86 1HH2 ARG 86 1.490 -5.177 13.651 675 2HH2 ARG 86 2HH2 ARG 86 1.174 -6.717 14.376 676 H MET 87 H MET 87 -4.449 -3.643 7.902 677 HA MET 87 HA MET 87 -7.353 -3.001 8.278 678 1HB MET 87 1HB MET 87 -5.479 -2.214 6.192 679 2HB MET 87 2HB MET 87 -6.812 -3.147 5.512 680 1HG MET 87 1HG MET 87 -8.383 -1.638 6.830 681 2HG MET 87 2HG MET 87 -6.983 -0.622 7.174 682 1HE MET 87 1HE MET 87 -9.776 -0.979 3.985 683 2HE MET 87 2HE MET 87 -9.194 -2.308 4.988 684 3HE MET 87 3HE MET 87 -8.581 -2.108 3.347 685 H ARG 88 H ARG 88 -8.766 -4.684 7.571 686 HA ARG 88 HA ARG 88 -7.444 -7.200 6.612 687 1HB ARG 88 1HB ARG 88 -9.555 -6.859 8.774 688 2HB ARG 88 2HB ARG 88 -8.892 -8.400 8.230 689 1HG ARG 88 1HG ARG 88 -6.706 -7.847 9.045 690 2HG ARG 88 2HG ARG 88 -7.165 -6.167 9.321 691 1HD ARG 88 1HD ARG 88 -7.533 -6.871 11.474 692 2HD ARG 88 2HD ARG 88 -9.047 -7.521 10.817 693 HE ARG 88 HE ARG 88 -6.994 -9.402 10.260 694 1HH1 ARG 88 1HH1 ARG 88 -8.645 -8.022 12.996 695 2HH1 ARG 88 2HH1 ARG 88 -8.433 -9.431 13.975 696 1HH2 ARG 88 1HH2 ARG 88 -6.731 -11.221 11.551 697 2HH2 ARG 88 2HH2 ARG 88 -7.358 -11.229 13.166 698 H ILE 89 H ILE 89 -9.118 -8.748 5.695 699 HA ILE 89 HA ILE 89 -11.486 -7.302 4.563 700 HB ILE 89 HB ILE 89 -9.560 -9.162 3.120 701 1HG1 ILE 89 1HG1 ILE 89 -9.914 -6.160 2.865 702 2HG1 ILE 89 2HG1 ILE 89 -8.582 -6.941 3.716 703 1HG2 ILE 89 1HG2 ILE 89 -11.995 -9.077 2.362 704 2HG2 ILE 89 2HG2 ILE 89 -10.802 -8.647 1.137 705 3HG2 ILE 89 3HG2 ILE 89 -11.716 -7.383 1.959 706 1HD1 ILE 89 1HD1 ILE 89 -9.062 -7.919 0.964 707 2HD1 ILE 89 2HD1 ILE 89 -7.541 -7.561 1.782 708 3HD1 ILE 89 3HD1 ILE 89 -8.495 -6.253 1.080 709 H PHE 90 H PHE 90 -12.940 -8.441 5.938 710 HA PHE 90 HA PHE 90 -12.830 -11.395 6.032 711 1HB PHE 90 1HB PHE 90 -14.454 -9.186 7.311 712 2HB PHE 90 2HB PHE 90 -14.903 -10.879 7.516 713 HD1 PHE 90 HD1 PHE 90 -13.674 -12.325 8.967 714 HD2 PHE 90 HD2 PHE 90 -12.188 -8.398 8.058 715 HE1 PHE 90 HE1 PHE 90 -11.959 -12.563 10.743 716 HE2 PHE 90 HE2 PHE 90 -10.473 -8.636 9.834 717 HZ PHE 90 HZ PHE 90 -10.359 -10.719 11.177 718 H THR 91 H THR 91 -15.236 -12.367 5.888 719 HA THR 91 HA THR 91 -16.414 -11.383 3.309 720 HB THR 91 HB THR 91 -17.143 -13.947 3.354 721 HG1 THR 91 HG1 THR 91 -14.726 -14.030 4.807 722 1HG2 THR 91 1HG2 THR 91 -15.648 -12.894 1.685 723 2HG2 THR 91 2HG2 THR 91 -15.070 -14.496 2.142 724 3HG2 THR 91 3HG2 THR 91 -14.295 -13.056 2.803 725 H ILE 92 H ILE 92 -18.046 -10.072 4.299 726 HA ILE 92 HA ILE 92 -19.652 -10.735 6.524 727 HB ILE 92 HB ILE 92 -21.197 -9.063 5.520 728 1HG1 ILE 92 1HG1 ILE 92 -19.424 -8.911 3.105 729 2HG1 ILE 92 2HG1 ILE 92 -20.712 -10.115 3.144 730 1HG2 ILE 92 1HG2 ILE 92 -18.880 -8.485 6.529 731 2HG2 ILE 92 2HG2 ILE 92 -19.683 -7.249 5.561 732 3HG2 ILE 92 3HG2 ILE 92 -18.380 -8.208 4.861 733 1HD1 ILE 92 1HD1 ILE 92 -22.027 -7.890 4.051 734 2HD1 ILE 92 2HD1 ILE 92 -22.016 -8.419 2.369 735 3HD1 ILE 92 3HD1 ILE 92 -20.886 -7.178 2.910 736 H LYS 93 H LYS 93 -19.707 -12.040 3.300 737 HA LYS 93 HA LYS 93 -22.091 -13.683 4.059 738 1HB LYS 93 1HB LYS 93 -21.553 -12.216 1.449 739 2HB LYS 93 2HB LYS 93 -22.901 -13.322 1.714 740 1HG LYS 93 1HG LYS 93 -23.040 -11.583 3.884 741 2HG LYS 93 2HG LYS 93 -22.600 -10.533 2.537 742 1HD LYS 93 1HD LYS 93 -24.509 -12.092 1.366 743 2HD LYS 93 2HD LYS 93 -25.105 -12.032 3.025 744 1HE LYS 93 1HE LYS 93 -24.900 -9.529 2.957 745 2HE LYS 93 2HE LYS 93 -24.460 -9.655 1.243 746 1HZ LYS 93 1HZ LYS 93 -26.855 -9.359 1.504 747 2HZ LYS 93 2HZ LYS 93 -26.937 -10.737 2.494 748 3HZ LYS 93 3HZ LYS 93 -26.512 -10.892 0.857 749 HA PRO 94 HA PRO 94 -19.833 -17.159 2.613 750 1HB PRO 94 1HB PRO 94 -22.082 -17.980 0.931 751 2HB PRO 94 2HB PRO 94 -21.343 -18.832 2.285 752 1HG PRO 94 1HG PRO 94 -23.774 -17.671 2.438 753 2HG PRO 94 2HG PRO 94 -22.686 -17.817 3.823 754 1HD PRO 94 1HD PRO 94 -23.360 -15.432 2.191 755 2HD PRO 94 2HD PRO 94 -22.907 -15.546 3.907 756 H ILE 95 H ILE 95 -18.791 -18.012 0.660 757 HA ILE 95 HA ILE 95 -19.310 -16.494 -1.850 758 HB ILE 95 HB ILE 95 -16.768 -16.595 -0.202 759 1HG1 ILE 95 1HG1 ILE 95 -18.388 -14.327 -1.398 760 2HG1 ILE 95 2HG1 ILE 95 -18.383 -14.804 0.300 761 1HG2 ILE 95 1HG2 ILE 95 -17.045 -16.496 -3.110 762 2HG2 ILE 95 2HG2 ILE 95 -15.585 -16.655 -2.119 763 3HG2 ILE 95 3HG2 ILE 95 -16.242 -15.056 -2.471 764 1HD1 ILE 95 1HD1 ILE 95 -16.079 -13.668 -1.305 765 2HD1 ILE 95 2HD1 ILE 95 -15.872 -14.399 0.287 766 3HD1 ILE 95 3HD1 ILE 95 -16.865 -12.952 0.103 767 H ALA 96 H ALA 96 -19.039 -17.776 -3.633 768 HA ALA 96 HA ALA 96 -18.103 -20.572 -3.222 769 1HB ALA 96 1HB ALA 96 -20.311 -20.255 -4.170 770 2HB ALA 96 2HB ALA 96 -19.263 -20.789 -5.485 771 3HB ALA 96 3HB ALA 96 -19.693 -19.083 -5.337 772 H ILE 97 H ILE 97 -16.838 -21.530 -5.045 773 HA ILE 97 HA ILE 97 -14.454 -20.052 -5.625 774 HB ILE 97 HB ILE 97 -15.681 -22.532 -6.890 775 1HG1 ILE 97 1HG1 ILE 97 -13.665 -23.269 -5.123 776 2HG1 ILE 97 2HG1 ILE 97 -14.493 -21.963 -4.281 777 1HG2 ILE 97 1HG2 ILE 97 -13.414 -21.099 -7.670 778 2HG2 ILE 97 2HG2 ILE 97 -13.780 -22.773 -8.085 779 3HG2 ILE 97 3HG2 ILE 97 -12.776 -22.412 -6.681 780 1HD1 ILE 97 1HD1 ILE 97 -16.370 -23.208 -3.970 781 2HD1 ILE 97 2HD1 ILE 97 -15.331 -24.589 -4.326 782 3HD1 ILE 97 3HD1 ILE 97 -16.308 -23.867 -5.605 783 H GLY 98 H GLY 98 -14.521 -18.272 -6.958 784 1HA GLY 98 1HA GLY 98 -14.480 -17.640 -9.371 785 2HA GLY 98 2HA GLY 98 -15.967 -18.569 -9.559 786 H GLU 99 H GLU 99 -15.564 -16.652 -6.685 787 HA GLU 99 HA GLU 99 -17.802 -14.913 -7.576 788 1HB GLU 99 1HB GLU 99 -16.513 -15.786 -5.009 789 2HB GLU 99 2HB GLU 99 -17.360 -14.242 -5.004 790 1HG GLU 99 1HG GLU 99 -18.509 -16.944 -5.739 791 2HG GLU 99 2HG GLU 99 -18.902 -15.983 -4.321 792 H GLU 100 H GLU 100 -17.501 -12.560 -6.490 793 HA GLU 100 HA GLU 100 -14.746 -11.589 -7.172 794 1HB GLU 100 1HB GLU 100 -16.842 -11.193 -8.763 795 2HB GLU 100 2HB GLU 100 -17.219 -9.927 -7.594 796 1HG GLU 100 1HG GLU 100 -14.554 -9.482 -7.994 797 2HG GLU 100 2HG GLU 100 -15.035 -10.069 -9.586 798 H ILE 101 H ILE 101 -13.835 -10.649 -5.408 799 HA ILE 101 HA ILE 101 -15.534 -9.894 -3.118 800 HB ILE 101 HB ILE 101 -12.519 -9.788 -3.470 801 1HG1 ILE 101 1HG1 ILE 101 -14.300 -12.058 -2.538 802 2HG1 ILE 101 2HG1 ILE 101 -13.314 -12.032 -3.991 803 1HG2 ILE 101 1HG2 ILE 101 -12.396 -9.468 -1.203 804 2HG2 ILE 101 2HG2 ILE 101 -13.854 -10.408 -0.892 805 3HG2 ILE 101 3HG2 ILE 101 -13.984 -8.745 -1.463 806 1HD1 ILE 101 1HD1 ILE 101 -11.541 -12.779 -2.831 807 2HD1 ILE 101 2HD1 ILE 101 -12.531 -12.833 -1.372 808 3HD1 ILE 101 3HD1 ILE 101 -11.635 -11.369 -1.776 809 H THR 102 H THR 102 -16.067 -7.840 -2.629 810 HA THR 102 HA THR 102 -14.443 -5.533 -3.427 811 HB THR 102 HB THR 102 -17.142 -6.184 -4.670 812 HG1 THR 102 HG1 THR 102 -15.719 -7.072 -5.966 813 1HG2 THR 102 1HG2 THR 102 -17.166 -3.836 -4.197 814 2HG2 THR 102 2HG2 THR 102 -16.737 -3.992 -5.900 815 3HG2 THR 102 3HG2 THR 102 -15.487 -3.651 -4.704 816 H ILE 103 H ILE 103 -15.079 -3.667 -2.213 817 HA ILE 103 HA ILE 103 -17.239 -4.179 -0.194 818 HB ILE 103 HB ILE 103 -15.868 -2.706 1.253 819 1HG1 ILE 103 1HG1 ILE 103 -13.518 -2.671 -0.476 820 2HG1 ILE 103 2HG1 ILE 103 -14.864 -1.774 -1.177 821 1HG2 ILE 103 1HG2 ILE 103 -15.403 -5.224 0.926 822 2HG2 ILE 103 2HG2 ILE 103 -14.124 -4.259 1.664 823 3HG2 ILE 103 3HG2 ILE 103 -14.016 -4.713 -0.036 824 1HD1 ILE 103 1HD1 ILE 103 -14.024 -0.100 0.153 825 2HD1 ILE 103 2HD1 ILE 103 -13.304 -1.230 1.300 826 3HD1 ILE 103 3HD1 ILE 103 -15.034 -0.889 1.365 827 H SER 104 H SER 104 -18.333 -2.155 0.591 828 HA SER 104 HA SER 104 -19.150 -0.487 -1.681 829 1HB SER 104 1HB SER 104 -20.526 -1.507 0.290 830 2HB SER 104 2HB SER 104 -19.911 -0.145 1.225 831 HG SER 104 HG SER 104 -21.753 0.596 0.349 832 H TYR 105 H TYR 105 -19.645 1.949 -0.282 833 HA TYR 105 HA TYR 105 -16.861 2.899 0.295 834 1HB TYR 105 1HB TYR 105 -19.093 4.213 -1.296 835 2HB TYR 105 2HB TYR 105 -17.535 4.962 -0.950 836 HD1 TYR 105 HD1 TYR 105 -19.080 3.812 -3.615 837 HD2 TYR 105 HD2 TYR 105 -15.687 2.666 -1.242 838 HE1 TYR 105 HE1 TYR 105 -18.101 2.647 -5.574 839 HE2 TYR 105 HE2 TYR 105 -14.709 1.503 -3.200 840 HH TYR 105 HH TYR 105 -14.841 1.385 -5.520 841 H GLY 106 H GLY 106 -19.669 5.039 0.335 842 1HA GLY 106 1HA GLY 106 -20.372 4.707 3.091 843 2HA GLY 106 2HA GLY 106 -19.161 5.980 2.952 844 H ASP 107 H ASP 107 -21.632 6.700 3.877 845 HA ASP 107 HA ASP 107 -23.574 7.464 1.929 846 1HB ASP 107 1HB ASP 107 -22.756 8.317 4.697 847 2HB ASP 107 2HB ASP 107 -23.986 9.247 3.842 848 H ASP 108 H ASP 108 -21.120 9.538 3.534 849 HA ASP 108 HA ASP 108 -21.480 11.819 1.882 850 1HB ASP 108 1HB ASP 108 -19.630 10.753 3.870 851 2HB ASP 108 2HB ASP 108 -18.776 11.697 2.650 852 H TYR 109 H TYR 109 -19.324 8.998 1.502 853 HA TYR 109 HA TYR 109 -18.256 10.047 -1.034 854 1HB TYR 109 1HB TYR 109 -17.424 8.362 1.039 855 2HB TYR 109 2HB TYR 109 -17.686 7.265 -0.314 856 HD1 TYR 109 HD1 TYR 109 -15.554 6.743 -1.144 857 HD2 TYR 109 HD2 TYR 109 -16.546 10.833 -0.288 858 HE1 TYR 109 HE1 TYR 109 -13.408 7.474 -2.151 859 HE2 TYR 109 HE2 TYR 109 -14.400 11.564 -1.294 860 HH TYR 109 HH TYR 109 -11.858 9.640 -1.795 861 H TRP 110 H TRP 110 -21.181 9.354 -0.880 862 HA TRP 110 HA TRP 110 -21.407 7.989 -3.396 863 1HB TRP 110 1HB TRP 110 -20.734 6.258 -1.490 864 2HB TRP 110 2HB TRP 110 -22.459 6.332 -1.123 865 HD1 TRP 110 HD1 TRP 110 -23.800 4.600 -2.349 866 HE1 TRP 110 HE1 TRP 110 -23.648 3.384 -4.623 867 HE3 TRP 110 HE3 TRP 110 -19.574 6.762 -4.213 868 HZ2 TRP 110 HZ2 TRP 110 -21.950 3.345 -6.929 869 HZ3 TRP 110 HZ3 TRP 110 -18.709 6.122 -6.446 870 HH2 TRP 110 HH2 TRP 110 -19.890 4.417 -7.804 871 H LEU 111 H LEU 111 -23.925 7.012 -3.361 872 HA LEU 111 HA LEU 111 -25.652 9.217 -3.375 873 1HB LEU 111 1HB LEU 111 -25.941 6.865 -4.314 874 2HB LEU 111 2HB LEU 111 -26.398 6.354 -2.689 875 HG LEU 111 HG LEU 111 -28.135 8.258 -2.776 876 1HD1 LEU 111 1HD1 LEU 111 -27.007 8.287 -5.523 877 2HD1 LEU 111 2HD1 LEU 111 -27.749 9.592 -4.598 878 3HD1 LEU 111 3HD1 LEU 111 -28.763 8.397 -5.406 879 1HD2 LEU 111 1HD2 LEU 111 -28.614 5.795 -2.989 880 2HD2 LEU 111 2HD2 LEU 111 -28.485 5.974 -4.739 881 3HD2 LEU 111 3HD2 LEU 111 -29.758 6.819 -3.858 882 H SER 112 H SER 112 -27.332 9.887 -1.875 883 HA SER 112 HA SER 112 -26.485 10.009 0.882 884 1HB SER 112 1HB SER 112 -27.742 11.792 -0.196 885 2HB SER 112 2HB SER 112 -29.059 10.685 -0.584 886 HG SER 112 HG SER 112 -28.995 12.148 1.474 887 H ARG 113 H ARG 113 -26.572 8.180 2.146 888 HA ARG 113 HA ARG 113 -27.437 6.241 3.177 889 1HB ARG 113 1HB ARG 113 -29.380 8.341 3.035 890 2HB ARG 113 2HB ARG 113 -30.225 6.809 2.810 891 1HG ARG 113 1HG ARG 113 -29.393 5.941 4.874 892 2HG ARG 113 2HG ARG 113 -28.213 7.241 5.028 893 1HD ARG 113 1HD ARG 113 -30.764 8.481 4.782 894 2HD ARG 113 2HD ARG 113 -30.924 7.188 5.986 895 HE ARG 113 HE ARG 113 -28.456 8.711 6.294 896 1HH1 ARG 113 1HH1 ARG 113 -31.857 8.604 7.028 897 2HH1 ARG 113 2HH1 ARG 113 -31.696 9.590 8.439 898 1HH2 ARG 113 1HH2 ARG 113 -28.273 9.990 8.130 899 2HH2 ARG 113 2HH2 ARG 113 -29.683 10.370 9.060 900 HA PRO 114 HA PRO 114 -28.392 4.314 -0.905 901 1HB PRO 114 1HB PRO 114 -26.588 2.250 -0.615 902 2HB PRO 114 2HB PRO 114 -26.171 3.817 -1.330 903 1HG PRO 114 1HG PRO 114 -25.631 2.766 1.395 904 2HG PRO 114 2HG PRO 114 -24.642 3.818 0.374 905 1HD PRO 114 1HD PRO 114 -26.152 4.692 2.494 906 2HD PRO 114 2HD PRO 114 -25.679 5.710 1.121 907 H ARG 115 H ARG 115 -30.417 3.489 -0.306 908 HA ARG 115 HA ARG 115 -30.701 1.528 1.840 909 1HB ARG 115 1HB ARG 115 -32.650 2.452 -0.282 910 2HB ARG 115 2HB ARG 115 -33.052 1.684 1.253 911 1HG ARG 115 1HG ARG 115 -31.818 4.420 0.830 912 2HG ARG 115 2HG ARG 115 -33.374 4.038 1.545 913 1HD ARG 115 1HD ARG 115 -31.855 2.643 3.247 914 2HD ARG 115 2HD ARG 115 -30.661 3.868 2.766 915 HE ARG 115 HE ARG 115 -32.941 5.359 3.196 916 1HH1 ARG 115 1HH1 ARG 115 -31.237 2.975 5.074 917 2HH1 ARG 115 2HH1 ARG 115 -31.715 3.663 6.586 918 1HH2 ARG 115 1HH2 ARG 115 -33.550 6.236 5.172 919 2HH2 ARG 115 2HH2 ARG 115 -33.015 5.496 6.644 920 H LEU 116 H LEU 116 -30.504 -0.670 1.566 921 HA LEU 116 HA LEU 116 -30.728 -1.759 -1.223 922 1HB LEU 116 1HB LEU 116 -28.617 -1.799 0.781 923 2HB LEU 116 2HB LEU 116 -29.087 -3.439 0.337 924 HG LEU 116 HG LEU 116 -28.882 -1.642 -1.971 925 1HD1 LEU 116 1HD1 LEU 116 -26.370 -1.644 -1.928 926 2HD1 LEU 116 2HD1 LEU 116 -26.444 -2.200 -0.256 927 3HD1 LEU 116 3HD1 LEU 116 -27.091 -0.617 -0.689 928 1HD2 LEU 116 1HD2 LEU 116 -28.362 -4.413 -1.187 929 2HD2 LEU 116 2HD2 LEU 116 -27.104 -3.762 -2.238 930 3HD2 LEU 116 3HD2 LEU 116 -28.787 -3.757 -2.768 931 H THR 117 H THR 117 -32.637 -1.583 1.228 932 HA THR 117 HA THR 117 -32.993 -4.312 2.152 933 HB THR 117 HB THR 117 -34.932 -1.972 2.092 934 HG1 THR 117 HG1 THR 117 -33.389 -1.105 3.233 935 1HG2 THR 117 1HG2 THR 117 -35.969 -3.043 3.980 936 2HG2 THR 117 2HG2 THR 117 -34.665 -4.225 4.099 937 3HG2 THR 117 3HG2 THR 117 -35.781 -4.277 2.734 938 H GLN 118 H GLN 118 -34.493 -5.854 1.400 939 HA GLN 118 HA GLN 118 -35.198 -5.798 -1.391 940 1HB GLN 118 1HB GLN 118 -34.773 -7.752 0.266 941 2HB GLN 118 2HB GLN 118 -36.450 -7.523 0.759 942 1HG GLN 118 1HG GLN 118 -37.043 -7.689 -1.731 943 2HG GLN 118 2HG GLN 118 -35.400 -8.283 -1.973 944 1HE2 GLN 118 1HE2 GLN 118 -37.034 -10.214 -2.666 945 2HE2 GLN 118 2HE2 GLN 118 -37.314 -11.358 -1.444 946 H ASN 119 H ASN 119 -37.206 -5.365 -2.366 947 HA ASN 119 HA ASN 119 -38.996 -3.544 -1.008 948 1HB ASN 119 1HB ASN 119 -40.240 -3.747 -3.160 949 2HB ASN 119 2HB ASN 119 -38.512 -3.516 -3.430 950 1HD2 ASN 119 1HD2 ASN 119 -41.030 -5.293 -4.591 951 2HD2 ASN 119 2HD2 ASN 119 -40.209 -6.703 -5.058 952 1H GLY 201 1H GLY 201 -38.949 34.773 -4.509 953 2H GLY 201 2H GLY 201 -40.039 36.062 -4.331 954 3H GLY 201 3H GLY 201 -38.985 35.661 -3.062 955 1HA GLY 201 1HA GLY 201 -38.452 37.117 -5.542 956 2HA GLY 201 2HA GLY 201 -37.848 37.417 -3.912 957 H LYS 202 H LYS 202 -35.783 36.765 -3.511 958 HA LYS 202 HA LYS 202 -34.604 34.669 -5.307 959 1HB LYS 202 1HB LYS 202 -32.529 36.030 -5.193 960 2HB LYS 202 2HB LYS 202 -33.871 36.980 -5.832 961 1HG LYS 202 1HG LYS 202 -33.876 37.179 -2.967 962 2HG LYS 202 2HG LYS 202 -32.259 37.556 -3.561 963 1HD LYS 202 1HD LYS 202 -32.968 39.419 -4.715 964 2HD LYS 202 2HD LYS 202 -34.563 38.740 -5.038 965 1HE LYS 202 1HE LYS 202 -34.280 39.047 -2.196 966 2HE LYS 202 2HE LYS 202 -33.852 40.580 -2.980 967 1HZ LYS 202 1HZ LYS 202 -36.322 38.970 -3.331 968 2HZ LYS 202 2HZ LYS 202 -35.871 40.190 -4.423 969 3HZ LYS 202 3HZ LYS 202 -36.196 40.578 -2.802 970 H ALA 203 H ALA 203 -35.800 34.489 -2.538 971 HA ALA 203 HA ALA 203 -33.652 34.224 -0.623 972 1HB ALA 203 1HB ALA 203 -35.471 34.050 0.715 973 2HB ALA 203 2HB ALA 203 -35.973 32.567 -0.097 974 3HB ALA 203 3HB ALA 203 -36.476 34.133 -0.732 975 HA PRO 204 HA PRO 204 -34.192 29.488 -1.608 976 1HB PRO 204 1HB PRO 204 -35.055 29.589 -4.443 977 2HB PRO 204 2HB PRO 204 -35.659 28.572 -3.124 978 1HG PRO 204 1HG PRO 204 -37.064 30.633 -4.146 979 2HG PRO 204 2HG PRO 204 -37.192 30.124 -2.458 980 1HD PRO 204 1HD PRO 204 -35.811 32.481 -3.624 981 2HD PRO 204 2HD PRO 204 -36.611 32.296 -2.051 982 H ARG 205 H ARG 205 -31.886 30.233 -1.564 983 HA ARG 205 HA ARG 205 -30.509 29.496 -4.053 984 1HB ARG 205 1HB ARG 205 -29.359 31.707 -4.200 985 2HB ARG 205 2HB ARG 205 -31.103 31.865 -4.407 986 1HG ARG 205 1HG ARG 205 -31.401 32.787 -2.272 987 2HG ARG 205 2HG ARG 205 -29.881 32.126 -1.668 988 1HD ARG 205 1HD ARG 205 -29.188 33.795 -3.851 989 2HD ARG 205 2HD ARG 205 -30.358 34.706 -2.877 990 HE ARG 205 HE ARG 205 -28.372 33.307 -1.257 991 1HH1 ARG 205 1HH1 ARG 205 -29.068 36.188 -3.083 992 2HH1 ARG 205 2HH1 ARG 205 -27.938 37.154 -2.199 993 1HH2 ARG 205 1HH2 ARG 205 -26.912 34.582 -0.124 994 2HH2 ARG 205 2HH2 ARG 205 -26.725 36.253 -0.536 995 H LYS 206 H LYS 206 -28.169 29.271 -3.692 996 HA LYS 206 HA LYS 206 -26.351 28.534 -2.376 997 1HB LYS 206 1HB LYS 206 -26.823 31.089 -1.873 998 2HB LYS 206 2HB LYS 206 -27.321 30.481 -0.294 999 1HG LYS 206 1HG LYS 206 -25.187 29.804 0.269 1000 2HG LYS 206 2HG LYS 206 -24.736 29.480 -1.405 1001 1HD LYS 206 1HD LYS 206 -23.513 31.421 -0.938 1002 2HD LYS 206 2HD LYS 206 -24.968 32.075 -1.690 1003 1HE LYS 206 1HE LYS 206 -25.224 33.331 0.189 1004 2HE LYS 206 2HE LYS 206 -25.622 31.824 1.036 1005 1HZ LYS 206 1HZ LYS 206 -23.754 32.656 2.158 1006 2HZ LYS 206 2HZ LYS 206 -22.976 33.122 0.722 1007 3HZ LYS 206 3HZ LYS 206 -23.114 31.476 1.118 1008 H GLN 207 H GLN 207 -28.139 26.632 -2.110 1009 HA GLN 207 HA GLN 207 -29.222 26.328 0.587 1010 1HB GLN 207 1HB GLN 207 -29.079 24.820 -1.992 1011 2HB GLN 207 2HB GLN 207 -29.405 23.882 -0.534 1012 1HG GLN 207 1HG GLN 207 -30.944 26.409 -0.880 1013 2HG GLN 207 2HG GLN 207 -31.365 25.068 -1.946 1014 1HE2 GLN 207 1HE2 GLN 207 -33.465 25.082 -0.630 1015 2HE2 GLN 207 2HE2 GLN 207 -33.488 24.239 0.843 1016 H LEU 208 H LEU 208 -28.645 23.799 1.367 1017 HA LEU 208 HA LEU 208 -25.845 24.006 2.246 1018 1HB LEU 208 1HB LEU 208 -28.107 22.039 2.756 1019 2HB LEU 208 2HB LEU 208 -26.555 21.998 3.592 1020 HG LEU 208 HG LEU 208 -28.092 24.570 3.546 1021 1HD1 LEU 208 1HD1 LEU 208 -29.605 23.937 5.189 1022 2HD1 LEU 208 2HD1 LEU 208 -28.600 22.598 5.743 1023 3HD1 LEU 208 3HD1 LEU 208 -29.523 22.448 4.247 1024 1HD2 LEU 208 1HD2 LEU 208 -26.630 25.133 5.187 1025 2HD2 LEU 208 2HD2 LEU 208 -25.709 23.724 4.658 1026 3HD2 LEU 208 3HD2 LEU 208 -26.831 23.587 6.012 1027 H ALA 209 H ALA 209 -24.363 22.128 2.022 1028 HA ALA 209 HA ALA 209 -24.857 20.605 -0.517 1029 1HB ALA 209 1HB ALA 209 -22.661 22.271 0.515 1030 2HB ALA 209 2HB ALA 209 -23.016 21.798 -1.147 1031 3HB ALA 209 3HB ALA 209 -22.114 20.709 -0.093 1032 H THR 210 H THR 210 -24.173 18.398 -0.525 1033 HA THR 210 HA THR 210 -24.480 16.904 1.861 1034 HB THR 210 HB THR 210 -23.354 15.111 0.414 1035 HG1 THR 210 HG1 THR 210 -22.024 16.577 -0.732 1036 1HG2 THR 210 1HG2 THR 210 -25.517 16.756 -0.933 1037 2HG2 THR 210 2HG2 THR 210 -25.807 15.619 0.383 1038 3HG2 THR 210 3HG2 THR 210 -25.204 15.037 -1.168 1039 H LYS 211 H LYS 211 -21.688 18.566 0.588 1040 HA LYS 211 HA LYS 211 -19.475 18.747 1.397 1041 1HB LYS 211 1HB LYS 211 -21.067 19.411 3.323 1042 2HB LYS 211 2HB LYS 211 -20.724 17.817 3.996 1043 1HG LYS 211 1HG LYS 211 -18.207 18.556 3.558 1044 2HG LYS 211 2HG LYS 211 -18.904 20.172 3.669 1045 1HD LYS 211 1HD LYS 211 -20.080 19.131 5.819 1046 2HD LYS 211 2HD LYS 211 -18.690 18.047 5.765 1047 1HE LYS 211 1HE LYS 211 -17.701 19.742 6.979 1048 2HE LYS 211 2HE LYS 211 -17.456 20.453 5.372 1049 1HZ LYS 211 1HZ LYS 211 -19.508 21.629 5.555 1050 2HZ LYS 211 2HZ LYS 211 -18.634 21.938 6.978 1051 3HZ LYS 211 3HZ LYS 211 -19.919 20.827 6.995 1052 H ALA 212 H ALA 212 -18.973 16.728 0.098 1053 HA ALA 212 HA ALA 212 -18.917 14.145 1.447 1054 1HB ALA 212 1HB ALA 212 -17.744 15.305 -1.100 1055 2HB ALA 212 2HB ALA 212 -19.156 14.259 -0.947 1056 3HB ALA 212 3HB ALA 212 -17.543 13.611 -0.651 1057 H ALA 213 H ALA 213 -16.546 13.017 1.195 1058 HA ALA 213 HA ALA 213 -14.311 14.759 1.939 1059 1HB ALA 213 1HB ALA 213 -16.138 13.601 3.894 1060 2HB ALA 213 2HB ALA 213 -14.838 14.765 4.149 1061 3HB ALA 213 3HB ALA 213 -14.489 13.036 4.159 1062 H ARG 214 H ARG 214 -15.231 11.398 2.776 1063 HA ARG 214 HA ARG 214 -13.366 10.294 0.784 1064 1HB ARG 214 1HB ARG 214 -12.678 10.851 3.582 1065 2HB ARG 214 2HB ARG 214 -12.404 9.165 3.143 1066 1HG ARG 214 1HG ARG 214 -10.445 9.881 2.262 1067 2HG ARG 214 2HG ARG 214 -11.422 10.547 0.954 1068 1HD ARG 214 1HD ARG 214 -11.647 12.480 2.937 1069 2HD ARG 214 2HD ARG 214 -9.958 11.953 3.068 1070 HE ARG 214 HE ARG 214 -10.496 12.172 0.314 1071 1HH1 ARG 214 1HH1 ARG 214 -10.481 14.251 3.107 1072 2HH1 ARG 214 2HH1 ARG 214 -10.076 15.661 2.191 1073 1HH2 ARG 214 1HH2 ARG 214 -9.971 14.017 -0.852 1074 2HH2 ARG 214 2HH2 ARG 214 -9.789 15.532 -0.032 1075 1HN MLZ 215 1HN MLZ 215 -13.073 7.760 1.655 1076 HA MLZ 215 HA MLZ 215 -15.607 6.523 1.297 1077 1HB MLZ 215 1HB MLZ 215 -12.983 5.604 2.523 1078 2HB MLZ 215 2HB MLZ 215 -14.309 4.504 2.146 1079 1HG MLZ 215 1HG MLZ 215 -12.491 5.991 0.299 1080 2HG MLZ 215 2HG MLZ 215 -14.156 5.734 -0.223 1081 1HD MLZ 215 1HD MLZ 215 -12.348 3.523 0.791 1082 2HD MLZ 215 2HD MLZ 215 -13.936 3.338 0.048 1083 1HE MLZ 215 1HE MLZ 215 -12.171 2.862 -1.612 1084 2HE MLZ 215 2HE MLZ 215 -11.468 4.466 -1.331 1085 HZ MLZ 215 HZ MLZ 215 -13.309 5.523 -2.214 1086 1HCM MLZ 215 1HCM MLZ 215 -12.759 3.002 -3.627 1087 2HCM MLZ 215 2HCM MLZ 215 -12.380 4.651 -4.109 1088 3HCM MLZ 215 3HCM MLZ 215 -14.034 4.060 -4.219 1089 H SER 216 H SER 216 -17.232 6.062 2.737 1090 HA SER 216 HA SER 216 -18.398 5.883 4.782 1091 1HB SER 216 1HB SER 216 -16.400 7.881 5.835 1092 2HB SER 216 2HB SER 216 -17.491 8.342 4.529 1093 HG SER 216 HG SER 216 -19.232 7.801 5.848 1094 H ALA 217 H ALA 217 -16.684 3.784 4.597 1095 HA ALA 217 HA ALA 217 -15.570 2.186 5.933 1096 1HB ALA 217 1HB ALA 217 -14.114 4.221 7.478 1097 2HB ALA 217 2HB ALA 217 -14.089 4.532 5.742 1098 3HB ALA 217 3HB ALA 217 -13.486 2.999 6.373 1099 HA PRO 218 HA PRO 218 -17.415 1.741 9.883 1100 1HB PRO 218 1HB PRO 218 -14.809 1.500 11.290 1101 2HB PRO 218 2HB PRO 218 -16.125 0.321 11.160 1102 1HG PRO 218 1HG PRO 218 -13.802 0.046 9.836 1103 2HG PRO 218 2HG PRO 218 -15.344 -0.528 9.186 1104 1HD PRO 218 1HD PRO 218 -13.741 1.861 8.429 1105 2HD PRO 218 2HD PRO 218 -14.774 0.822 7.424 1106 H ALA 219 H ALA 219 -17.323 2.651 12.256 1107 HA ALA 219 HA ALA 219 -16.206 5.435 12.217 1108 1HB ALA 219 1HB ALA 219 -18.889 4.480 13.286 1109 2HB ALA 219 2HB ALA 219 -18.663 5.285 11.733 1110 3HB ALA 219 3HB ALA 219 -18.328 6.151 13.232 1111 H THR 220 H THR 220 -14.934 3.171 13.439 1112 HA THR 220 HA THR 220 -15.537 2.726 16.168 1113 HB THR 220 HB THR 220 -13.915 1.450 14.825 1114 HG1 THR 220 HG1 THR 220 -12.523 2.797 16.885 1115 1HG2 THR 220 1HG2 THR 220 -11.723 3.370 15.017 1116 2HG2 THR 220 2HG2 THR 220 -13.049 3.975 14.024 1117 3HG2 THR 220 3HG2 THR 220 -12.276 2.440 13.624 1118 H GLY 221 H GLY 221 -14.063 3.559 18.014 1119 1HA GLY 221 1HA GLY 221 -14.442 6.263 18.485 1120 2HA GLY 221 2HA GLY 221 -13.200 5.318 19.294 1121 1H MET 1 1H MET 1 2.572 -9.905 4.786 1122 2H MET 1 2H MET 1 1.101 -9.171 5.213 1123 3H MET 1 3H MET 1 1.101 -10.662 4.399 1124 HA MET 1 HA MET 1 2.218 -10.245 7.125 1125 1HB MET 1 1HB MET 1 -0.486 -10.731 6.000 1126 2HB MET 1 2HB MET 1 -0.043 -11.768 7.354 1127 1HG MET 1 1HG MET 1 -0.849 -9.982 8.551 1128 2HG MET 1 2HG MET 1 0.810 -9.425 8.339 1129 1HE MET 1 1HE MET 1 -0.950 -6.350 8.359 1130 2HE MET 1 2HE MET 1 0.661 -6.414 7.642 1131 3HE MET 1 3HE MET 1 0.245 -7.491 8.976 1132 H PHE 2 H PHE 2 1.482 -12.775 8.012 1133 HA PHE 2 HA PHE 2 3.558 -14.455 7.152 1134 1HB PHE 2 1HB PHE 2 2.269 -16.193 8.342 1135 2HB PHE 2 2HB PHE 2 2.177 -14.665 9.217 1136 HD1 PHE 2 HD1 PHE 2 0.340 -17.072 7.122 1137 HD2 PHE 2 HD2 PHE 2 0.109 -13.358 9.268 1138 HE1 PHE 2 HE1 PHE 2 -2.133 -17.123 6.944 1139 HE2 PHE 2 HE2 PHE 2 -2.365 -13.409 9.089 1140 HZ PHE 2 HZ PHE 2 -3.486 -15.292 7.927 1141 H ASN 3 H ASN 3 3.833 -15.777 5.392 1142 HA ASN 3 HA ASN 3 1.474 -16.704 3.847 1143 1HB ASN 3 1HB ASN 3 2.101 -14.482 2.944 1144 2HB ASN 3 2HB ASN 3 3.757 -15.043 2.712 1145 1HD2 ASN 3 1HD2 ASN 3 4.090 -15.517 0.536 1146 2HD2 ASN 3 2HD2 ASN 3 2.961 -16.270 -0.484 1147 H ASP 4 H ASP 4 2.122 -18.399 2.261 1148 HA ASP 4 HA ASP 4 4.079 -20.226 3.332 1149 1HB ASP 4 1HB ASP 4 2.668 -20.095 0.640 1150 2HB ASP 4 2HB ASP 4 3.443 -21.528 1.316 1151 H ARG 5 H ARG 5 5.728 -18.213 3.143 1152 HA ARG 5 HA ARG 5 7.827 -18.938 1.376 1153 1HB ARG 5 1HB ARG 5 5.667 -17.426 0.188 1154 2HB ARG 5 2HB ARG 5 7.128 -16.439 0.187 1155 1HG ARG 5 1HG ARG 5 8.215 -18.744 -0.636 1156 2HG ARG 5 2HG ARG 5 6.574 -19.013 -1.220 1157 1HD ARG 5 1HD ARG 5 8.232 -16.535 -1.821 1158 2HD ARG 5 2HD ARG 5 7.989 -17.889 -2.941 1159 HE ARG 5 HE ARG 5 5.444 -17.025 -1.951 1160 1HH1 ARG 5 1HH1 ARG 5 8.033 -15.997 -4.040 1161 2HH1 ARG 5 2HH1 ARG 5 6.994 -15.042 -5.040 1162 1HH2 ARG 5 1HH2 ARG 5 4.116 -15.780 -3.264 1163 2HH2 ARG 5 2HH2 ARG 5 4.792 -14.919 -4.606 1164 H VAL 6 H VAL 6 6.156 -16.316 3.048 1165 HA VAL 6 HA VAL 6 8.640 -15.577 4.457 1166 HB VAL 6 HB VAL 6 8.332 -13.166 3.705 1167 1HG1 VAL 6 1HG1 VAL 6 8.785 -14.907 1.296 1168 2HG1 VAL 6 2HG1 VAL 6 9.901 -14.979 2.660 1169 3HG1 VAL 6 3HG1 VAL 6 9.657 -13.459 1.801 1170 1HG2 VAL 6 1HG2 VAL 6 7.015 -12.797 1.647 1171 2HG2 VAL 6 2HG2 VAL 6 5.990 -13.372 2.962 1172 3HG2 VAL 6 3HG2 VAL 6 6.489 -14.480 1.684 1173 H ILE 7 H ILE 7 7.895 -13.336 5.733 1174 HA ILE 7 HA ILE 7 5.075 -13.397 6.549 1175 HB ILE 7 HB ILE 7 6.007 -15.317 7.760 1176 1HG1 ILE 7 1HG1 ILE 7 5.760 -12.925 9.611 1177 2HG1 ILE 7 2HG1 ILE 7 4.398 -13.828 8.949 1178 1HG2 ILE 7 1HG2 ILE 7 8.103 -15.341 8.611 1179 2HG2 ILE 7 2HG2 ILE 7 7.872 -13.792 9.422 1180 3HG2 ILE 7 3HG2 ILE 7 8.354 -13.837 7.726 1181 1HD1 ILE 7 1HD1 ILE 7 5.979 -14.440 11.261 1182 2HD1 ILE 7 2HD1 ILE 7 6.215 -15.719 10.069 1183 3HD1 ILE 7 3HD1 ILE 7 4.589 -15.320 10.624 1184 H VAL 8 H VAL 8 4.671 -11.672 8.223 1185 HA VAL 8 HA VAL 8 6.445 -9.369 7.717 1186 HB VAL 8 HB VAL 8 3.992 -9.184 7.554 1187 1HG1 VAL 8 1HG1 VAL 8 2.629 -10.163 9.055 1188 2HG1 VAL 8 2HG1 VAL 8 3.381 -9.276 10.381 1189 3HG1 VAL 8 3HG1 VAL 8 4.060 -10.815 9.853 1190 1HG2 VAL 8 1HG2 VAL 8 5.436 -7.679 9.729 1191 2HG2 VAL 8 2HG2 VAL 8 3.731 -7.355 9.411 1192 3HG2 VAL 8 3HG2 VAL 8 4.926 -7.112 8.138 1193 H LYS 9 H LYS 9 8.083 -8.917 9.078 1194 HA LYS 9 HA LYS 9 7.700 -9.251 11.989 1195 1HB LYS 9 1HB LYS 9 9.830 -10.571 10.296 1196 2HB LYS 9 2HB LYS 9 9.951 -10.437 12.051 1197 1HG LYS 9 1HG LYS 9 7.638 -11.530 12.146 1198 2HG LYS 9 2HG LYS 9 7.861 -11.914 10.441 1199 1HD LYS 9 1HD LYS 9 9.366 -13.556 10.891 1200 2HD LYS 9 2HD LYS 9 10.170 -12.601 12.137 1201 1HE LYS 9 1HE LYS 9 8.226 -13.094 13.671 1202 2HE LYS 9 2HE LYS 9 7.604 -14.201 12.432 1203 1HZ LYS 9 1HZ LYS 9 10.160 -14.342 13.922 1204 2HZ LYS 9 2HZ LYS 9 9.962 -15.149 12.440 1205 3HZ LYS 9 3HZ LYS 9 8.967 -15.540 13.760 1206 H LYS 10 H LYS 10 9.749 -6.301 12.156 1207 HA LYS 10 HA LYS 10 8.514 -6.539 14.115 1208 1HB LYS 10 1HB LYS 10 6.857 -7.042 11.882 1209 2HB LYS 10 2HB LYS 10 6.435 -8.266 13.081 1210 1HG LYS 10 1HG LYS 10 6.608 -5.287 13.634 1211 2HG LYS 10 2HG LYS 10 5.109 -6.176 13.363 1212 1HD LYS 10 1HD LYS 10 5.127 -7.066 15.453 1213 2HD LYS 10 2HD LYS 10 6.860 -7.389 15.395 1214 1HE LYS 10 1HE LYS 10 7.365 -5.434 16.461 1215 2HE LYS 10 2HE LYS 10 6.172 -4.516 15.522 1216 1HZ LYS 10 1HZ LYS 10 5.334 -4.635 17.721 1217 2HZ LYS 10 2HZ LYS 10 5.686 -6.291 17.854 1218 3HZ LYS 10 3HZ LYS 10 4.439 -5.768 16.827 1219 H SER 11 H SER 11 10.644 -8.334 13.768 1220 HA SER 11 HA SER 11 9.685 -11.010 14.606 1221 1HB SER 11 1HB SER 11 11.798 -11.679 13.895 1222 2HB SER 11 2HB SER 11 11.647 -10.194 12.960 1223 HG SER 11 HG SER 11 13.555 -9.995 13.972 1224 HA PRO 12 HA PRO 12 10.747 -10.928 18.888 1225 1HB PRO 12 1HB PRO 12 13.548 -11.898 18.524 1226 2HB PRO 12 2HB PRO 12 12.255 -12.555 19.542 1227 1HG PRO 12 1HG PRO 12 13.009 -13.723 17.246 1228 2HG PRO 12 2HG PRO 12 11.339 -13.760 17.824 1229 1HD PRO 12 1HD PRO 12 12.537 -12.206 15.605 1230 2HD PRO 12 2HD PRO 12 10.876 -12.800 15.805 1231 H LEU 13 H LEU 13 10.907 -8.775 19.477 1232 HA LEU 13 HA LEU 13 11.894 -6.682 19.951 1233 1HB LEU 13 1HB LEU 13 13.986 -8.811 20.284 1234 2HB LEU 13 2HB LEU 13 14.484 -7.125 20.429 1235 HG LEU 13 HG LEU 13 13.843 -8.072 22.627 1236 1HD1 LEU 13 1HD1 LEU 13 12.831 -6.127 23.294 1237 2HD1 LEU 13 2HD1 LEU 13 11.584 -6.230 22.051 1238 3HD1 LEU 13 3HD1 LEU 13 13.194 -5.637 21.639 1239 1HD2 LEU 13 1HD2 LEU 13 12.165 -9.689 21.686 1240 2HD2 LEU 13 2HD2 LEU 13 11.076 -8.329 21.414 1241 3HD2 LEU 13 3HD2 LEU 13 11.554 -8.760 23.056 1242 H GLY 14 H GLY 14 11.471 -6.832 17.265 1243 1HA GLY 14 1HA GLY 14 13.943 -5.582 16.167 1244 2HA GLY 14 2HA GLY 14 13.135 -6.842 15.235 1245 H GLY 15 H GLY 15 13.425 -4.300 14.150 1246 1HA GLY 15 1HA GLY 15 11.038 -2.692 14.611 1247 2HA GLY 15 2HA GLY 15 12.216 -2.451 13.320 1248 H TYR 16 H TYR 16 10.186 -2.127 11.984 1249 HA TYR 16 HA TYR 16 8.698 -4.626 11.389 1250 1HB TYR 16 1HB TYR 16 8.372 -1.694 11.059 1251 2HB TYR 16 2HB TYR 16 7.693 -2.674 9.760 1252 HD1 TYR 16 HD1 TYR 16 5.888 -4.270 10.185 1253 HD2 TYR 16 HD2 TYR 16 7.506 -1.842 13.338 1254 HE1 TYR 16 HE1 TYR 16 3.946 -4.838 11.619 1255 HE2 TYR 16 HE2 TYR 16 5.564 -2.410 14.772 1256 HH TYR 16 HH TYR 16 2.908 -3.268 14.011 1257 H GLY 17 H GLY 17 10.069 -5.894 10.120 1258 1HA GLY 17 1HA GLY 17 10.802 -4.745 7.465 1259 2HA GLY 17 2HA GLY 17 11.978 -5.708 8.363 1260 H VAL 18 H VAL 18 11.863 -7.218 6.455 1261 HA VAL 18 HA VAL 18 9.365 -8.878 6.509 1262 HB VAL 18 HB VAL 18 11.498 -8.399 4.400 1263 1HG1 VAL 18 1HG1 VAL 18 8.961 -10.028 4.108 1264 2HG1 VAL 18 2HG1 VAL 18 10.527 -10.760 4.461 1265 3HG1 VAL 18 3HG1 VAL 18 10.284 -9.881 2.952 1266 1HG2 VAL 18 1HG2 VAL 18 9.467 -7.494 3.165 1267 2HG2 VAL 18 2HG2 VAL 18 10.005 -6.536 4.544 1268 3HG2 VAL 18 3HG2 VAL 18 8.600 -7.590 4.698 1269 H PHE 19 H PHE 19 9.562 -11.058 6.999 1270 HA PHE 19 HA PHE 19 12.296 -12.026 7.736 1271 1HB PHE 19 1HB PHE 19 9.711 -12.083 8.941 1272 2HB PHE 19 2HB PHE 19 10.123 -13.748 8.530 1273 HD1 PHE 19 HD1 PHE 19 11.330 -14.962 10.101 1274 HD2 PHE 19 HD2 PHE 19 11.789 -10.694 9.955 1275 HE1 PHE 19 HE1 PHE 19 12.867 -15.062 12.045 1276 HE2 PHE 19 HE2 PHE 19 13.327 -10.794 11.899 1277 HZ PHE 19 HZ PHE 19 13.865 -12.977 12.945 1278 H ALA 20 H ALA 20 13.114 -13.877 6.733 1279 HA ALA 20 HA ALA 20 11.559 -14.880 4.392 1280 1HB ALA 20 1HB ALA 20 13.853 -15.650 3.689 1281 2HB ALA 20 2HB ALA 20 14.493 -14.963 5.183 1282 3HB ALA 20 3HB ALA 20 13.764 -13.912 3.970 1283 H ARG 21 H ARG 21 10.249 -16.459 5.521 1284 HA ARG 21 HA ARG 21 11.240 -18.435 7.336 1285 1HB ARG 21 1HB ARG 21 8.840 -17.702 6.034 1286 2HB ARG 21 2HB ARG 21 9.131 -19.377 5.565 1287 1HG ARG 21 1HG ARG 21 8.954 -20.159 7.734 1288 2HG ARG 21 2HG ARG 21 9.515 -18.643 8.438 1289 1HD ARG 21 1HD ARG 21 7.385 -17.881 8.656 1290 2HD ARG 21 2HD ARG 21 7.004 -18.298 6.974 1291 HE ARG 21 HE ARG 21 7.181 -20.753 8.283 1292 1HH1 ARG 21 1HH1 ARG 21 5.342 -17.826 8.701 1293 2HH1 ARG 21 2HH1 ARG 21 3.988 -18.647 9.395 1294 1HH2 ARG 21 1HH2 ARG 21 5.410 -21.795 9.187 1295 2HH2 ARG 21 2HH2 ARG 21 4.023 -20.876 9.670 1296 H LYS 22 H LYS 22 11.400 -18.119 3.861 1297 HA LYS 22 HA LYS 22 12.360 -20.905 3.499 1298 1HB LYS 22 1HB LYS 22 11.177 -18.712 1.935 1299 2HB LYS 22 2HB LYS 22 12.482 -19.532 1.089 1300 1HG LYS 22 1HG LYS 22 11.400 -21.651 1.268 1301 2HG LYS 22 2HG LYS 22 10.246 -21.036 2.450 1302 1HD LYS 22 1HD LYS 22 8.959 -20.966 0.521 1303 2HD LYS 22 2HD LYS 22 9.649 -19.345 0.511 1304 1HE LYS 22 1HE LYS 22 10.025 -20.156 -1.699 1305 2HE LYS 22 2HE LYS 22 11.578 -20.417 -0.883 1306 1HZ LYS 22 1HZ LYS 22 10.884 -22.452 -1.961 1307 2HZ LYS 22 2HZ LYS 22 9.375 -22.397 -1.185 1308 3HZ LYS 22 3HZ LYS 22 10.787 -22.657 -0.279 1309 H SER 23 H SER 23 15.691 -19.817 2.264 1310 HA SER 23 HA SER 23 13.286 -21.502 1.662 1311 1HB SER 23 1HB SER 23 15.897 -22.356 0.648 1312 2HB SER 23 2HB SER 23 15.908 -22.104 2.394 1313 HG SER 23 HG SER 23 14.774 -24.081 0.954 1314 H PHE 24 H PHE 24 15.465 -19.135 0.375 1315 HA PHE 24 HA PHE 24 14.255 -19.538 -2.338 1316 1HB PHE 24 1HB PHE 24 15.167 -17.110 -0.765 1317 2HB PHE 24 2HB PHE 24 14.745 -17.026 -2.472 1318 HD1 PHE 24 HD1 PHE 24 13.490 -16.510 0.718 1319 HD2 PHE 24 HD2 PHE 24 12.423 -18.379 -2.999 1320 HE1 PHE 24 HE1 PHE 24 11.092 -16.341 1.322 1321 HE2 PHE 24 HE2 PHE 24 10.024 -18.210 -2.394 1322 HZ PHE 24 HZ PHE 24 9.360 -17.190 -0.233 1323 H GLU 25 H GLU 25 15.644 -18.916 -4.156 1324 HA GLU 25 HA GLU 25 18.510 -19.551 -3.616 1325 1HB GLU 25 1HB GLU 25 16.699 -20.666 -5.301 1326 2HB GLU 25 2HB GLU 25 17.363 -19.425 -6.365 1327 1HG GLU 25 1HG GLU 25 19.671 -20.317 -5.451 1328 2HG GLU 25 2HG GLU 25 18.737 -21.767 -5.088 1329 H LYS 26 H LYS 26 20.026 -18.373 -5.251 1330 HA LYS 26 HA LYS 26 19.718 -15.517 -4.883 1331 1HB LYS 26 1HB LYS 26 21.876 -16.671 -4.896 1332 2HB LYS 26 2HB LYS 26 21.596 -17.219 -6.544 1333 1HG LYS 26 1HG LYS 26 21.662 -14.957 -7.387 1334 2HG LYS 26 2HG LYS 26 21.694 -14.297 -5.752 1335 1HD LYS 26 1HD LYS 26 23.888 -15.282 -5.352 1336 2HD LYS 26 2HD LYS 26 23.845 -16.089 -6.920 1337 1HE LYS 26 1HE LYS 26 23.396 -13.167 -7.044 1338 2HE LYS 26 2HE LYS 26 25.017 -13.650 -6.509 1339 1HZ LYS 26 1HZ LYS 26 23.640 -14.880 -8.836 1340 2HZ LYS 26 2HZ LYS 26 25.275 -15.027 -8.400 1341 3HZ LYS 26 3HZ LYS 26 24.684 -13.549 -8.992 1342 H GLY 27 H GLY 27 17.592 -15.270 -6.024 1343 1HA GLY 27 1HA GLY 27 17.345 -13.877 -8.216 1344 2HA GLY 27 2HA GLY 27 17.835 -15.381 -8.994 1345 H GLU 28 H GLU 28 15.679 -14.977 -6.185 1346 HA GLU 28 HA GLU 28 13.500 -16.211 -7.840 1347 1HB GLU 28 1HB GLU 28 14.441 -16.589 -4.997 1348 2HB GLU 28 2HB GLU 28 12.787 -17.002 -5.446 1349 1HG GLU 28 1HG GLU 28 13.961 -18.266 -7.440 1350 2HG GLU 28 2HG GLU 28 15.363 -18.233 -6.371 1351 H LEU 29 H LEU 29 11.311 -15.525 -7.247 1352 HA LEU 29 HA LEU 29 11.223 -12.682 -6.418 1353 1HB LEU 29 1HB LEU 29 10.113 -13.816 -8.475 1354 2HB LEU 29 2HB LEU 29 8.949 -14.468 -7.323 1355 HG LEU 29 HG LEU 29 8.179 -12.341 -8.376 1356 1HD1 LEU 29 1HD1 LEU 29 8.728 -11.719 -5.494 1357 2HD1 LEU 29 2HD1 LEU 29 7.745 -13.126 -5.898 1358 3HD1 LEU 29 3HD1 LEU 29 7.237 -11.518 -6.414 1359 1HD2 LEU 29 1HD2 LEU 29 10.041 -10.718 -6.750 1360 2HD2 LEU 29 2HD2 LEU 29 9.414 -10.426 -8.373 1361 3HD2 LEU 29 3HD2 LEU 29 10.771 -11.527 -8.136 1362 H VAL 30 H VAL 30 10.587 -12.113 -4.377 1363 HA VAL 30 HA VAL 30 9.596 -14.230 -2.550 1364 HB VAL 30 HB VAL 30 10.488 -11.349 -2.150 1365 1HG1 VAL 30 1HG1 VAL 30 10.128 -13.530 -0.080 1366 2HG1 VAL 30 2HG1 VAL 30 8.913 -12.293 -0.404 1367 3HG1 VAL 30 3HG1 VAL 30 10.501 -11.831 0.210 1368 1HG2 VAL 30 1HG2 VAL 30 11.947 -13.733 -2.679 1369 2HG2 VAL 30 2HG2 VAL 30 12.198 -13.338 -0.979 1370 3HG2 VAL 30 3HG2 VAL 30 12.589 -12.154 -2.226 1371 H GLU 31 H GLU 31 8.657 -10.952 -3.651 1372 HA GLU 31 HA GLU 31 5.829 -11.617 -3.557 1373 1HB GLU 31 1HB GLU 31 6.617 -11.380 -1.126 1374 2HB GLU 31 2HB GLU 31 6.869 -9.670 -1.476 1375 1HG GLU 31 1HG GLU 31 4.679 -9.721 -0.610 1376 2HG GLU 31 2HG GLU 31 4.419 -9.722 -2.354 1377 H GLU 32 H GLU 32 4.542 -9.902 -4.432 1378 HA GLU 32 HA GLU 32 5.935 -7.381 -5.191 1379 1HB GLU 32 1HB GLU 32 5.192 -7.754 -7.549 1380 2HB GLU 32 2HB GLU 32 6.302 -9.012 -7.004 1381 1HG GLU 32 1HG GLU 32 4.189 -10.329 -6.331 1382 2HG GLU 32 2HG GLU 32 3.302 -9.170 -7.321 1383 H CYS 33 H CYS 33 4.444 -5.647 -5.560 1384 HA CYS 33 HA CYS 33 1.540 -6.256 -5.307 1385 1HB CYS 33 1HB CYS 33 3.287 -5.394 -3.216 1386 2HB CYS 33 2HB CYS 33 2.226 -4.040 -3.607 1387 HG CYS 33 HG CYS 33 0.320 -6.165 -3.424 1388 H LEU 34 H LEU 34 0.799 -3.536 -4.852 1389 HA LEU 34 HA LEU 34 1.394 -2.409 -7.544 1390 1HB LEU 34 1HB LEU 34 -0.833 -2.531 -5.644 1391 2HB LEU 34 2HB LEU 34 -0.585 -0.906 -6.280 1392 HG LEU 34 HG LEU 34 -2.126 -2.212 -7.712 1393 1HD1 LEU 34 1HD1 LEU 34 -1.179 -1.520 -9.738 1394 2HD1 LEU 34 2HD1 LEU 34 0.454 -1.958 -9.236 1395 3HD1 LEU 34 3HD1 LEU 34 -0.320 -0.521 -8.566 1396 1HD2 LEU 34 1HD2 LEU 34 0.119 -3.953 -8.622 1397 2HD2 LEU 34 2HD2 LEU 34 -1.613 -4.284 -8.581 1398 3HD2 LEU 34 3HD2 LEU 34 -0.662 -4.372 -7.098 1399 H CYS 35 H CYS 35 1.332 0.131 -7.488 1400 HA CYS 35 HA CYS 35 2.600 1.288 -5.072 1401 1HB CYS 35 1HB CYS 35 3.900 0.718 -7.717 1402 2HB CYS 35 2HB CYS 35 4.367 2.190 -6.866 1403 HG CYS 35 HG CYS 35 5.138 0.727 -4.842 1404 H ILE 36 H ILE 36 2.549 3.647 -5.136 1405 HA ILE 36 HA ILE 36 0.447 4.684 -6.968 1406 HB ILE 36 HB ILE 36 1.849 5.964 -4.594 1407 1HG1 ILE 36 1HG1 ILE 36 -0.848 4.586 -4.616 1408 2HG1 ILE 36 2HG1 ILE 36 0.633 3.771 -4.113 1409 1HG2 ILE 36 1HG2 ILE 36 0.767 7.690 -5.753 1410 2HG2 ILE 36 2HG2 ILE 36 -0.464 7.182 -4.597 1411 3HG2 ILE 36 3HG2 ILE 36 -0.552 6.641 -6.274 1412 1HD1 ILE 36 1HD1 ILE 36 0.855 5.061 -2.200 1413 2HD1 ILE 36 2HD1 ILE 36 -0.903 5.029 -2.342 1414 3HD1 ILE 36 3HD1 ILE 36 0.001 6.436 -2.902 1415 H VAL 37 H VAL 37 0.852 6.875 -7.959 1416 HA VAL 37 HA VAL 37 3.736 7.492 -8.404 1417 HB VAL 37 HB VAL 37 1.657 6.962 -10.561 1418 1HG1 VAL 37 1HG1 VAL 37 3.096 8.435 -11.610 1419 2HG1 VAL 37 2HG1 VAL 37 3.985 6.935 -11.871 1420 3HG1 VAL 37 3HG1 VAL 37 4.452 8.020 -10.562 1421 1HG2 VAL 37 1HG2 VAL 37 3.924 5.329 -9.422 1422 2HG2 VAL 37 2HG2 VAL 37 3.337 5.056 -11.062 1423 3HG2 VAL 37 3HG2 VAL 37 2.249 4.845 -9.690 1424 H ARG 38 H ARG 38 3.685 9.597 -7.633 1425 HA ARG 38 HA ARG 38 1.537 11.395 -8.687 1426 1HB ARG 38 1HB ARG 38 2.918 11.008 -6.109 1427 2HB ARG 38 2HB ARG 38 2.757 12.697 -6.583 1428 1HG ARG 38 1HG ARG 38 0.505 10.671 -6.414 1429 2HG ARG 38 2HG ARG 38 0.796 11.989 -5.280 1430 1HD ARG 38 1HD ARG 38 -0.306 13.443 -6.627 1431 2HD ARG 38 2HD ARG 38 0.709 12.997 -8.007 1432 HE ARG 38 HE ARG 38 -1.235 10.931 -7.334 1433 1HH1 ARG 38 1HH1 ARG 38 -0.725 13.924 -9.038 1434 2HH1 ARG 38 2HH1 ARG 38 -2.003 13.628 -10.164 1435 1HH2 ARG 38 1HH2 ARG 38 -2.890 10.571 -8.808 1436 2HH2 ARG 38 2HH2 ARG 38 -3.221 11.745 -10.037 1437 H HIS 39 H HIS 39 2.806 13.837 -8.153 1438 HA HIS 39 HA HIS 39 5.250 13.721 -9.889 1439 1HB HIS 39 1HB HIS 39 2.814 15.527 -9.926 1440 2HB HIS 39 2HB HIS 39 4.299 15.931 -10.789 1441 HD1 HIS 39 HD1 HIS 39 1.208 14.045 -11.143 1442 HD2 HIS 39 HD2 HIS 39 5.058 13.768 -12.719 1443 HE1 HIS 39 HE1 HIS 39 1.042 12.550 -13.180 1444 H ASN 40 H ASN 40 5.949 13.746 -7.356 1445 HA ASN 40 HA ASN 40 7.012 14.982 -5.644 1446 1HB ASN 40 1HB ASN 40 7.189 16.959 -7.950 1447 2HB ASN 40 2HB ASN 40 8.264 16.897 -6.553 1448 1HD2 ASN 40 1HD2 ASN 40 9.522 14.775 -6.293 1449 2HD2 ASN 40 2HD2 ASN 40 9.988 13.953 -7.704 1450 H ASP 41 H ASP 41 7.020 17.948 -5.535 1451 HA ASP 41 HA ASP 41 5.736 19.680 -4.590 1452 1HB ASP 41 1HB ASP 41 3.447 18.230 -5.971 1453 2HB ASP 41 2HB ASP 41 3.504 19.933 -5.528 1454 H ASP 42 H ASP 42 2.825 19.175 -3.818 1455 HA ASP 42 HA ASP 42 3.057 18.634 -1.113 1456 1HB ASP 42 1HB ASP 42 0.893 18.103 -3.157 1457 2HB ASP 42 2HB ASP 42 0.615 17.799 -1.442 1458 H TRP 43 H TRP 43 3.007 16.272 -3.732 1459 HA TRP 43 HA TRP 43 2.480 13.924 -2.169 1460 1HB TRP 43 1HB TRP 43 2.329 14.039 -4.614 1461 2HB TRP 43 2HB TRP 43 4.044 14.423 -4.726 1462 HD1 TRP 43 HD1 TRP 43 5.530 12.454 -5.229 1463 HE1 TRP 43 HE1 TRP 43 5.389 9.899 -4.922 1464 HE3 TRP 43 HE3 TRP 43 1.058 12.106 -2.792 1465 HZ2 TRP 43 HZ2 TRP 43 3.613 7.965 -3.796 1466 HZ3 TRP 43 HZ3 TRP 43 0.168 9.896 -2.112 1467 HH2 TRP 43 HH2 TRP 43 1.438 7.826 -2.609 1468 H GLY 44 H GLY 44 5.540 15.499 -3.147 1469 1HA GLY 44 1HA GLY 44 7.268 13.578 -1.910 1470 2HA GLY 44 2HA GLY 44 7.721 15.231 -2.324 1471 H THR 45 H THR 45 5.793 16.588 -0.724 1472 HA THR 45 HA THR 45 7.135 16.624 1.819 1473 HB THR 45 HB THR 45 4.444 17.699 0.893 1474 HG1 THR 45 HG1 THR 45 5.579 19.201 -0.015 1475 1HG2 THR 45 1HG2 THR 45 5.510 17.587 3.488 1476 2HG2 THR 45 2HG2 THR 45 4.184 18.612 2.940 1477 3HG2 THR 45 3HG2 THR 45 5.836 19.229 2.934 1478 H ALA 46 H ALA 46 3.682 15.863 1.209 1479 HA ALA 46 HA ALA 46 3.135 14.681 3.707 1480 1HB ALA 46 1HB ALA 46 1.529 15.343 1.887 1481 2HB ALA 46 2HB ALA 46 1.209 13.732 2.528 1482 3HB ALA 46 3HB ALA 46 2.031 13.916 0.979 1483 H LEU 47 H LEU 47 3.856 12.911 0.661 1484 HA LEU 47 HA LEU 47 4.464 10.480 2.238 1485 1HB LEU 47 1HB LEU 47 4.345 11.119 -0.734 1486 2HB LEU 47 2HB LEU 47 4.662 9.512 -0.090 1487 HG LEU 47 HG LEU 47 2.336 9.536 -0.571 1488 1HD1 LEU 47 1HD1 LEU 47 1.999 10.330 2.267 1489 2HD1 LEU 47 2HD1 LEU 47 3.178 9.056 1.961 1490 3HD1 LEU 47 3HD1 LEU 47 1.506 8.850 1.443 1491 1HD2 LEU 47 1HD2 LEU 47 1.725 11.952 1.057 1492 2HD2 LEU 47 2HD2 LEU 47 0.948 11.352 -0.409 1493 3HD2 LEU 47 3HD2 LEU 47 2.482 12.213 -0.515 1494 H GLU 48 H GLU 48 6.342 12.415 2.845 1495 HA GLU 48 HA GLU 48 8.655 12.313 1.082 1496 1HB GLU 48 1HB GLU 48 9.702 13.495 3.015 1497 2HB GLU 48 2HB GLU 48 8.138 14.192 2.592 1498 1HG GLU 48 1HG GLU 48 7.563 13.894 4.757 1499 2HG GLU 48 2HG GLU 48 7.499 12.168 4.400 1500 H ASP 49 H ASP 49 7.335 9.937 3.032 1501 HA ASP 49 HA ASP 49 10.016 8.665 3.421 1502 1HB ASP 49 1HB ASP 49 9.080 7.762 5.539 1503 2HB ASP 49 2HB ASP 49 9.035 9.525 5.535 1504 H TYR 50 H TYR 50 9.939 6.305 3.273 1505 HA TYR 50 HA TYR 50 9.230 4.301 2.234 1506 1HB TYR 50 1HB TYR 50 6.498 5.455 2.918 1507 2HB TYR 50 2HB TYR 50 6.897 3.752 2.715 1508 HD1 TYR 50 HD1 TYR 50 9.136 3.103 4.214 1509 HD2 TYR 50 HD2 TYR 50 6.222 6.126 5.122 1510 HE1 TYR 50 HE1 TYR 50 9.746 2.971 6.614 1511 HE2 TYR 50 HE2 TYR 50 6.832 5.993 7.521 1512 HH TYR 50 HH TYR 50 8.844 3.480 8.769 1513 H LEU 51 H LEU 51 9.336 6.954 0.690 1514 HA LEU 51 HA LEU 51 7.470 6.215 -1.538 1515 1HB LEU 51 1HB LEU 51 7.306 8.435 -0.193 1516 2HB LEU 51 2HB LEU 51 8.775 8.903 -1.049 1517 HG LEU 51 HG LEU 51 7.449 8.174 -3.187 1518 1HD1 LEU 51 1HD1 LEU 51 4.969 9.119 -2.092 1519 2HD1 LEU 51 2HD1 LEU 51 5.517 7.736 -1.146 1520 3HD1 LEU 51 3HD1 LEU 51 5.299 7.581 -2.889 1521 1HD2 LEU 51 1HD2 LEU 51 7.578 10.648 -1.658 1522 2HD2 LEU 51 2HD2 LEU 51 6.115 10.573 -2.641 1523 3HD2 LEU 51 3HD2 LEU 51 7.699 10.407 -3.400 1524 H PHE 52 H PHE 52 8.495 5.440 -3.330 1525 HA PHE 52 HA PHE 52 11.418 5.812 -3.653 1526 1HB PHE 52 1HB PHE 52 9.256 4.216 -5.072 1527 2HB PHE 52 2HB PHE 52 10.946 4.200 -5.574 1528 HD1 PHE 52 HD1 PHE 52 12.449 2.703 -4.569 1529 HD2 PHE 52 HD2 PHE 52 8.775 3.673 -2.566 1530 HE1 PHE 52 HE1 PHE 52 12.947 1.004 -2.834 1531 HE2 PHE 52 HE2 PHE 52 9.274 1.974 -0.830 1532 HZ PHE 52 HZ PHE 52 11.359 0.639 -0.964 1533 H SER 53 H SER 53 12.097 7.599 -4.788 1534 HA SER 53 HA SER 53 10.193 8.946 -6.622 1535 1HB SER 53 1HB SER 53 12.756 9.607 -5.194 1536 2HB SER 53 2HB SER 53 12.233 10.614 -6.541 1537 HG SER 53 HG SER 53 10.539 9.935 -4.384 1538 H ARG 54 H ARG 54 10.500 9.052 -8.819 1539 HA ARG 54 HA ARG 54 12.844 7.571 -9.950 1540 1HB ARG 54 1HB ARG 54 10.173 7.169 -10.237 1541 2HB ARG 54 2HB ARG 54 10.446 8.296 -11.565 1542 1HG ARG 54 1HG ARG 54 12.247 6.839 -12.426 1543 2HG ARG 54 2HG ARG 54 11.956 5.706 -11.105 1544 1HD ARG 54 1HD ARG 54 10.490 4.714 -12.558 1545 2HD ARG 54 2HD ARG 54 9.420 6.073 -12.159 1546 HE ARG 54 HE ARG 54 11.373 6.796 -14.184 1547 1HH1 ARG 54 1HH1 ARG 54 8.337 5.182 -13.640 1548 2HH1 ARG 54 2HH1 ARG 54 7.777 5.455 -15.253 1549 1HH2 ARG 54 1HH2 ARG 54 10.624 7.137 -16.273 1550 2HH2 ARG 54 2HH2 ARG 54 9.060 6.553 -16.734 1551 H LYS 55 H LYS 55 13.405 8.456 -12.247 1552 HA LYS 55 HA LYS 55 14.013 11.307 -11.999 1553 1HB LYS 55 1HB LYS 55 14.430 9.288 -14.237 1554 2HB LYS 55 2HB LYS 55 15.226 10.857 -14.114 1555 1HG LYS 55 1HG LYS 55 15.477 9.239 -11.677 1556 2HG LYS 55 2HG LYS 55 16.215 8.486 -13.091 1557 1HD LYS 55 1HD LYS 55 16.784 11.347 -12.948 1558 2HD LYS 55 2HD LYS 55 17.357 10.485 -11.520 1559 1HE LYS 55 1HE LYS 55 19.163 10.324 -13.070 1560 2HE LYS 55 2HE LYS 55 18.331 8.764 -13.221 1561 1HZ LYS 55 1HZ LYS 55 16.939 9.855 -14.981 1562 2HZ LYS 55 2HZ LYS 55 18.568 9.628 -15.408 1563 3HZ LYS 55 3HZ LYS 55 18.018 11.166 -14.943 1564 H ASN 56 H ASN 56 11.750 12.059 -12.003 1565 HA ASN 56 HA ASN 56 10.264 11.785 -14.554 1566 1HB ASN 56 1HB ASN 56 11.787 13.665 -14.906 1567 2HB ASN 56 2HB ASN 56 10.156 14.300 -14.694 1568 1HD2 ASN 56 1HD2 ASN 56 13.242 13.765 -12.948 1569 2HD2 ASN 56 2HD2 ASN 56 12.972 14.968 -11.781 1570 H MET 57 H MET 57 10.046 11.274 -11.472 1571 HA MET 57 HA MET 57 7.948 13.006 -10.509 1572 1HB MET 57 1HB MET 57 6.035 11.654 -11.020 1573 2HB MET 57 2HB MET 57 6.950 11.758 -12.518 1574 1HG MET 57 1HG MET 57 8.026 9.535 -11.202 1575 2HG MET 57 2HG MET 57 6.289 9.419 -10.920 1576 1HE MET 57 1HE MET 57 4.829 9.780 -14.486 1577 2HE MET 57 2HE MET 57 5.560 11.227 -13.792 1578 3HE MET 57 3HE MET 57 4.638 10.127 -12.767 1579 H SER 58 H SER 58 6.507 10.766 -9.181 1580 HA SER 58 HA SER 58 8.613 9.420 -7.594 1581 1HB SER 58 1HB SER 58 6.529 11.032 -6.147 1582 2HB SER 58 2HB SER 58 8.138 10.563 -5.603 1583 HG SER 58 HG SER 58 9.028 12.131 -6.799 1584 H ALA 59 H ALA 59 7.616 7.854 -6.020 1585 HA ALA 59 HA ALA 59 4.777 7.153 -6.536 1586 1HB ALA 59 1HB ALA 59 5.708 5.893 -8.272 1587 2HB ALA 59 2HB ALA 59 5.816 4.732 -6.949 1588 3HB ALA 59 3HB ALA 59 7.235 5.666 -7.420 1589 H MET 60 H MET 60 3.959 5.623 -4.932 1590 HA MET 60 HA MET 60 5.597 5.589 -2.431 1591 1HB MET 60 1HB MET 60 3.380 6.635 -2.332 1592 2HB MET 60 2HB MET 60 2.641 5.193 -3.026 1593 1HG MET 60 1HG MET 60 2.307 5.178 -0.610 1594 2HG MET 60 2HG MET 60 3.420 3.884 -1.052 1595 1HE MET 60 1HE MET 60 3.703 7.873 0.457 1596 2HE MET 60 2HE MET 60 3.681 6.925 1.944 1597 3HE MET 60 3HE MET 60 2.451 6.656 0.708 1598 H ALA 61 H ALA 61 5.622 3.574 -1.166 1599 HA ALA 61 HA ALA 61 5.824 1.187 -2.876 1600 1HB ALA 61 1HB ALA 61 6.350 0.379 -0.327 1601 2HB ALA 61 2HB ALA 61 6.616 2.115 -0.163 1602 3HB ALA 61 3HB ALA 61 7.543 1.188 -1.344 1603 H LEU 62 H LEU 62 3.643 0.652 -3.393 1604 HA LEU 62 HA LEU 62 1.566 -0.404 -3.049 1605 1HB LEU 62 1HB LEU 62 0.894 0.602 -0.491 1606 2HB LEU 62 2HB LEU 62 1.914 1.830 -1.239 1607 HG LEU 62 HG LEU 62 0.467 1.647 -3.303 1608 1HD1 LEU 62 1HD1 LEU 62 -0.508 -0.610 -1.948 1609 2HD1 LEU 62 2HD1 LEU 62 -1.149 0.081 -3.438 1610 3HD1 LEU 62 3HD1 LEU 62 -1.821 0.565 -1.881 1611 1HD2 LEU 62 1HD2 LEU 62 -1.150 2.369 -0.852 1612 2HD2 LEU 62 2HD2 LEU 62 -1.209 3.110 -2.452 1613 3HD2 LEU 62 3HD2 LEU 62 0.195 3.363 -1.414 1614 H GLY 63 H GLY 63 3.046 -2.405 -2.685 1615 1HA GLY 63 1HA GLY 63 1.971 -3.932 -0.531 1616 2HA GLY 63 2HA GLY 63 3.327 -4.429 -1.539 1617 H PHE 64 H PHE 64 4.897 -5.050 -0.134 1618 HA PHE 64 HA PHE 64 5.310 -3.598 2.406 1619 1HB PHE 64 1HB PHE 64 6.601 -6.025 1.104 1620 2HB PHE 64 2HB PHE 64 6.929 -5.484 2.750 1621 HD1 PHE 64 HD1 PHE 64 4.304 -6.798 0.476 1622 HD2 PHE 64 HD2 PHE 64 5.386 -5.905 4.536 1623 HE1 PHE 64 HE1 PHE 64 2.310 -8.034 1.279 1624 HE2 PHE 64 HE2 PHE 64 3.392 -7.142 5.339 1625 HZ PHE 64 HZ PHE 64 1.854 -8.205 3.709 1626 H GLY 65 H GLY 65 5.932 -2.084 0.001 1627 1HA GLY 65 1HA GLY 65 8.825 -2.170 -0.384 1628 2HA GLY 65 2HA GLY 65 7.726 -0.971 -1.063 1629 H ALA 66 H ALA 66 6.643 -0.623 1.815 1630 HA ALA 66 HA ALA 66 8.560 1.509 2.533 1631 1HB ALA 66 1HB ALA 66 5.852 0.658 3.622 1632 2HB ALA 66 2HB ALA 66 6.124 1.901 2.401 1633 3HB ALA 66 3HB ALA 66 6.693 2.146 4.052 1634 H ILE 67 H ILE 67 7.011 -1.289 4.161 1635 HA ILE 67 HA ILE 67 8.259 -1.040 6.670 1636 HB ILE 67 HB ILE 67 7.859 -3.548 6.757 1637 1HG1 ILE 67 1HG1 ILE 67 6.324 -3.882 4.431 1638 2HG1 ILE 67 2HG1 ILE 67 7.824 -3.136 3.883 1639 1HG2 ILE 67 1HG2 ILE 67 5.766 -1.581 5.855 1640 2HG2 ILE 67 2HG2 ILE 67 6.043 -2.241 7.468 1641 3HG2 ILE 67 3HG2 ILE 67 5.337 -3.255 6.209 1642 1HD1 ILE 67 1HD1 ILE 67 8.690 -5.225 3.966 1643 2HD1 ILE 67 2HD1 ILE 67 7.361 -5.829 4.957 1644 3HD1 ILE 67 3HD1 ILE 67 8.719 -4.996 5.715 1645 H PHE 68 H PHE 68 9.725 -1.934 3.651 1646 HA PHE 68 HA PHE 68 11.800 -3.655 4.351 1647 1HB PHE 68 1HB PHE 68 11.458 -1.333 2.481 1648 2HB PHE 68 2HB PHE 68 13.059 -2.051 2.628 1649 HD1 PHE 68 HD1 PHE 68 10.570 -2.068 0.444 1650 HD2 PHE 68 HD2 PHE 68 12.496 -4.895 3.042 1651 HE1 PHE 68 HE1 PHE 68 9.865 -3.920 -1.048 1652 HE2 PHE 68 HE2 PHE 68 11.791 -6.746 1.551 1653 HZ PHE 68 HZ PHE 68 10.476 -6.259 -0.495 1654 H ASN 69 H ASN 69 13.621 -3.500 5.629 1655 HA ASN 69 HA ASN 69 14.056 -0.963 7.117 1656 1HB ASN 69 1HB ASN 69 15.191 -3.770 7.424 1657 2HB ASN 69 2HB ASN 69 15.376 -2.458 8.587 1658 1HD2 ASN 69 1HD2 ASN 69 14.208 -4.413 9.865 1659 2HD2 ASN 69 2HD2 ASN 69 12.514 -4.302 9.915 1660 H HIS 70 H HIS 70 16.734 -1.259 7.777 1661 HA HIS 70 HA HIS 70 18.081 -0.704 5.167 1662 1HB HIS 70 1HB HIS 70 18.095 1.083 6.846 1663 2HB HIS 70 2HB HIS 70 18.713 -0.029 8.067 1664 HD1 HIS 70 HD1 HIS 70 21.100 0.585 8.465 1665 HD2 HIS 70 HD2 HIS 70 20.150 0.679 4.406 1666 HE1 HIS 70 HE1 HIS 70 23.256 1.091 7.236 1667 H SER 71 H SER 71 20.257 -1.626 4.864 1668 HA SER 71 HA SER 71 21.375 -3.564 6.693 1669 1HB SER 71 1HB SER 71 19.244 -4.662 5.854 1670 2HB SER 71 2HB SER 71 19.952 -4.652 4.239 1671 HG SER 71 HG SER 71 21.225 -5.792 6.492 1672 H LYS 72 H LYS 72 23.513 -3.705 6.155 1673 HA LYS 72 HA LYS 72 24.662 -2.381 3.911 1674 1HB LYS 72 1HB LYS 72 25.466 -3.613 6.266 1675 2HB LYS 72 2HB LYS 72 26.166 -4.655 5.028 1676 1HG LYS 72 1HG LYS 72 27.849 -3.090 5.136 1677 2HG LYS 72 2HG LYS 72 26.811 -2.267 3.972 1678 1HD LYS 72 1HD LYS 72 25.728 -1.042 5.849 1679 2HD LYS 72 2HD LYS 72 26.840 -1.822 6.973 1680 1HE LYS 72 1HE LYS 72 28.102 -0.473 4.640 1681 2HE LYS 72 2HE LYS 72 27.366 0.589 5.855 1682 1HZ LYS 72 1HZ LYS 72 29.625 0.033 6.497 1683 2HZ LYS 72 2HZ LYS 72 29.285 -1.626 6.380 1684 3HZ LYS 72 3HZ LYS 72 28.532 -0.687 7.578 1685 H ASP 73 H ASP 73 23.709 -5.768 4.401 1686 HA ASP 73 HA ASP 73 24.294 -6.266 1.499 1687 1HB ASP 73 1HB ASP 73 24.892 -7.707 4.026 1688 2HB ASP 73 2HB ASP 73 24.331 -8.726 2.701 1689 HA PRO 74 HA PRO 74 19.745 -6.744 2.337 1690 1HB PRO 74 1HB PRO 74 19.050 -5.836 -0.204 1691 2HB PRO 74 2HB PRO 74 19.147 -4.811 1.238 1692 1HG PRO 74 1HG PRO 74 21.096 -5.169 -0.975 1693 2HG PRO 74 2HG PRO 74 20.697 -3.718 -0.045 1694 1HD PRO 74 1HD PRO 74 22.956 -5.169 0.363 1695 2HD PRO 74 2HD PRO 74 22.145 -4.256 1.653 1696 H ASN 75 H ASN 75 19.777 -9.018 2.229 1697 HA ASN 75 HA ASN 75 20.691 -10.642 0.116 1698 1HB ASN 75 1HB ASN 75 18.330 -11.053 1.989 1699 2HB ASN 75 2HB ASN 75 19.231 -12.331 1.173 1700 1HD2 ASN 75 1HD2 ASN 75 21.019 -13.153 2.292 1701 2HD2 ASN 75 2HD2 ASN 75 21.750 -12.404 3.628 1702 H ALA 76 H ALA 76 17.820 -8.671 0.293 1703 HA ALA 76 HA ALA 76 16.946 -9.794 -2.346 1704 1HB ALA 76 1HB ALA 76 15.165 -10.537 -1.124 1705 2HB ALA 76 2HB ALA 76 14.659 -8.848 -1.096 1706 3HB ALA 76 3HB ALA 76 15.582 -9.514 0.250 1707 H ARG 77 H ARG 77 15.649 -8.196 -3.616 1708 HA ARG 77 HA ARG 77 16.069 -5.350 -2.831 1709 1HB ARG 77 1HB ARG 77 18.003 -6.178 -4.188 1710 2HB ARG 77 2HB ARG 77 16.881 -6.611 -5.478 1711 1HG ARG 77 1HG ARG 77 16.255 -4.313 -5.812 1712 2HG ARG 77 2HG ARG 77 17.104 -3.808 -4.352 1713 1HD ARG 77 1HD ARG 77 19.261 -4.390 -5.360 1714 2HD ARG 77 2HD ARG 77 18.441 -5.015 -6.803 1715 HE ARG 77 HE ARG 77 17.443 -2.426 -6.469 1716 1HH1 ARG 77 1HH1 ARG 77 20.579 -3.885 -6.869 1717 2HH1 ARG 77 2HH1 ARG 77 21.246 -2.498 -7.657 1718 1HH2 ARG 77 1HH2 ARG 77 18.332 -0.638 -7.495 1719 2HH2 ARG 77 2HH2 ARG 77 19.985 -0.672 -8.010 1720 H HIS 78 H HIS 78 14.651 -3.890 -4.033 1721 HA HIS 78 HA HIS 78 12.131 -5.200 -4.851 1722 1HB HIS 78 1HB HIS 78 11.303 -2.862 -4.740 1723 2HB HIS 78 2HB HIS 78 12.197 -3.282 -3.279 1724 HD1 HIS 78 HD1 HIS 78 14.473 -2.128 -2.890 1725 HD2 HIS 78 HD2 HIS 78 12.641 -1.003 -6.461 1726 HE1 HIS 78 HE1 HIS 78 15.765 -0.131 -3.761 1727 H GLU 79 H GLU 79 11.023 -4.331 -6.857 1728 HA GLU 79 HA GLU 79 12.874 -3.361 -8.973 1729 1HB GLU 79 1HB GLU 79 12.726 -5.965 -8.684 1730 2HB GLU 79 2HB GLU 79 11.137 -5.789 -9.427 1731 1HG GLU 79 1HG GLU 79 12.857 -6.258 -11.134 1732 2HG GLU 79 2HG GLU 79 12.169 -4.651 -11.361 1733 H LEU 80 H LEU 80 11.657 -2.675 -10.924 1734 HA LEU 80 HA LEU 80 8.777 -2.078 -10.325 1735 1HB LEU 80 1HB LEU 80 11.036 -0.442 -11.501 1736 2HB LEU 80 2HB LEU 80 9.352 0.013 -11.757 1737 HG LEU 80 HG LEU 80 10.380 -0.558 -8.983 1738 1HD1 LEU 80 1HD1 LEU 80 10.315 2.215 -10.163 1739 2HD1 LEU 80 2HD1 LEU 80 11.765 1.220 -10.282 1740 3HD1 LEU 80 3HD1 LEU 80 11.125 1.660 -8.699 1741 1HD2 LEU 80 1HD2 LEU 80 8.534 0.985 -8.391 1742 2HD2 LEU 80 2HD2 LEU 80 7.950 -0.382 -9.341 1743 3HD2 LEU 80 3HD2 LEU 80 8.168 1.192 -10.104 1744 H THR 81 H THR 81 7.343 -2.206 -12.122 1745 HA THR 81 HA THR 81 8.109 -4.053 -14.229 1746 HB THR 81 HB THR 81 5.710 -3.202 -14.995 1747 HG1 THR 81 HG1 THR 81 5.131 -1.586 -13.802 1748 1HG2 THR 81 1HG2 THR 81 4.832 -4.950 -13.761 1749 2HG2 THR 81 2HG2 THR 81 5.692 -4.483 -12.293 1750 3HG2 THR 81 3HG2 THR 81 6.550 -5.313 -13.592 1751 H ALA 82 H ALA 82 9.966 -2.338 -14.791 1752 HA ALA 82 HA ALA 82 10.818 -0.804 -16.372 1753 1HB ALA 82 1HB ALA 82 9.676 -1.009 -18.562 1754 2HB ALA 82 2HB ALA 82 8.281 -1.739 -17.767 1755 3HB ALA 82 3HB ALA 82 9.826 -2.589 -17.793 1756 H GLY 83 H GLY 83 9.180 0.364 -14.294 1757 1HA GLY 83 1HA GLY 83 8.787 2.972 -15.248 1758 2HA GLY 83 2HA GLY 83 7.226 2.168 -15.407 1759 H LEU 84 H LEU 84 6.025 2.959 -13.728 1760 HA LEU 84 HA LEU 84 7.127 2.607 -10.965 1761 1HB LEU 84 1HB LEU 84 6.761 5.019 -12.372 1762 2HB LEU 84 2HB LEU 84 5.379 4.922 -11.282 1763 HG LEU 84 HG LEU 84 6.879 4.577 -9.372 1764 1HD1 LEU 84 1HD1 LEU 84 8.810 4.146 -11.543 1765 2HD1 LEU 84 2HD1 LEU 84 8.854 3.579 -9.874 1766 3HD1 LEU 84 3HD1 LEU 84 9.417 5.203 -10.269 1767 1HD2 LEU 84 1HD2 LEU 84 7.356 6.804 -9.156 1768 2HD2 LEU 84 2HD2 LEU 84 6.456 6.928 -10.668 1769 3HD2 LEU 84 3HD2 LEU 84 8.218 6.871 -10.693 1770 H LYS 85 H LYS 85 5.058 1.233 -12.807 1771 HA LYS 85 HA LYS 85 2.497 1.760 -11.474 1772 1HB LYS 85 1HB LYS 85 3.344 -0.413 -13.426 1773 2HB LYS 85 2HB LYS 85 1.695 0.116 -13.100 1774 1HG LYS 85 1HG LYS 85 3.874 1.900 -14.228 1775 2HG LYS 85 2HG LYS 85 2.640 1.100 -15.201 1776 1HD LYS 85 1HD LYS 85 1.087 2.644 -14.653 1777 2HD LYS 85 2HD LYS 85 1.483 2.534 -12.938 1778 1HE LYS 85 1HE LYS 85 3.561 3.945 -13.473 1779 2HE LYS 85 2HE LYS 85 2.807 4.261 -15.048 1780 1HZ LYS 85 1HZ LYS 85 2.095 5.939 -13.495 1781 2HZ LYS 85 2HZ LYS 85 1.618 4.763 -12.367 1782 3HZ LYS 85 3HZ LYS 85 0.775 4.925 -13.832 1783 H ARG 86 H ARG 86 4.253 -1.333 -11.978 1784 HA ARG 86 HA ARG 86 3.130 -2.274 -9.376 1785 1HB ARG 86 1HB ARG 86 3.902 -3.434 -12.011 1786 2HB ARG 86 2HB ARG 86 4.142 -4.470 -10.604 1787 1HG ARG 86 1HG ARG 86 1.735 -3.844 -9.945 1788 2HG ARG 86 2HG ARG 86 1.573 -3.218 -11.586 1789 1HD ARG 86 1HD ARG 86 2.706 -5.691 -12.040 1790 2HD ARG 86 2HD ARG 86 1.647 -6.013 -10.653 1791 HE ARG 86 HE ARG 86 0.094 -4.427 -12.311 1792 1HH1 ARG 86 1HH1 ARG 86 1.890 -7.381 -12.726 1793 2HH1 ARG 86 2HH1 ARG 86 0.831 -7.981 -13.954 1794 1HH2 ARG 86 1HH2 ARG 86 -1.266 -5.229 -13.907 1795 2HH2 ARG 86 2HH2 ARG 86 -0.942 -6.775 -14.619 1796 H MET 87 H MET 87 4.572 -3.691 -8.057 1797 HA MET 87 HA MET 87 7.485 -3.062 -8.381 1798 1HB MET 87 1HB MET 87 5.576 -2.258 -6.334 1799 2HB MET 87 2HB MET 87 6.893 -3.192 -5.626 1800 1HG MET 87 1HG MET 87 8.493 -1.696 -6.921 1801 2HG MET 87 2HG MET 87 7.104 -0.676 -7.296 1802 1HE MET 87 1HE MET 87 9.836 -1.029 -4.054 1803 2HE MET 87 2HE MET 87 9.267 -2.360 -5.062 1804 3HE MET 87 3HE MET 87 8.625 -2.150 -3.433 1805 H ARG 88 H ARG 88 8.878 -4.747 -7.641 1806 HA ARG 88 HA ARG 88 7.527 -7.251 -6.693 1807 1HB ARG 88 1HB ARG 88 9.680 -6.931 -8.818 1808 2HB ARG 88 2HB ARG 88 9.001 -8.467 -8.279 1809 1HG ARG 88 1HG ARG 88 6.833 -7.909 -9.138 1810 2HG ARG 88 2HG ARG 88 7.304 -6.232 -9.413 1811 1HD ARG 88 1HD ARG 88 7.708 -6.948 -11.556 1812 2HD ARG 88 2HD ARG 88 9.208 -7.600 -10.869 1813 HE ARG 88 HE ARG 88 7.137 -9.471 -10.340 1814 1HH1 ARG 88 1HH1 ARG 88 8.844 -8.110 -13.051 1815 2HH1 ARG 88 2HH1 ARG 88 8.644 -9.524 -14.027 1816 1HH2 ARG 88 1HH2 ARG 88 6.891 -11.295 -11.627 1817 2HH2 ARG 88 2HH2 ARG 88 7.548 -11.314 -13.230 1818 H ILE 89 H ILE 89 9.179 -8.803 -5.739 1819 HA ILE 89 HA ILE 89 11.532 -7.361 -4.570 1820 HB ILE 89 HB ILE 89 9.572 -9.207 -3.154 1821 1HG1 ILE 89 1HG1 ILE 89 9.933 -6.205 -2.907 1822 2HG1 ILE 89 2HG1 ILE 89 8.614 -6.985 -3.779 1823 1HG2 ILE 89 1HG2 ILE 89 11.993 -9.128 -2.352 1824 2HG2 ILE 89 2HG2 ILE 89 10.778 -8.687 -1.151 1825 3HG2 ILE 89 3HG2 ILE 89 11.713 -7.431 -1.963 1826 1HD1 ILE 89 1HD1 ILE 89 9.039 -7.952 -1.014 1827 2HD1 ILE 89 2HD1 ILE 89 7.535 -7.591 -1.862 1828 3HD1 ILE 89 3HD1 ILE 89 8.480 -6.284 -1.148 1829 H PHE 90 H PHE 90 13.006 -8.512 -5.913 1830 HA PHE 90 HA PHE 90 12.886 -11.466 -5.995 1831 1HB PHE 90 1HB PHE 90 14.542 -9.270 -7.254 1832 2HB PHE 90 2HB PHE 90 14.988 -10.965 -7.443 1833 HD1 PHE 90 HD1 PHE 90 13.780 -12.413 -8.909 1834 HD2 PHE 90 HD2 PHE 90 12.293 -8.477 -8.047 1835 HE1 PHE 90 HE1 PHE 90 12.098 -12.653 -10.715 1836 HE2 PHE 90 HE2 PHE 90 10.611 -8.717 -9.853 1837 HZ PHE 90 HZ PHE 90 10.513 -10.805 -11.188 1838 H THR 91 H THR 91 15.284 -12.447 -5.801 1839 HA THR 91 HA THR 91 16.419 -11.455 -3.206 1840 HB THR 91 HB THR 91 17.139 -14.022 -3.226 1841 HG1 THR 91 HG1 THR 91 14.749 -14.102 -4.722 1842 1HG2 THR 91 1HG2 THR 91 15.618 -12.955 -1.589 1843 2HG2 THR 91 2HG2 THR 91 15.041 -14.557 -2.049 1844 3HG2 THR 91 3HG2 THR 91 14.284 -13.118 -2.732 1845 H ILE 92 H ILE 92 18.074 -10.155 -4.171 1846 HA ILE 92 HA ILE 92 19.717 -10.833 -6.364 1847 HB ILE 92 HB ILE 92 21.251 -9.164 -5.339 1848 1HG1 ILE 92 1HG1 ILE 92 19.434 -8.994 -2.958 1849 2HG1 ILE 92 2HG1 ILE 92 20.718 -10.202 -2.968 1850 1HG2 ILE 92 1HG2 ILE 92 18.956 -8.582 -6.394 1851 2HG2 ILE 92 2HG2 ILE 92 19.746 -7.344 -5.417 1852 3HG2 ILE 92 3HG2 ILE 92 18.426 -8.295 -4.736 1853 1HD1 ILE 92 1HD1 ILE 92 22.058 -7.987 -3.861 1854 2HD1 ILE 92 2HD1 ILE 92 22.015 -8.508 -2.176 1855 3HD1 ILE 92 3HD1 ILE 92 20.900 -7.265 -2.744 1856 H LYS 93 H LYS 93 19.709 -12.125 -3.133 1857 HA LYS 93 HA LYS 93 22.100 -13.780 -3.840 1858 1HB LYS 93 1HB LYS 93 21.519 -12.299 -1.247 1859 2HB LYS 93 2HB LYS 93 22.868 -13.411 -1.482 1860 1HG LYS 93 1HG LYS 93 23.053 -11.683 -3.658 1861 2HG LYS 93 2HG LYS 93 22.594 -10.625 -2.323 1862 1HD LYS 93 1HD LYS 93 24.474 -12.186 -1.111 1863 2HD LYS 93 2HD LYS 93 25.101 -12.136 -2.758 1864 1HE LYS 93 1HE LYS 93 24.905 -9.632 -2.705 1865 2HE LYS 93 2HE LYS 93 24.433 -9.748 -0.999 1866 1HZ LYS 93 1HZ LYS 93 26.833 -9.463 -1.218 1867 2HZ LYS 93 2HZ LYS 93 26.928 -10.845 -2.199 1868 3HZ LYS 93 3HZ LYS 93 26.472 -10.991 -0.569 1869 HA PRO 94 HA PRO 94 19.791 -17.234 -2.429 1870 1HB PRO 94 1HB PRO 94 22.030 -18.067 -0.684 1871 2HB PRO 94 2HB PRO 94 21.301 -18.919 -2.054 1872 1HG PRO 94 1HG PRO 94 23.738 -17.768 -2.171 1873 2HG PRO 94 2HG PRO 94 22.673 -17.914 -3.574 1874 1HD PRO 94 1HD PRO 94 23.327 -15.527 -1.936 1875 2HD PRO 94 2HD PRO 94 22.910 -15.641 -3.658 1876 H ILE 95 H ILE 95 18.719 -18.080 -0.482 1877 HA ILE 95 HA ILE 95 19.199 -16.552 2.030 1878 HB ILE 95 HB ILE 95 16.687 -16.651 0.336 1879 1HG1 ILE 95 1HG1 ILE 95 18.294 -14.384 1.550 1880 2HG1 ILE 95 2HG1 ILE 95 18.318 -14.869 -0.145 1881 1HG2 ILE 95 1HG2 ILE 95 16.911 -16.537 3.244 1882 2HG2 ILE 95 2HG2 ILE 95 15.469 -16.696 2.238 1883 3HG2 ILE 95 3HG2 ILE 95 16.127 -15.098 2.590 1884 1HD1 ILE 95 1HD1 ILE 95 15.990 -13.716 1.411 1885 2HD1 ILE 95 2HD1 ILE 95 15.809 -14.454 -0.180 1886 3HD1 ILE 95 3HD1 ILE 95 16.804 -13.011 0.015 1887 H ALA 96 H ALA 96 18.890 -17.824 3.814 1888 HA ALA 96 HA ALA 96 17.950 -20.619 3.399 1889 1HB ALA 96 1HB ALA 96 20.143 -20.310 4.384 1890 2HB ALA 96 2HB ALA 96 19.070 -20.834 5.683 1891 3HB ALA 96 3HB ALA 96 19.513 -19.133 5.537 1892 H ILE 97 H ILE 97 16.649 -21.563 5.202 1893 HA ILE 97 HA ILE 97 14.260 -20.073 5.731 1894 HB ILE 97 HB ILE 97 15.454 -22.552 7.030 1895 1HG1 ILE 97 1HG1 ILE 97 13.468 -23.290 5.229 1896 2HG1 ILE 97 2HG1 ILE 97 14.318 -21.993 4.395 1897 1HG2 ILE 97 1HG2 ILE 97 13.178 -21.106 7.761 1898 2HG2 ILE 97 2HG2 ILE 97 13.530 -22.780 8.191 1899 3HG2 ILE 97 3HG2 ILE 97 12.553 -22.422 6.766 1900 1HD1 ILE 97 1HD1 ILE 97 16.194 -23.245 4.127 1901 2HD1 ILE 97 2HD1 ILE 97 15.143 -24.620 4.470 1902 3HD1 ILE 97 3HD1 ILE 97 16.099 -23.896 5.764 1903 H GLY 98 H GLY 98 14.310 -18.287 7.056 1904 1HA GLY 98 1HA GLY 98 14.226 -17.644 9.465 1905 2HA GLY 98 2HA GLY 98 15.706 -18.577 9.686 1906 H GLU 99 H GLU 99 15.365 -16.673 6.796 1907 HA GLU 99 HA GLU 99 17.591 -14.938 7.719 1908 1HB GLU 99 1HB GLU 99 16.344 -15.813 5.132 1909 2HB GLU 99 2HB GLU 99 17.201 -14.274 5.139 1910 1HG GLU 99 1HG GLU 99 18.328 -16.980 5.915 1911 2HG GLU 99 2HG GLU 99 18.747 -16.029 4.492 1912 H GLU 100 H GLU 100 17.320 -12.588 6.619 1913 HA GLU 100 HA GLU 100 14.557 -11.604 7.250 1914 1HB GLU 100 1HB GLU 100 16.626 -11.209 8.871 1915 2HB GLU 100 2HB GLU 100 17.029 -9.950 7.703 1916 1HG GLU 100 1HG GLU 100 14.358 -9.493 8.051 1917 2HG GLU 100 2HG GLU 100 14.807 -10.074 9.655 1918 H ILE 101 H ILE 101 13.680 -10.669 5.458 1919 HA ILE 101 HA ILE 101 15.426 -9.935 3.196 1920 HB ILE 101 HB ILE 101 12.406 -9.813 3.492 1921 1HG1 ILE 101 1HG1 ILE 101 14.193 -12.095 2.599 1922 2HG1 ILE 101 2HG1 ILE 101 13.184 -12.063 4.043 1923 1HG2 ILE 101 1HG2 ILE 101 12.326 -9.500 1.219 1924 2HG2 ILE 101 2HG2 ILE 101 13.787 -10.446 0.936 1925 3HG2 ILE 101 3HG2 ILE 101 13.911 -8.782 1.507 1926 1HD1 ILE 101 1HD1 ILE 101 11.428 -12.802 2.850 1927 2HD1 ILE 101 2HD1 ILE 101 12.444 -12.868 1.410 1928 3HD1 ILE 101 3HD1 ILE 101 11.547 -11.398 1.790 1929 H THR 102 H THR 102 15.979 -7.882 2.705 1930 HA THR 102 HA THR 102 14.346 -5.567 3.463 1931 HB THR 102 HB THR 102 17.020 -6.220 4.761 1932 HG1 THR 102 HG1 THR 102 15.569 -7.097 6.034 1933 1HG2 THR 102 1HG2 THR 102 17.062 -3.874 4.277 1934 2HG2 THR 102 2HG2 THR 102 16.601 -4.021 5.972 1935 3HG2 THR 102 3HG2 THR 102 15.375 -3.681 4.751 1936 H ILE 103 H ILE 103 15.013 -3.707 2.254 1937 HA ILE 103 HA ILE 103 17.208 -4.237 0.278 1938 HB ILE 103 HB ILE 103 15.869 -2.766 -1.202 1939 1HG1 ILE 103 1HG1 ILE 103 13.488 -2.713 0.484 1940 2HG1 ILE 103 2HG1 ILE 103 14.824 -1.818 1.205 1941 1HG2 ILE 103 1HG2 ILE 103 15.388 -5.281 -0.871 1942 2HG2 ILE 103 2HG2 ILE 103 14.127 -4.315 -1.638 1943 3HG2 ILE 103 3HG2 ILE 103 13.986 -4.760 0.063 1944 1HD1 ILE 103 1HD1 ILE 103 14.016 -0.147 -0.149 1945 2HD1 ILE 103 2HD1 ILE 103 13.313 -1.280 -1.303 1946 3HD1 ILE 103 3HD1 ILE 103 15.044 -0.947 -1.337 1947 H SER 104 H SER 104 18.324 -2.222 -0.496 1948 HA SER 104 HA SER 104 19.105 -0.546 1.782 1949 1HB SER 104 1HB SER 104 20.513 -1.581 -0.158 1950 2HB SER 104 2HB SER 104 19.921 -0.220 -1.111 1951 HG SER 104 HG SER 104 21.750 0.517 -0.204 1952 H TYR 105 H TYR 105 19.636 1.881 0.381 1953 HA TYR 105 HA TYR 105 16.866 2.839 -0.252 1954 1HB TYR 105 1HB TYR 105 19.074 4.152 1.374 1955 2HB TYR 105 2HB TYR 105 17.525 4.906 0.995 1956 HD1 TYR 105 HD1 TYR 105 19.016 3.763 3.694 1957 HD2 TYR 105 HD2 TYR 105 15.663 2.619 1.264 1958 HE1 TYR 105 HE1 TYR 105 17.997 2.611 5.640 1959 HE2 TYR 105 HE2 TYR 105 14.645 1.469 3.210 1960 HH TYR 105 HH TYR 105 14.734 1.361 5.532 1961 H GLY 106 H GLY 106 19.686 4.962 -0.254 1962 1HA GLY 106 1HA GLY 106 20.437 4.621 -2.992 1963 2HA GLY 106 2HA GLY 106 19.228 5.899 -2.881 1964 H ASP 107 H ASP 107 21.718 6.605 -3.763 1965 HA ASP 107 HA ASP 107 23.626 7.370 -1.782 1966 1HB ASP 107 1HB ASP 107 22.863 8.214 -4.571 1967 2HB ASP 107 2HB ASP 107 24.081 9.143 -3.697 1968 H ASP 108 H ASP 108 21.212 9.446 -3.443 1969 HA ASP 108 HA ASP 108 21.550 11.734 -1.795 1970 1HB ASP 108 1HB ASP 108 19.733 10.665 -3.812 1971 2HB ASP 108 2HB ASP 108 18.860 11.619 -2.613 1972 H TYR 109 H TYR 109 19.388 8.920 -1.439 1973 HA TYR 109 HA TYR 109 18.263 9.991 1.068 1974 1HB TYR 109 1HB TYR 109 17.464 8.297 -1.011 1975 2HB TYR 109 2HB TYR 109 17.698 7.206 0.352 1976 HD1 TYR 109 HD1 TYR 109 15.548 6.695 1.144 1977 HD2 TYR 109 HD2 TYR 109 16.571 10.778 0.288 1978 HE1 TYR 109 HE1 TYR 109 13.387 7.439 2.108 1979 HE2 TYR 109 HE2 TYR 109 14.411 11.522 1.251 1980 HH TYR 109 HH TYR 109 11.853 9.611 1.715 1981 H TRP 110 H TRP 110 21.186 9.290 0.972 1982 HA TRP 110 HA TRP 110 21.364 7.930 3.499 1983 1HB TRP 110 1HB TRP 110 20.720 6.190 1.589 1984 2HB TRP 110 2HB TRP 110 22.451 6.258 1.253 1985 HD1 TRP 110 HD1 TRP 110 23.766 4.519 2.515 1986 HE1 TRP 110 HE1 TRP 110 23.563 3.320 4.790 1987 HE3 TRP 110 HE3 TRP 110 19.511 6.713 4.288 1988 HZ2 TRP 110 HZ2 TRP 110 21.822 3.301 7.063 1989 HZ3 TRP 110 HZ3 TRP 110 18.603 6.088 6.507 1990 HH2 TRP 110 HH2 TRP 110 19.751 4.385 7.895 1991 H LEU 111 H LEU 111 23.878 6.943 3.515 1992 HA LEU 111 HA LEU 111 25.613 9.142 3.551 1993 1HB LEU 111 1HB LEU 111 25.875 6.793 4.506 1994 2HB LEU 111 2HB LEU 111 26.360 6.273 2.892 1995 HG LEU 111 HG LEU 111 28.103 8.170 3.002 1996 1HD1 LEU 111 1HD1 LEU 111 26.924 8.216 5.728 1997 2HD1 LEU 111 2HD1 LEU 111 27.689 9.514 4.810 1998 3HD1 LEU 111 3HD1 LEU 111 28.683 8.318 5.643 1999 1HD2 LEU 111 1HD2 LEU 111 28.569 5.706 3.236 2000 2HD2 LEU 111 2HD2 LEU 111 28.407 5.894 4.982 2001 3HD2 LEU 111 3HD2 LEU 111 29.699 6.730 4.121 2002 H SER 112 H SER 112 27.323 9.797 2.078 2003 HA SER 112 HA SER 112 26.527 9.910 -0.694 2004 1HB SER 112 1HB SER 112 27.771 11.693 0.398 2005 2HB SER 112 2HB SER 112 29.077 10.583 0.815 2006 HG SER 112 HG SER 112 29.056 12.036 -1.249 2007 H ARG 113 H ARG 113 26.630 8.074 -1.947 2008 HA ARG 113 HA ARG 113 27.507 6.127 -2.953 2009 1HB ARG 113 1HB ARG 113 29.455 8.220 -2.785 2010 2HB ARG 113 2HB ARG 113 30.290 6.686 -2.537 2011 1HG ARG 113 1HG ARG 113 29.494 5.810 -4.613 2012 2HG ARG 113 2HG ARG 113 28.322 7.115 -4.794 2013 1HD ARG 113 1HD ARG 113 30.872 8.347 -4.507 2014 2HD ARG 113 2HD ARG 113 31.049 7.047 -5.701 2015 HE ARG 113 HE ARG 113 28.594 8.578 -6.063 2016 1HH1 ARG 113 1HH1 ARG 113 32.007 8.454 -6.733 2017 2HH1 ARG 113 2HH1 ARG 113 31.876 9.434 -8.151 2018 1HH2 ARG 113 1HH2 ARG 113 28.449 9.849 -7.907 2019 2HH2 ARG 113 2HH2 ARG 113 29.878 10.219 -8.814 2020 HA PRO 114 HA PRO 114 28.378 4.216 1.155 2021 1HB PRO 114 1HB PRO 114 26.573 2.157 0.841 2022 2HB PRO 114 2HB PRO 114 26.148 3.730 1.541 2023 1HG PRO 114 1HG PRO 114 25.655 2.668 -1.189 2024 2HG PRO 114 2HG PRO 114 24.651 3.728 -0.191 2025 1HD PRO 114 1HD PRO 114 26.203 4.587 -2.286 2026 2HD PRO 114 2HD PRO 114 25.706 5.613 -0.926 2027 H ARG 115 H ARG 115 30.411 3.379 0.597 2028 HA ARG 115 HA ARG 115 30.713 1.396 -1.534 2029 1HB ARG 115 1HB ARG 115 32.641 2.334 0.617 2030 2HB ARG 115 2HB ARG 115 33.068 1.558 -0.906 2031 1HG ARG 115 1HG ARG 115 31.835 4.300 -0.518 2032 2HG ARG 115 2HG ARG 115 33.414 3.922 -1.198 2033 1HD ARG 115 1HD ARG 115 31.915 2.512 -2.924 2034 2HD ARG 115 2HD ARG 115 30.719 3.742 -2.472 2035 HE ARG 115 HE ARG 115 33.008 5.224 -2.867 2036 1HH1 ARG 115 1HH1 ARG 115 31.329 2.837 -4.764 2037 2HH1 ARG 115 2HH1 ARG 115 31.837 3.516 -6.270 2038 1HH2 ARG 115 1HH2 ARG 115 33.656 6.089 -4.835 2039 2HH2 ARG 115 2HH2 ARG 115 33.145 5.344 -6.313 2040 H LEU 116 H LEU 116 30.517 -0.789 -1.252 2041 HA LEU 116 HA LEU 116 30.685 -1.865 1.545 2042 1HB LEU 116 1HB LEU 116 28.612 -1.906 -0.498 2043 2HB LEU 116 2HB LEU 116 29.067 -3.546 -0.037 2044 HG LEU 116 HG LEU 116 28.825 -1.736 2.258 2045 1HD1 LEU 116 1HD1 LEU 116 26.315 -1.729 2.168 2046 2HD1 LEU 116 2HD1 LEU 116 26.418 -2.293 0.500 2047 3HD1 LEU 116 3HD1 LEU 116 27.063 -0.711 0.938 2048 1HD2 LEU 116 1HD2 LEU 116 28.309 -4.509 1.478 2049 2HD2 LEU 116 2HD2 LEU 116 27.035 -3.848 2.502 2050 3HD2 LEU 116 3HD2 LEU 116 28.707 -3.848 3.063 2051 H THR 117 H THR 117 32.640 -1.707 -0.871 2052 HA THR 117 HA THR 117 33.001 -4.443 -1.775 2053 HB THR 117 HB THR 117 34.948 -2.109 -1.691 2054 HG1 THR 117 HG1 THR 117 33.430 -1.243 -2.865 2055 1HG2 THR 117 1HG2 THR 117 36.016 -3.193 -3.554 2056 2HG2 THR 117 2HG2 THR 117 34.710 -4.371 -3.691 2057 3HG2 THR 117 3HG2 THR 117 35.801 -4.421 -2.306 2058 H GLN 118 H GLN 118 34.481 -5.986 -0.989 2059 HA GLN 118 HA GLN 118 35.135 -5.920 1.815 2060 1HB GLN 118 1HB GLN 118 34.733 -7.880 0.160 2061 2HB GLN 118 2HB GLN 118 36.420 -7.659 -0.303 2062 1HG GLN 118 1HG GLN 118 36.965 -7.817 2.198 2063 2HG GLN 118 2HG GLN 118 35.316 -8.403 2.412 2064 1HE2 GLN 118 1HE2 GLN 118 36.930 -10.337 3.145 2065 2HE2 GLN 118 2HE2 GLN 118 37.227 -11.487 1.933 2066 H ASN 119 H ASN 119 37.126 -5.490 2.825 2067 HA ASN 119 HA ASN 119 38.948 -3.682 1.491 2068 1HB ASN 119 1HB ASN 119 40.151 -3.880 3.667 2069 2HB ASN 119 2HB ASN 119 38.420 -3.640 3.904 2070 1HD2 ASN 119 1HD2 ASN 119 40.909 -5.422 5.119 2071 2HD2 ASN 119 2HD2 ASN 119 40.074 -6.827 5.578 2072 1H GLY 201 1H GLY 201 38.987 34.651 4.809 2073 2H GLY 201 2H GLY 201 40.086 35.935 4.645 2074 3H GLY 201 3H GLY 201 39.053 35.532 3.359 2075 1HA GLY 201 1HA GLY 201 38.480 37.002 5.822 2076 2HA GLY 201 2HA GLY 201 37.908 37.296 4.180 2077 H LYS 202 H LYS 202 35.848 36.650 3.744 2078 HA LYS 202 HA LYS 202 34.628 34.567 5.528 2079 1HB LYS 202 1HB LYS 202 32.561 35.936 5.369 2080 2HB LYS 202 2HB LYS 202 33.894 36.884 6.028 2081 1HG LYS 202 1HG LYS 202 33.953 37.070 3.162 2082 2HG LYS 202 2HG LYS 202 32.327 37.455 3.724 2083 1HD LYS 202 1HD LYS 202 33.022 39.321 4.883 2084 2HD LYS 202 2HD LYS 202 34.608 38.637 5.239 2085 1HE LYS 202 1HE LYS 202 34.379 38.932 2.390 2086 2HE LYS 202 2HE LYS 202 33.943 40.470 3.159 2087 1HZ LYS 202 1HZ LYS 202 36.399 38.852 3.564 2088 2HZ LYS 202 2HZ LYS 202 35.932 40.079 4.641 2089 3HZ LYS 202 3HZ LYS 202 36.289 40.459 3.024 2090 H ALA 203 H ALA 203 35.875 34.370 2.782 2091 HA ALA 203 HA ALA 203 33.761 34.104 0.829 2092 1HB ALA 203 1HB ALA 203 35.604 33.916 -0.474 2093 2HB ALA 203 2HB ALA 203 36.085 32.435 0.353 2094 3HB ALA 203 3HB ALA 203 36.582 34.002 0.991 2095 HA PRO 204 HA PRO 204 34.263 29.370 1.846 2096 1HB PRO 204 1HB PRO 204 35.075 29.482 4.696 2097 2HB PRO 204 2HB PRO 204 35.699 28.456 3.393 2098 1HG PRO 204 1HG PRO 204 37.093 30.517 4.432 2099 2HG PRO 204 2HG PRO 204 37.250 29.999 2.748 2100 1HD PRO 204 1HD PRO 204 35.857 32.367 3.878 2101 2HD PRO 204 2HD PRO 204 36.685 32.171 2.320 2102 H ARG 205 H ARG 205 31.962 30.124 1.756 2103 HA ARG 205 HA ARG 205 30.537 29.405 4.223 2104 1HB ARG 205 1HB ARG 205 29.393 31.620 4.338 2105 2HB ARG 205 2HB ARG 205 31.133 31.773 4.576 2106 1HG ARG 205 1HG ARG 205 31.474 32.684 2.443 2107 2HG ARG 205 2HG ARG 205 29.963 32.025 1.814 2108 1HD ARG 205 1HD ARG 205 29.236 33.708 3.976 2109 2HD ARG 205 2HD ARG 205 30.428 34.609 3.020 2110 HE ARG 205 HE ARG 205 28.467 33.210 1.369 2111 1HH1 ARG 205 1HH1 ARG 205 29.140 36.097 3.195 2112 2HH1 ARG 205 2HH1 ARG 205 28.030 37.063 2.285 2113 1HH2 ARG 205 1HH2 ARG 205 27.033 34.485 0.204 2114 2HH2 ARG 205 2HH2 ARG 205 26.845 36.159 0.604 2115 H LYS 206 H LYS 206 28.203 29.186 3.819 2116 HA LYS 206 HA LYS 206 26.406 28.450 2.473 2117 1HB LYS 206 1HB LYS 206 26.898 31.001 1.967 2118 2HB LYS 206 2HB LYS 206 27.422 30.383 0.401 2119 1HG LYS 206 1HG LYS 206 25.297 29.712 -0.199 2120 2HG LYS 206 2HG LYS 206 24.813 29.397 1.468 2121 1HD LYS 206 1HD LYS 206 23.607 31.342 0.969 2122 2HD LYS 206 2HD LYS 206 25.050 31.994 1.745 2123 1HE LYS 206 1HE LYS 206 25.346 33.239 -0.135 2124 2HE LYS 206 2HE LYS 206 25.753 31.726 -0.967 2125 1HZ LYS 206 1HZ LYS 206 23.910 32.560 -2.128 2126 2HZ LYS 206 2HZ LYS 206 23.107 33.036 -0.709 2127 3HZ LYS 206 3HZ LYS 206 23.246 31.388 -1.095 2128 H GLN 207 H GLN 207 28.192 26.540 2.249 2129 HA GLN 207 HA GLN 207 29.324 26.219 -0.425 2130 1HB GLN 207 1HB GLN 207 29.126 24.724 2.157 2131 2HB GLN 207 2HB GLN 207 29.475 23.778 0.710 2132 1HG GLN 207 1HG GLN 207 31.018 26.301 1.072 2133 2HG GLN 207 2HG GLN 207 31.413 24.964 2.152 2134 1HE2 GLN 207 1HE2 GLN 207 33.537 24.963 0.876 2135 2HE2 GLN 207 2HE2 GLN 207 33.585 24.112 -0.592 2136 H LEU 208 H LEU 208 28.751 23.689 -1.204 2137 HA LEU 208 HA LEU 208 25.968 23.903 -2.136 2138 1HB LEU 208 1HB LEU 208 28.231 21.924 -2.594 2139 2HB LEU 208 2HB LEU 208 26.695 21.885 -3.459 2140 HG LEU 208 HG LEU 208 28.241 24.451 -3.397 2141 1HD1 LEU 208 1HD1 LEU 208 29.782 23.805 -5.008 2142 2HD1 LEU 208 2HD1 LEU 208 28.782 22.467 -5.575 2143 3HD1 LEU 208 3HD1 LEU 208 29.676 22.321 -4.062 2144 1HD2 LEU 208 1HD2 LEU 208 26.812 25.012 -5.067 2145 2HD2 LEU 208 2HD2 LEU 208 25.876 23.610 -4.548 2146 3HD2 LEU 208 3HD2 LEU 208 27.022 23.461 -5.881 2147 H ALA 209 H ALA 209 24.475 22.031 -1.931 2148 HA ALA 209 HA ALA 209 24.916 20.518 0.625 2149 1HB ALA 209 1HB ALA 209 22.746 22.188 -0.456 2150 2HB ALA 209 2HB ALA 209 23.068 21.721 1.214 2151 3HB ALA 209 3HB ALA 209 22.182 20.631 0.149 2152 H THR 210 H THR 210 24.223 18.314 0.630 2153 HA THR 210 HA THR 210 24.568 16.808 -1.743 2154 HB THR 210 HB THR 210 23.408 15.026 -0.308 2155 HG1 THR 210 HG1 THR 210 22.063 16.502 0.806 2156 1HG2 THR 210 1HG2 THR 210 25.553 16.669 1.070 2157 2HG2 THR 210 2HG2 THR 210 25.863 15.524 -0.234 2158 3HG2 THR 210 3HG2 THR 210 25.229 14.952 1.309 2159 H LYS 211 H LYS 211 21.759 18.486 -0.529 2160 HA LYS 211 HA LYS 211 19.563 18.672 -1.380 2161 1HB LYS 211 1HB LYS 211 21.193 19.321 -3.280 2162 2HB LYS 211 2HB LYS 211 20.856 17.725 -3.951 2163 1HG LYS 211 1HG LYS 211 18.334 18.475 -3.563 2164 2HG LYS 211 2HG LYS 211 19.040 20.088 -3.669 2165 1HD LYS 211 1HD LYS 211 20.251 19.033 -5.792 2166 2HD LYS 211 2HD LYS 211 18.856 17.954 -5.759 2167 1HE LYS 211 1HE LYS 211 17.896 19.647 -6.999 2168 2HE LYS 211 2HE LYS 211 17.624 20.366 -5.400 2169 1HZ LYS 211 1HZ LYS 211 19.684 21.533 -5.550 2170 2HZ LYS 211 2HZ LYS 211 18.838 21.839 -6.990 2171 3HZ LYS 211 3HZ LYS 211 20.118 20.724 -6.979 2172 H ALA 212 H ALA 212 19.029 16.661 -0.081 2173 HA ALA 212 HA ALA 212 18.988 14.072 -1.419 2174 1HB ALA 212 1HB ALA 212 17.773 15.248 1.101 2175 2HB ALA 212 2HB ALA 212 19.183 14.196 0.979 2176 3HB ALA 212 3HB ALA 212 17.573 13.553 0.656 2177 H ALA 213 H ALA 213 16.608 12.954 -1.205 2178 HA ALA 213 HA ALA 213 14.394 14.701 -1.999 2179 1HB ALA 213 1HB ALA 213 16.253 13.527 -3.914 2180 2HB ALA 213 2HB ALA 213 14.962 14.695 -4.199 2181 3HB ALA 213 3HB ALA 213 14.606 12.967 -4.207 2182 H ARG 214 H ARG 214 15.316 11.332 -2.803 2183 HA ARG 214 HA ARG 214 13.410 10.246 -0.841 2184 1HB ARG 214 1HB ARG 214 12.776 10.792 -3.653 2185 2HB ARG 214 2HB ARG 214 12.488 9.109 -3.211 2186 1HG ARG 214 1HG ARG 214 10.516 9.836 -2.370 2187 2HG ARG 214 2HG ARG 214 11.470 10.505 -1.045 2188 1HD ARG 214 1HD ARG 214 11.740 12.427 -3.035 2189 2HD ARG 214 2HD ARG 214 10.052 11.907 -3.194 2190 HE ARG 214 HE ARG 214 10.540 12.137 -0.432 2191 1HH1 ARG 214 1HH1 ARG 214 10.584 14.202 -3.235 2192 2HH1 ARG 214 2HH1 ARG 214 10.168 15.618 -2.334 2193 1HH2 ARG 214 1HH2 ARG 214 10.000 13.990 0.714 2194 2HH2 ARG 214 2HH2 ARG 214 9.839 15.501 -0.115 2195 1HN MLZ 215 1HN MLZ 215 13.123 7.708 -1.704 2196 HA MLZ 215 HA MLZ 215 15.645 6.464 -1.294 2197 1HB MLZ 215 1HB MLZ 215 13.041 5.548 -2.564 2198 2HB MLZ 215 2HB MLZ 215 14.356 4.446 -2.157 2199 1HG MLZ 215 1HG MLZ 215 12.509 5.949 -0.352 2200 2HG MLZ 215 2HG MLZ 215 14.163 5.688 0.202 2201 1HD MLZ 215 1HD MLZ 215 12.365 3.478 -0.834 2202 2HD MLZ 215 2HD MLZ 215 13.939 3.292 -0.061 2203 1HE MLZ 215 1HE MLZ 215 12.142 2.830 1.568 2204 2HE MLZ 215 2HE MLZ 215 11.451 4.435 1.267 2205 HZ MLZ 215 HZ MLZ 215 13.279 5.489 2.179 2206 1HCM MLZ 215 1HCM MLZ 215 12.693 2.977 3.587 2207 2HCM MLZ 215 2HCM MLZ 215 12.311 4.633 4.056 2208 3HCM MLZ 215 3HCM MLZ 215 13.963 4.034 4.201 2209 H SER 216 H SER 216 17.295 5.991 -2.701 2210 HA SER 216 HA SER 216 18.499 5.797 -4.724 2211 1HB SER 216 1HB SER 216 16.527 7.796 -5.823 2212 2HB SER 216 2HB SER 216 17.597 8.260 -4.499 2213 HG SER 216 HG SER 216 19.359 7.705 -5.783 2214 H ALA 217 H ALA 217 16.773 3.704 -4.560 2215 HA ALA 217 HA ALA 217 15.677 2.104 -5.909 2216 1HB ALA 217 1HB ALA 217 14.259 4.137 -7.491 2217 2HB ALA 217 2HB ALA 217 14.203 4.457 -5.757 2218 3HB ALA 217 3HB ALA 217 13.605 2.924 -6.391 2219 HA PRO 218 HA PRO 218 17.593 1.633 -9.822 2220 1HB PRO 218 1HB PRO 218 15.013 1.396 -11.276 2221 2HB PRO 218 2HB PRO 218 16.322 0.212 -11.116 2222 1HG PRO 218 1HG PRO 218 13.974 -0.047 -9.834 2223 2HG PRO 218 2HG PRO 218 15.500 -0.624 -9.153 2224 1HD PRO 218 1HD PRO 218 13.893 1.775 -8.437 2225 2HD PRO 218 2HD PRO 218 14.903 0.736 -7.409 2226 H ALA 219 H ALA 219 17.549 2.532 -12.201 2227 HA ALA 219 HA ALA 219 16.442 5.321 -12.196 2228 1HB ALA 219 1HB ALA 219 19.141 4.351 -13.210 2229 2HB ALA 219 2HB ALA 219 18.889 5.164 -11.666 2230 3HB ALA 219 3HB ALA 219 18.585 6.024 -13.175 2231 H THR 220 H THR 220 15.184 3.056 -13.430 2232 HA THR 220 HA THR 220 15.836 2.596 -16.145 2233 HB THR 220 HB THR 220 14.185 1.332 -14.827 2234 HG1 THR 220 HG1 THR 220 12.836 2.675 -16.919 2235 1HG2 THR 220 1HG2 THR 220 12.004 3.260 -15.069 2236 2HG2 THR 220 2HG2 THR 220 13.314 3.864 -14.054 2237 3HG2 THR 220 3HG2 THR 220 12.528 2.335 -13.661 2238 H GLY 221 H GLY 221 14.396 3.417 -18.020 2239 1HA GLY 221 1HA GLY 221 14.798 6.135 -18.501 2240 2HA GLY 221 2HA GLY 221 13.568 5.183 -19.328 2241 1HN SAH 301 1HN SAH 301 -11.385 -1.145 -9.436 2242 2HN SAH 301 2HN SAH 301 -10.702 -0.318 -10.758 2243 HA SAH 301 HA SAH 301 -10.523 1.709 -9.333 2244 1HB SAH 301 1HB SAH 301 -11.542 -0.391 -7.401 2245 2HB SAH 301 2HB SAH 301 -10.745 1.082 -6.846 2246 1HG SAH 301 1HG SAH 301 -13.457 0.810 -7.449 2247 2HG SAH 301 2HG SAH 301 -12.787 1.631 -8.856 2248 1H5* SAH 301 1H5* SAH 301 -14.918 2.618 -7.146 2249 2H5* SAH 301 2H5* SAH 301 -14.570 4.172 -6.389 2250 H4* SAH 301 H4* SAH 301 -13.580 4.880 -8.550 2251 H3* SAH 301 H3* SAH 301 -16.319 4.632 -7.699 2252 *HO3 SAH 301 *HO3 SAH 301 -16.468 6.565 -8.950 2253 H2* SAH 301 H2* SAH 301 -17.304 3.623 -9.435 2254 *HO2 SAH 301 *HO2 SAH 301 -16.322 5.918 -10.546 2255 H1* SAH 301 H1* SAH 301 -15.153 3.377 -11.342 2256 H8 SAH 301 H8 SAH 301 -14.654 0.626 -9.107 2257 1HN6 SAH 301 1HN6 SAH 301 -19.989 -2.006 -10.544 2258 2HN6 SAH 301 2HN6 SAH 301 -18.756 -1.980 -9.305 2259 H2 SAH 301 H2 SAH 301 -19.974 2.148 -12.319 2260 1HN SAH 302 1HN SAH 302 11.193 -1.131 9.392 2261 2HN SAH 302 2HN SAH 302 10.492 -0.301 10.699 2262 HA SAH 302 HA SAH 302 10.347 1.720 9.265 2263 1HB SAH 302 1HB SAH 302 11.394 -0.392 7.360 2264 2HB SAH 302 2HB SAH 302 10.613 1.081 6.784 2265 1HG SAH 302 1HG SAH 302 13.312 0.801 7.437 2266 2HG SAH 302 2HG SAH 302 12.622 1.632 8.830 2267 1H5* SAH 302 1H5* SAH 302 14.785 2.602 7.153 2268 2H5* SAH 302 2H5* SAH 302 14.457 4.153 6.382 2269 H4* SAH 302 H4* SAH 302 13.431 4.876 8.521 2270 H3* SAH 302 H3* SAH 302 16.184 4.613 7.722 2271 *HO3 SAH 302 *HO3 SAH 302 16.317 6.551 8.967 2272 H2* SAH 302 H2* SAH 302 17.132 3.608 9.481 2273 *HO2 SAH 302 *HO2 SAH 302 16.139 5.913 10.563 2274 H1* SAH 302 H1* SAH 302 14.945 3.380 11.349 2275 H8 SAH 302 H8 SAH 302 14.477 0.620 9.118 2276 1HN6 SAH 302 1HN6 SAH 302 19.774 -2.026 10.667 2277 2HN6 SAH 302 2HN6 SAH 302 18.564 -2.000 9.404 2278 H2 SAH 302 H2 SAH 302 19.742 2.137 12.422 Start of MODEL 3 1 1H MET 1 1H MET 1 -0.970 -12.161 -9.444 2 2H MET 1 2H MET 1 -0.334 -12.864 -8.035 3 3H MET 1 3H MET 1 0.272 -11.377 -8.590 4 HA MET 1 HA MET 1 -1.222 -11.068 -6.687 5 1HB MET 1 1HB MET 1 -1.964 -10.110 -9.464 6 2HB MET 1 2HB MET 1 -2.676 -9.425 -8.011 7 1HG MET 1 1HG MET 1 -0.099 -9.291 -7.306 8 2HG MET 1 2HG MET 1 0.075 -9.163 -9.047 9 1HE MET 1 1HE MET 1 -0.236 -6.444 -6.103 10 2HE MET 1 2HE MET 1 -0.812 -8.102 -5.929 11 3HE MET 1 3HE MET 1 -1.966 -6.768 -5.982 12 H PHE 2 H PHE 2 -2.008 -13.602 -6.776 13 HA PHE 2 HA PHE 2 -4.877 -13.528 -6.521 14 1HB PHE 2 1HB PHE 2 -5.295 -15.067 -8.520 15 2HB PHE 2 2HB PHE 2 -4.874 -13.406 -8.930 16 HD1 PHE 2 HD1 PHE 2 -2.826 -12.878 -10.065 17 HD2 PHE 2 HD2 PHE 2 -3.574 -16.877 -8.687 18 HE1 PHE 2 HE1 PHE 2 -0.882 -13.691 -11.371 19 HE2 PHE 2 HE2 PHE 2 -1.628 -17.690 -9.993 20 HZ PHE 2 HZ PHE 2 -0.283 -16.096 -11.334 21 H ASN 3 H ASN 3 -5.443 -15.210 -5.196 22 HA ASN 3 HA ASN 3 -3.619 -17.590 -5.084 23 1HB ASN 3 1HB ASN 3 -4.812 -15.804 -2.968 24 2HB ASN 3 2HB ASN 3 -4.421 -17.477 -2.572 25 1HD2 ASN 3 1HD2 ASN 3 -2.934 -14.512 -3.974 26 2HD2 ASN 3 2HD2 ASN 3 -1.362 -14.867 -3.442 27 H ASP 4 H ASP 4 -4.751 -19.549 -4.197 28 HA ASP 4 HA ASP 4 -7.121 -20.210 -5.553 29 1HB ASP 4 1HB ASP 4 -5.915 -21.218 -2.952 30 2HB ASP 4 2HB ASP 4 -7.197 -22.061 -3.822 31 H ARG 5 H ARG 5 -6.733 -18.394 -2.597 32 HA ARG 5 HA ARG 5 -9.488 -18.789 -1.677 33 1HB ARG 5 1HB ARG 5 -7.277 -16.837 -0.929 34 2HB ARG 5 2HB ARG 5 -8.761 -17.078 -0.007 35 1HG ARG 5 1HG ARG 5 -7.258 -19.549 -0.644 36 2HG ARG 5 2HG ARG 5 -6.449 -18.444 0.467 37 1HD ARG 5 1HD ARG 5 -8.890 -18.373 1.576 38 2HD ARG 5 2HD ARG 5 -8.985 -19.983 0.839 39 HE ARG 5 HE ARG 5 -7.369 -20.703 2.404 40 1HH1 ARG 5 1HH1 ARG 5 -7.262 -17.243 2.043 41 2HH1 ARG 5 2HH1 ARG 5 -6.069 -17.041 3.280 42 1HH2 ARG 5 1HH2 ARG 5 -5.822 -20.416 4.004 43 2HH2 ARG 5 2HH2 ARG 5 -5.258 -18.822 4.383 44 H VAL 6 H VAL 6 -7.662 -16.194 -3.325 45 HA VAL 6 HA VAL 6 -10.227 -15.105 -4.346 46 HB VAL 6 HB VAL 6 -9.590 -12.841 -3.463 47 1HG1 VAL 6 1HG1 VAL 6 -10.307 -13.256 -1.210 48 2HG1 VAL 6 2HG1 VAL 6 -9.679 -14.902 -1.246 49 3HG1 VAL 6 3HG1 VAL 6 -11.089 -14.475 -2.216 50 1HG2 VAL 6 1HG2 VAL 6 -7.165 -13.229 -3.299 51 2HG2 VAL 6 2HG2 VAL 6 -7.434 -14.431 -2.036 52 3HG2 VAL 6 3HG2 VAL 6 -7.816 -12.736 -1.736 53 H ILE 7 H ILE 7 -9.572 -13.009 -5.731 54 HA ILE 7 HA ILE 7 -6.900 -13.285 -6.987 55 HB ILE 7 HB ILE 7 -8.282 -14.945 -8.131 56 1HG1 ILE 7 1HG1 ILE 7 -8.275 -12.554 -9.968 57 2HG1 ILE 7 2HG1 ILE 7 -6.765 -13.295 -9.436 58 1HG2 ILE 7 1HG2 ILE 7 -10.360 -13.162 -7.557 59 2HG2 ILE 7 2HG2 ILE 7 -10.493 -14.654 -8.488 60 3HG2 ILE 7 3HG2 ILE 7 -10.220 -13.120 -9.315 61 1HD1 ILE 7 1HD1 ILE 7 -7.791 -15.526 -10.216 62 2HD1 ILE 7 2HD1 ILE 7 -7.288 -14.397 -11.474 63 3HD1 ILE 7 3HD1 ILE 7 -8.994 -14.542 -11.051 64 H VAL 8 H VAL 8 -6.605 -11.509 -8.667 65 HA VAL 8 HA VAL 8 -8.067 -9.066 -7.766 66 HB VAL 8 HB VAL 8 -5.577 -9.232 -7.541 67 1HG1 VAL 8 1HG1 VAL 8 -5.137 -8.843 -10.433 68 2HG1 VAL 8 2HG1 VAL 8 -5.678 -10.463 -9.997 69 3HG1 VAL 8 3HG1 VAL 8 -4.214 -9.799 -9.274 70 1HG2 VAL 8 1HG2 VAL 8 -6.788 -7.186 -9.406 71 2HG2 VAL 8 2HG2 VAL 8 -5.105 -7.082 -8.889 72 3HG2 VAL 8 3HG2 VAL 8 -6.400 -7.012 -7.694 73 H LYS 9 H LYS 9 -9.528 -8.181 -9.140 74 HA LYS 9 HA LYS 9 -9.202 -8.652 -12.077 75 1HB LYS 9 1HB LYS 9 -11.714 -8.628 -10.379 76 2HB LYS 9 2HB LYS 9 -11.692 -8.796 -12.132 77 1HG LYS 9 1HG LYS 9 -9.860 -10.707 -11.192 78 2HG LYS 9 2HG LYS 9 -11.238 -10.812 -10.096 79 1HD LYS 9 1HD LYS 9 -12.727 -10.875 -12.150 80 2HD LYS 9 2HD LYS 9 -11.261 -11.061 -13.113 81 1HE LYS 9 1HE LYS 9 -10.694 -13.126 -11.911 82 2HE LYS 9 2HE LYS 9 -12.110 -12.924 -10.863 83 1HZ LYS 9 1HZ LYS 9 -13.487 -12.865 -12.903 84 2HZ LYS 9 2HZ LYS 9 -12.697 -14.354 -12.692 85 3HZ LYS 9 3HZ LYS 9 -12.108 -13.233 -13.823 86 H LYS 10 H LYS 10 -9.974 -5.169 -12.606 87 HA LYS 10 HA LYS 10 -9.528 -6.182 -14.658 88 1HB LYS 10 1HB LYS 10 -7.788 -7.314 -12.583 89 2HB LYS 10 2HB LYS 10 -7.947 -8.359 -13.995 90 1HG LYS 10 1HG LYS 10 -7.081 -6.732 -15.451 91 2HG LYS 10 2HG LYS 10 -7.437 -5.411 -14.339 92 1HD LYS 10 1HD LYS 10 -5.020 -5.883 -14.375 93 2HD LYS 10 2HD LYS 10 -5.700 -6.257 -12.791 94 1HE LYS 10 1HE LYS 10 -4.588 -8.252 -13.105 95 2HE LYS 10 2HE LYS 10 -6.023 -8.660 -14.065 96 1HZ LYS 10 1HZ LYS 10 -4.049 -8.963 -15.402 97 2HZ LYS 10 2HZ LYS 10 -3.524 -7.385 -15.062 98 3HZ LYS 10 3HZ LYS 10 -4.920 -7.632 -15.997 99 H SER 11 H SER 11 -12.012 -6.825 -14.079 100 HA SER 11 HA SER 11 -12.262 -9.801 -14.208 101 1HB SER 11 1HB SER 11 -14.255 -9.487 -13.059 102 2HB SER 11 2HB SER 11 -13.421 -8.024 -12.544 103 HG SER 11 HG SER 11 -15.598 -7.746 -13.410 104 HA PRO 12 HA PRO 12 -14.080 -9.968 -18.212 105 1HB PRO 12 1HB PRO 12 -16.902 -10.037 -17.258 106 2HB PRO 12 2HB PRO 12 -16.026 -11.211 -18.257 107 1HG PRO 12 1HG PRO 12 -16.623 -11.675 -15.680 108 2HG PRO 12 2HG PRO 12 -15.155 -12.299 -16.443 109 1HD PRO 12 1HD PRO 12 -15.483 -10.063 -14.516 110 2HD PRO 12 2HD PRO 12 -14.116 -11.174 -14.744 111 H LEU 13 H LEU 13 -16.376 -8.051 -16.225 112 HA LEU 13 HA LEU 13 -16.995 -6.217 -18.397 113 1HB LEU 13 1HB LEU 13 -18.289 -6.963 -16.250 114 2HB LEU 13 2HB LEU 13 -17.422 -5.655 -15.479 115 HG LEU 13 HG LEU 13 -18.460 -4.797 -18.036 116 1HD1 LEU 13 1HD1 LEU 13 -20.236 -6.296 -17.817 117 2HD1 LEU 13 2HD1 LEU 13 -20.870 -4.827 -17.068 118 3HD1 LEU 13 3HD1 LEU 13 -20.257 -6.142 -16.060 119 1HD2 LEU 13 1HD2 LEU 13 -19.710 -3.292 -16.171 120 2HD2 LEU 13 2HD2 LEU 13 -18.029 -3.025 -16.634 121 3HD2 LEU 13 3HD2 LEU 13 -18.407 -3.951 -15.181 122 H GLY 14 H GLY 14 -15.127 -5.896 -15.351 123 1HA GLY 14 1HA GLY 14 -12.880 -4.630 -15.973 124 2HA GLY 14 2HA GLY 14 -14.018 -3.341 -16.362 125 H GLY 15 H GLY 15 -12.753 -2.215 -14.585 126 1HA GLY 15 1HA GLY 15 -13.058 -1.227 -12.443 127 2HA GLY 15 2HA GLY 15 -14.228 -2.490 -12.059 128 H TYR 16 H TYR 16 -11.567 -1.399 -10.795 129 HA TYR 16 HA TYR 16 -10.052 -3.952 -10.632 130 1HB TYR 16 1HB TYR 16 -9.445 -1.194 -10.659 131 2HB TYR 16 2HB TYR 16 -9.068 -1.745 -9.027 132 HD1 TYR 16 HD1 TYR 16 -7.839 -4.130 -8.950 133 HD2 TYR 16 HD2 TYR 16 -7.795 -1.422 -12.284 134 HE1 TYR 16 HE1 TYR 16 -5.766 -5.200 -9.792 135 HE2 TYR 16 HE2 TYR 16 -5.722 -2.492 -13.126 136 HH TYR 16 HH TYR 16 -3.787 -4.439 -11.299 137 H GLY 17 H GLY 17 -11.476 -5.186 -9.277 138 1HA GLY 17 1HA GLY 17 -11.591 -4.225 -6.452 139 2HA GLY 17 2HA GLY 17 -12.967 -5.049 -7.187 140 H VAL 18 H VAL 18 -12.482 -6.572 -5.246 141 HA VAL 18 HA VAL 18 -10.274 -8.465 -6.031 142 HB VAL 18 HB VAL 18 -9.868 -7.492 -3.867 143 1HG1 VAL 18 1HG1 VAL 18 -11.783 -6.495 -3.078 144 2HG1 VAL 18 2HG1 VAL 18 -11.831 -7.971 -2.111 145 3HG1 VAL 18 3HG1 VAL 18 -12.805 -7.840 -3.571 146 1HG2 VAL 18 1HG2 VAL 18 -10.127 -10.195 -4.210 147 2HG2 VAL 18 2HG2 VAL 18 -11.172 -9.922 -2.816 148 3HG2 VAL 18 3HG2 VAL 18 -9.476 -9.438 -2.756 149 H PHE 19 H PHE 19 -10.960 -10.425 -6.779 150 HA PHE 19 HA PHE 19 -13.845 -11.067 -6.647 151 1HB PHE 19 1HB PHE 19 -11.531 -11.594 -8.336 152 2HB PHE 19 2HB PHE 19 -12.403 -13.085 -7.981 153 HD1 PHE 19 HD1 PHE 19 -14.413 -13.589 -9.102 154 HD2 PHE 19 HD2 PHE 19 -12.916 -9.563 -9.134 155 HE1 PHE 19 HE1 PHE 19 -16.176 -12.947 -10.724 156 HE2 PHE 19 HE2 PHE 19 -14.679 -8.921 -10.756 157 HZ PHE 19 HZ PHE 19 -16.309 -10.612 -11.551 158 H ALA 20 H ALA 20 -14.515 -13.283 -6.012 159 HA ALA 20 HA ALA 20 -12.755 -14.392 -3.851 160 1HB ALA 20 1HB ALA 20 -15.372 -13.316 -3.838 161 2HB ALA 20 2HB ALA 20 -14.569 -14.156 -2.512 162 3HB ALA 20 3HB ALA 20 -15.571 -15.058 -3.648 163 H ARG 21 H ARG 21 -11.777 -16.067 -5.078 164 HA ARG 21 HA ARG 21 -13.157 -17.797 -6.911 165 1HB ARG 21 1HB ARG 21 -10.566 -17.352 -5.912 166 2HB ARG 21 2HB ARG 21 -10.941 -19.015 -5.460 167 1HG ARG 21 1HG ARG 21 -10.213 -19.439 -7.592 168 2HG ARG 21 2HG ARG 21 -11.876 -19.019 -7.995 169 1HD ARG 21 1HD ARG 21 -11.193 -16.679 -8.416 170 2HD ARG 21 2HD ARG 21 -9.519 -17.096 -8.003 171 HE ARG 21 HE ARG 21 -9.340 -18.165 -10.106 172 1HH1 ARG 21 1HH1 ARG 21 -12.679 -17.738 -9.221 173 2HH1 ARG 21 2HH1 ARG 21 -13.271 -18.325 -10.736 174 1HH2 ARG 21 1HH2 ARG 21 -10.131 -18.922 -12.066 175 2HH2 ARG 21 2HH2 ARG 21 -11.840 -18.991 -12.337 176 H LYS 22 H LYS 22 -13.062 -17.628 -3.445 177 HA LYS 22 HA LYS 22 -14.009 -20.398 -3.069 178 1HB LYS 22 1HB LYS 22 -12.765 -18.261 -1.582 179 2HB LYS 22 2HB LYS 22 -14.097 -18.958 -0.674 180 1HG LYS 22 1HG LYS 22 -13.124 -21.142 -0.775 181 2HG LYS 22 2HG LYS 22 -11.974 -20.647 -2.016 182 1HD LYS 22 1HD LYS 22 -10.637 -20.591 -0.107 183 2HD LYS 22 2HD LYS 22 -11.198 -18.920 -0.180 184 1HE LYS 22 1HE LYS 22 -12.856 -19.306 1.508 185 2HE LYS 22 2HE LYS 22 -12.652 -21.064 1.402 186 1HZ LYS 22 1HZ LYS 22 -10.337 -20.781 2.091 187 2HZ LYS 22 2HZ LYS 22 -11.395 -20.167 3.269 188 3HZ LYS 22 3HZ LYS 22 -10.569 -19.105 2.234 189 H SER 23 H SER 23 -17.339 -19.412 -1.780 190 HA SER 23 HA SER 23 -14.948 -21.162 -1.390 191 1HB SER 23 1HB SER 23 -17.043 -22.204 -2.133 192 2HB SER 23 2HB SER 23 -16.696 -22.708 -0.479 193 HG SER 23 HG SER 23 -18.511 -21.855 0.066 194 H PHE 24 H PHE 24 -16.874 -18.742 0.167 195 HA PHE 24 HA PHE 24 -15.429 -19.268 2.738 196 1HB PHE 24 1HB PHE 24 -16.474 -16.827 1.290 197 2HB PHE 24 2HB PHE 24 -16.098 -16.756 3.011 198 HD1 PHE 24 HD1 PHE 24 -14.772 -16.562 -0.301 199 HD2 PHE 24 HD2 PHE 24 -13.748 -17.587 3.743 200 HE1 PHE 24 HE1 PHE 24 -12.368 -16.284 -0.839 201 HE2 PHE 24 HE2 PHE 24 -11.343 -17.309 3.204 202 HZ PHE 24 HZ PHE 24 -10.653 -16.657 0.913 203 H GLU 25 H GLU 25 -16.702 -18.517 4.705 204 HA GLU 25 HA GLU 25 -19.542 -19.415 4.452 205 1HB GLU 25 1HB GLU 25 -17.612 -20.373 6.008 206 2HB GLU 25 2HB GLU 25 -18.067 -19.018 7.036 207 1HG GLU 25 1HG GLU 25 -20.487 -20.199 6.186 208 2HG GLU 25 2HG GLU 25 -19.427 -21.525 6.651 209 H LYS 26 H LYS 26 -20.623 -18.263 6.711 210 HA LYS 26 HA LYS 26 -20.942 -15.475 5.886 211 1HB LYS 26 1HB LYS 26 -22.738 -17.054 6.710 212 2HB LYS 26 2HB LYS 26 -22.004 -16.967 8.310 213 1HG LYS 26 1HG LYS 26 -22.361 -14.542 8.368 214 2HG LYS 26 2HG LYS 26 -23.028 -14.584 6.737 215 1HD LYS 26 1HD LYS 26 -24.910 -15.905 7.462 216 2HD LYS 26 2HD LYS 26 -24.191 -16.151 9.054 217 1HE LYS 26 1HE LYS 26 -24.229 -13.375 8.786 218 2HE LYS 26 2HE LYS 26 -25.771 -13.892 8.076 219 1HZ LYS 26 1HZ LYS 26 -24.673 -14.583 10.748 220 2HZ LYS 26 2HZ LYS 26 -25.979 -15.413 10.049 221 3HZ LYS 26 3HZ LYS 26 -26.117 -13.758 10.406 222 H GLY 27 H GLY 27 -18.520 -16.896 7.637 223 1HA GLY 27 1HA GLY 27 -17.827 -14.355 8.925 224 2HA GLY 27 2HA GLY 27 -18.137 -15.679 10.048 225 H GLU 28 H GLU 28 -16.020 -14.566 7.450 226 HA GLU 28 HA GLU 28 -13.864 -16.292 8.538 227 1HB GLU 28 1HB GLU 28 -15.038 -16.406 5.743 228 2HB GLU 28 2HB GLU 28 -13.449 -17.068 6.127 229 1HG GLU 28 1HG GLU 28 -14.729 -18.299 8.059 230 2HG GLU 28 2HG GLU 28 -16.156 -17.973 7.075 231 H LEU 29 H LEU 29 -11.780 -15.455 8.060 232 HA LEU 29 HA LEU 29 -11.723 -12.646 7.183 233 1HB LEU 29 1HB LEU 29 -10.494 -13.846 9.150 234 2HB LEU 29 2HB LEU 29 -9.384 -14.424 7.909 235 HG LEU 29 HG LEU 29 -8.589 -12.330 8.981 236 1HD1 LEU 29 1HD1 LEU 29 -8.399 -12.984 6.406 237 2HD1 LEU 29 2HD1 LEU 29 -7.785 -11.443 7.003 238 3HD1 LEU 29 3HD1 LEU 29 -9.358 -11.517 6.209 239 1HD2 LEU 29 1HD2 LEU 29 -11.289 -11.593 8.776 240 2HD2 LEU 29 2HD2 LEU 29 -10.442 -10.546 7.637 241 3HD2 LEU 29 3HD2 LEU 29 -9.959 -10.577 9.333 242 H VAL 30 H VAL 30 -11.361 -12.113 5.072 243 HA VAL 30 HA VAL 30 -10.496 -14.134 3.127 244 HB VAL 30 HB VAL 30 -11.062 -11.150 2.933 245 1HG1 VAL 30 1HG1 VAL 30 -11.508 -11.815 0.495 246 2HG1 VAL 30 2HG1 VAL 30 -10.656 -13.315 0.862 247 3HG1 VAL 30 3HG1 VAL 30 -9.818 -11.769 0.997 248 1HG2 VAL 30 1HG2 VAL 30 -12.798 -13.596 2.491 249 2HG2 VAL 30 2HG2 VAL 30 -13.258 -11.963 2.010 250 3HG2 VAL 30 3HG2 VAL 30 -13.021 -12.346 3.715 251 H GLU 31 H GLU 31 -9.234 -10.951 4.196 252 HA GLU 31 HA GLU 31 -6.471 -11.924 4.056 253 1HB GLU 31 1HB GLU 31 -5.858 -10.357 2.229 254 2HB GLU 31 2HB GLU 31 -7.078 -11.508 1.684 255 1HG GLU 31 1HG GLU 31 -8.640 -9.491 2.693 256 2HG GLU 31 2HG GLU 31 -7.274 -8.586 2.041 257 H GLU 32 H GLU 32 -4.969 -9.848 4.350 258 HA GLU 32 HA GLU 32 -6.220 -7.561 5.679 259 1HB GLU 32 1HB GLU 32 -5.262 -8.146 7.911 260 2HB GLU 32 2HB GLU 32 -6.442 -9.341 7.371 261 1HG GLU 32 1HG GLU 32 -4.369 -10.563 6.352 262 2HG GLU 32 2HG GLU 32 -3.441 -9.561 7.468 263 H CYS 33 H CYS 33 -4.684 -5.888 6.056 264 HA CYS 33 HA CYS 33 -1.815 -6.468 5.534 265 1HB CYS 33 1HB CYS 33 -3.498 -5.752 3.498 266 2HB CYS 33 2HB CYS 33 -2.965 -4.165 4.052 267 HG CYS 33 HG CYS 33 -0.468 -5.609 3.845 268 H LEU 34 H LEU 34 -1.097 -3.717 5.237 269 HA LEU 34 HA LEU 34 -1.720 -2.719 7.990 270 1HB LEU 34 1HB LEU 34 0.592 -2.135 6.103 271 2HB LEU 34 2HB LEU 34 0.474 -1.617 7.784 272 HG LEU 34 HG LEU 34 0.548 -4.496 6.825 273 1HD1 LEU 34 1HD1 LEU 34 2.597 -2.605 7.944 274 2HD1 LEU 34 2HD1 LEU 34 2.758 -3.769 6.629 275 3HD1 LEU 34 3HD1 LEU 34 2.721 -4.328 8.301 276 1HD2 LEU 34 1HD2 LEU 34 -0.023 -3.187 9.437 277 2HD2 LEU 34 2HD2 LEU 34 1.021 -4.608 9.476 278 3HD2 LEU 34 3HD2 LEU 34 -0.603 -4.726 8.799 279 H CYS 35 H CYS 35 -1.269 -0.143 7.953 280 HA CYS 35 HA CYS 35 -2.507 1.091 5.537 281 1HB CYS 35 1HB CYS 35 -3.513 1.273 8.403 282 2HB CYS 35 2HB CYS 35 -4.148 2.222 7.062 283 HG CYS 35 HG CYS 35 -5.519 0.277 6.397 284 H ILE 36 H ILE 36 -2.558 3.597 5.918 285 HA ILE 36 HA ILE 36 -0.033 4.371 7.366 286 HB ILE 36 HB ILE 36 -1.381 5.606 4.935 287 1HG1 ILE 36 1HG1 ILE 36 1.121 3.903 5.161 288 2HG1 ILE 36 2HG1 ILE 36 -0.415 3.374 4.477 289 1HG2 ILE 36 1HG2 ILE 36 1.453 6.139 5.697 290 2HG2 ILE 36 2HG2 ILE 36 0.198 6.919 6.660 291 3HG2 ILE 36 3HG2 ILE 36 0.280 7.203 4.922 292 1HD1 ILE 36 1HD1 ILE 36 -0.209 4.765 2.604 293 2HD1 ILE 36 2HD1 ILE 36 1.459 4.259 2.871 294 3HD1 ILE 36 3HD1 ILE 36 0.923 5.849 3.412 295 H VAL 37 H VAL 37 -0.403 5.716 9.097 296 HA VAL 37 HA VAL 37 -3.084 6.982 9.336 297 HB VAL 37 HB VAL 37 -0.795 6.714 11.321 298 1HG1 VAL 37 1HG1 VAL 37 -3.748 7.071 11.867 299 2HG1 VAL 37 2HG1 VAL 37 -2.653 8.446 11.700 300 3HG1 VAL 37 3HG1 VAL 37 -2.402 7.271 12.991 301 1HG2 VAL 37 1HG2 VAL 37 -1.867 4.725 12.133 302 2HG2 VAL 37 2HG2 VAL 37 -1.736 4.532 10.385 303 3HG2 VAL 37 3HG2 VAL 37 -3.277 4.993 11.108 304 H ARG 38 H ARG 38 -2.984 8.897 8.137 305 HA ARG 38 HA ARG 38 -0.811 10.837 8.882 306 1HB ARG 38 1HB ARG 38 -2.275 10.196 6.322 307 2HB ARG 38 2HB ARG 38 -1.508 11.768 6.541 308 1HG ARG 38 1HG ARG 38 -0.147 9.064 6.742 309 2HG ARG 38 2HG ARG 38 0.059 10.241 5.446 310 1HD ARG 38 1HD ARG 38 1.757 11.115 6.672 311 2HD ARG 38 2HD ARG 38 0.559 11.670 7.830 312 HE ARG 38 HE ARG 38 1.246 8.839 8.114 313 1HH1 ARG 38 1HH1 ARG 38 2.058 12.110 8.991 314 2HH1 ARG 38 2HH1 ARG 38 2.859 11.637 10.448 315 1HH2 ARG 38 1HH2 ARG 38 2.291 8.251 10.011 316 2HH2 ARG 38 2HH2 ARG 38 2.991 9.469 11.024 317 H HIS 39 H HIS 39 -1.841 13.170 8.023 318 HA HIS 39 HA HIS 39 -4.333 13.485 9.643 319 1HB HIS 39 1HB HIS 39 -2.213 15.438 8.669 320 2HB HIS 39 2HB HIS 39 -3.569 15.862 9.714 321 HD1 HIS 39 HD1 HIS 39 -0.163 15.281 10.072 322 HD2 HIS 39 HD2 HIS 39 -3.476 13.678 12.029 323 HE1 HIS 39 HE1 HIS 39 0.683 14.357 12.273 324 H ASN 40 H ASN 40 -5.238 15.894 8.604 325 HA ASN 40 HA ASN 40 -6.363 15.018 6.009 326 1HB ASN 40 1HB ASN 40 -6.925 17.405 7.811 327 2HB ASN 40 2HB ASN 40 -7.938 16.864 6.473 328 1HD2 ASN 40 1HD2 ASN 40 -8.094 16.862 9.678 329 2HD2 ASN 40 2HD2 ASN 40 -8.757 15.330 9.987 330 H ASP 41 H ASP 41 -6.773 18.081 5.501 331 HA ASP 41 HA ASP 41 -5.729 19.719 4.181 332 1HB ASP 41 1HB ASP 41 -3.270 18.640 5.611 333 2HB ASP 41 2HB ASP 41 -3.437 20.236 4.885 334 H ASP 42 H ASP 42 -2.749 19.167 3.368 335 HA ASP 42 HA ASP 42 -3.066 18.412 0.737 336 1HB ASP 42 1HB ASP 42 -0.839 17.838 2.717 337 2HB ASP 42 2HB ASP 42 -0.652 17.631 0.975 338 H TRP 43 H TRP 43 -2.647 16.171 3.491 339 HA TRP 43 HA TRP 43 -2.391 13.753 2.030 340 1HB TRP 43 1HB TRP 43 -2.042 14.006 4.454 341 2HB TRP 43 2HB TRP 43 -3.752 14.374 4.679 342 HD1 TRP 43 HD1 TRP 43 -5.319 12.395 5.074 343 HE1 TRP 43 HE1 TRP 43 -5.104 9.831 4.921 344 HE3 TRP 43 HE3 TRP 43 -0.675 12.024 2.985 345 HZ2 TRP 43 HZ2 TRP 43 -3.212 7.880 4.029 346 HZ3 TRP 43 HZ3 TRP 43 0.307 9.803 2.493 347 HH2 TRP 43 HH2 TRP 43 -0.954 7.732 3.012 348 H GLY 44 H GLY 44 -5.342 15.400 3.204 349 1HA GLY 44 1HA GLY 44 -7.157 13.434 2.142 350 2HA GLY 44 2HA GLY 44 -7.595 15.070 2.631 351 H THR 45 H THR 45 -5.419 16.080 0.712 352 HA THR 45 HA THR 45 -7.198 16.278 -1.624 353 HB THR 45 HB THR 45 -4.409 17.392 -1.179 354 HG1 THR 45 HG1 THR 45 -5.721 19.250 -0.442 355 1HG2 THR 45 1HG2 THR 45 -6.763 18.489 -2.740 356 2HG2 THR 45 2HG2 THR 45 -5.462 17.544 -3.465 357 3HG2 THR 45 3HG2 THR 45 -5.112 19.109 -2.731 358 H ALA 46 H ALA 46 -3.694 15.550 -1.315 359 HA ALA 46 HA ALA 46 -3.367 14.424 -3.891 360 1HB ALA 46 1HB ALA 46 -1.454 15.015 -2.604 361 2HB ALA 46 2HB ALA 46 -1.407 13.253 -2.650 362 3HB ALA 46 3HB ALA 46 -2.003 14.082 -1.212 363 H LEU 47 H LEU 47 -3.785 12.655 -0.792 364 HA LEU 47 HA LEU 47 -4.365 10.170 -2.282 365 1HB LEU 47 1HB LEU 47 -3.986 10.988 0.610 366 2HB LEU 47 2HB LEU 47 -4.549 9.372 0.191 367 HG LEU 47 HG LEU 47 -2.133 9.313 0.454 368 1HD1 LEU 47 1HD1 LEU 47 -2.250 9.330 -2.507 369 2HD1 LEU 47 2HD1 LEU 47 -3.463 8.334 -1.705 370 3HD1 LEU 47 3HD1 LEU 47 -1.749 8.047 -1.406 371 1HD2 LEU 47 1HD2 LEU 47 -1.913 11.348 -1.769 372 2HD2 LEU 47 2HD2 LEU 47 -0.638 10.758 -0.703 373 3HD2 LEU 47 3HD2 LEU 47 -1.902 11.810 -0.067 374 H GLU 48 H GLU 48 -6.355 11.945 -2.902 375 HA GLU 48 HA GLU 48 -8.604 11.594 -1.013 376 1HB GLU 48 1HB GLU 48 -9.727 13.092 -2.651 377 2HB GLU 48 2HB GLU 48 -8.150 13.735 -2.191 378 1HG GLU 48 1HG GLU 48 -7.617 13.787 -4.380 379 2HG GLU 48 2HG GLU 48 -7.649 12.024 -4.367 380 H ASP 49 H ASP 49 -8.002 9.081 -1.738 381 HA ASP 49 HA ASP 49 -10.292 8.281 -3.418 382 1HB ASP 49 1HB ASP 49 -7.481 8.391 -4.304 383 2HB ASP 49 2HB ASP 49 -8.242 6.824 -4.578 384 H TYR 50 H TYR 50 -7.266 6.556 -2.691 385 HA TYR 50 HA TYR 50 -8.811 4.421 -1.341 386 1HB TYR 50 1HB TYR 50 -5.810 4.619 -1.755 387 2HB TYR 50 2HB TYR 50 -6.784 3.159 -1.602 388 HD1 TYR 50 HD1 TYR 50 -4.816 4.335 -3.890 389 HD2 TYR 50 HD2 TYR 50 -9.068 3.896 -3.437 390 HE1 TYR 50 HE1 TYR 50 -5.072 4.269 -6.355 391 HE2 TYR 50 HE2 TYR 50 -9.321 3.831 -5.903 392 HH TYR 50 HH TYR 50 -7.579 3.111 -7.911 393 H LEU 51 H LEU 51 -8.924 6.773 0.139 394 HA LEU 51 HA LEU 51 -6.924 6.360 2.332 395 1HB LEU 51 1HB LEU 51 -7.368 8.537 0.775 396 2HB LEU 51 2HB LEU 51 -8.521 8.865 2.067 397 HG LEU 51 HG LEU 51 -6.671 8.514 3.726 398 1HD1 LEU 51 1HD1 LEU 51 -4.807 7.485 2.988 399 2HD1 LEU 51 2HD1 LEU 51 -4.423 8.950 2.084 400 3HD1 LEU 51 3HD1 LEU 51 -5.327 7.647 1.310 401 1HD2 LEU 51 1HD2 LEU 51 -6.953 10.694 1.794 402 2HD2 LEU 51 2HD2 LEU 51 -5.329 10.611 2.481 403 3HD2 LEU 51 3HD2 LEU 51 -6.727 10.768 3.544 404 H PHE 52 H PHE 52 -7.939 5.176 3.927 405 HA PHE 52 HA PHE 52 -10.810 5.612 4.533 406 1HB PHE 52 1HB PHE 52 -8.618 3.689 5.274 407 2HB PHE 52 2HB PHE 52 -10.019 3.819 6.337 408 HD1 PHE 52 HD1 PHE 52 -12.203 3.045 5.647 409 HD2 PHE 52 HD2 PHE 52 -8.886 2.969 2.919 410 HE1 PHE 52 HE1 PHE 52 -13.514 1.624 4.093 411 HE2 PHE 52 HE2 PHE 52 -10.196 1.549 1.365 412 HZ PHE 52 HZ PHE 52 -12.510 0.876 1.952 413 H SER 53 H SER 53 -11.062 7.545 5.663 414 HA SER 53 HA SER 53 -9.041 8.284 7.710 415 1HB SER 53 1HB SER 53 -9.913 10.464 7.422 416 2HB SER 53 2HB SER 53 -10.088 9.756 5.816 417 HG SER 53 HG SER 53 -11.973 10.821 7.162 418 H ARG 54 H ARG 54 -9.795 9.025 9.836 419 HA ARG 54 HA ARG 54 -12.360 7.741 10.709 420 1HB ARG 54 1HB ARG 54 -9.694 7.052 11.325 421 2HB ARG 54 2HB ARG 54 -10.294 7.893 12.755 422 1HG ARG 54 1HG ARG 54 -12.355 6.402 12.614 423 2HG ARG 54 2HG ARG 54 -11.482 5.457 11.407 424 1HD ARG 54 1HD ARG 54 -10.937 4.327 13.402 425 2HD ARG 54 2HD ARG 54 -9.570 5.446 13.240 426 HE ARG 54 HE ARG 54 -11.681 6.804 14.591 427 1HH1 ARG 54 1HH1 ARG 54 -9.447 4.180 15.078 428 2HH1 ARG 54 2HH1 ARG 54 -9.405 4.388 16.794 429 1HH2 ARG 54 1HH2 ARG 54 -11.611 7.054 16.820 430 2HH2 ARG 54 2HH2 ARG 54 -10.621 6.002 17.775 431 H LYS 55 H LYS 55 -12.651 8.652 13.191 432 HA LYS 55 HA LYS 55 -13.014 11.528 12.864 433 1HB LYS 55 1HB LYS 55 -13.801 9.319 14.667 434 2HB LYS 55 2HB LYS 55 -13.625 10.875 15.480 435 1HG LYS 55 1HG LYS 55 -15.289 11.889 14.173 436 2HG LYS 55 2HG LYS 55 -15.148 10.687 12.891 437 1HD LYS 55 1HD LYS 55 -16.560 9.231 13.931 438 2HD LYS 55 2HD LYS 55 -15.917 9.601 15.531 439 1HE LYS 55 1HE LYS 55 -17.412 11.820 14.255 440 2HE LYS 55 2HE LYS 55 -18.387 10.405 14.691 441 1HZ LYS 55 1HZ LYS 55 -18.130 11.935 16.572 442 2HZ LYS 55 2HZ LYS 55 -16.442 11.780 16.476 443 3HZ LYS 55 3HZ LYS 55 -17.395 10.438 16.892 444 H ASN 56 H ASN 56 -10.762 12.176 12.709 445 HA ASN 56 HA ASN 56 -9.025 11.778 15.064 446 1HB ASN 56 1HB ASN 56 -9.712 14.577 14.168 447 2HB ASN 56 2HB ASN 56 -10.730 13.741 15.341 448 1HD2 ASN 56 1HD2 ASN 56 -8.519 16.039 15.445 449 2HD2 ASN 56 2HD2 ASN 56 -7.612 15.594 16.809 450 H MET 57 H MET 57 -9.140 11.399 11.979 451 HA MET 57 HA MET 57 -7.198 13.200 10.824 452 1HB MET 57 1HB MET 57 -5.241 11.667 10.972 453 2HB MET 57 2HB MET 57 -5.797 12.145 12.575 454 1HG MET 57 1HG MET 57 -7.301 9.854 11.870 455 2HG MET 57 2HG MET 57 -5.632 9.499 11.429 456 1HE MET 57 1HE MET 57 -4.278 11.635 13.942 457 2HE MET 57 2HE MET 57 -3.761 10.407 12.785 458 3HE MET 57 3HE MET 57 -3.596 10.113 14.516 459 H SER 58 H SER 58 -5.893 11.603 9.044 460 HA SER 58 HA SER 58 -8.011 9.922 7.752 461 1HB SER 58 1HB SER 58 -6.353 12.223 6.716 462 2HB SER 58 2HB SER 58 -6.966 11.003 5.599 463 HG SER 58 HG SER 58 -8.879 11.816 5.788 464 H ALA 59 H ALA 59 -7.201 7.961 7.005 465 HA ALA 59 HA ALA 59 -4.216 7.689 6.879 466 1HB ALA 59 1HB ALA 59 -4.934 6.614 8.878 467 2HB ALA 59 2HB ALA 59 -4.808 5.293 7.715 468 3HB ALA 59 3HB ALA 59 -6.387 5.976 8.108 469 H MET 60 H MET 60 -3.546 5.748 5.539 470 HA MET 60 HA MET 60 -5.219 5.589 3.081 471 1HB MET 60 1HB MET 60 -2.761 6.201 3.076 472 2HB MET 60 2HB MET 60 -2.413 4.574 3.665 473 1HG MET 60 1HG MET 60 -2.991 3.575 1.662 474 2HG MET 60 2HG MET 60 -4.135 4.848 1.236 475 1HE MET 60 1HE MET 60 -2.397 6.219 -1.558 476 2HE MET 60 2HE MET 60 -3.476 6.931 -0.359 477 3HE MET 60 3HE MET 60 -3.718 5.265 -0.884 478 H ALA 61 H ALA 61 -5.296 3.349 2.039 479 HA ALA 61 HA ALA 61 -6.234 1.419 4.025 480 1HB ALA 61 1HB ALA 61 -6.590 2.086 1.266 481 2HB ALA 61 2HB ALA 61 -7.531 0.947 2.229 482 3HB ALA 61 3HB ALA 61 -6.112 0.390 1.343 483 H LEU 62 H LEU 62 -3.755 1.215 1.401 484 HA LEU 62 HA LEU 62 -2.143 -0.546 3.163 485 1HB LEU 62 1HB LEU 62 -0.997 -0.173 0.575 486 2HB LEU 62 2HB LEU 62 -1.674 1.358 1.071 487 HG LEU 62 HG LEU 62 -0.460 0.422 3.382 488 1HD1 LEU 62 1HD1 LEU 62 0.613 -1.004 1.260 489 2HD1 LEU 62 2HD1 LEU 62 1.370 -0.782 2.838 490 3HD1 LEU 62 3HD1 LEU 62 1.765 0.303 1.505 491 1HD2 LEU 62 1HD2 LEU 62 0.957 2.321 3.112 492 2HD2 LEU 62 2HD2 LEU 62 -0.543 2.751 2.288 493 3HD2 LEU 62 3HD2 LEU 62 0.861 2.235 1.352 494 H GLY 63 H GLY 63 -3.696 -2.386 3.002 495 1HA GLY 63 1HA GLY 63 -2.893 -4.277 0.996 496 2HA GLY 63 2HA GLY 63 -4.215 -4.506 2.139 497 H PHE 64 H PHE 64 -5.749 -5.288 0.679 498 HA PHE 64 HA PHE 64 -6.270 -3.970 -1.880 499 1HB PHE 64 1HB PHE 64 -7.418 -6.222 -0.234 500 2HB PHE 64 2HB PHE 64 -8.283 -5.647 -1.659 501 HD1 PHE 64 HD1 PHE 64 -4.736 -6.440 -0.693 502 HD2 PHE 64 HD2 PHE 64 -7.841 -6.778 -3.642 503 HE1 PHE 64 HE1 PHE 64 -3.213 -7.752 -2.147 504 HE2 PHE 64 HE2 PHE 64 -6.318 -8.089 -5.095 505 HZ PHE 64 HZ PHE 64 -4.004 -8.576 -4.348 506 H GLY 65 H GLY 65 -6.512 -1.917 -0.160 507 1HA GLY 65 1HA GLY 65 -9.316 -1.690 0.743 508 2HA GLY 65 2HA GLY 65 -8.042 -0.502 1.020 509 H ALA 66 H ALA 66 -7.123 -0.161 -1.615 510 HA ALA 66 HA ALA 66 -9.000 1.730 -2.654 511 1HB ALA 66 1HB ALA 66 -6.666 0.259 -3.932 512 2HB ALA 66 2HB ALA 66 -6.558 1.761 -3.015 513 3HB ALA 66 3HB ALA 66 -7.398 1.733 -4.565 514 H ILE 67 H ILE 67 -8.122 -1.548 -3.799 515 HA ILE 67 HA ILE 67 -9.718 -1.748 -6.061 516 HB ILE 67 HB ILE 67 -9.777 -4.202 -5.470 517 1HG1 ILE 67 1HG1 ILE 67 -8.354 -4.707 -3.360 518 2HG1 ILE 67 2HG1 ILE 67 -8.793 -3.080 -2.849 519 1HG2 ILE 67 1HG2 ILE 67 -7.406 -4.483 -5.645 520 2HG2 ILE 67 2HG2 ILE 67 -7.100 -2.930 -4.867 521 3HG2 ILE 67 3HG2 ILE 67 -7.790 -2.983 -6.489 522 1HD1 ILE 67 1HD1 ILE 67 -10.888 -3.724 -2.311 523 2HD1 ILE 67 2HD1 ILE 67 -10.314 -5.381 -2.484 524 3HD1 ILE 67 3HD1 ILE 67 -11.094 -4.572 -3.844 525 H PHE 68 H PHE 68 -10.848 -1.594 -2.743 526 HA PHE 68 HA PHE 68 -13.330 -2.869 -2.863 527 1HB PHE 68 1HB PHE 68 -12.256 -0.393 -1.535 528 2HB PHE 68 2HB PHE 68 -13.961 -0.784 -1.348 529 HD1 PHE 68 HD1 PHE 68 -13.900 -3.759 -1.295 530 HD2 PHE 68 HD2 PHE 68 -11.304 -0.886 0.570 531 HE1 PHE 68 HE1 PHE 68 -13.315 -5.416 0.449 532 HE2 PHE 68 HE2 PHE 68 -10.722 -2.546 2.313 533 HZ PHE 68 HZ PHE 68 -11.728 -4.810 2.254 534 H ASN 69 H ASN 69 -14.819 -2.706 -4.486 535 HA ASN 69 HA ASN 69 -15.160 -0.103 -5.895 536 1HB ASN 69 1HB ASN 69 -15.917 -2.989 -6.449 537 2HB ASN 69 2HB ASN 69 -16.409 -1.660 -7.497 538 1HD2 ASN 69 1HD2 ASN 69 -14.819 -3.478 -8.747 539 2HD2 ASN 69 2HD2 ASN 69 -13.228 -2.905 -8.911 540 H HIS 70 H HIS 70 -17.710 -0.374 -6.860 541 HA HIS 70 HA HIS 70 -19.351 0.117 -4.441 542 1HB HIS 70 1HB HIS 70 -19.029 1.479 -6.724 543 2HB HIS 70 2HB HIS 70 -20.312 0.400 -7.269 544 HD1 HIS 70 HD1 HIS 70 -20.186 3.638 -6.223 545 HD2 HIS 70 HD2 HIS 70 -22.262 0.376 -4.666 546 HE1 HIS 70 HE1 HIS 70 -22.101 4.588 -4.868 547 H SER 71 H SER 71 -21.132 -1.163 -3.903 548 HA SER 71 HA SER 71 -22.170 -3.175 -5.790 549 1HB SER 71 1HB SER 71 -19.979 -3.836 -4.309 550 2HB SER 71 2HB SER 71 -21.261 -4.304 -3.193 551 HG SER 71 HG SER 71 -21.764 -5.900 -4.450 552 H LYS 72 H LYS 72 -24.273 -3.800 -5.211 553 HA LYS 72 HA LYS 72 -25.549 -2.257 -3.053 554 1HB LYS 72 1HB LYS 72 -26.572 -2.510 -5.273 555 2HB LYS 72 2HB LYS 72 -26.558 -4.266 -5.102 556 1HG LYS 72 1HG LYS 72 -28.769 -3.610 -4.517 557 2HG LYS 72 2HG LYS 72 -27.960 -3.890 -2.976 558 1HD LYS 72 1HD LYS 72 -29.078 -1.802 -2.720 559 2HD LYS 72 2HD LYS 72 -27.385 -1.394 -3.000 560 1HE LYS 72 1HE LYS 72 -28.559 0.049 -4.478 561 2HE LYS 72 2HE LYS 72 -28.072 -1.299 -5.522 562 1HZ LYS 72 1HZ LYS 72 -30.650 -1.149 -4.046 563 2HZ LYS 72 2HZ LYS 72 -30.185 -2.352 -5.151 564 3HZ LYS 72 3HZ LYS 72 -30.470 -0.767 -5.691 565 H ASP 73 H ASP 73 -24.297 -5.465 -3.518 566 HA ASP 73 HA ASP 73 -25.591 -6.314 -0.946 567 1HB ASP 73 1HB ASP 73 -25.504 -8.605 -1.941 568 2HB ASP 73 2HB ASP 73 -26.453 -7.498 -2.932 569 HA PRO 74 HA PRO 74 -20.927 -6.110 -0.549 570 1HB PRO 74 1HB PRO 74 -21.734 -5.459 2.241 571 2HB PRO 74 2HB PRO 74 -20.559 -4.644 1.194 572 1HG PRO 74 1HG PRO 74 -22.961 -3.585 1.762 573 2HG PRO 74 2HG PRO 74 -22.152 -3.331 0.210 574 1HD PRO 74 1HD PRO 74 -24.466 -5.073 0.876 575 2HD PRO 74 2HD PRO 74 -24.094 -4.204 -0.628 576 H ASN 75 H ASN 75 -20.481 -8.314 -0.572 577 HA ASN 75 HA ASN 75 -21.703 -10.134 1.388 578 1HB ASN 75 1HB ASN 75 -20.413 -11.808 0.085 579 2HB ASN 75 2HB ASN 75 -21.309 -10.731 -0.986 580 1HD2 ASN 75 1HD2 ASN 75 -19.191 -11.926 -2.204 581 2HD2 ASN 75 2HD2 ASN 75 -17.876 -10.864 -2.364 582 H ALA 76 H ALA 76 -18.873 -8.173 1.242 583 HA ALA 76 HA ALA 76 -17.822 -9.548 3.673 584 1HB ALA 76 1HB ALA 76 -15.513 -9.054 2.448 585 2HB ALA 76 2HB ALA 76 -16.521 -9.099 1.001 586 3HB ALA 76 3HB ALA 76 -16.431 -10.509 2.058 587 H ARG 77 H ARG 77 -16.947 -8.100 5.165 588 HA ARG 77 HA ARG 77 -16.979 -5.206 4.378 589 1HB ARG 77 1HB ARG 77 -18.129 -6.752 6.513 590 2HB ARG 77 2HB ARG 77 -16.977 -5.612 7.208 591 1HG ARG 77 1HG ARG 77 -18.083 -3.820 5.762 592 2HG ARG 77 2HG ARG 77 -19.355 -4.999 5.441 593 1HD ARG 77 1HD ARG 77 -18.623 -4.652 8.303 594 2HD ARG 77 2HD ARG 77 -19.456 -3.284 7.541 595 HE ARG 77 HE ARG 77 -20.755 -5.692 6.733 596 1HH1 ARG 77 1HH1 ARG 77 -20.249 -3.741 9.571 597 2HH1 ARG 77 2HH1 ARG 77 -21.739 -4.225 10.304 598 1HH2 ARG 77 1HH2 ARG 77 -22.683 -6.305 7.704 599 2HH2 ARG 77 2HH2 ARG 77 -23.109 -5.666 9.256 600 H HIS 78 H HIS 78 -15.485 -4.000 6.188 601 HA HIS 78 HA HIS 78 -12.853 -5.444 6.210 602 1HB HIS 78 1HB HIS 78 -11.885 -3.181 5.788 603 2HB HIS 78 2HB HIS 78 -13.006 -3.657 4.512 604 HD1 HIS 78 HD1 HIS 78 -15.358 -2.492 4.487 605 HD2 HIS 78 HD2 HIS 78 -12.737 -0.987 7.358 606 HE1 HIS 78 HE1 HIS 78 -16.366 -0.318 5.308 607 H GLU 79 H GLU 79 -11.383 -4.691 7.962 608 HA GLU 79 HA GLU 79 -12.816 -3.451 10.282 609 1HB GLU 79 1HB GLU 79 -12.770 -5.925 10.456 610 2HB GLU 79 2HB GLU 79 -11.018 -5.906 10.255 611 1HG GLU 79 1HG GLU 79 -11.493 -6.070 12.624 612 2HG GLU 79 2HG GLU 79 -10.874 -4.450 12.305 613 H LEU 80 H LEU 80 -11.380 -2.336 11.766 614 HA LEU 80 HA LEU 80 -8.591 -1.927 10.762 615 1HB LEU 80 1HB LEU 80 -9.972 -0.076 10.021 616 2HB LEU 80 2HB LEU 80 -10.719 0.071 11.611 617 HG LEU 80 HG LEU 80 -8.474 0.627 12.554 618 1HD1 LEU 80 1HD1 LEU 80 -6.594 0.458 11.312 619 2HD1 LEU 80 2HD1 LEU 80 -7.306 1.395 9.998 620 3HD1 LEU 80 3HD1 LEU 80 -7.578 -0.346 10.088 621 1HD2 LEU 80 1HD2 LEU 80 -10.251 2.288 11.484 622 2HD2 LEU 80 2HD2 LEU 80 -8.955 2.565 10.320 623 3HD2 LEU 80 3HD2 LEU 80 -8.684 2.881 12.034 624 H THR 81 H THR 81 -7.048 -1.828 12.409 625 HA THR 81 HA THR 81 -7.841 -2.678 15.085 626 HB THR 81 HB THR 81 -5.273 -2.225 15.372 627 HG1 THR 81 HG1 THR 81 -5.179 -0.840 13.540 628 1HG2 THR 81 1HG2 THR 81 -6.052 -4.470 15.115 629 2HG2 THR 81 2HG2 THR 81 -4.786 -4.262 13.904 630 3HG2 THR 81 3HG2 THR 81 -6.483 -4.201 13.426 631 H ALA 82 H ALA 82 -6.271 -1.260 16.809 632 HA ALA 82 HA ALA 82 -7.667 1.337 16.937 633 1HB ALA 82 1HB ALA 82 -6.919 -0.581 18.746 634 2HB ALA 82 2HB ALA 82 -7.283 1.087 19.187 635 3HB ALA 82 3HB ALA 82 -5.611 0.585 18.939 636 H GLY 83 H GLY 83 -6.713 2.921 15.680 637 1HA GLY 83 1HA GLY 83 -4.828 4.591 15.911 638 2HA GLY 83 2HA GLY 83 -3.741 3.205 15.882 639 H LEU 84 H LEU 84 -6.413 2.838 13.768 640 HA LEU 84 HA LEU 84 -6.504 2.789 11.405 641 1HB LEU 84 1HB LEU 84 -5.114 5.322 12.239 642 2HB LEU 84 2HB LEU 84 -5.224 4.953 10.519 643 HG LEU 84 HG LEU 84 -7.626 4.908 12.361 644 1HD1 LEU 84 1HD1 LEU 84 -7.443 7.148 10.493 645 2HD1 LEU 84 2HD1 LEU 84 -6.151 7.172 11.693 646 3HD1 LEU 84 3HD1 LEU 84 -7.837 7.154 12.212 647 1HD2 LEU 84 1HD2 LEU 84 -7.366 3.818 9.914 648 2HD2 LEU 84 2HD2 LEU 84 -7.755 5.471 9.438 649 3HD2 LEU 84 3HD2 LEU 84 -8.870 4.561 10.457 650 H LYS 85 H LYS 85 -4.259 1.341 12.739 651 HA LYS 85 HA LYS 85 -2.025 1.726 10.814 652 1HB LYS 85 1HB LYS 85 -2.469 0.458 13.500 653 2HB LYS 85 2HB LYS 85 -1.100 -0.083 12.530 654 1HG LYS 85 1HG LYS 85 -1.477 2.855 12.716 655 2HG LYS 85 2HG LYS 85 -0.986 2.049 14.204 656 1HD LYS 85 1HD LYS 85 0.996 1.199 13.222 657 2HD LYS 85 2HD LYS 85 0.415 1.512 11.587 658 1HE LYS 85 1HE LYS 85 1.757 3.381 11.804 659 2HE LYS 85 2HE LYS 85 0.322 4.032 12.619 660 1HZ LYS 85 1HZ LYS 85 1.156 3.392 14.713 661 2HZ LYS 85 2HZ LYS 85 2.477 4.112 13.924 662 3HZ LYS 85 3HZ LYS 85 2.373 2.421 14.034 663 H ARG 86 H ARG 86 -3.660 -1.130 12.262 664 HA ARG 86 HA ARG 86 -2.999 -2.670 9.809 665 1HB ARG 86 1HB ARG 86 -3.007 -3.141 12.573 666 2HB ARG 86 2HB ARG 86 -4.390 -4.056 11.972 667 1HG ARG 86 1HG ARG 86 -3.078 -5.466 10.705 668 2HG ARG 86 2HG ARG 86 -1.853 -4.231 10.411 669 1HD ARG 86 1HD ARG 86 -0.880 -4.537 12.572 670 2HD ARG 86 2HD ARG 86 -2.282 -5.457 13.151 671 HE ARG 86 HE ARG 86 -1.398 -6.860 10.911 672 1HH1 ARG 86 1HH1 ARG 86 0.009 -5.798 13.914 673 2HH1 ARG 86 2HH1 ARG 86 1.122 -7.119 13.986 674 1HH2 ARG 86 1HH2 ARG 86 0.058 -8.566 11.029 675 2HH2 ARG 86 2HH2 ARG 86 1.151 -8.675 12.367 676 H MET 87 H MET 87 -4.692 -4.088 8.881 677 HA MET 87 HA MET 87 -7.510 -3.329 9.424 678 1HB MET 87 1HB MET 87 -5.832 -2.453 7.169 679 2HB MET 87 2HB MET 87 -7.345 -3.198 6.656 680 1HG MET 87 1HG MET 87 -8.375 -1.660 8.546 681 2HG MET 87 2HG MET 87 -6.909 -0.716 8.282 682 1HE MET 87 1HE MET 87 -10.194 -1.939 7.205 683 2HE MET 87 2HE MET 87 -9.417 -2.787 5.868 684 3HE MET 87 3HE MET 87 -10.472 -1.411 5.546 685 H ARG 88 H ARG 88 -8.969 -4.969 8.738 686 HA ARG 88 HA ARG 88 -7.736 -7.370 7.432 687 1HB ARG 88 1HB ARG 88 -9.592 -7.199 9.835 688 2HB ARG 88 2HB ARG 88 -9.108 -8.707 9.058 689 1HG ARG 88 1HG ARG 88 -6.847 -8.447 9.701 690 2HG ARG 88 2HG ARG 88 -7.055 -6.731 10.051 691 1HD ARG 88 1HD ARG 88 -8.825 -7.650 11.818 692 2HD ARG 88 2HD ARG 88 -7.819 -9.108 11.709 693 HE ARG 88 HE ARG 88 -6.246 -6.660 11.942 694 1HH1 ARG 88 1HH1 ARG 88 -7.993 -9.119 13.681 695 2HH1 ARG 88 2HH1 ARG 88 -7.087 -8.888 15.136 696 1HH2 ARG 88 1HH2 ARG 88 -5.084 -6.380 13.842 697 2HH2 ARG 88 2HH2 ARG 88 -5.452 -7.351 15.229 698 H ILE 89 H ILE 89 -9.576 -8.894 6.664 699 HA ILE 89 HA ILE 89 -11.987 -7.335 5.816 700 HB ILE 89 HB ILE 89 -10.114 -9.038 4.129 701 1HG1 ILE 89 1HG1 ILE 89 -10.894 -6.131 3.800 702 2HG1 ILE 89 2HG1 ILE 89 -9.470 -6.637 4.708 703 1HG2 ILE 89 1HG2 ILE 89 -11.680 -8.195 2.261 704 2HG2 ILE 89 2HG2 ILE 89 -12.826 -7.835 3.553 705 3HG2 ILE 89 3HG2 ILE 89 -12.288 -9.494 3.287 706 1HD1 ILE 89 1HD1 ILE 89 -9.517 -6.154 1.995 707 2HD1 ILE 89 2HD1 ILE 89 -9.700 -7.907 2.063 708 3HD1 ILE 89 3HD1 ILE 89 -8.308 -7.134 2.822 709 H PHE 90 H PHE 90 -13.704 -8.465 6.634 710 HA PHE 90 HA PHE 90 -13.488 -11.445 6.841 711 1HB PHE 90 1HB PHE 90 -14.897 -9.241 8.323 712 2HB PHE 90 2HB PHE 90 -15.587 -10.863 8.368 713 HD1 PHE 90 HD1 PHE 90 -14.228 -12.775 9.246 714 HD2 PHE 90 HD2 PHE 90 -12.885 -8.703 9.505 715 HE1 PHE 90 HE1 PHE 90 -12.559 -13.435 10.957 716 HE2 PHE 90 HE2 PHE 90 -11.216 -9.362 11.216 717 HZ PHE 90 HZ PHE 90 -11.053 -11.728 11.942 718 H THR 91 H THR 91 -15.707 -12.547 6.555 719 HA THR 91 HA THR 91 -17.088 -11.346 4.181 720 HB THR 91 HB THR 91 -17.688 -13.859 3.873 721 HG1 THR 91 HG1 THR 91 -16.717 -15.240 5.150 722 1HG2 THR 91 1HG2 THR 91 -15.750 -12.367 2.816 723 2HG2 THR 91 2HG2 THR 91 -15.827 -14.104 2.517 724 3HG2 THR 91 3HG2 THR 91 -14.725 -13.467 3.739 725 H ILE 92 H ILE 92 -18.599 -10.156 5.553 726 HA ILE 92 HA ILE 92 -20.122 -11.145 7.691 727 HB ILE 92 HB ILE 92 -21.773 -9.404 6.909 728 1HG1 ILE 92 1HG1 ILE 92 -19.966 -8.622 4.691 729 2HG1 ILE 92 2HG1 ILE 92 -20.947 -10.058 4.403 730 1HG2 ILE 92 1HG2 ILE 92 -20.085 -8.466 8.218 731 2HG2 ILE 92 2HG2 ILE 92 -19.905 -7.555 6.718 732 3HG2 ILE 92 3HG2 ILE 92 -18.817 -8.898 7.070 733 1HD1 ILE 92 1HD1 ILE 92 -21.755 -7.284 4.408 734 2HD1 ILE 92 2HD1 ILE 92 -22.661 -8.176 5.630 735 3HD1 ILE 92 3HD1 ILE 92 -22.691 -8.707 3.948 736 H LYS 93 H LYS 93 -20.367 -11.933 4.294 737 HA LYS 93 HA LYS 93 -22.713 -13.689 4.931 738 1HB LYS 93 1HB LYS 93 -22.197 -12.064 2.412 739 2HB LYS 93 2HB LYS 93 -23.614 -13.066 2.720 740 1HG LYS 93 1HG LYS 93 -22.833 -10.797 4.557 741 2HG LYS 93 2HG LYS 93 -23.873 -10.548 3.155 742 1HD LYS 93 1HD LYS 93 -24.977 -12.784 4.370 743 2HD LYS 93 2HD LYS 93 -24.495 -11.781 5.738 744 1HE LYS 93 1HE LYS 93 -26.159 -10.286 5.325 745 2HE LYS 93 2HE LYS 93 -25.752 -10.215 3.600 746 1HZ LYS 93 1HZ LYS 93 -27.969 -11.287 4.240 747 2HZ LYS 93 2HZ LYS 93 -27.042 -12.596 4.796 748 3HZ LYS 93 3HZ LYS 93 -26.974 -12.142 3.161 749 HA PRO 94 HA PRO 94 -20.303 -16.934 3.177 750 1HB PRO 94 1HB PRO 94 -22.713 -17.966 1.889 751 2HB PRO 94 2HB PRO 94 -21.706 -18.724 3.122 752 1HG PRO 94 1HG PRO 94 -24.177 -17.770 3.639 753 2HG PRO 94 2HG PRO 94 -22.880 -17.785 4.841 754 1HD PRO 94 1HD PRO 94 -23.979 -15.511 3.270 755 2HD PRO 94 2HD PRO 94 -23.319 -15.537 4.919 756 H ILE 95 H ILE 95 -19.253 -17.320 1.197 757 HA ILE 95 HA ILE 95 -20.407 -15.922 -1.197 758 HB ILE 95 HB ILE 95 -17.544 -16.125 -0.188 759 1HG1 ILE 95 1HG1 ILE 95 -19.404 -13.749 -0.515 760 2HG1 ILE 95 2HG1 ILE 95 -18.991 -14.512 1.020 761 1HG2 ILE 95 1HG2 ILE 95 -18.001 -14.230 -2.333 762 2HG2 ILE 95 2HG2 ILE 95 -18.462 -15.856 -2.837 763 3HG2 ILE 95 3HG2 ILE 95 -16.829 -15.546 -2.246 764 1HD1 ILE 95 1HD1 ILE 95 -17.270 -13.042 1.106 765 2HD1 ILE 95 2HD1 ILE 95 -17.442 -12.622 -0.598 766 3HD1 ILE 95 3HD1 ILE 95 -16.513 -14.046 -0.130 767 H ALA 96 H ALA 96 -20.294 -17.073 -3.129 768 HA ALA 96 HA ALA 96 -19.354 -19.895 -2.940 769 1HB ALA 96 1HB ALA 96 -20.778 -20.140 -4.961 770 2HB ALA 96 2HB ALA 96 -21.050 -18.397 -4.975 771 3HB ALA 96 3HB ALA 96 -21.675 -19.377 -3.648 772 H ILE 97 H ILE 97 -18.186 -20.761 -4.886 773 HA ILE 97 HA ILE 97 -15.892 -19.191 -5.557 774 HB ILE 97 HB ILE 97 -17.150 -21.640 -6.849 775 1HG1 ILE 97 1HG1 ILE 97 -14.749 -21.986 -5.219 776 2HG1 ILE 97 2HG1 ILE 97 -16.089 -21.307 -4.297 777 1HG2 ILE 97 1HG2 ILE 97 -15.527 -21.441 -8.400 778 2HG2 ILE 97 2HG2 ILE 97 -14.348 -21.684 -7.112 779 3HG2 ILE 97 3HG2 ILE 97 -14.835 -20.050 -7.565 780 1HD1 ILE 97 1HD1 ILE 97 -15.991 -23.855 -4.379 781 2HD1 ILE 97 2HD1 ILE 97 -16.398 -23.726 -6.090 782 3HD1 ILE 97 3HD1 ILE 97 -17.526 -23.138 -4.868 783 H GLY 98 H GLY 98 -15.802 -17.506 -6.976 784 1HA GLY 98 1HA GLY 98 -16.018 -16.687 -9.270 785 2HA GLY 98 2HA GLY 98 -17.501 -17.629 -9.423 786 H GLU 99 H GLU 99 -16.592 -15.521 -6.710 787 HA GLU 99 HA GLU 99 -18.985 -13.832 -7.378 788 1HB GLU 99 1HB GLU 99 -17.953 -15.166 -4.952 789 2HB GLU 99 2HB GLU 99 -18.460 -13.497 -4.689 790 1HG GLU 99 1HG GLU 99 -20.178 -15.530 -6.132 791 2HG GLU 99 2HG GLU 99 -20.286 -15.246 -4.395 792 H GLU 100 H GLU 100 -18.756 -11.553 -6.384 793 HA GLU 100 HA GLU 100 -15.941 -10.591 -6.781 794 1HB GLU 100 1HB GLU 100 -18.069 -10.010 -8.293 795 2HB GLU 100 2HB GLU 100 -18.359 -8.830 -7.015 796 1HG GLU 100 1HG GLU 100 -15.612 -8.638 -7.571 797 2HG GLU 100 2HG GLU 100 -16.386 -8.775 -9.149 798 H ILE 101 H ILE 101 -15.010 -9.726 -4.975 799 HA ILE 101 HA ILE 101 -16.726 -9.118 -2.628 800 HB ILE 101 HB ILE 101 -13.732 -9.427 -3.027 801 1HG1 ILE 101 1HG1 ILE 101 -15.714 -11.201 -1.583 802 2HG1 ILE 101 2HG1 ILE 101 -15.167 -11.482 -3.235 803 1HG2 ILE 101 1HG2 ILE 101 -14.036 -9.662 -0.382 804 2HG2 ILE 101 2HG2 ILE 101 -15.388 -8.574 -0.697 805 3HG2 ILE 101 3HG2 ILE 101 -13.749 -8.097 -1.143 806 1HD1 ILE 101 1HD1 ILE 101 -13.924 -12.465 -0.983 807 2HD1 ILE 101 2HD1 ILE 101 -12.979 -11.015 -1.321 808 3HD1 ILE 101 3HD1 ILE 101 -13.146 -12.266 -2.553 809 H THR 102 H THR 102 -17.192 -7.070 -2.102 810 HA THR 102 HA THR 102 -15.347 -4.838 -2.664 811 HB THR 102 HB THR 102 -17.208 -3.647 -3.917 812 HG1 THR 102 HG1 THR 102 -18.857 -5.062 -3.099 813 1HG2 THR 102 1HG2 THR 102 -16.728 -4.696 -6.010 814 2HG2 THR 102 2HG2 THR 102 -16.444 -6.257 -5.242 815 3HG2 THR 102 3HG2 THR 102 -15.295 -4.939 -5.013 816 H ILE 103 H ILE 103 -16.570 -2.713 -1.839 817 HA ILE 103 HA ILE 103 -18.533 -3.336 0.306 818 HB ILE 103 HB ILE 103 -17.083 -2.252 1.988 819 1HG1 ILE 103 1HG1 ILE 103 -14.573 -2.098 0.965 820 2HG1 ILE 103 2HG1 ILE 103 -15.516 -1.624 -0.448 821 1HG2 ILE 103 1HG2 ILE 103 -15.556 -4.043 2.269 822 2HG2 ILE 103 2HG2 ILE 103 -15.398 -4.289 0.529 823 3HG2 ILE 103 3HG2 ILE 103 -16.889 -4.745 1.353 824 1HD1 ILE 103 1HD1 ILE 103 -15.655 0.436 0.464 825 2HD1 ILE 103 2HD1 ILE 103 -14.973 -0.130 1.989 826 3HD1 ILE 103 3HD1 ILE 103 -16.707 -0.263 1.695 827 H SER 104 H SER 104 -19.626 -1.411 1.092 828 HA SER 104 HA SER 104 -20.088 0.599 -0.921 829 1HB SER 104 1HB SER 104 -21.720 -0.248 0.771 830 2HB SER 104 2HB SER 104 -20.771 0.523 2.042 831 HG SER 104 HG SER 104 -22.623 1.730 1.135 832 H TYR 105 H TYR 105 -20.259 2.869 0.988 833 HA TYR 105 HA TYR 105 -17.354 3.445 1.433 834 1HB TYR 105 1HB TYR 105 -19.425 5.230 0.097 835 2HB TYR 105 2HB TYR 105 -17.728 5.636 0.355 836 HD1 TYR 105 HD1 TYR 105 -15.942 4.381 -0.847 837 HD2 TYR 105 HD2 TYR 105 -20.109 3.744 -1.665 838 HE1 TYR 105 HE1 TYR 105 -15.351 3.239 -2.968 839 HE2 TYR 105 HE2 TYR 105 -19.519 2.602 -3.786 840 HH TYR 105 HH TYR 105 -16.325 1.630 -4.520 841 H GLY 106 H GLY 106 -20.413 5.292 1.763 842 1HA GLY 106 1HA GLY 106 -21.039 5.156 4.389 843 2HA GLY 106 2HA GLY 106 -19.571 6.129 4.462 844 H ASP 107 H ASP 107 -21.524 7.539 5.394 845 HA ASP 107 HA ASP 107 -23.351 8.793 3.583 846 1HB ASP 107 1HB ASP 107 -23.459 10.478 5.440 847 2HB ASP 107 2HB ASP 107 -23.557 8.819 6.030 848 H ASP 108 H ASP 108 -20.051 9.675 4.619 849 HA ASP 108 HA ASP 108 -19.896 12.220 3.354 850 1HB ASP 108 1HB ASP 108 -18.161 10.178 4.540 851 2HB ASP 108 2HB ASP 108 -17.363 11.043 3.228 852 H TYR 109 H TYR 109 -18.523 9.130 2.143 853 HA TYR 109 HA TYR 109 -18.114 10.143 -0.531 854 1HB TYR 109 1HB TYR 109 -17.807 7.669 1.036 855 2HB TYR 109 2HB TYR 109 -18.191 7.370 -0.660 856 HD1 TYR 109 HD1 TYR 109 -15.507 7.396 1.352 857 HD2 TYR 109 HD2 TYR 109 -16.919 9.506 -2.113 858 HE1 TYR 109 HE1 TYR 109 -13.169 7.935 0.728 859 HE2 TYR 109 HE2 TYR 109 -14.580 10.045 -2.738 860 HH TYR 109 HH TYR 109 -11.883 9.277 -0.598 861 H TRP 110 H TRP 110 -19.928 10.775 -1.673 862 HA TRP 110 HA TRP 110 -22.574 9.919 -1.442 863 1HB TRP 110 1HB TRP 110 -22.787 10.817 -3.717 864 2HB TRP 110 2HB TRP 110 -21.661 11.810 -2.791 865 HD1 TRP 110 HD1 TRP 110 -19.135 11.815 -3.513 866 HE1 TRP 110 HE1 TRP 110 -17.897 10.873 -5.574 867 HE3 TRP 110 HE3 TRP 110 -22.788 8.834 -5.422 868 HZ2 TRP 110 HZ2 TRP 110 -18.408 9.074 -7.753 869 HZ3 TRP 110 HZ3 TRP 110 -22.404 7.519 -7.470 870 HH2 TRP 110 HH2 TRP 110 -20.220 7.630 -8.650 871 H LEU 111 H LEU 111 -23.609 8.016 -1.853 872 HA LEU 111 HA LEU 111 -22.077 5.799 -3.061 873 1HB LEU 111 1HB LEU 111 -23.379 5.657 -0.918 874 2HB LEU 111 2HB LEU 111 -24.859 5.907 -1.840 875 HG LEU 111 HG LEU 111 -24.086 3.886 -3.258 876 1HD1 LEU 111 1HD1 LEU 111 -22.672 2.304 -1.804 877 2HD1 LEU 111 2HD1 LEU 111 -22.243 3.735 -0.867 878 3HD1 LEU 111 3HD1 LEU 111 -21.821 3.641 -2.577 879 1HD2 LEU 111 1HD2 LEU 111 -24.613 2.526 -0.835 880 2HD2 LEU 111 2HD2 LEU 111 -25.780 2.991 -2.073 881 3HD2 LEU 111 3HD2 LEU 111 -25.452 4.073 -0.720 882 H SER 112 H SER 112 -25.445 5.409 -3.609 883 HA SER 112 HA SER 112 -25.677 6.757 -6.148 884 1HB SER 112 1HB SER 112 -25.061 5.022 -7.626 885 2HB SER 112 2HB SER 112 -23.845 4.887 -6.356 886 HG SER 112 HG SER 112 -24.685 2.865 -6.720 887 H ARG 113 H ARG 113 -27.866 7.073 -6.013 888 HA ARG 113 HA ARG 113 -30.164 6.612 -5.688 889 1HB ARG 113 1HB ARG 113 -28.839 4.404 -7.175 890 2HB ARG 113 2HB ARG 113 -30.463 4.057 -6.582 891 1HG ARG 113 1HG ARG 113 -30.990 5.039 -8.612 892 2HG ARG 113 2HG ARG 113 -30.961 6.473 -7.585 893 1HD ARG 113 1HD ARG 113 -28.315 6.276 -8.277 894 2HD ARG 113 2HD ARG 113 -29.107 5.679 -9.748 895 HE ARG 113 HE ARG 113 -29.212 8.405 -8.765 896 1HH1 ARG 113 1HH1 ARG 113 -31.059 5.916 -10.350 897 2HH1 ARG 113 2HH1 ARG 113 -32.088 7.043 -11.162 898 1HH2 ARG 113 1HH2 ARG 113 -30.559 9.848 -9.831 899 2HH2 ARG 113 2HH2 ARG 113 -31.809 9.254 -10.873 900 HA PRO 114 HA PRO 114 -29.131 4.168 -1.790 901 1HB PRO 114 1HB PRO 114 -30.473 6.475 -0.501 902 2HB PRO 114 2HB PRO 114 -28.921 5.720 -0.099 903 1HG PRO 114 1HG PRO 114 -29.114 8.142 -1.269 904 2HG PRO 114 2HG PRO 114 -27.757 7.043 -1.548 905 1HD PRO 114 1HD PRO 114 -30.059 7.696 -3.315 906 2HD PRO 114 2HD PRO 114 -28.384 7.282 -3.738 907 H ARG 115 H ARG 115 -30.658 2.606 -1.617 908 HA ARG 115 HA ARG 115 -33.348 3.182 -0.762 909 1HB ARG 115 1HB ARG 115 -34.449 2.522 -2.886 910 2HB ARG 115 2HB ARG 115 -33.476 3.973 -3.081 911 1HG ARG 115 1HG ARG 115 -31.590 2.243 -3.700 912 2HG ARG 115 2HG ARG 115 -32.956 1.190 -4.067 913 1HD ARG 115 1HD ARG 115 -33.827 3.366 -5.351 914 2HD ARG 115 2HD ARG 115 -32.090 3.712 -5.425 915 HE ARG 115 HE ARG 115 -33.460 1.552 -6.823 916 1HH1 ARG 115 1HH1 ARG 115 -30.483 2.525 -5.306 917 2HH1 ARG 115 2HH1 ARG 115 -29.521 1.433 -6.242 918 1HH2 ARG 115 1HH2 ARG 115 -32.192 0.144 -8.026 919 2HH2 ARG 115 2HH2 ARG 115 -30.479 0.094 -7.770 920 H LEU 116 H LEU 116 -31.176 0.887 -2.379 921 HA LEU 116 HA LEU 116 -30.963 -1.454 -2.146 922 1HB LEU 116 1HB LEU 116 -31.458 -0.164 0.419 923 2HB LEU 116 2HB LEU 116 -32.047 -1.826 0.429 924 HG LEU 116 HG LEU 116 -29.688 -1.741 1.132 925 1HD1 LEU 116 1HD1 LEU 116 -30.672 -3.180 -1.219 926 2HD1 LEU 116 2HD1 LEU 116 -29.740 -3.779 0.152 927 3HD1 LEU 116 3HD1 LEU 116 -28.916 -3.018 -1.209 928 1HD2 LEU 116 1HD2 LEU 116 -28.592 0.031 0.178 929 2HD2 LEU 116 2HD2 LEU 116 -29.496 -0.088 -1.331 930 3HD2 LEU 116 3HD2 LEU 116 -28.152 -1.186 -1.020 931 H THR 117 H THR 117 -32.571 -3.312 -0.794 932 HA THR 117 HA THR 117 -35.317 -2.881 -1.902 933 HB THR 117 HB THR 117 -33.513 -5.301 -2.281 934 HG1 THR 117 HG1 THR 117 -34.461 -3.354 -4.112 935 1HG2 THR 117 1HG2 THR 117 -35.284 -6.250 -3.578 936 2HG2 THR 117 2HG2 THR 117 -36.198 -4.742 -3.560 937 3HG2 THR 117 3HG2 THR 117 -36.031 -5.690 -2.082 938 H GLN 118 H GLN 118 -33.422 -5.425 -0.218 939 HA GLN 118 HA GLN 118 -35.494 -5.402 1.944 940 1HB GLN 118 1HB GLN 118 -34.538 -7.584 0.125 941 2HB GLN 118 2HB GLN 118 -34.933 -8.021 1.787 942 1HG GLN 118 1HG GLN 118 -37.099 -6.549 1.269 943 2HG GLN 118 2HG GLN 118 -36.720 -7.017 -0.389 944 1HE2 GLN 118 1HE2 GLN 118 -36.294 -9.500 -0.650 945 2HE2 GLN 118 2HE2 GLN 118 -37.286 -10.537 0.256 946 H ASN 119 H ASN 119 -34.678 -6.202 4.002 947 HA ASN 119 HA ASN 119 -31.690 -6.064 4.205 948 1HB ASN 119 1HB ASN 119 -33.645 -4.501 5.339 949 2HB ASN 119 2HB ASN 119 -33.384 -5.698 6.607 950 1HD2 ASN 119 1HD2 ASN 119 -30.637 -6.194 6.397 951 2HD2 ASN 119 2HD2 ASN 119 -29.768 -4.769 6.703 952 1H GLY 201 1H GLY 201 -17.243 29.524 -14.599 953 2H GLY 201 2H GLY 201 -17.002 30.251 -13.084 954 3H GLY 201 3H GLY 201 -17.663 28.690 -13.181 955 1HA GLY 201 1HA GLY 201 -15.661 27.715 -13.775 956 2HA GLY 201 2HA GLY 201 -14.978 29.267 -14.259 957 H LYS 202 H LYS 202 -13.345 29.705 -12.839 958 HA LYS 202 HA LYS 202 -12.210 29.997 -10.787 959 1HB LYS 202 1HB LYS 202 -15.129 30.529 -10.157 960 2HB LYS 202 2HB LYS 202 -13.846 30.823 -8.983 961 1HG LYS 202 1HG LYS 202 -13.357 31.935 -11.681 962 2HG LYS 202 2HG LYS 202 -14.693 32.675 -10.799 963 1HD LYS 202 1HD LYS 202 -13.316 33.564 -9.195 964 2HD LYS 202 2HD LYS 202 -12.197 32.202 -9.254 965 1HE LYS 202 1HE LYS 202 -11.893 33.311 -11.768 966 2HE LYS 202 2HE LYS 202 -12.119 34.740 -10.741 967 1HZ LYS 202 1HZ LYS 202 -10.246 32.486 -10.210 968 2HZ LYS 202 2HZ LYS 202 -10.476 33.834 -9.202 969 3HZ LYS 202 3HZ LYS 202 -9.798 34.034 -10.746 970 H ALA 203 H ALA 203 -11.528 27.778 -10.518 971 HA ALA 203 HA ALA 203 -13.068 25.626 -9.538 972 1HB ALA 203 1HB ALA 203 -10.478 25.405 -8.450 973 2HB ALA 203 2HB ALA 203 -10.283 26.395 -9.897 974 3HB ALA 203 3HB ALA 203 -11.012 24.793 -10.016 975 HA PRO 204 HA PRO 204 -11.849 26.801 -5.071 976 1HB PRO 204 1HB PRO 204 -10.677 29.275 -4.677 977 2HB PRO 204 2HB PRO 204 -9.761 27.773 -4.892 978 1HG PRO 204 1HG PRO 204 -10.329 29.947 -6.834 979 2HG PRO 204 2HG PRO 204 -8.886 28.942 -6.654 980 1HD PRO 204 1HD PRO 204 -10.775 28.575 -8.596 981 2HD PRO 204 2HD PRO 204 -9.731 27.280 -7.975 982 H ARG 205 H ARG 205 -14.074 27.095 -4.740 983 HA ARG 205 HA ARG 205 -15.138 29.880 -5.074 984 1HB ARG 205 1HB ARG 205 -15.996 27.687 -6.316 985 2HB ARG 205 2HB ARG 205 -16.845 27.422 -4.794 986 1HG ARG 205 1HG ARG 205 -18.304 29.125 -5.176 987 2HG ARG 205 2HG ARG 205 -17.046 30.177 -5.825 988 1HD ARG 205 1HD ARG 205 -17.573 29.617 -7.966 989 2HD ARG 205 2HD ARG 205 -17.603 27.887 -7.575 990 HE ARG 205 HE ARG 205 -19.910 29.666 -7.601 991 1HH1 ARG 205 1HH1 ARG 205 -18.491 26.862 -6.104 992 2HH1 ARG 205 2HH1 ARG 205 -20.019 26.203 -5.634 993 1HH2 ARG 205 1HH2 ARG 205 -21.882 28.790 -6.979 994 2HH2 ARG 205 2HH2 ARG 205 -21.926 27.284 -6.124 995 H LYS 206 H LYS 206 -14.950 27.068 -2.919 996 HA LYS 206 HA LYS 206 -16.234 28.684 -0.750 997 1HB LYS 206 1HB LYS 206 -15.999 25.785 -1.478 998 2HB LYS 206 2HB LYS 206 -16.161 26.191 0.230 999 1HG LYS 206 1HG LYS 206 -18.130 27.712 -0.584 1000 2HG LYS 206 2HG LYS 206 -18.090 26.694 -2.024 1001 1HD LYS 206 1HD LYS 206 -19.655 25.661 -0.540 1002 2HD LYS 206 2HD LYS 206 -18.186 24.690 -0.440 1003 1HE LYS 206 1HE LYS 206 -18.402 24.996 1.821 1004 2HE LYS 206 2HE LYS 206 -17.754 26.617 1.502 1005 1HZ LYS 206 1HZ LYS 206 -20.595 25.770 1.643 1006 2HZ LYS 206 2HZ LYS 206 -20.125 27.233 0.919 1007 3HZ LYS 206 3HZ LYS 206 -19.814 26.963 2.566 1008 H GLN 207 H GLN 207 -15.012 29.230 1.040 1009 HA GLN 207 HA GLN 207 -12.140 28.943 0.981 1010 1HB GLN 207 1HB GLN 207 -13.671 30.735 2.053 1011 2HB GLN 207 2HB GLN 207 -13.872 29.591 3.380 1012 1HG GLN 207 1HG GLN 207 -11.728 29.880 4.127 1013 2HG GLN 207 2HG GLN 207 -11.079 30.068 2.498 1014 1HE2 GLN 207 1HE2 GLN 207 -10.839 32.207 1.683 1015 2HE2 GLN 207 2HE2 GLN 207 -11.273 33.595 2.559 1016 H LEU 208 H LEU 208 -12.026 26.527 0.803 1017 HA LEU 208 HA LEU 208 -11.706 24.386 1.750 1018 1HB LEU 208 1HB LEU 208 -10.749 26.479 3.487 1019 2HB LEU 208 2HB LEU 208 -11.366 25.156 4.477 1020 HG LEU 208 HG LEU 208 -9.702 24.383 2.138 1021 1HD1 LEU 208 1HD1 LEU 208 -7.646 24.754 3.671 1022 2HD1 LEU 208 2HD1 LEU 208 -8.666 25.912 4.525 1023 3HD1 LEU 208 3HD1 LEU 208 -8.293 26.156 2.819 1024 1HD2 LEU 208 1HD2 LEU 208 -8.823 23.175 4.505 1025 2HD2 LEU 208 2HD2 LEU 208 -9.929 22.476 3.324 1026 3HD2 LEU 208 3HD2 LEU 208 -10.565 23.347 4.719 1027 H ALA 209 H ALA 209 -12.485 23.048 3.856 1028 HA ALA 209 HA ALA 209 -15.102 23.878 4.898 1029 1HB ALA 209 1HB ALA 209 -16.396 22.293 3.671 1030 2HB ALA 209 2HB ALA 209 -14.960 21.424 3.129 1031 3HB ALA 209 3HB ALA 209 -15.332 23.015 2.464 1032 H THR 210 H THR 210 -16.067 21.934 6.182 1033 HA THR 210 HA THR 210 -13.831 20.300 7.337 1034 HB THR 210 HB THR 210 -14.492 22.169 8.790 1035 HG1 THR 210 HG1 THR 210 -14.153 19.980 9.649 1036 1HG2 THR 210 1HG2 THR 210 -17.073 21.630 9.623 1037 2HG2 THR 210 2HG2 THR 210 -17.159 21.333 7.886 1038 3HG2 THR 210 3HG2 THR 210 -16.617 22.900 8.488 1039 H LYS 211 H LYS 211 -15.173 19.061 5.359 1040 HA LYS 211 HA LYS 211 -17.312 17.440 6.698 1041 1HB LYS 211 1HB LYS 211 -17.799 18.856 4.625 1042 2HB LYS 211 2HB LYS 211 -16.732 17.769 3.736 1043 1HG LYS 211 1HG LYS 211 -18.344 16.200 3.595 1044 2HG LYS 211 2HG LYS 211 -18.629 16.265 5.334 1045 1HD LYS 211 1HD LYS 211 -20.191 18.048 5.116 1046 2HD LYS 211 2HD LYS 211 -19.691 18.384 3.458 1047 1HE LYS 211 1HE LYS 211 -21.622 17.148 3.042 1048 2HE LYS 211 2HE LYS 211 -20.447 15.823 3.130 1049 1HZ LYS 211 1HZ LYS 211 -22.100 15.241 4.667 1050 2HZ LYS 211 2HZ LYS 211 -22.258 16.828 5.249 1051 3HZ LYS 211 3HZ LYS 211 -20.875 15.919 5.628 1052 H ALA 212 H ALA 212 -14.319 17.316 4.807 1053 HA ALA 212 HA ALA 212 -12.856 15.516 4.357 1054 1HB ALA 212 1HB ALA 212 -14.104 14.178 6.752 1055 2HB ALA 212 2HB ALA 212 -13.225 15.693 6.964 1056 3HB ALA 212 3HB ALA 212 -12.401 14.280 6.306 1057 H ALA 213 H ALA 213 -14.364 15.026 2.463 1058 HA ALA 213 HA ALA 213 -16.340 12.909 2.733 1059 1HB ALA 213 1HB ALA 213 -16.798 14.177 0.875 1060 2HB ALA 213 2HB ALA 213 -15.688 13.065 0.073 1061 3HB ALA 213 3HB ALA 213 -15.107 14.626 0.653 1062 H ARG 214 H ARG 214 -14.650 11.471 3.930 1063 HA ARG 214 HA ARG 214 -13.025 9.938 1.926 1064 1HB ARG 214 1HB ARG 214 -12.710 10.473 4.900 1065 2HB ARG 214 2HB ARG 214 -11.709 9.318 4.020 1066 1HG ARG 214 1HG ARG 214 -11.996 12.235 3.246 1067 2HG ARG 214 2HG ARG 214 -10.676 11.606 4.232 1068 1HD ARG 214 1HD ARG 214 -9.613 11.234 2.245 1069 2HD ARG 214 2HD ARG 214 -10.727 9.867 2.056 1070 HE ARG 214 HE ARG 214 -11.899 11.148 0.453 1071 1HH1 ARG 214 1HH1 ARG 214 -9.992 13.211 2.509 1072 2HH1 ARG 214 2HH1 ARG 214 -10.384 14.642 1.622 1073 1HH2 ARG 214 1HH2 ARG 214 -12.393 13.020 -0.683 1074 2HH2 ARG 214 2HH2 ARG 214 -11.733 14.538 -0.172 1075 1HN MLZ 215 1HN MLZ 215 -12.685 7.568 2.858 1076 HA MLZ 215 HA MLZ 215 -15.277 6.300 2.949 1077 1HB MLZ 215 1HB MLZ 215 -12.394 5.592 2.999 1078 2HB MLZ 215 2HB MLZ 215 -13.468 4.401 3.734 1079 1HG MLZ 215 1HG MLZ 215 -14.480 5.476 1.193 1080 2HG MLZ 215 2HG MLZ 215 -14.350 3.802 1.731 1081 1HD MLZ 215 1HD MLZ 215 -12.078 5.507 0.662 1082 2HD MLZ 215 2HD MLZ 215 -11.921 3.847 1.237 1083 1HE MLZ 215 1HE MLZ 215 -13.998 4.387 -0.851 1084 2HE MLZ 215 2HE MLZ 215 -12.962 2.964 -0.632 1085 HZ MLZ 215 HZ MLZ 215 -11.064 4.243 -1.336 1086 1HCM MLZ 215 1HCM MLZ 215 -12.593 3.208 -3.014 1087 2HCM MLZ 215 2HCM MLZ 215 -11.566 4.502 -3.618 1088 3HCM MLZ 215 3HCM MLZ 215 -13.257 4.820 -3.250 1089 H SER 216 H SER 216 -16.565 6.222 4.741 1090 HA SER 216 HA SER 216 -17.217 6.021 7.001 1091 1HB SER 216 1HB SER 216 -14.728 7.301 7.950 1092 2HB SER 216 2HB SER 216 -15.523 8.168 6.637 1093 HG SER 216 HG SER 216 -17.366 8.304 7.842 1094 H ALA 217 H ALA 217 -15.739 5.654 9.326 1095 HA ALA 217 HA ALA 217 -14.261 3.102 8.766 1096 1HB ALA 217 1HB ALA 217 -13.533 5.564 10.121 1097 2HB ALA 217 2HB ALA 217 -12.514 4.177 9.737 1098 3HB ALA 217 3HB ALA 217 -13.437 4.204 11.240 1099 HA PRO 218 HA PRO 218 -16.919 1.079 11.611 1100 1HB PRO 218 1HB PRO 218 -15.162 -0.302 13.255 1101 2HB PRO 218 2HB PRO 218 -15.614 -0.824 11.623 1102 1HG PRO 218 1HG PRO 218 -13.162 0.564 12.556 1103 2HG PRO 218 2HG PRO 218 -13.354 -0.658 11.298 1104 1HD PRO 218 1HD PRO 218 -13.019 1.999 10.798 1105 2HD PRO 218 2HD PRO 218 -13.884 0.895 9.717 1106 H ALA 219 H ALA 219 -14.159 2.732 13.122 1107 HA ALA 219 HA ALA 219 -14.015 3.952 15.141 1108 1HB ALA 219 1HB ALA 219 -16.779 4.264 14.030 1109 2HB ALA 219 2HB ALA 219 -15.535 5.488 14.288 1110 3HB ALA 219 3HB ALA 219 -16.482 4.891 15.651 1111 H THR 220 H THR 220 -13.561 1.981 16.402 1112 HA THR 220 HA THR 220 -15.390 1.593 18.602 1113 HB THR 220 HB THR 220 -16.606 0.406 16.798 1114 HG1 THR 220 HG1 THR 220 -16.852 -0.541 18.756 1115 1HG2 THR 220 1HG2 THR 220 -14.636 -0.121 15.400 1116 2HG2 THR 220 2HG2 THR 220 -15.579 -1.572 15.739 1117 3HG2 THR 220 3HG2 THR 220 -14.081 -1.269 16.619 1118 H GLY 221 H GLY 221 -14.628 -0.549 19.840 1119 1HA GLY 221 1HA GLY 221 -12.074 -1.676 19.413 1120 2HA GLY 221 2HA GLY 221 -11.835 -0.234 20.400 1121 1H MET 1 1H MET 1 1.115 -12.168 9.561 1122 2H MET 1 2H MET 1 0.471 -12.876 8.158 1123 3H MET 1 3H MET 1 -0.136 -11.391 8.716 1124 HA MET 1 HA MET 1 1.339 -11.079 6.799 1125 1HB MET 1 1HB MET 1 2.102 -10.116 9.572 1126 2HB MET 1 2HB MET 1 2.807 -9.428 8.110 1127 1HG MET 1 1HG MET 1 0.207 -9.306 7.429 1128 2HG MET 1 2HG MET 1 0.046 -9.178 9.179 1129 1HE MET 1 1HE MET 1 0.328 -6.455 6.216 1130 2HE MET 1 2HE MET 1 0.910 -8.109 6.032 1131 3HE MET 1 3HE MET 1 2.058 -6.771 6.082 1132 H PHE 2 H PHE 2 2.138 -13.608 6.885 1133 HA PHE 2 HA PHE 2 5.004 -13.519 6.606 1134 1HB PHE 2 1HB PHE 2 5.447 -15.054 8.603 1135 2HB PHE 2 2HB PHE 2 5.020 -13.395 9.015 1136 HD1 PHE 2 HD1 PHE 2 2.981 -12.876 10.166 1137 HD2 PHE 2 HD2 PHE 2 3.735 -16.872 8.786 1138 HE1 PHE 2 HE1 PHE 2 1.051 -13.696 11.489 1139 HE2 PHE 2 HE2 PHE 2 1.805 -17.693 10.110 1140 HZ PHE 2 HZ PHE 2 0.463 -16.104 11.461 1141 H ASN 3 H ASN 3 5.568 -15.201 5.278 1142 HA ASN 3 HA ASN 3 3.754 -17.590 5.184 1143 1HB ASN 3 1HB ASN 3 4.920 -15.800 3.056 1144 2HB ASN 3 2HB ASN 3 4.533 -17.476 2.665 1145 1HD2 ASN 3 1HD2 ASN 3 3.045 -14.516 4.076 1146 2HD2 ASN 3 2HD2 ASN 3 1.470 -14.880 3.558 1147 H ASP 4 H ASP 4 4.888 -19.544 4.289 1148 HA ASP 4 HA ASP 4 7.271 -20.192 5.627 1149 1HB ASP 4 1HB ASP 4 6.049 -21.210 3.037 1150 2HB ASP 4 2HB ASP 4 7.342 -22.045 3.897 1151 H ARG 5 H ARG 5 6.850 -18.381 2.671 1152 HA ARG 5 HA ARG 5 9.598 -18.764 1.729 1153 1HB ARG 5 1HB ARG 5 7.372 -16.824 0.997 1154 2HB ARG 5 2HB ARG 5 8.849 -17.060 0.063 1155 1HG ARG 5 1HG ARG 5 7.364 -19.536 0.716 1156 2HG ARG 5 2HG ARG 5 6.541 -18.436 -0.390 1157 1HD ARG 5 1HD ARG 5 8.972 -18.355 -1.520 1158 2HD ARG 5 2HD ARG 5 9.081 -19.964 -0.781 1159 HE ARG 5 HE ARG 5 7.455 -20.694 -2.332 1160 1HH1 ARG 5 1HH1 ARG 5 7.334 -17.233 -1.974 1161 2HH1 ARG 5 2HH1 ARG 5 6.130 -17.038 -3.201 1162 1HH2 ARG 5 1HH2 ARG 5 5.893 -20.416 -3.919 1163 2HH2 ARG 5 2HH2 ARG 5 5.319 -18.825 -4.295 1164 H VAL 6 H VAL 6 7.775 -16.175 3.388 1165 HA VAL 6 HA VAL 6 10.343 -15.074 4.388 1166 HB VAL 6 HB VAL 6 9.688 -12.815 3.507 1167 1HG1 VAL 6 1HG1 VAL 6 10.388 -13.228 1.248 1168 2HG1 VAL 6 2HG1 VAL 6 9.768 -14.878 1.292 1169 3HG1 VAL 6 3HG1 VAL 6 11.184 -14.443 2.249 1170 1HG2 VAL 6 1HG2 VAL 6 7.264 -13.214 3.364 1171 2HG2 VAL 6 2HG2 VAL 6 7.528 -14.416 2.101 1172 3HG2 VAL 6 3HG2 VAL 6 7.899 -12.719 1.795 1173 H ILE 7 H ILE 7 9.688 -12.981 5.776 1174 HA ILE 7 HA ILE 7 7.029 -13.267 7.055 1175 HB ILE 7 HB ILE 7 8.431 -14.920 8.189 1176 1HG1 ILE 7 1HG1 ILE 7 8.426 -12.526 10.022 1177 2HG1 ILE 7 2HG1 ILE 7 6.916 -13.275 9.504 1178 1HG2 ILE 7 1HG2 ILE 7 10.494 -13.127 7.595 1179 2HG2 ILE 7 2HG2 ILE 7 10.643 -14.617 8.527 1180 3HG2 ILE 7 3HG2 ILE 7 10.369 -13.083 9.353 1181 1HD1 ILE 7 1HD1 ILE 7 7.959 -15.500 10.279 1182 2HD1 ILE 7 2HD1 ILE 7 7.461 -14.372 11.539 1183 3HD1 ILE 7 3HD1 ILE 7 9.164 -14.509 11.102 1184 H VAL 8 H VAL 8 6.741 -11.491 8.735 1185 HA VAL 8 HA VAL 8 8.184 -9.042 7.819 1186 HB VAL 8 HB VAL 8 5.693 -9.220 7.615 1187 1HG1 VAL 8 1HG1 VAL 8 5.275 -8.830 10.510 1188 2HG1 VAL 8 2HG1 VAL 8 5.821 -10.447 10.071 1189 3HG1 VAL 8 3HG1 VAL 8 4.347 -9.791 9.360 1190 1HG2 VAL 8 1HG2 VAL 8 6.909 -7.166 9.467 1191 2HG2 VAL 8 2HG2 VAL 8 5.221 -7.070 8.964 1192 3HG2 VAL 8 3HG2 VAL 8 6.506 -6.996 7.758 1193 H LYS 9 H LYS 9 9.651 -8.149 9.180 1194 HA LYS 9 HA LYS 9 9.352 -8.616 12.120 1195 1HB LYS 9 1HB LYS 9 11.851 -8.582 10.398 1196 2HB LYS 9 2HB LYS 9 11.844 -8.749 12.152 1197 1HG LYS 9 1HG LYS 9 10.014 -10.670 11.231 1198 2HG LYS 9 2HG LYS 9 11.383 -10.771 10.123 1199 1HD LYS 9 1HD LYS 9 12.890 -10.825 12.167 1200 2HD LYS 9 2HD LYS 9 11.432 -11.016 13.141 1201 1HE LYS 9 1HE LYS 9 10.865 -13.084 11.946 1202 2HE LYS 9 2HE LYS 9 12.271 -12.877 10.886 1203 1HZ LYS 9 1HZ LYS 9 13.664 -12.809 12.913 1204 2HZ LYS 9 2HZ LYS 9 12.880 -14.302 12.710 1205 3HZ LYS 9 3HZ LYS 9 12.295 -13.183 13.846 1206 H LYS 10 H LYS 10 10.114 -5.129 12.638 1207 HA LYS 10 HA LYS 10 9.688 -6.144 14.696 1208 1HB LYS 10 1HB LYS 10 7.937 -7.285 12.636 1209 2HB LYS 10 2HB LYS 10 8.112 -8.328 14.047 1210 1HG LYS 10 1HG LYS 10 7.252 -6.704 15.508 1211 2HG LYS 10 2HG LYS 10 7.592 -5.382 14.392 1212 1HD LYS 10 1HD LYS 10 5.177 -5.865 14.450 1213 2HD LYS 10 2HD LYS 10 5.845 -6.238 12.860 1214 1HE LYS 10 1HE LYS 10 4.746 -8.238 13.186 1215 2HE LYS 10 2HE LYS 10 6.191 -8.638 14.134 1216 1HZ LYS 10 1HZ LYS 10 4.229 -8.949 15.489 1217 2HZ LYS 10 2HZ LYS 10 3.694 -7.373 15.150 1218 3HZ LYS 10 3HZ LYS 10 5.099 -7.613 16.074 1219 H SER 11 H SER 11 12.171 -6.775 14.096 1220 HA SER 11 HA SER 11 12.436 -9.749 14.225 1221 1HB SER 11 1HB SER 11 14.418 -9.427 13.059 1222 2HB SER 11 2HB SER 11 13.573 -7.968 12.549 1223 HG SER 11 HG SER 11 15.755 -7.679 13.397 1224 HA PRO 12 HA PRO 12 14.289 -9.903 18.214 1225 1HB PRO 12 1HB PRO 12 17.102 -9.960 17.236 1226 2HB PRO 12 2HB PRO 12 16.241 -11.137 18.244 1227 1HG PRO 12 1HG PRO 12 16.819 -11.601 15.663 1228 2HG PRO 12 2HG PRO 12 15.360 -12.231 16.439 1229 1HD PRO 12 1HD PRO 12 15.660 -9.996 14.507 1230 2HD PRO 12 2HD PRO 12 14.301 -11.113 14.748 1231 H LEU 13 H LEU 13 16.558 -7.976 16.206 1232 HA LEU 13 HA LEU 13 17.172 -6.140 18.376 1233 1HB LEU 13 1HB LEU 13 18.466 -6.882 16.209 1234 2HB LEU 13 2HB LEU 13 17.564 -5.575 15.446 1235 HG LEU 13 HG LEU 13 18.644 -4.713 17.993 1236 1HD1 LEU 13 1HD1 LEU 13 20.445 -6.201 17.765 1237 2HD1 LEU 13 2HD1 LEU 13 21.052 -4.726 17.010 1238 3HD1 LEU 13 3HD1 LEU 13 20.460 -6.052 16.008 1239 1HD2 LEU 13 1HD2 LEU 13 19.870 -3.203 16.117 1240 2HD2 LEU 13 2HD2 LEU 13 18.192 -2.945 16.596 1241 3HD2 LEU 13 3HD2 LEU 13 18.562 -3.869 15.140 1242 H GLY 14 H GLY 14 15.291 -5.829 15.340 1243 1HA GLY 14 1HA GLY 14 13.043 -4.574 15.978 1244 2HA GLY 14 2HA GLY 14 14.174 -3.275 16.357 1245 H GLY 15 H GLY 15 12.894 -2.160 14.590 1246 1HA GLY 15 1HA GLY 15 13.177 -1.173 12.444 1247 2HA GLY 15 2HA GLY 15 14.350 -2.431 12.052 1248 H TYR 16 H TYR 16 11.673 -1.354 10.809 1249 HA TYR 16 HA TYR 16 10.168 -3.913 10.661 1250 1HB TYR 16 1HB TYR 16 9.549 -1.160 10.691 1251 2HB TYR 16 2HB TYR 16 9.160 -1.714 9.063 1252 HD1 TYR 16 HD1 TYR 16 7.942 -4.104 8.999 1253 HD2 TYR 16 HD2 TYR 16 7.913 -1.393 12.330 1254 HE1 TYR 16 HE1 TYR 16 5.882 -5.184 9.860 1255 HE2 TYR 16 HE2 TYR 16 5.853 -2.473 13.191 1256 HH TYR 16 HH TYR 16 3.911 -4.431 11.382 1257 H GLY 17 H GLY 17 11.586 -5.145 9.299 1258 1HA GLY 17 1HA GLY 17 11.671 -4.187 6.471 1259 2HA GLY 17 2HA GLY 17 13.056 -5.005 7.195 1260 H VAL 18 H VAL 18 12.543 -6.524 5.268 1261 HA VAL 18 HA VAL 18 10.371 -8.436 6.063 1262 HB VAL 18 HB VAL 18 9.944 -7.464 3.902 1263 1HG1 VAL 18 1HG1 VAL 18 11.850 -6.461 3.095 1264 2HG1 VAL 18 2HG1 VAL 18 11.897 -7.937 2.132 1265 3HG1 VAL 18 3HG1 VAL 18 12.883 -7.799 3.584 1266 1HG2 VAL 18 1HG2 VAL 18 10.217 -10.165 4.248 1267 2HG2 VAL 18 2HG2 VAL 18 11.248 -9.890 2.843 1268 3HG2 VAL 18 3HG2 VAL 18 9.551 -9.412 2.798 1269 H PHE 19 H PHE 19 11.076 -10.388 6.808 1270 HA PHE 19 HA PHE 19 13.962 -11.017 6.653 1271 1HB PHE 19 1HB PHE 19 11.664 -11.553 8.362 1272 2HB PHE 19 2HB PHE 19 12.540 -13.040 8.001 1273 HD1 PHE 19 HD1 PHE 19 14.562 -13.533 9.106 1274 HD2 PHE 19 HD2 PHE 19 13.047 -9.515 9.147 1275 HE1 PHE 19 HE1 PHE 19 16.336 -12.880 10.712 1276 HE2 PHE 19 HE2 PHE 19 14.819 -8.862 10.753 1277 HZ PHE 19 HZ PHE 19 16.464 -10.544 11.536 1278 H ALA 20 H ALA 20 14.637 -13.231 6.016 1279 HA ALA 20 HA ALA 20 12.862 -14.349 3.871 1280 1HB ALA 20 1HB ALA 20 15.475 -13.262 3.834 1281 2HB ALA 20 2HB ALA 20 14.664 -14.107 2.515 1282 3HB ALA 20 3HB ALA 20 15.680 -15.003 3.644 1283 H ARG 21 H ARG 21 11.903 -16.027 5.108 1284 HA ARG 21 HA ARG 21 13.310 -17.748 6.929 1285 1HB ARG 21 1HB ARG 21 10.705 -17.318 5.953 1286 2HB ARG 21 2HB ARG 21 11.085 -18.980 5.500 1287 1HG ARG 21 1HG ARG 21 10.375 -19.405 7.639 1288 2HG ARG 21 2HG ARG 21 12.041 -18.978 8.027 1289 1HD ARG 21 1HD ARG 21 11.351 -16.640 8.450 1290 2HD ARG 21 2HD ARG 21 9.675 -17.064 8.052 1291 HE ARG 21 HE ARG 21 9.519 -18.132 10.158 1292 1HH1 ARG 21 1HH1 ARG 21 12.849 -17.691 9.244 1293 2HH1 ARG 21 2HH1 ARG 21 13.456 -18.273 10.755 1294 1HH2 ARG 21 1HH2 ARG 21 10.331 -18.883 12.112 1295 2HH2 ARG 21 2HH2 ARG 21 12.043 -18.943 12.368 1296 H LYS 22 H LYS 22 13.183 -17.586 3.465 1297 HA LYS 22 HA LYS 22 14.148 -20.360 3.093 1298 1HB LYS 22 1HB LYS 22 12.868 -18.212 1.597 1299 2HB LYS 22 2HB LYS 22 14.201 -18.915 0.687 1300 1HG LYS 22 1HG LYS 22 13.239 -21.102 0.799 1301 2HG LYS 22 2HG LYS 22 12.097 -20.611 2.048 1302 1HD LYS 22 1HD LYS 22 10.743 -20.563 0.150 1303 2HD LYS 22 2HD LYS 22 11.296 -18.889 0.217 1304 1HE LYS 22 1HE LYS 22 12.943 -19.270 -1.484 1305 2HE LYS 22 2HE LYS 22 12.747 -21.028 -1.374 1306 1HZ LYS 22 1HZ LYS 22 10.426 -20.758 -2.044 1307 2HZ LYS 22 2HZ LYS 22 11.471 -20.140 -3.231 1308 3HZ LYS 22 3HZ LYS 22 10.648 -19.080 -2.191 1309 H SER 23 H SER 23 17.453 -19.350 1.766 1310 HA SER 23 HA SER 23 15.068 -21.112 1.399 1311 1HB SER 23 1HB SER 23 17.173 -22.144 2.125 1312 2HB SER 23 2HB SER 23 16.815 -22.651 0.474 1313 HG SER 23 HG SER 23 18.622 -21.790 -0.087 1314 H PHE 24 H PHE 24 16.970 -18.685 -0.177 1315 HA PHE 24 HA PHE 24 15.503 -19.221 -2.733 1316 1HB PHE 24 1HB PHE 24 16.551 -16.773 -1.300 1317 2HB PHE 24 2HB PHE 24 16.160 -16.706 -3.017 1318 HD1 PHE 24 HD1 PHE 24 14.860 -16.515 0.306 1319 HD2 PHE 24 HD2 PHE 24 13.808 -17.549 -3.729 1320 HE1 PHE 24 HE1 PHE 24 12.459 -16.248 0.864 1321 HE2 PHE 24 HE2 PHE 24 11.406 -17.282 -3.169 1322 HZ PHE 24 HZ PHE 24 10.732 -16.631 -0.873 1323 H GLU 25 H GLU 25 16.758 -18.466 -4.715 1324 HA GLU 25 HA GLU 25 19.604 -19.348 -4.482 1325 1HB GLU 25 1HB GLU 25 17.665 -20.318 -6.025 1326 2HB GLU 25 2HB GLU 25 18.106 -18.960 -7.059 1327 1HG GLU 25 1HG GLU 25 20.539 -20.133 -6.226 1328 2HG GLU 25 2HG GLU 25 19.482 -21.469 -6.682 1329 H LYS 26 H LYS 26 20.661 -18.196 -6.754 1330 HA LYS 26 HA LYS 26 20.973 -15.406 -5.935 1331 1HB LYS 26 1HB LYS 26 22.769 -16.977 -6.772 1332 2HB LYS 26 2HB LYS 26 22.021 -16.895 -8.367 1333 1HG LYS 26 1HG LYS 26 22.366 -14.469 -8.431 1334 2HG LYS 26 2HG LYS 26 23.047 -14.505 -6.804 1335 1HD LYS 26 1HD LYS 26 24.929 -15.819 -7.544 1336 2HD LYS 26 2HD LYS 26 24.199 -16.070 -9.130 1337 1HE LYS 26 1HE LYS 26 24.225 -13.294 -8.865 1338 2HE LYS 26 2HE LYS 26 25.775 -13.802 -8.167 1339 1HZ LYS 26 1HZ LYS 26 24.658 -14.502 -10.829 1340 2HZ LYS 26 2HZ LYS 26 25.975 -15.324 -10.141 1341 3HZ LYS 26 3HZ LYS 26 26.101 -13.669 -10.499 1342 H GLY 27 H GLY 27 18.543 -16.840 -7.664 1343 1HA GLY 27 1HA GLY 27 17.827 -14.304 -8.949 1344 2HA GLY 27 2HA GLY 27 18.134 -15.629 -10.072 1345 H GLU 28 H GLU 28 16.034 -14.522 -7.458 1346 HA GLU 28 HA GLU 28 13.877 -16.259 -8.526 1347 1HB GLU 28 1HB GLU 28 15.075 -16.365 -5.740 1348 2HB GLU 28 2HB GLU 28 13.486 -17.035 -6.111 1349 1HG GLU 28 1HG GLU 28 14.755 -18.261 -8.052 1350 2HG GLU 28 2HG GLU 28 16.188 -17.927 -7.080 1351 H LEU 29 H LEU 29 11.796 -15.435 -8.030 1352 HA LEU 29 HA LEU 29 11.730 -12.623 -7.157 1353 1HB LEU 29 1HB LEU 29 10.490 -13.830 -9.112 1354 2HB LEU 29 2HB LEU 29 9.394 -14.412 -7.862 1355 HG LEU 29 HG LEU 29 8.577 -12.319 -8.929 1356 1HD1 LEU 29 1HD1 LEU 29 8.415 -12.975 -6.352 1357 2HD1 LEU 29 2HD1 LEU 29 7.788 -11.437 -6.944 1358 3HD1 LEU 29 3HD1 LEU 29 9.369 -11.503 -6.164 1359 1HD2 LEU 29 1HD2 LEU 29 11.277 -11.573 -8.748 1360 2HD2 LEU 29 2HD2 LEU 29 10.436 -10.528 -7.603 1361 3HD2 LEU 29 3HD2 LEU 29 9.939 -10.563 -9.295 1362 H VAL 30 H VAL 30 11.384 -12.088 -5.043 1363 HA VAL 30 HA VAL 30 10.545 -14.111 -3.089 1364 HB VAL 30 HB VAL 30 11.098 -11.124 -2.903 1365 1HG1 VAL 30 1HG1 VAL 30 11.568 -11.784 -0.468 1366 2HG1 VAL 30 2HG1 VAL 30 10.720 -13.289 -0.826 1367 3HG1 VAL 30 3HG1 VAL 30 9.873 -11.747 -0.956 1368 1HG2 VAL 30 1HG2 VAL 30 12.849 -13.561 -2.473 1369 2HG2 VAL 30 2HG2 VAL 30 13.305 -11.925 -1.998 1370 3HG2 VAL 30 3HG2 VAL 30 13.056 -12.311 -3.700 1371 H GLU 31 H GLU 31 9.258 -10.936 -4.151 1372 HA GLU 31 HA GLU 31 6.501 -11.921 -3.986 1373 1HB GLU 31 1HB GLU 31 5.896 -10.355 -2.156 1374 2HB GLU 31 2HB GLU 31 7.126 -11.499 -1.620 1375 1HG GLU 31 1HG GLU 31 8.670 -9.477 -2.645 1376 2HG GLU 31 2HG GLU 31 7.305 -8.577 -1.982 1377 H GLU 32 H GLU 32 4.987 -9.853 -4.270 1378 HA GLU 32 HA GLU 32 6.216 -7.561 -5.612 1379 1HB GLU 32 1HB GLU 32 5.242 -8.154 -7.835 1380 2HB GLU 32 2HB GLU 32 6.432 -9.342 -7.304 1381 1HG GLU 32 1HG GLU 32 4.373 -10.572 -6.266 1382 2HG GLU 32 2HG GLU 32 3.431 -9.576 -7.375 1383 H CYS 33 H CYS 33 4.668 -5.896 -5.978 1384 HA CYS 33 HA CYS 33 1.807 -6.489 -5.431 1385 1HB CYS 33 1HB CYS 33 3.504 -5.762 -3.410 1386 2HB CYS 33 2HB CYS 33 2.959 -4.179 -3.962 1387 HG CYS 33 HG CYS 33 0.470 -5.634 -3.731 1388 H LEU 34 H LEU 34 1.078 -3.741 -5.131 1389 HA LEU 34 HA LEU 34 1.674 -2.744 -7.890 1390 1HB LEU 34 1HB LEU 34 -0.626 -2.168 -5.984 1391 2HB LEU 34 2HB LEU 34 -0.524 -1.651 -7.667 1392 HG LEU 34 HG LEU 34 -0.576 -4.529 -6.704 1393 1HD1 LEU 34 1HD1 LEU 34 -2.643 -2.650 -7.808 1394 2HD1 LEU 34 2HD1 LEU 34 -2.788 -3.813 -6.490 1395 3HD1 LEU 34 3HD1 LEU 34 -2.763 -4.373 -8.162 1396 1HD2 LEU 34 1HD2 LEU 34 -0.034 -3.221 -9.322 1397 2HD2 LEU 34 2HD2 LEU 34 -1.071 -4.647 -9.351 1398 3HD2 LEU 34 3HD2 LEU 34 0.559 -4.756 -8.688 1399 H CYS 35 H CYS 35 1.211 -0.169 -7.853 1400 HA CYS 35 HA CYS 35 2.462 1.074 -5.448 1401 1HB CYS 35 1HB CYS 35 3.444 1.254 -8.323 1402 2HB CYS 35 2HB CYS 35 4.086 2.210 -6.988 1403 HG CYS 35 HG CYS 35 5.472 0.273 -6.333 1404 H ILE 36 H ILE 36 2.488 3.580 -5.834 1405 HA ILE 36 HA ILE 36 -0.044 4.341 -7.261 1406 HB ILE 36 HB ILE 36 1.320 5.584 -4.842 1407 1HG1 ILE 36 1HG1 ILE 36 -1.175 3.869 -5.045 1408 2HG1 ILE 36 2HG1 ILE 36 0.370 3.348 -4.373 1409 1HG2 ILE 36 1HG2 ILE 36 -1.522 6.103 -5.581 1410 2HG2 ILE 36 2HG2 ILE 36 -0.279 6.887 -6.555 1411 3HG2 ILE 36 3HG2 ILE 36 -0.347 7.173 -4.816 1412 1HD1 ILE 36 1HD1 ILE 36 0.173 4.740 -2.500 1413 2HD1 ILE 36 2HD1 ILE 36 -1.495 4.226 -2.752 1414 3HD1 ILE 36 3HD1 ILE 36 -0.971 5.818 -3.299 1415 H VAL 37 H VAL 37 0.308 5.685 -8.995 1416 HA VAL 37 HA VAL 37 2.980 6.962 -9.259 1417 HB VAL 37 HB VAL 37 0.676 6.681 -11.224 1418 1HG1 VAL 37 1HG1 VAL 37 3.621 7.056 -11.797 1419 2HG1 VAL 37 2HG1 VAL 37 2.521 8.423 -11.620 1420 3HG1 VAL 37 3HG1 VAL 37 2.264 7.246 -12.909 1421 1HG2 VAL 37 1HG2 VAL 37 1.749 4.697 -12.044 1422 2HG2 VAL 37 2HG2 VAL 37 1.634 4.505 -10.294 1423 3HG2 VAL 37 3HG2 VAL 37 3.167 4.972 -11.031 1424 H ARG 38 H ARG 38 2.883 8.878 -8.062 1425 HA ARG 38 HA ARG 38 0.708 10.806 -8.806 1426 1HB ARG 38 1HB ARG 38 2.180 10.177 -6.243 1427 2HB ARG 38 2HB ARG 38 1.404 11.745 -6.458 1428 1HG ARG 38 1HG ARG 38 0.054 9.034 -6.644 1429 2HG ARG 38 2HG ARG 38 -0.144 10.211 -5.346 1430 1HD ARG 38 1HD ARG 38 -1.873 11.075 -6.544 1431 2HD ARG 38 2HD ARG 38 -0.676 11.636 -7.724 1432 HE ARG 38 HE ARG 38 -1.350 8.801 -8.001 1433 1HH1 ARG 38 1HH1 ARG 38 -2.185 12.066 -8.875 1434 2HH1 ARG 38 2HH1 ARG 38 -2.994 11.587 -10.326 1435 1HH2 ARG 38 1HH2 ARG 38 -2.406 8.205 -9.890 1436 2HH2 ARG 38 2HH2 ARG 38 -3.120 9.419 -10.898 1437 H HIS 39 H HIS 39 1.719 13.145 -7.943 1438 HA HIS 39 HA HIS 39 4.195 13.471 -9.583 1439 1HB HIS 39 1HB HIS 39 2.074 15.415 -8.594 1440 2HB HIS 39 2HB HIS 39 3.419 15.845 -9.651 1441 HD1 HIS 39 HD1 HIS 39 0.013 15.247 -9.979 1442 HD2 HIS 39 HD2 HIS 39 3.317 13.657 -11.963 1443 HE1 HIS 39 HE1 HIS 39 -0.847 14.317 -12.172 1444 H ASN 40 H ASN 40 5.097 15.885 -8.555 1445 HA ASN 40 HA ASN 40 6.249 15.018 -5.969 1446 1HB ASN 40 1HB ASN 40 6.784 17.406 -7.778 1447 2HB ASN 40 2HB ASN 40 7.811 16.871 -6.448 1448 1HD2 ASN 40 1HD2 ASN 40 7.940 16.866 -9.654 1449 2HD2 ASN 40 2HD2 ASN 40 8.607 15.337 -9.967 1450 H ASP 41 H ASP 41 6.648 18.084 -5.467 1451 HA ASP 41 HA ASP 41 5.608 19.718 -4.141 1452 1HB ASP 41 1HB ASP 41 3.142 18.626 -5.549 1453 2HB ASP 41 2HB ASP 41 3.308 20.224 -4.827 1454 H ASP 42 H ASP 42 2.637 19.153 -3.302 1455 HA ASP 42 HA ASP 42 2.981 18.403 -0.673 1456 1HB ASP 42 1HB ASP 42 0.740 17.816 -2.633 1457 2HB ASP 42 2HB ASP 42 0.569 17.610 -0.890 1458 H TRP 43 H TRP 43 2.550 16.156 -3.420 1459 HA TRP 43 HA TRP 43 2.317 13.738 -1.955 1460 1HB TRP 43 1HB TRP 43 1.946 13.988 -4.376 1461 2HB TRP 43 2HB TRP 43 3.653 14.364 -4.616 1462 HD1 TRP 43 HD1 TRP 43 5.225 12.391 -5.022 1463 HE1 TRP 43 HE1 TRP 43 5.024 9.826 -4.865 1464 HE3 TRP 43 HE3 TRP 43 0.602 12.000 -2.893 1465 HZ2 TRP 43 HZ2 TRP 43 3.149 7.867 -3.954 1466 HZ3 TRP 43 HZ3 TRP 43 -0.365 9.775 -2.392 1467 HH2 TRP 43 HH2 TRP 43 0.900 7.710 -2.918 1468 H GLY 44 H GLY 44 5.250 15.398 -3.156 1469 1HA GLY 44 1HA GLY 44 7.083 13.442 -2.107 1470 2HA GLY 44 2HA GLY 44 7.509 15.079 -2.602 1471 H THR 45 H THR 45 5.344 16.080 -0.665 1472 HA THR 45 HA THR 45 7.143 16.291 1.656 1473 HB THR 45 HB THR 45 4.345 17.391 1.232 1474 HG1 THR 45 HG1 THR 45 5.641 19.254 0.483 1475 1HG2 THR 45 1HG2 THR 45 6.707 18.501 2.774 1476 2HG2 THR 45 2HG2 THR 45 5.416 17.551 3.510 1477 3HG2 THR 45 3HG2 THR 45 5.052 19.113 2.777 1478 H ALA 46 H ALA 46 3.639 15.545 1.377 1479 HA ALA 46 HA ALA 46 3.340 14.421 3.958 1480 1HB ALA 46 1HB ALA 46 1.413 15.002 2.686 1481 2HB ALA 46 2HB ALA 46 1.374 13.239 2.734 1482 3HB ALA 46 3HB ALA 46 1.955 14.069 1.290 1483 H LEU 47 H LEU 47 3.740 12.651 0.857 1484 HA LEU 47 HA LEU 47 4.344 10.170 2.344 1485 1HB LEU 47 1HB LEU 47 3.937 10.983 -0.545 1486 2HB LEU 47 2HB LEU 47 4.511 9.370 -0.129 1487 HG LEU 47 HG LEU 47 2.093 9.300 -0.371 1488 1HD1 LEU 47 1HD1 LEU 47 2.233 9.321 2.588 1489 2HD1 LEU 47 2HD1 LEU 47 3.446 8.330 1.778 1490 3HD1 LEU 47 3HD1 LEU 47 1.731 8.033 1.493 1491 1HD2 LEU 47 1HD2 LEU 47 1.883 11.336 1.851 1492 2HD2 LEU 47 2HD2 LEU 47 0.601 10.739 0.797 1493 3HD2 LEU 47 3HD2 LEU 47 1.855 11.796 0.149 1494 H GLU 48 H GLU 48 6.331 11.955 2.946 1495 HA GLU 48 HA GLU 48 8.568 11.613 1.041 1496 1HB GLU 48 1HB GLU 48 9.695 13.118 2.665 1497 2HB GLU 48 2HB GLU 48 8.112 13.753 2.217 1498 1HG GLU 48 1HG GLU 48 7.597 13.805 4.411 1499 2HG GLU 48 2HG GLU 48 7.636 12.042 4.400 1500 H ASP 49 H ASP 49 7.982 9.098 1.771 1501 HA ASP 49 HA ASP 49 10.289 8.311 3.432 1502 1HB ASP 49 1HB ASP 49 7.485 8.408 4.342 1503 2HB ASP 49 2HB ASP 49 8.256 6.845 4.612 1504 H TYR 50 H TYR 50 7.266 6.571 2.733 1505 HA TYR 50 HA TYR 50 8.810 4.441 1.372 1506 1HB TYR 50 1HB TYR 50 5.811 4.625 1.811 1507 2HB TYR 50 2HB TYR 50 6.790 3.170 1.652 1508 HD1 TYR 50 HD1 TYR 50 4.836 4.339 3.955 1509 HD2 TYR 50 HD2 TYR 50 9.085 3.921 3.466 1510 HE1 TYR 50 HE1 TYR 50 5.114 4.277 6.418 1511 HE2 TYR 50 HE2 TYR 50 9.361 3.859 5.930 1512 HH TYR 50 HH TYR 50 7.640 3.132 7.953 1513 H LEU 51 H LEU 51 8.900 6.792 -0.112 1514 HA LEU 51 HA LEU 51 6.881 6.367 -2.286 1515 1HB LEU 51 1HB LEU 51 7.328 8.548 -0.737 1516 2HB LEU 51 2HB LEU 51 8.469 8.879 -2.039 1517 HG LEU 51 HG LEU 51 6.607 8.517 -3.681 1518 1HD1 LEU 51 1HD1 LEU 51 4.754 7.481 -2.926 1519 2HD1 LEU 51 2HD1 LEU 51 4.371 8.945 -2.021 1520 3HD1 LEU 51 3HD1 LEU 51 5.288 7.648 -1.253 1521 1HD2 LEU 51 1HD2 LEU 51 6.893 10.701 -1.757 1522 2HD2 LEU 51 2HD2 LEU 51 5.264 10.610 -2.428 1523 3HD2 LEU 51 3HD2 LEU 51 6.653 10.772 -3.503 1524 H PHE 52 H PHE 52 7.888 5.185 -3.889 1525 HA PHE 52 HA PHE 52 10.751 5.635 -4.520 1526 1HB PHE 52 1HB PHE 52 8.564 3.700 -5.240 1527 2HB PHE 52 2HB PHE 52 9.955 3.836 -6.315 1528 HD1 PHE 52 HD1 PHE 52 12.148 3.073 -5.643 1529 HD2 PHE 52 HD2 PHE 52 8.855 2.984 -2.887 1530 HE1 PHE 52 HE1 PHE 52 13.479 1.661 -4.099 1531 HE2 PHE 52 HE2 PHE 52 10.185 1.572 -1.342 1532 HZ PHE 52 HZ PHE 52 12.497 0.910 -1.948 1533 H SER 53 H SER 53 10.984 7.569 -5.653 1534 HA SER 53 HA SER 53 8.944 8.294 -7.685 1535 1HB SER 53 1HB SER 53 9.808 10.479 -7.406 1536 2HB SER 53 2HB SER 53 10.000 9.774 -5.801 1537 HG SER 53 HG SER 53 11.869 10.847 -7.165 1538 H ARG 54 H ARG 54 9.676 9.037 -9.817 1539 HA ARG 54 HA ARG 54 12.241 7.768 -10.714 1540 1HB ARG 54 1HB ARG 54 9.572 7.059 -11.304 1541 2HB ARG 54 2HB ARG 54 10.155 7.902 -12.739 1542 1HG ARG 54 1HG ARG 54 12.225 6.423 -12.614 1543 2HG ARG 54 2HG ARG 54 11.368 5.475 -11.399 1544 1HD ARG 54 1HD ARG 54 10.811 4.340 -13.388 1545 2HD ARG 54 2HD ARG 54 9.440 5.453 -13.216 1546 HE ARG 54 HE ARG 54 11.533 6.820 -14.586 1547 1HH1 ARG 54 1HH1 ARG 54 9.307 4.184 -15.051 1548 2HH1 ARG 54 2HH1 ARG 54 9.250 4.390 -16.767 1549 1HH2 ARG 54 1HH2 ARG 54 11.443 7.067 -16.815 1550 2HH2 ARG 54 2HH2 ARG 54 10.450 6.009 -17.760 1551 H LYS 55 H LYS 55 12.509 8.671 -13.194 1552 HA LYS 55 HA LYS 55 12.864 11.552 -12.883 1553 1HB LYS 55 1HB LYS 55 13.642 9.344 -14.686 1554 2HB LYS 55 2HB LYS 55 13.451 10.898 -15.498 1555 1HG LYS 55 1HG LYS 55 15.120 11.922 -14.205 1556 2HG LYS 55 2HG LYS 55 14.995 10.720 -12.920 1557 1HD LYS 55 1HD LYS 55 16.405 9.270 -13.970 1558 2HD LYS 55 2HD LYS 55 15.748 9.635 -15.565 1559 1HE LYS 55 1HE LYS 55 17.243 11.863 -14.304 1560 2HE LYS 55 2HE LYS 55 18.221 10.451 -14.747 1561 1HZ LYS 55 1HZ LYS 55 17.941 11.978 -16.627 1562 2HZ LYS 55 2HZ LYS 55 16.254 11.816 -16.517 1563 3HZ LYS 55 3HZ LYS 55 17.211 10.477 -16.939 1564 H ASN 56 H ASN 56 10.603 12.190 -12.698 1565 HA ASN 56 HA ASN 56 8.849 11.778 -15.041 1566 1HB ASN 56 1HB ASN 56 9.532 14.584 -14.155 1567 2HB ASN 56 2HB ASN 56 10.543 13.751 -15.336 1568 1HD2 ASN 56 1HD2 ASN 56 8.321 16.038 -15.424 1569 2HD2 ASN 56 2HD2 ASN 56 7.404 15.587 -16.779 1570 H MET 57 H MET 57 8.982 11.407 -11.962 1571 HA MET 57 HA MET 57 7.050 13.199 -10.789 1572 1HB MET 57 1HB MET 57 5.101 11.655 -10.919 1573 2HB MET 57 2HB MET 57 5.640 12.135 -12.526 1574 1HG MET 57 1HG MET 57 7.162 9.852 -11.832 1575 2HG MET 57 2HG MET 57 5.498 9.489 -11.376 1576 1HE MET 57 1HE MET 57 4.113 11.616 -13.880 1577 2HE MET 57 2HE MET 57 3.612 10.387 -12.718 1578 3HE MET 57 3HE MET 57 3.434 10.090 -14.447 1579 H SER 58 H SER 58 5.770 11.597 -8.996 1580 HA SER 58 HA SER 58 7.906 9.928 -7.720 1581 1HB SER 58 1HB SER 58 6.247 12.222 -6.672 1582 2HB SER 58 2HB SER 58 6.874 11.006 -5.560 1583 HG SER 58 HG SER 58 8.782 11.828 -5.765 1584 H ALA 59 H ALA 59 7.111 7.965 -6.964 1585 HA ALA 59 HA ALA 59 4.130 7.678 -6.811 1586 1HB ALA 59 1HB ALA 59 4.837 6.605 -8.815 1587 2HB ALA 59 2HB ALA 59 4.726 5.286 -7.650 1588 3HB ALA 59 3HB ALA 59 6.298 5.974 -8.057 1589 H MET 60 H MET 60 3.479 5.736 -5.466 1590 HA MET 60 HA MET 60 5.174 5.585 -3.022 1591 1HB MET 60 1HB MET 60 2.714 6.188 -2.996 1592 2HB MET 60 2HB MET 60 2.367 4.560 -3.579 1593 1HG MET 60 1HG MET 60 2.968 3.564 -1.580 1594 2HG MET 60 2HG MET 60 4.109 4.843 -1.166 1595 1HE MET 60 1HE MET 60 2.388 6.209 1.641 1596 2HE MET 60 2HE MET 60 3.454 6.925 0.432 1597 3HE MET 60 3HE MET 60 3.708 5.261 0.957 1598 H ALA 61 H ALA 61 5.264 3.346 -1.979 1599 HA ALA 61 HA ALA 61 6.204 1.417 -3.964 1600 1HB ALA 61 1HB ALA 61 6.577 2.091 -1.211 1601 2HB ALA 61 2HB ALA 61 7.516 0.955 -2.181 1602 3HB ALA 61 3HB ALA 61 6.106 0.393 -1.283 1603 H LEU 62 H LEU 62 3.747 1.208 -1.324 1604 HA LEU 62 HA LEU 62 2.125 -0.561 -3.068 1605 1HB LEU 62 1HB LEU 62 1.005 -0.186 -0.468 1606 2HB LEU 62 2HB LEU 62 1.690 1.355 -0.975 1607 HG LEU 62 HG LEU 62 0.439 0.399 -3.273 1608 1HD1 LEU 62 1HD1 LEU 62 -0.624 -1.044 -1.147 1609 2HD1 LEU 62 2HD1 LEU 62 -1.386 -0.815 -2.721 1610 3HD1 LEU 62 3HD1 LEU 62 -1.781 0.264 -1.382 1611 1HD2 LEU 62 1HD2 LEU 62 -0.985 2.290 -2.995 1612 2HD2 LEU 62 2HD2 LEU 62 0.519 2.729 -2.185 1613 3HD2 LEU 62 3HD2 LEU 62 -0.875 2.208 -1.237 1614 H GLY 63 H GLY 63 3.690 -2.395 -2.920 1615 1HA GLY 63 1HA GLY 63 2.913 -4.288 -0.905 1616 2HA GLY 63 2HA GLY 63 4.227 -4.512 -2.058 1617 H PHE 64 H PHE 64 5.776 -5.285 -0.611 1618 HA PHE 64 HA PHE 64 6.309 -3.961 1.941 1619 1HB PHE 64 1HB PHE 64 7.457 -6.209 0.290 1620 2HB PHE 64 2HB PHE 64 8.332 -5.629 1.706 1621 HD1 PHE 64 HD1 PHE 64 4.780 -6.440 0.771 1622 HD2 PHE 64 HD2 PHE 64 7.912 -6.760 3.694 1623 HE1 PHE 64 HE1 PHE 64 3.276 -7.757 2.239 1624 HE2 PHE 64 HE2 PHE 64 6.407 -8.076 5.162 1625 HZ PHE 64 HZ PHE 64 4.089 -8.575 4.434 1626 H GLY 65 H GLY 65 6.531 -1.909 0.219 1627 1HA GLY 65 1HA GLY 65 9.326 -1.669 -0.708 1628 2HA GLY 65 2HA GLY 65 8.043 -0.488 -0.977 1629 H ALA 66 H ALA 66 7.145 -0.149 1.666 1630 HA ALA 66 HA ALA 66 9.022 1.753 2.686 1631 1HB ALA 66 1HB ALA 66 6.706 0.273 3.986 1632 2HB ALA 66 2HB ALA 66 6.582 1.772 3.068 1633 3HB ALA 66 3HB ALA 66 7.436 1.751 4.611 1634 H ILE 67 H ILE 67 8.169 -1.527 3.843 1635 HA ILE 67 HA ILE 67 9.783 -1.716 6.093 1636 HB ILE 67 HB ILE 67 9.851 -4.172 5.504 1637 1HG1 ILE 67 1HG1 ILE 67 8.413 -4.687 3.405 1638 2HG1 ILE 67 2HG1 ILE 67 8.840 -3.058 2.888 1639 1HG2 ILE 67 1HG2 ILE 67 7.482 -4.464 5.699 1640 2HG2 ILE 67 2HG2 ILE 67 7.163 -2.914 4.921 1641 3HG2 ILE 67 3HG2 ILE 67 7.866 -2.961 6.538 1642 1HD1 ILE 67 1HD1 ILE 67 10.935 -3.693 2.335 1643 2HD1 ILE 67 2HD1 ILE 67 10.372 -5.353 2.514 1644 3HD1 ILE 67 3HD1 ILE 67 11.157 -4.538 3.867 1645 H PHE 68 H PHE 68 10.887 -1.563 2.764 1646 HA PHE 68 HA PHE 68 13.375 -2.826 2.864 1647 1HB PHE 68 1HB PHE 68 12.279 -0.356 1.543 1648 2HB PHE 68 2HB PHE 68 13.984 -0.740 1.342 1649 HD1 PHE 68 HD1 PHE 68 13.936 -3.715 1.293 1650 HD2 PHE 68 HD2 PHE 68 11.311 -0.856 -0.554 1651 HE1 PHE 68 HE1 PHE 68 13.345 -5.376 -0.445 1652 HE2 PHE 68 HE2 PHE 68 10.723 -2.521 -2.290 1653 HZ PHE 68 HZ PHE 68 11.739 -4.780 -2.237 1654 H ASN 69 H ASN 69 14.877 -2.654 4.474 1655 HA ASN 69 HA ASN 69 15.217 -0.047 5.878 1656 1HB ASN 69 1HB ASN 69 15.992 -2.929 6.429 1657 2HB ASN 69 2HB ASN 69 16.487 -1.596 7.470 1658 1HD2 ASN 69 1HD2 ASN 69 14.917 -3.418 8.737 1659 2HD2 ASN 69 2HD2 ASN 69 13.326 -2.856 8.915 1660 H HIS 70 H HIS 70 17.777 -0.305 6.822 1661 HA HIS 70 HA HIS 70 19.395 0.191 4.388 1662 1HB HIS 70 1HB HIS 70 19.087 1.554 6.672 1663 2HB HIS 70 2HB HIS 70 20.379 0.481 7.207 1664 HD1 HIS 70 HD1 HIS 70 20.229 3.718 6.159 1665 HD2 HIS 70 HD2 HIS 70 22.307 0.463 4.589 1666 HE1 HIS 70 HE1 HIS 70 22.127 4.676 4.786 1667 H SER 71 H SER 71 21.179 -1.081 3.837 1668 HA SER 71 HA SER 71 22.242 -3.086 5.716 1669 1HB SER 71 1HB SER 71 20.041 -3.759 4.255 1670 2HB SER 71 2HB SER 71 21.316 -4.223 3.129 1671 HG SER 71 HG SER 71 21.837 -5.814 4.383 1672 H LYS 72 H LYS 72 24.341 -3.702 5.121 1673 HA LYS 72 HA LYS 72 25.593 -2.156 2.950 1674 1HB LYS 72 1HB LYS 72 26.634 -2.403 5.165 1675 2HB LYS 72 2HB LYS 72 26.629 -4.159 4.992 1676 1HG LYS 72 1HG LYS 72 28.831 -3.491 4.388 1677 2HG LYS 72 2HG LYS 72 28.010 -3.779 2.854 1678 1HD LYS 72 1HD LYS 72 29.118 -1.685 2.588 1679 2HD LYS 72 2HD LYS 72 27.425 -1.282 2.877 1680 1HE LYS 72 1HE LYS 72 28.604 0.167 4.347 1681 2HE LYS 72 2HE LYS 72 28.131 -1.182 5.398 1682 1HZ LYS 72 1HZ LYS 72 30.696 -1.022 3.898 1683 2HZ LYS 72 2HZ LYS 72 30.247 -2.226 5.009 1684 3HZ LYS 72 3HZ LYS 72 30.528 -0.639 5.544 1685 H ASP 73 H ASP 73 24.360 -5.369 3.429 1686 HA ASP 73 HA ASP 73 25.636 -6.215 0.847 1687 1HB ASP 73 1HB ASP 73 25.568 -8.505 1.846 1688 2HB ASP 73 2HB ASP 73 26.521 -7.392 2.828 1689 HA PRO 74 HA PRO 74 20.968 -6.033 0.489 1690 1HB PRO 74 1HB PRO 74 21.748 -5.382 -2.308 1691 2HB PRO 74 2HB PRO 74 20.578 -4.571 -1.252 1692 1HG PRO 74 1HG PRO 74 22.971 -3.501 -1.841 1693 2HG PRO 74 2HG PRO 74 22.173 -3.249 -0.282 1694 1HD PRO 74 1HD PRO 74 24.490 -4.981 -0.966 1695 2HD PRO 74 2HD PRO 74 24.126 -4.113 0.540 1696 H ASN 75 H ASN 75 20.533 -8.239 0.519 1697 HA ASN 75 HA ASN 75 21.746 -10.056 -1.450 1698 1HB ASN 75 1HB ASN 75 20.475 -11.734 -0.134 1699 2HB ASN 75 2HB ASN 75 21.376 -10.652 0.929 1700 1HD2 ASN 75 1HD2 ASN 75 19.273 -11.856 2.166 1701 2HD2 ASN 75 2HD2 ASN 75 17.955 -10.799 2.336 1702 H ALA 76 H ALA 76 18.908 -8.108 -1.282 1703 HA ALA 76 HA ALA 76 17.844 -9.490 -3.703 1704 1HB ALA 76 1HB ALA 76 15.543 -9.007 -2.458 1705 2HB ALA 76 2HB ALA 76 16.563 -9.045 -1.020 1706 3HB ALA 76 3HB ALA 76 16.472 -10.456 -2.074 1707 H ARG 77 H ARG 77 16.949 -8.048 -5.187 1708 HA ARG 77 HA ARG 77 16.973 -5.154 -4.404 1709 1HB ARG 77 1HB ARG 77 18.113 -6.696 -6.547 1710 2HB ARG 77 2HB ARG 77 16.950 -5.563 -7.234 1711 1HG ARG 77 1HG ARG 77 18.061 -3.764 -5.800 1712 2HG ARG 77 2HG ARG 77 19.341 -4.936 -5.488 1713 1HD ARG 77 1HD ARG 77 18.582 -4.596 -8.344 1714 2HD ARG 77 2HD ARG 77 19.415 -3.224 -7.590 1715 HE ARG 77 HE ARG 77 20.732 -5.625 -6.791 1716 1HH1 ARG 77 1HH1 ARG 77 20.193 -3.679 -9.627 1717 2HH1 ARG 77 2HH1 ARG 77 21.679 -4.157 -10.371 1718 1HH2 ARG 77 1HH2 ARG 77 22.655 -6.230 -7.778 1719 2HH2 ARG 77 2HH2 ARG 77 23.064 -5.590 -9.334 1720 H HIS 78 H HIS 78 15.460 -3.957 -6.203 1721 HA HIS 78 HA HIS 78 12.834 -5.414 -6.202 1722 1HB HIS 78 1HB HIS 78 11.859 -3.154 -5.773 1723 2HB HIS 78 2HB HIS 78 12.993 -3.624 -4.507 1724 HD1 HIS 78 HD1 HIS 78 15.340 -2.448 -4.503 1725 HD2 HIS 78 HD2 HIS 78 12.687 -0.958 -7.354 1726 HE1 HIS 78 HE1 HIS 78 16.330 -0.270 -5.335 1727 H GLU 79 H GLU 79 11.345 -4.670 -7.941 1728 HA GLU 79 HA GLU 79 12.753 -3.425 -10.275 1729 1HB GLU 79 1HB GLU 79 12.718 -5.900 -10.446 1730 2HB GLU 79 2HB GLU 79 10.968 -5.889 -10.229 1731 1HG GLU 79 1HG GLU 79 11.423 -6.054 -12.603 1732 2HG GLU 79 2HG GLU 79 10.799 -4.436 -12.281 1733 H LEU 80 H LEU 80 11.304 -2.326 -11.747 1734 HA LEU 80 HA LEU 80 8.518 -1.922 -10.722 1735 1HB LEU 80 1HB LEU 80 9.896 -0.063 -9.995 1736 2HB LEU 80 2HB LEU 80 10.628 0.085 -11.592 1737 HG LEU 80 HG LEU 80 8.366 0.636 -12.516 1738 1HD1 LEU 80 1HD1 LEU 80 6.503 0.454 -11.256 1739 2HD1 LEU 80 2HD1 LEU 80 7.223 1.395 -9.949 1740 3HD1 LEU 80 3HD1 LEU 80 7.502 -0.344 -10.041 1741 1HD2 LEU 80 1HD2 LEU 80 10.150 2.299 -11.462 1742 2HD2 LEU 80 2HD2 LEU 80 8.863 2.572 -10.287 1743 3HD2 LEU 80 3HD2 LEU 80 8.576 2.887 -11.998 1744 H THR 81 H THR 81 6.960 -1.832 -12.355 1745 HA THR 81 HA THR 81 7.734 -2.681 -15.037 1746 HB THR 81 HB THR 81 5.161 -2.242 -15.303 1747 HG1 THR 81 HG1 THR 81 5.076 -0.854 -13.472 1748 1HG2 THR 81 1HG2 THR 81 5.953 -4.483 -15.049 1749 2HG2 THR 81 2HG2 THR 81 4.697 -4.279 -13.828 1750 3HG2 THR 81 3HG2 THR 81 6.397 -4.209 -13.365 1751 H ALA 82 H ALA 82 6.143 -1.273 -16.749 1752 HA ALA 82 HA ALA 82 7.525 1.330 -16.891 1753 1HB ALA 82 1HB ALA 82 6.772 -0.593 -18.692 1754 2HB ALA 82 2HB ALA 82 7.124 1.076 -19.138 1755 3HB ALA 82 3HB ALA 82 5.456 0.567 -18.876 1756 H GLY 83 H GLY 83 6.575 2.912 -15.629 1757 1HA GLY 83 1HA GLY 83 4.679 4.572 -15.846 1758 2HA GLY 83 2HA GLY 83 3.599 3.180 -15.805 1759 H LEU 84 H LEU 84 6.291 2.829 -13.714 1760 HA LEU 84 HA LEU 84 6.403 2.783 -11.352 1761 1HB LEU 84 1HB LEU 84 4.993 5.309 -12.175 1762 2HB LEU 84 2HB LEU 84 5.122 4.939 -10.456 1763 HG LEU 84 HG LEU 84 7.506 4.906 -12.320 1764 1HD1 LEU 84 1HD1 LEU 84 7.329 7.147 -10.452 1765 2HD1 LEU 84 2HD1 LEU 84 6.027 7.165 -11.642 1766 3HD1 LEU 84 3HD1 LEU 84 7.708 7.154 -12.175 1767 1HD2 LEU 84 1HD2 LEU 84 7.272 3.818 -9.870 1768 2HD2 LEU 84 2HD2 LEU 84 7.658 5.473 -9.399 1769 3HD2 LEU 84 3HD2 LEU 84 8.768 4.567 -10.426 1770 H LYS 85 H LYS 85 4.153 1.323 -12.665 1771 HA LYS 85 HA LYS 85 1.933 1.697 -10.721 1772 1HB LYS 85 1HB LYS 85 2.362 0.429 -13.410 1773 2HB LYS 85 2HB LYS 85 1.002 -0.115 -12.427 1774 1HG LYS 85 1HG LYS 85 1.365 2.824 -12.620 1775 2HG LYS 85 2HG LYS 85 0.865 2.014 -14.105 1776 1HD LYS 85 1HD LYS 85 -1.105 1.156 -13.104 1777 2HD LYS 85 2HD LYS 85 -0.512 1.474 -11.473 1778 1HE LYS 85 1HE LYS 85 -1.865 3.336 -11.681 1779 2HE LYS 85 2HE LYS 85 -0.441 3.994 -12.509 1780 1HZ LYS 85 1HZ LYS 85 -1.288 3.347 -14.595 1781 2HZ LYS 85 2HZ LYS 85 -2.606 4.061 -13.797 1782 3HZ LYS 85 3HZ LYS 85 -2.494 2.370 -13.905 1783 H ARG 86 H ARG 86 3.570 -1.150 -12.180 1784 HA ARG 86 HA ARG 86 2.937 -2.691 -9.719 1785 1HB ARG 86 1HB ARG 86 2.924 -3.164 -12.483 1786 2HB ARG 86 2HB ARG 86 4.316 -4.073 -11.893 1787 1HG ARG 86 1HG ARG 86 3.021 -5.487 -10.613 1788 2HG ARG 86 2HG ARG 86 1.793 -4.257 -10.310 1789 1HD ARG 86 1HD ARG 86 0.804 -4.570 -12.463 1790 2HD ARG 86 2HD ARG 86 2.204 -5.485 -13.053 1791 HE ARG 86 HE ARG 86 1.346 -6.889 -10.804 1792 1HH1 ARG 86 1HH1 ARG 86 -0.091 -5.837 -13.795 1793 2HH1 ARG 86 2HH1 ARG 86 -1.198 -7.164 -13.857 1794 1HH2 ARG 86 1HH2 ARG 86 -0.102 -8.602 -10.907 1795 2HH2 ARG 86 2HH2 ARG 86 -1.206 -8.718 -12.236 1796 H MET 87 H MET 87 4.645 -4.100 -8.805 1797 HA MET 87 HA MET 87 7.454 -3.327 -9.373 1798 1HB MET 87 1HB MET 87 5.791 -2.457 -7.104 1799 2HB MET 87 2HB MET 87 7.312 -3.194 -6.603 1800 1HG MET 87 1HG MET 87 8.319 -1.653 -8.504 1801 2HG MET 87 2HG MET 87 6.850 -0.717 -8.228 1802 1HE MET 87 1HE MET 87 10.151 -1.922 -7.178 1803 2HE MET 87 2HE MET 87 9.388 -2.772 -5.834 1804 3HE MET 87 3HE MET 87 10.439 -1.390 -5.521 1805 H ARG 88 H ARG 88 8.926 -4.960 -8.698 1806 HA ARG 88 HA ARG 88 7.716 -7.365 -7.378 1807 1HB ARG 88 1HB ARG 88 9.550 -7.188 -9.797 1808 2HB ARG 88 2HB ARG 88 9.081 -8.697 -9.015 1809 1HG ARG 88 1HG ARG 88 6.813 -8.449 -9.638 1810 2HG ARG 88 2HG ARG 88 7.010 -6.732 -9.991 1811 1HD ARG 88 1HD ARG 88 8.768 -7.646 -11.773 1812 2HD ARG 88 2HD ARG 88 7.771 -9.108 -11.654 1813 HE ARG 88 HE ARG 88 6.184 -6.668 -11.876 1814 1HH1 ARG 88 1HH1 ARG 88 7.928 -9.120 -13.627 1815 2HH1 ARG 88 2HH1 ARG 88 7.009 -8.895 -15.074 1816 1HH2 ARG 88 1HH2 ARG 88 5.005 -6.395 -13.766 1817 2HH2 ARG 88 2HH2 ARG 88 5.366 -7.365 -15.155 1818 H ILE 89 H ILE 89 9.570 -8.879 -6.623 1819 HA ILE 89 HA ILE 89 11.981 -7.308 -5.798 1820 HB ILE 89 HB ILE 89 10.130 -9.018 -4.093 1821 1HG1 ILE 89 1HG1 ILE 89 10.898 -6.106 -3.775 1822 2HG1 ILE 89 2HG1 ILE 89 9.469 -6.622 -4.670 1823 1HG2 ILE 89 1HG2 ILE 89 11.708 -8.165 -2.240 1824 2HG2 ILE 89 2HG2 ILE 89 12.841 -7.801 -3.541 1825 3HG2 ILE 89 3HG2 ILE 89 12.313 -9.462 -3.270 1826 1HD1 ILE 89 1HD1 ILE 89 9.538 -6.134 -1.958 1827 2HD1 ILE 89 2HD1 ILE 89 9.728 -7.886 -2.025 1828 3HD1 ILE 89 3HD1 ILE 89 8.325 -7.121 -2.773 1829 H PHE 90 H PHE 90 13.696 -8.431 -6.630 1830 HA PHE 90 HA PHE 90 13.491 -11.412 -6.831 1831 1HB PHE 90 1HB PHE 90 14.878 -9.203 -8.327 1832 2HB PHE 90 2HB PHE 90 15.575 -10.822 -8.376 1833 HD1 PHE 90 HD1 PHE 90 14.218 -12.741 -9.240 1834 HD2 PHE 90 HD2 PHE 90 12.854 -8.676 -9.493 1835 HE1 PHE 90 HE1 PHE 90 12.537 -13.411 -10.937 1836 HE2 PHE 90 HE2 PHE 90 11.174 -9.346 -11.189 1837 HZ PHE 90 HZ PHE 90 11.015 -11.713 -11.912 1838 H THR 91 H THR 91 15.719 -12.503 -6.563 1839 HA THR 91 HA THR 91 17.114 -11.292 -4.202 1840 HB THR 91 HB THR 91 17.728 -13.803 -3.896 1841 HG1 THR 91 HG1 THR 91 16.753 -15.190 -5.163 1842 1HG2 THR 91 1HG2 THR 91 15.792 -12.319 -2.824 1843 2HG2 THR 91 2HG2 THR 91 15.880 -14.055 -2.524 1844 3HG2 THR 91 3HG2 THR 91 14.765 -13.424 -3.737 1845 H ILE 92 H ILE 92 18.608 -10.097 -5.588 1846 HA ILE 92 HA ILE 92 20.117 -11.082 -7.738 1847 HB ILE 92 HB ILE 92 21.766 -9.332 -6.971 1848 1HG1 ILE 92 1HG1 ILE 92 19.974 -8.556 -4.739 1849 2HG1 ILE 92 2HG1 ILE 92 20.965 -9.986 -4.458 1850 1HG2 ILE 92 1HG2 ILE 92 20.063 -8.403 -8.267 1851 2HG2 ILE 92 2HG2 ILE 92 19.891 -7.492 -6.767 1852 3HG2 ILE 92 3HG2 ILE 92 18.807 -8.840 -7.108 1853 1HD1 ILE 92 1HD1 ILE 92 21.759 -7.210 -4.473 1854 2HD1 ILE 92 2HD1 ILE 92 22.659 -8.099 -5.701 1855 3HD1 ILE 92 3HD1 ILE 92 22.706 -8.627 -4.019 1856 H LYS 93 H LYS 93 20.395 -11.864 -4.342 1857 HA LYS 93 HA LYS 93 22.743 -13.610 -4.996 1858 1HB LYS 93 1HB LYS 93 22.241 -11.983 -2.474 1859 2HB LYS 93 2HB LYS 93 23.660 -12.980 -2.793 1860 1HG LYS 93 1HG LYS 93 22.853 -10.717 -4.627 1861 2HG LYS 93 2HG LYS 93 23.903 -10.461 -3.234 1862 1HD LYS 93 1HD LYS 93 25.008 -12.694 -4.455 1863 2HD LYS 93 2HD LYS 93 24.509 -11.695 -5.821 1864 1HE LYS 93 1HE LYS 93 26.170 -10.192 -5.423 1865 2HE LYS 93 2HE LYS 93 25.777 -10.120 -3.695 1866 1HZ LYS 93 1HZ LYS 93 27.994 -11.182 -4.352 1867 2HZ LYS 93 2HZ LYS 93 27.068 -12.497 -4.900 1868 3HZ LYS 93 3HZ LYS 93 27.012 -12.041 -3.265 1869 HA PRO 94 HA PRO 94 20.352 -16.856 -3.226 1870 1HB PRO 94 1HB PRO 94 22.804 -17.890 -1.945 1871 2HB PRO 94 2HB PRO 94 21.779 -18.650 -3.172 1872 1HG PRO 94 1HG PRO 94 24.238 -17.683 -3.713 1873 2HG PRO 94 2HG PRO 94 22.930 -17.706 -4.903 1874 1HD PRO 94 1HD PRO 94 24.033 -15.424 -3.346 1875 2HD PRO 94 2HD PRO 94 23.357 -15.457 -4.988 1876 H ILE 95 H ILE 95 19.332 -17.253 -1.229 1877 HA ILE 95 HA ILE 95 20.500 -15.847 1.153 1878 HB ILE 95 HB ILE 95 17.630 -16.064 0.169 1879 1HG1 ILE 95 1HG1 ILE 95 19.481 -13.680 0.477 1880 2HG1 ILE 95 2HG1 ILE 95 19.059 -14.447 -1.054 1881 1HG2 ILE 95 1HG2 ILE 95 18.096 -14.165 2.307 1882 2HG2 ILE 95 2HG2 ILE 95 18.570 -15.789 2.809 1883 3HG2 ILE 95 3HG2 ILE 95 16.931 -15.487 2.232 1884 1HD1 ILE 95 1HD1 ILE 95 17.330 -12.985 -1.127 1885 2HD1 ILE 95 2HD1 ILE 95 17.514 -12.561 0.576 1886 3HD1 ILE 95 3HD1 ILE 95 16.588 -13.991 0.117 1887 H ALA 96 H ALA 96 20.409 -16.996 3.087 1888 HA ALA 96 HA ALA 96 19.480 -19.822 2.909 1889 1HB ALA 96 1HB ALA 96 20.923 -20.059 4.918 1890 2HB ALA 96 2HB ALA 96 21.187 -18.315 4.928 1891 3HB ALA 96 3HB ALA 96 21.806 -19.293 3.597 1892 H ILE 97 H ILE 97 18.333 -20.692 4.866 1893 HA ILE 97 HA ILE 97 16.038 -19.132 5.555 1894 HB ILE 97 HB ILE 97 17.318 -21.574 6.839 1895 1HG1 ILE 97 1HG1 ILE 97 14.905 -21.933 5.230 1896 2HG1 ILE 97 2HG1 ILE 97 16.235 -21.249 4.294 1897 1HG2 ILE 97 1HG2 ILE 97 15.708 -21.380 8.404 1898 2HG2 ILE 97 2HG2 ILE 97 14.518 -21.630 7.126 1899 3HG2 ILE 97 3HG2 ILE 97 15.001 -19.994 7.573 1900 1HD1 ILE 97 1HD1 ILE 97 16.148 -23.797 4.381 1901 2HD1 ILE 97 2HD1 ILE 97 16.570 -23.664 6.089 1902 3HD1 ILE 97 3HD1 ILE 97 17.684 -23.072 4.857 1903 H GLY 98 H GLY 98 15.951 -17.447 6.973 1904 1HA GLY 98 1HA GLY 98 16.183 -16.623 9.264 1905 2HA GLY 98 2HA GLY 98 17.671 -17.558 9.406 1906 H GLU 99 H GLU 99 16.733 -15.457 6.700 1907 HA GLU 99 HA GLU 99 19.121 -13.756 7.344 1908 1HB GLU 99 1HB GLU 99 18.074 -15.097 4.928 1909 2HB GLU 99 2HB GLU 99 18.571 -13.426 4.659 1910 1HG GLU 99 1HG GLU 99 20.311 -15.450 6.089 1911 2HG GLU 99 2HG GLU 99 20.403 -15.167 4.351 1912 H GLU 100 H GLU 100 18.872 -11.479 6.350 1913 HA GLU 100 HA GLU 100 16.055 -10.531 6.770 1914 1HB GLU 100 1HB GLU 100 18.194 -9.938 8.262 1915 2HB GLU 100 2HB GLU 100 18.467 -8.759 6.980 1916 1HG GLU 100 1HG GLU 100 15.725 -8.578 7.560 1917 2HG GLU 100 2HG GLU 100 16.513 -8.710 9.131 1918 H ILE 101 H ILE 101 15.102 -9.670 4.969 1919 HA ILE 101 HA ILE 101 16.803 -9.063 2.608 1920 HB ILE 101 HB ILE 101 13.810 -9.381 3.032 1921 1HG1 ILE 101 1HG1 ILE 101 15.788 -11.147 1.573 1922 2HG1 ILE 101 2HG1 ILE 101 15.257 -11.430 3.230 1923 1HG2 ILE 101 1HG2 ILE 101 14.092 -9.618 0.385 1924 2HG2 ILE 101 2HG2 ILE 101 15.441 -8.523 0.686 1925 3HG2 ILE 101 3HG2 ILE 101 13.805 -8.053 1.147 1926 1HD1 ILE 101 1HD1 ILE 101 13.999 -12.421 0.990 1927 2HD1 ILE 101 2HD1 ILE 101 13.050 -10.975 1.335 1928 3HD1 ILE 101 3HD1 ILE 101 13.234 -12.223 2.566 1929 H THR 102 H THR 102 17.257 -7.009 2.071 1930 HA THR 102 HA THR 102 15.401 -4.788 2.649 1931 HB THR 102 HB THR 102 17.267 -3.584 3.886 1932 HG1 THR 102 HG1 THR 102 18.915 -4.992 3.056 1933 1HG2 THR 102 1HG2 THR 102 16.809 -4.632 5.985 1934 2HG2 THR 102 2HG2 THR 102 16.525 -6.196 5.221 1935 3HG2 THR 102 3HG2 THR 102 15.369 -4.883 4.999 1936 H ILE 103 H ILE 103 16.606 -2.655 1.812 1937 HA ILE 103 HA ILE 103 18.554 -3.271 -0.348 1938 HB ILE 103 HB ILE 103 17.085 -2.197 -2.019 1939 1HG1 ILE 103 1HG1 ILE 103 14.582 -2.053 -0.975 1940 2HG1 ILE 103 2HG1 ILE 103 15.536 -1.573 0.429 1941 1HG2 ILE 103 1HG2 ILE 103 15.564 -3.995 -2.285 1942 2HG2 ILE 103 2HG2 ILE 103 15.421 -4.240 -0.544 1943 3HG2 ILE 103 3HG2 ILE 103 16.908 -4.690 -1.379 1944 1HD1 ILE 103 1HD1 ILE 103 15.656 0.487 -0.486 1945 2HD1 ILE 103 2HD1 ILE 103 14.964 -0.084 -2.004 1946 3HD1 ILE 103 3HD1 ILE 103 16.701 -0.209 -1.725 1947 H SER 104 H SER 104 19.632 -1.342 -1.145 1948 HA SER 104 HA SER 104 20.100 0.672 0.862 1949 1HB SER 104 1HB SER 104 21.722 -0.169 -0.844 1950 2HB SER 104 2HB SER 104 20.759 0.596 -2.107 1951 HG SER 104 HG SER 104 22.613 1.813 -1.218 1952 H TYR 105 H TYR 105 20.244 2.940 -1.052 1953 HA TYR 105 HA TYR 105 17.333 3.502 -1.473 1954 1HB TYR 105 1HB TYR 105 19.406 5.299 -0.157 1955 2HB TYR 105 2HB TYR 105 17.706 5.696 -0.400 1956 HD1 TYR 105 HD1 TYR 105 15.936 4.434 0.818 1957 HD2 TYR 105 HD2 TYR 105 20.112 3.818 1.601 1958 HE1 TYR 105 HE1 TYR 105 15.368 3.292 2.945 1959 HE2 TYR 105 HE2 TYR 105 19.546 2.676 3.729 1960 HH TYR 105 HH TYR 105 16.363 1.690 4.491 1961 H GLY 106 H GLY 106 20.381 5.362 -1.831 1962 1HA GLY 106 1HA GLY 106 20.985 5.228 -4.462 1963 2HA GLY 106 2HA GLY 106 19.511 6.193 -4.523 1964 H ASP 107 H ASP 107 21.450 7.611 -5.474 1965 HA ASP 107 HA ASP 107 23.286 8.876 -3.679 1966 1HB ASP 107 1HB ASP 107 23.371 10.560 -5.539 1967 2HB ASP 107 2HB ASP 107 23.472 8.900 -6.128 1968 H ASP 108 H ASP 108 19.975 9.741 -4.690 1969 HA ASP 108 HA ASP 108 19.817 12.287 -3.425 1970 1HB ASP 108 1HB ASP 108 18.081 10.236 -4.594 1971 2HB ASP 108 2HB ASP 108 17.289 11.099 -3.276 1972 H TYR 109 H TYR 109 18.470 9.192 -2.199 1973 HA TYR 109 HA TYR 109 18.078 10.206 0.477 1974 1HB TYR 109 1HB TYR 109 17.770 7.729 -1.084 1975 2HB TYR 109 2HB TYR 109 18.169 7.434 0.608 1976 HD1 TYR 109 HD1 TYR 109 15.468 7.445 -1.381 1977 HD2 TYR 109 HD2 TYR 109 16.898 9.565 2.070 1978 HE1 TYR 109 HE1 TYR 109 13.133 7.973 -0.738 1979 HE2 TYR 109 HE2 TYR 109 14.563 10.094 2.714 1980 HH TYR 109 HH TYR 109 11.852 9.311 0.599 1981 H TRP 110 H TRP 110 19.898 10.848 1.603 1982 HA TRP 110 HA TRP 110 22.546 10.004 1.351 1983 1HB TRP 110 1HB TRP 110 22.774 10.906 3.623 1984 2HB TRP 110 2HB TRP 110 21.636 11.892 2.705 1985 HD1 TRP 110 HD1 TRP 110 19.117 11.887 3.448 1986 HE1 TRP 110 HE1 TRP 110 17.900 10.941 5.521 1987 HE3 TRP 110 HE3 TRP 110 22.799 8.925 5.330 1988 HZ2 TRP 110 HZ2 TRP 110 18.438 9.147 7.698 1989 HZ3 TRP 110 HZ3 TRP 110 22.439 7.610 7.382 1990 HH2 TRP 110 HH2 TRP 110 20.265 7.712 8.580 1991 H LEU 111 H LEU 111 23.594 8.107 1.755 1992 HA LEU 111 HA LEU 111 22.083 5.884 2.978 1993 1HB LEU 111 1HB LEU 111 23.367 5.746 0.824 1994 2HB LEU 111 2HB LEU 111 24.854 6.004 1.734 1995 HG LEU 111 HG LEU 111 24.103 3.981 3.160 1996 1HD1 LEU 111 1HD1 LEU 111 22.684 2.390 1.721 1997 2HD1 LEU 111 2HD1 LEU 111 22.240 3.818 0.786 1998 3HD1 LEU 111 3HD1 LEU 111 21.833 3.725 2.499 1999 1HD2 LEU 111 1HD2 LEU 111 24.614 2.620 0.734 2000 2HD2 LEU 111 2HD2 LEU 111 25.790 3.092 1.962 2001 3HD2 LEU 111 3HD2 LEU 111 25.445 4.171 0.610 2002 H SER 112 H SER 112 25.456 5.511 3.499 2003 HA SER 112 HA SER 112 25.704 6.862 6.034 2004 1HB SER 112 1HB SER 112 25.110 5.127 7.519 2005 2HB SER 112 2HB SER 112 23.883 4.984 6.261 2006 HG SER 112 HG SER 112 24.735 2.967 6.618 2007 H ARG 113 H ARG 113 27.890 7.189 5.880 2008 HA ARG 113 HA ARG 113 30.188 6.739 5.536 2009 1HB ARG 113 1HB ARG 113 28.886 4.526 7.038 2010 2HB ARG 113 2HB ARG 113 30.507 4.186 6.430 2011 1HG ARG 113 1HG ARG 113 31.046 5.173 8.455 2012 2HG ARG 113 2HG ARG 113 31.001 6.605 7.426 2013 1HD ARG 113 1HD ARG 113 28.362 6.397 8.142 2014 2HD ARG 113 2HD ARG 113 29.170 5.805 9.606 2015 HE ARG 113 HE ARG 113 29.253 8.530 8.619 2016 1HH1 ARG 113 1HH1 ARG 113 31.125 6.051 10.190 2017 2HH1 ARG 113 2HH1 ARG 113 32.155 7.185 10.993 2018 1HH2 ARG 113 1HH2 ARG 113 30.602 9.981 9.672 2019 2HH2 ARG 113 2HH2 ARG 113 31.863 9.394 10.704 2020 HA PRO 114 HA PRO 114 29.123 4.289 1.647 2021 1HB PRO 114 1HB PRO 114 30.453 6.597 0.348 2022 2HB PRO 114 2HB PRO 114 28.902 5.836 -0.042 2023 1HG PRO 114 1HG PRO 114 29.092 8.259 1.124 2024 2HG PRO 114 2HG PRO 114 27.743 7.154 1.417 2025 1HD PRO 114 1HD PRO 114 30.058 7.819 3.161 2026 2HD PRO 114 2HD PRO 114 28.389 7.399 3.600 2027 H ARG 115 H ARG 115 30.667 2.728 1.464 2028 HA ARG 115 HA ARG 115 33.351 3.318 0.577 2029 1HB ARG 115 1HB ARG 115 34.476 2.663 2.705 2030 2HB ARG 115 2HB ARG 115 33.492 4.112 2.904 2031 1HG ARG 115 1HG ARG 115 31.614 2.372 3.549 2032 2HG ARG 115 2HG ARG 115 32.991 1.328 3.899 2033 1HD ARG 115 1HD ARG 115 33.864 3.509 5.173 2034 2HD ARG 115 2HD ARG 115 32.125 3.847 5.264 2035 HE ARG 115 HE ARG 115 33.518 1.695 6.650 2036 1HH1 ARG 115 1HH1 ARG 115 30.523 2.652 5.156 2037 2HH1 ARG 115 2HH1 ARG 115 29.574 1.557 6.101 2038 1HH2 ARG 115 1HH2 ARG 115 32.266 0.282 7.864 2039 2HH2 ARG 115 2HH2 ARG 115 30.552 0.225 7.623 2040 H LEU 116 H LEU 116 31.199 1.015 2.225 2041 HA LEU 116 HA LEU 116 30.995 -1.327 1.996 2042 1HB LEU 116 1HB LEU 116 31.462 -0.039 -0.574 2043 2HB LEU 116 2HB LEU 116 32.059 -1.698 -0.587 2044 HG LEU 116 HG LEU 116 29.694 -1.625 -1.271 2045 1HD1 LEU 116 1HD1 LEU 116 30.704 -3.056 1.074 2046 2HD1 LEU 116 2HD1 LEU 116 29.763 -3.661 -0.289 2047 3HD1 LEU 116 3HD1 LEU 116 28.948 -2.903 1.079 2048 1HD2 LEU 116 1HD2 LEU 116 28.597 0.143 -0.309 2049 2HD2 LEU 116 2HD2 LEU 116 29.515 0.030 1.192 2050 3HD2 LEU 116 3HD2 LEU 116 28.173 -1.075 0.894 2051 H THR 117 H THR 117 32.600 -3.180 0.633 2052 HA THR 117 HA THR 117 35.354 -2.735 1.717 2053 HB THR 117 HB THR 117 33.564 -5.163 2.115 2054 HG1 THR 117 HG1 THR 117 34.519 -3.209 3.935 2055 1HG2 THR 117 1HG2 THR 117 35.350 -6.102 3.398 2056 2HG2 THR 117 2HG2 THR 117 36.257 -4.589 3.370 2057 3HG2 THR 117 3HG2 THR 117 36.082 -5.540 1.895 2058 H GLN 118 H GLN 118 33.456 -5.289 0.052 2059 HA GLN 118 HA GLN 118 35.510 -5.260 -2.127 2060 1HB GLN 118 1HB GLN 118 34.580 -7.444 -0.298 2061 2HB GLN 118 2HB GLN 118 34.962 -7.880 -1.963 2062 1HG GLN 118 1HG GLN 118 37.126 -6.398 -1.465 2063 2HG GLN 118 2HG GLN 118 36.763 -6.866 0.197 2064 1HE2 GLN 118 1HE2 GLN 118 36.351 -9.350 0.465 2065 2HE2 GLN 118 2HE2 GLN 118 37.341 -10.384 -0.449 2066 H ASN 119 H ASN 119 34.681 -6.065 -4.177 2067 HA ASN 119 HA ASN 119 31.690 -5.942 -4.355 2068 1HB ASN 119 1HB ASN 119 33.628 -4.371 -5.508 2069 2HB ASN 119 2HB ASN 119 33.362 -5.571 -6.772 2070 1HD2 ASN 119 1HD2 ASN 119 30.619 -6.080 -6.539 2071 2HD2 ASN 119 2HD2 ASN 119 29.741 -4.659 -6.839 2072 1H GLY 201 1H GLY 201 17.234 29.599 14.530 2073 2H GLY 201 2H GLY 201 16.977 30.324 13.016 2074 3H GLY 201 3H GLY 201 17.646 28.766 13.109 2075 1HA GLY 201 1HA GLY 201 15.653 27.782 13.722 2076 2HA GLY 201 2HA GLY 201 14.967 29.332 14.210 2077 H LYS 202 H LYS 202 13.320 29.759 12.803 2078 HA LYS 202 HA LYS 202 12.167 30.044 10.760 2079 1HB LYS 202 1HB LYS 202 15.078 30.589 10.105 2080 2HB LYS 202 2HB LYS 202 13.783 30.876 8.942 2081 1HG LYS 202 1HG LYS 202 13.311 31.989 11.643 2082 2HG LYS 202 2HG LYS 202 14.637 32.733 10.749 2083 1HD LYS 202 1HD LYS 202 13.242 33.614 9.155 2084 2HD LYS 202 2HD LYS 202 12.130 32.247 9.225 2085 1HE LYS 202 1HE LYS 202 11.842 33.358 11.740 2086 2HE LYS 202 2HE LYS 202 12.053 34.786 10.709 2087 1HZ LYS 202 1HZ LYS 202 10.186 32.523 10.197 2088 2HZ LYS 202 2HZ LYS 202 10.401 33.871 9.185 2089 3HZ LYS 202 3HZ LYS 202 9.735 34.070 10.735 2090 H ALA 203 H ALA 203 11.493 27.821 10.499 2091 HA ALA 203 HA ALA 203 13.034 25.676 9.510 2092 1HB ALA 203 1HB ALA 203 10.436 25.441 8.444 2093 2HB ALA 203 2HB ALA 203 10.249 26.432 9.891 2094 3HB ALA 203 3HB ALA 203 10.987 24.834 10.005 2095 HA PRO 204 HA PRO 204 11.772 26.840 5.051 2096 1HB PRO 204 1HB PRO 204 10.585 29.308 4.665 2097 2HB PRO 204 2HB PRO 204 9.678 27.802 4.889 2098 1HG PRO 204 1HG PRO 204 10.253 29.980 6.823 2099 2HG PRO 204 2HG PRO 204 8.812 28.968 6.657 2100 1HD PRO 204 1HD PRO 204 10.720 28.612 8.582 2101 2HD PRO 204 2HD PRO 204 9.677 27.312 7.972 2102 H ARG 205 H ARG 205 13.993 27.144 4.701 2103 HA ARG 205 HA ARG 205 15.047 29.935 5.023 2104 1HB ARG 205 1HB ARG 205 15.925 27.747 6.260 2105 2HB ARG 205 2HB ARG 205 16.763 27.484 4.731 2106 1HG ARG 205 1HG ARG 205 18.217 29.194 5.099 2107 2HG ARG 205 2HG ARG 205 16.959 30.241 5.758 2108 1HD ARG 205 1HD ARG 205 17.508 29.686 7.894 2109 2HD ARG 205 2HD ARG 205 17.542 27.956 7.505 2110 HE ARG 205 HE ARG 205 19.841 29.746 7.510 2111 1HH1 ARG 205 1HH1 ARG 205 18.422 26.933 6.028 2112 2HH1 ARG 205 2HH1 ARG 205 19.949 26.281 5.545 2113 1HH2 ARG 205 1HH2 ARG 205 21.812 28.878 6.872 2114 2HH2 ARG 205 2HH2 ARG 205 21.855 27.372 6.019 2115 H LYS 206 H LYS 206 14.854 27.119 2.872 2116 HA LYS 206 HA LYS 206 16.112 28.738 0.691 2117 1HB LYS 206 1HB LYS 206 15.897 25.839 1.425 2118 2HB LYS 206 2HB LYS 206 16.043 26.244 -0.286 2119 1HG LYS 206 1HG LYS 206 18.011 27.775 0.510 2120 2HG LYS 206 2HG LYS 206 17.988 26.759 1.952 2121 1HD LYS 206 1HD LYS 206 19.546 25.731 0.456 2122 2HD LYS 206 2HD LYS 206 18.080 24.753 0.369 2123 1HE LYS 206 1HE LYS 206 18.275 25.058 -1.894 2124 2HE LYS 206 2HE LYS 206 17.623 26.676 -1.571 2125 1HZ LYS 206 1HZ LYS 206 20.466 25.843 -1.736 2126 2HZ LYS 206 2HZ LYS 206 19.996 27.304 -1.009 2127 3HZ LYS 206 3HZ LYS 206 19.672 27.030 -2.653 2128 H GLN 207 H GLN 207 14.872 29.276 -1.089 2129 HA GLN 207 HA GLN 207 12.002 28.976 -1.006 2130 1HB GLN 207 1HB GLN 207 13.516 30.774 -2.092 2131 2HB GLN 207 2HB GLN 207 13.711 29.630 -3.420 2132 1HG GLN 207 1HG GLN 207 11.559 29.907 -4.149 2133 2HG GLN 207 2HG GLN 207 10.923 30.094 -2.515 2134 1HE2 GLN 207 1HE2 GLN 207 10.680 32.232 -1.701 2135 2HE2 GLN 207 2HE2 GLN 207 11.100 33.621 -2.581 2136 H LEU 208 H LEU 208 11.901 26.559 -0.823 2137 HA LEU 208 HA LEU 208 11.584 24.416 -1.766 2138 1HB LEU 208 1HB LEU 208 10.602 26.502 -3.496 2139 2HB LEU 208 2HB LEU 208 11.217 25.182 -4.491 2140 HG LEU 208 HG LEU 208 9.576 24.403 -2.137 2141 1HD1 LEU 208 1HD1 LEU 208 7.506 24.763 -3.653 2142 2HD1 LEU 208 2HD1 LEU 208 8.513 25.924 -4.517 2143 3HD1 LEU 208 3HD1 LEU 208 8.153 26.169 -2.808 2144 1HD2 LEU 208 1HD2 LEU 208 8.683 23.189 -4.495 2145 2HD2 LEU 208 2HD2 LEU 208 9.802 22.495 -3.322 2146 3HD2 LEU 208 3HD2 LEU 208 10.422 23.368 -4.724 2147 H ALA 209 H ALA 209 12.351 23.080 -3.876 2148 HA ALA 209 HA ALA 209 14.955 23.921 -4.941 2149 1HB ALA 209 1HB ALA 209 16.267 22.344 -3.724 2150 2HB ALA 209 2HB ALA 209 14.840 21.468 -3.169 2151 3HB ALA 209 3HB ALA 209 15.209 23.061 -2.508 2152 H THR 210 H THR 210 15.919 21.980 -6.231 2153 HA THR 210 HA THR 210 13.680 20.333 -7.366 2154 HB THR 210 HB THR 210 14.320 22.203 -8.827 2155 HG1 THR 210 HG1 THR 210 13.985 20.013 -9.680 2156 1HG2 THR 210 1HG2 THR 210 16.896 21.676 -9.680 2157 2HG2 THR 210 2HG2 THR 210 16.998 21.382 -7.944 2158 3HG2 THR 210 3HG2 THR 210 16.444 22.946 -8.543 2159 H LYS 211 H LYS 211 15.045 19.104 -5.398 2160 HA LYS 211 HA LYS 211 17.180 17.491 -6.753 2161 1HB LYS 211 1HB LYS 211 17.678 18.912 -4.685 2162 2HB LYS 211 2HB LYS 211 16.623 17.821 -3.787 2163 1HG LYS 211 1HG LYS 211 18.245 16.259 -3.657 2164 2HG LYS 211 2HG LYS 211 18.514 16.324 -5.399 2165 1HD LYS 211 1HD LYS 211 20.070 18.114 -5.196 2166 2HD LYS 211 2HD LYS 211 19.582 18.450 -3.535 2167 1HE LYS 211 1HE LYS 211 21.522 17.224 -3.133 2168 2HE LYS 211 2HE LYS 211 20.352 15.893 -3.210 2169 1HZ LYS 211 1HZ LYS 211 21.996 15.317 -4.760 2170 2HZ LYS 211 2HZ LYS 211 22.141 16.904 -5.346 2171 3HZ LYS 211 3HZ LYS 211 20.759 15.988 -5.711 2172 H ALA 212 H ALA 212 14.204 17.354 -4.837 2173 HA ALA 212 HA ALA 212 12.753 15.549 -4.372 2174 1HB ALA 212 1HB ALA 212 13.987 14.214 -6.776 2175 2HB ALA 212 2HB ALA 212 13.100 15.724 -6.982 2176 3HB ALA 212 3HB ALA 212 12.287 14.308 -6.316 2177 H ALA 213 H ALA 213 14.279 15.068 -2.490 2178 HA ALA 213 HA ALA 213 16.263 12.960 -2.775 2179 1HB ALA 213 1HB ALA 213 16.731 14.232 -0.922 2180 2HB ALA 213 2HB ALA 213 15.633 13.116 -0.110 2181 3HB ALA 213 3HB ALA 213 15.040 14.674 -0.686 2182 H ARG 214 H ARG 214 14.570 11.513 -3.956 2183 HA ARG 214 HA ARG 214 12.969 9.974 -1.937 2184 1HB ARG 214 1HB ARG 214 12.627 10.504 -4.908 2185 2HB ARG 214 2HB ARG 214 11.639 9.345 -4.018 2186 1HG ARG 214 1HG ARG 214 11.918 12.265 -3.250 2187 2HG ARG 214 2HG ARG 214 10.593 11.628 -4.224 2188 1HD ARG 214 1HD ARG 214 9.548 11.254 -2.228 2189 2HD ARG 214 2HD ARG 214 10.671 9.893 -2.047 2190 HE ARG 214 HE ARG 214 11.850 11.181 -0.455 2191 1HH1 ARG 214 1HH1 ARG 214 9.916 13.232 -2.498 2192 2HH1 ARG 214 2HH1 ARG 214 10.309 14.666 -1.615 2193 1HH2 ARG 214 1HH2 ARG 214 12.345 13.056 0.674 2194 2HH2 ARG 214 2HH2 ARG 214 11.673 14.570 0.168 2195 1HN MLZ 215 1HN MLZ 215 12.633 7.602 -2.862 2196 HA MLZ 215 HA MLZ 215 15.230 6.346 -2.975 2197 1HB MLZ 215 1HB MLZ 215 12.350 5.625 -3.000 2198 2HB MLZ 215 2HB MLZ 215 13.423 4.438 -3.742 2199 1HG MLZ 215 1HG MLZ 215 14.451 5.521 -1.211 2200 2HG MLZ 215 2HG MLZ 215 14.325 3.845 -1.746 2201 1HD MLZ 215 1HD MLZ 215 12.054 5.540 -0.659 2202 2HD MLZ 215 2HD MLZ 215 11.900 3.878 -1.231 2203 1HE MLZ 215 1HE MLZ 215 13.992 4.431 0.839 2204 2HE MLZ 215 2HE MLZ 215 12.961 3.002 0.630 2205 HZ MLZ 215 HZ MLZ 215 11.063 4.274 1.349 2206 1HCM MLZ 215 1HCM MLZ 215 12.611 3.247 3.010 2207 2HCM MLZ 215 2HCM MLZ 215 11.580 4.539 3.623 2208 3HCM MLZ 215 3HCM MLZ 215 13.269 4.866 3.239 2209 H SER 216 H SER 216 16.502 6.274 -4.777 2210 HA SER 216 HA SER 216 17.136 6.071 -7.043 2211 1HB SER 216 1HB SER 216 14.633 7.338 -7.972 2212 2HB SER 216 2HB SER 216 15.436 8.211 -6.666 2213 HG SER 216 HG SER 216 17.268 8.354 -7.887 2214 H ALA 217 H ALA 217 15.641 5.694 -9.355 2215 HA ALA 217 HA ALA 217 14.179 3.136 -8.779 2216 1HB ALA 217 1HB ALA 217 13.429 5.593 -10.131 2217 2HB ALA 217 2HB ALA 217 12.420 4.202 -9.737 2218 3HB ALA 217 3HB ALA 217 13.330 4.231 -11.247 2219 HA PRO 218 HA PRO 218 16.823 1.122 -11.644 2220 1HB PRO 218 1HB PRO 218 15.059 -0.269 -13.272 2221 2HB PRO 218 2HB PRO 218 15.527 -0.787 -11.642 2222 1HG PRO 218 1HG PRO 218 13.060 0.587 -12.564 2223 2HG PRO 218 2HG PRO 218 13.268 -0.631 -11.300 2224 1HD PRO 218 1HD PRO 218 12.925 2.025 -10.798 2225 2HD PRO 218 2HD PRO 218 13.808 0.928 -9.717 2226 H ALA 219 H ALA 219 14.042 2.761 -13.134 2227 HA ALA 219 HA ALA 219 13.876 3.978 -15.153 2228 1HB ALA 219 1HB ALA 219 16.647 4.304 -14.065 2229 2HB ALA 219 2HB ALA 219 15.396 5.522 -14.314 2230 3HB ALA 219 3HB ALA 219 16.334 4.928 -15.685 2231 H THR 220 H THR 220 13.420 2.003 -16.408 2232 HA THR 220 HA THR 220 15.233 1.621 -18.623 2233 HB THR 220 HB THR 220 16.469 0.442 -16.828 2234 HG1 THR 220 HG1 THR 220 16.704 -0.507 -18.787 2235 1HG2 THR 220 1HG2 THR 220 14.514 -0.092 -15.412 2236 2HG2 THR 220 2HG2 THR 220 15.461 -1.540 -15.757 2237 3HG2 THR 220 3HG2 THR 220 13.954 -1.245 -16.624 2238 H GLY 221 H GLY 221 14.470 -0.526 -19.852 2239 1HA GLY 221 1HA GLY 221 11.926 -1.665 -19.402 2240 2HA GLY 221 2HA GLY 221 11.671 -0.225 -20.389 2241 1HN SAH 301 1HN SAH 301 -11.454 -0.463 -8.438 2242 2HN SAH 301 2HN SAH 301 -10.207 0.116 -9.440 2243 HA SAH 301 HA SAH 301 -10.496 2.324 -8.165 2244 1HB SAH 301 1HB SAH 301 -11.936 0.217 -6.529 2245 2HB SAH 301 2HB SAH 301 -11.333 1.707 -5.808 2246 1HG SAH 301 1HG SAH 301 -13.783 1.336 -7.172 2247 2HG SAH 301 2HG SAH 301 -12.770 2.300 -8.245 2248 1H5* SAH 301 1H5* SAH 301 -15.368 2.460 -6.594 2249 2H5* SAH 301 2H5* SAH 301 -15.449 3.690 -5.333 2250 H4* SAH 301 H4* SAH 301 -14.746 5.235 -7.332 2251 H3* SAH 301 H3* SAH 301 -17.178 4.494 -5.975 2252 *HO3 SAH 301 *HO3 SAH 301 -17.605 6.755 -6.996 2253 H2* SAH 301 H2* SAH 301 -18.559 3.974 -7.657 2254 *HO2 SAH 301 *HO2 SAH 301 -17.921 5.956 -9.437 2255 H1* SAH 301 H1* SAH 301 -16.940 4.442 -9.993 2256 H8 SAH 301 H8 SAH 301 -16.046 1.231 -8.425 2257 1HN6 SAH 301 1HN6 SAH 301 -20.657 -1.487 -10.320 2258 2HN6 SAH 301 2HN6 SAH 301 -20.912 -1.139 -8.625 2259 H2 SAH 301 H2 SAH 301 -21.582 3.189 -10.963 2260 1HN SAH 302 1HN SAH 302 11.535 -0.418 8.451 2261 2HN SAH 302 2HN SAH 302 10.296 0.152 9.463 2262 HA SAH 302 HA SAH 302 10.557 2.360 8.182 2263 1HB SAH 302 1HB SAH 302 12.000 0.258 6.540 2264 2HB SAH 302 2HB SAH 302 11.384 1.745 5.821 2265 1HG SAH 302 1HG SAH 302 13.846 1.388 7.165 2266 2HG SAH 302 2HG SAH 302 12.838 2.348 8.247 2267 1H5* SAH 302 1H5* SAH 302 15.420 2.518 6.571 2268 2H5* SAH 302 2H5* SAH 302 15.483 3.747 5.309 2269 H4* SAH 302 H4* SAH 302 14.791 5.290 7.312 2270 H3* SAH 302 H3* SAH 302 17.215 4.559 5.935 2271 *HO3 SAH 302 *HO3 SAH 302 17.641 6.823 6.948 2272 H2* SAH 302 H2* SAH 302 18.612 4.048 7.606 2273 *HO2 SAH 302 *HO2 SAH 302 17.981 6.029 9.389 2274 H1* SAH 302 H1* SAH 302 17.011 4.510 9.955 2275 H8 SAH 302 H8 SAH 302 16.118 1.293 8.398 2276 1HN6 SAH 302 1HN6 SAH 302 20.758 -1.400 10.258 2277 2HN6 SAH 302 2HN6 SAH 302 20.997 -1.053 8.561 2278 H2 SAH 302 H2 SAH 302 21.667 3.281 10.888 Start of MODEL 4 1 1H MET 1 1H MET 1 -0.286 -13.415 -5.563 2 2H MET 1 2H MET 1 0.264 -12.199 -6.611 3 3H MET 1 3H MET 1 -0.632 -13.505 -7.223 4 HA MET 1 HA MET 1 -1.588 -11.248 -5.557 5 1HB MET 1 1HB MET 1 -2.442 -12.498 -8.194 6 2HB MET 1 2HB MET 1 -3.079 -11.009 -7.501 7 1HG MET 1 1HG MET 1 -0.205 -11.479 -8.351 8 2HG MET 1 2HG MET 1 -1.390 -10.507 -9.220 9 1HE MET 1 1HE MET 1 -1.812 -7.329 -7.448 10 2HE MET 1 2HE MET 1 -2.931 -8.679 -7.263 11 3HE MET 1 3HE MET 1 -2.132 -8.402 -8.811 12 H PHE 2 H PHE 2 -1.764 -14.649 -5.819 13 HA PHE 2 HA PHE 2 -4.392 -14.613 -4.396 14 1HB PHE 2 1HB PHE 2 -4.979 -16.652 -5.715 15 2HB PHE 2 2HB PHE 2 -4.713 -15.253 -6.753 16 HD1 PHE 2 HD1 PHE 2 -3.648 -18.605 -5.928 17 HD2 PHE 2 HD2 PHE 2 -2.453 -14.972 -7.883 18 HE1 PHE 2 HE1 PHE 2 -1.884 -19.845 -7.154 19 HE2 PHE 2 HE2 PHE 2 -0.689 -16.211 -9.108 20 HZ PHE 2 HZ PHE 2 -0.404 -18.647 -8.744 21 H ASN 3 H ASN 3 -3.787 -15.231 -2.352 22 HA ASN 3 HA ASN 3 -2.451 -17.849 -2.035 23 1HB ASN 3 1HB ASN 3 -0.650 -16.848 -0.649 24 2HB ASN 3 2HB ASN 3 -0.625 -16.198 -2.287 25 1HD2 ASN 3 1HD2 ASN 3 -1.154 -13.951 -2.579 26 2HD2 ASN 3 2HD2 ASN 3 -1.411 -12.897 -1.274 27 H ASP 4 H ASP 4 -1.987 -17.960 0.576 28 HA ASP 4 HA ASP 4 -3.019 -18.194 2.676 29 1HB ASP 4 1HB ASP 4 -3.784 -15.471 1.642 30 2HB ASP 4 2HB ASP 4 -4.389 -16.019 3.204 31 H ARG 5 H ARG 5 -5.733 -16.337 1.368 32 HA ARG 5 HA ARG 5 -7.367 -18.793 1.031 33 1HB ARG 5 1HB ARG 5 -7.615 -16.722 3.222 34 2HB ARG 5 2HB ARG 5 -9.001 -17.693 2.731 35 1HG ARG 5 1HG ARG 5 -7.156 -19.651 2.995 36 2HG ARG 5 2HG ARG 5 -6.533 -18.503 4.179 37 1HD ARG 5 1HD ARG 5 -9.424 -18.734 4.405 38 2HD ARG 5 2HD ARG 5 -8.640 -20.315 4.584 39 HE ARG 5 HE ARG 5 -8.355 -18.047 6.403 40 1HH1 ARG 5 1HH1 ARG 5 -6.824 -20.885 5.092 41 2HH1 ARG 5 2HH1 ARG 5 -5.781 -21.087 6.457 42 1HH2 ARG 5 1HH2 ARG 5 -6.990 -18.329 8.162 43 2HH2 ARG 5 2HH2 ARG 5 -5.872 -19.652 8.183 44 H VAL 6 H VAL 6 -6.502 -16.076 -0.378 45 HA VAL 6 HA VAL 6 -9.165 -15.640 -1.603 46 HB VAL 6 HB VAL 6 -7.529 -13.517 -0.165 47 1HG1 VAL 6 1HG1 VAL 6 -9.747 -12.206 -0.766 48 2HG1 VAL 6 2HG1 VAL 6 -9.829 -13.375 -2.084 49 3HG1 VAL 6 3HG1 VAL 6 -8.431 -12.310 -1.936 50 1HG2 VAL 6 1HG2 VAL 6 -8.779 -14.762 1.441 51 2HG2 VAL 6 2HG2 VAL 6 -10.186 -14.855 0.381 52 3HG2 VAL 6 3HG2 VAL 6 -9.740 -13.317 1.120 53 H ILE 7 H ILE 7 -9.006 -14.319 -3.577 54 HA ILE 7 HA ILE 7 -6.235 -14.236 -4.717 55 HB ILE 7 HB ILE 7 -7.580 -16.075 -5.623 56 1HG1 ILE 7 1HG1 ILE 7 -7.887 -14.176 -7.864 57 2HG1 ILE 7 2HG1 ILE 7 -6.290 -14.173 -7.116 58 1HG2 ILE 7 1HG2 ILE 7 -9.624 -14.767 -7.046 59 2HG2 ILE 7 2HG2 ILE 7 -9.666 -14.070 -5.426 60 3HG2 ILE 7 3HG2 ILE 7 -9.820 -15.813 -5.640 61 1HD1 ILE 7 1HD1 ILE 7 -7.483 -16.158 -8.858 62 2HD1 ILE 7 2HD1 ILE 7 -7.019 -16.887 -7.320 63 3HD1 ILE 7 3HD1 ILE 7 -5.817 -16.038 -8.291 64 H VAL 8 H VAL 8 -5.855 -12.490 -6.236 65 HA VAL 8 HA VAL 8 -7.645 -10.151 -5.765 66 HB VAL 8 HB VAL 8 -4.792 -10.473 -6.763 67 1HG1 VAL 8 1HG1 VAL 8 -5.537 -8.484 -7.794 68 2HG1 VAL 8 2HG1 VAL 8 -4.805 -7.918 -6.291 69 3HG1 VAL 8 3HG1 VAL 8 -6.559 -8.052 -6.423 70 1HG2 VAL 8 1HG2 VAL 8 -5.962 -10.424 -4.160 71 2HG2 VAL 8 2HG2 VAL 8 -5.073 -8.917 -4.377 72 3HG2 VAL 8 3HG2 VAL 8 -4.250 -10.462 -4.579 73 H LYS 9 H LYS 9 -8.628 -9.086 -7.466 74 HA LYS 9 HA LYS 9 -7.950 -9.850 -10.246 75 1HB LYS 9 1HB LYS 9 -10.581 -10.227 -8.823 76 2HB LYS 9 2HB LYS 9 -10.476 -10.188 -10.582 77 1HG LYS 9 1HG LYS 9 -8.542 -11.937 -10.210 78 2HG LYS 9 2HG LYS 9 -9.338 -12.189 -8.665 79 1HD LYS 9 1HD LYS 9 -11.471 -12.634 -9.864 80 2HD LYS 9 2HD LYS 9 -10.629 -12.427 -11.397 81 1HE LYS 9 1HE LYS 9 -9.155 -14.321 -10.882 82 2HE LYS 9 2HE LYS 9 -9.921 -14.499 -9.294 83 1HZ LYS 9 1HZ LYS 9 -11.305 -14.655 -11.926 84 2HZ LYS 9 2HZ LYS 9 -12.055 -14.803 -10.411 85 3HZ LYS 9 3HZ LYS 9 -10.946 -15.979 -10.926 86 H LYS 10 H LYS 10 -9.064 -6.528 -11.113 87 HA LYS 10 HA LYS 10 -8.338 -7.556 -13.044 88 1HB LYS 10 1HB LYS 10 -6.237 -7.553 -12.069 89 2HB LYS 10 2HB LYS 10 -6.700 -8.640 -10.775 90 1HG LYS 10 1HG LYS 10 -5.163 -9.679 -12.454 91 2HG LYS 10 2HG LYS 10 -6.697 -10.519 -12.301 92 1HD LYS 10 1HD LYS 10 -6.098 -10.249 -14.676 93 2HD LYS 10 2HD LYS 10 -7.548 -9.320 -14.298 94 1HE LYS 10 1HE LYS 10 -6.494 -7.312 -14.645 95 2HE LYS 10 2HE LYS 10 -4.976 -7.877 -13.921 96 1HZ LYS 10 1HZ LYS 10 -4.660 -9.299 -15.889 97 2HZ LYS 10 2HZ LYS 10 -4.700 -7.651 -16.300 98 3HZ LYS 10 3HZ LYS 10 -6.055 -8.632 -16.591 99 H SER 11 H SER 11 -10.496 -8.412 -13.402 100 HA SER 11 HA SER 11 -10.663 -11.381 -13.011 101 1HB SER 11 1HB SER 11 -13.114 -9.711 -13.374 102 2HB SER 11 2HB SER 11 -12.856 -11.097 -12.318 103 HG SER 11 HG SER 11 -13.053 -9.069 -11.208 104 HA PRO 12 HA PRO 12 -11.618 -12.147 -17.232 105 1HB PRO 12 1HB PRO 12 -14.571 -12.280 -16.836 106 2HB PRO 12 2HB PRO 12 -13.472 -13.498 -17.506 107 1HG PRO 12 1HG PRO 12 -14.538 -13.715 -15.051 108 2HG PRO 12 2HG PRO 12 -12.926 -14.326 -15.444 109 1HD PRO 12 1HD PRO 12 -13.710 -11.929 -13.883 110 2HD PRO 12 2HD PRO 12 -12.272 -12.961 -13.734 111 H LEU 13 H LEU 13 -14.458 -10.246 -16.111 112 HA LEU 13 HA LEU 13 -14.513 -8.652 -18.550 113 1HB LEU 13 1HB LEU 13 -16.023 -9.039 -16.054 114 2HB LEU 13 2HB LEU 13 -16.025 -7.364 -16.606 115 HG LEU 13 HG LEU 13 -17.915 -8.629 -17.578 116 1HD1 LEU 13 1HD1 LEU 13 -16.282 -6.897 -18.865 117 2HD1 LEU 13 2HD1 LEU 13 -17.712 -7.603 -19.617 118 3HD1 LEU 13 3HD1 LEU 13 -16.120 -8.298 -19.923 119 1HD2 LEU 13 1HD2 LEU 13 -16.910 -10.858 -17.591 120 2HD2 LEU 13 2HD2 LEU 13 -15.701 -10.332 -18.763 121 3HD2 LEU 13 3HD2 LEU 13 -17.400 -10.428 -19.230 122 H GLY 14 H GLY 14 -13.163 -8.280 -15.309 123 1HA GLY 14 1HA GLY 14 -11.089 -6.714 -15.472 124 2HA GLY 14 2HA GLY 14 -12.270 -5.523 -16.018 125 H GLY 15 H GLY 15 -12.263 -4.115 -14.270 126 1HA GLY 15 1HA GLY 15 -12.907 -3.348 -12.143 127 2HA GLY 15 2HA GLY 15 -13.701 -4.903 -11.895 128 H TYR 16 H TYR 16 -11.875 -3.262 -10.118 129 HA TYR 16 HA TYR 16 -9.754 -5.341 -9.680 130 1HB TYR 16 1HB TYR 16 -9.843 -2.393 -9.726 131 2HB TYR 16 2HB TYR 16 -8.953 -3.059 -8.359 132 HD1 TYR 16 HD1 TYR 16 -8.325 -1.719 -11.377 133 HD2 TYR 16 HD2 TYR 16 -7.714 -5.456 -9.348 134 HE1 TYR 16 HE1 TYR 16 -6.405 -2.214 -12.866 135 HE2 TYR 16 HE2 TYR 16 -5.794 -5.950 -10.838 136 HH TYR 16 HH TYR 16 -4.141 -3.918 -12.442 137 H GLY 17 H GLY 17 -11.330 -6.527 -8.332 138 1HA GLY 17 1HA GLY 17 -11.572 -5.326 -5.607 139 2HA GLY 17 2HA GLY 17 -12.945 -6.166 -6.330 140 H VAL 18 H VAL 18 -12.525 -7.495 -4.206 141 HA VAL 18 HA VAL 18 -10.272 -9.416 -4.543 142 HB VAL 18 HB VAL 18 -12.311 -8.899 -2.350 143 1HG1 VAL 18 1HG1 VAL 18 -10.620 -10.317 -1.009 144 2HG1 VAL 18 2HG1 VAL 18 -10.027 -10.865 -2.577 145 3HG1 VAL 18 3HG1 VAL 18 -11.697 -11.182 -2.106 146 1HG2 VAL 18 1HG2 VAL 18 -10.104 -8.181 -1.189 147 2HG2 VAL 18 2HG2 VAL 18 -10.814 -7.083 -2.372 148 3HG2 VAL 18 3HG2 VAL 18 -9.446 -8.101 -2.823 149 H PHE 19 H PHE 19 -10.634 -11.672 -4.688 150 HA PHE 19 HA PHE 19 -13.425 -12.476 -5.437 151 1HB PHE 19 1HB PHE 19 -10.741 -12.893 -6.585 152 2HB PHE 19 2HB PHE 19 -11.681 -14.379 -6.448 153 HD1 PHE 19 HD1 PHE 19 -12.173 -10.792 -7.458 154 HD2 PHE 19 HD2 PHE 19 -13.104 -14.919 -8.207 155 HE1 PHE 19 HE1 PHE 19 -13.510 -10.131 -9.440 156 HE2 PHE 19 HE2 PHE 19 -14.440 -14.258 -10.189 157 HZ PHE 19 HZ PHE 19 -14.642 -11.865 -10.807 158 H ALA 20 H ALA 20 -14.328 -13.800 -3.914 159 HA ALA 20 HA ALA 20 -12.616 -15.015 -1.846 160 1HB ALA 20 1HB ALA 20 -15.162 -13.878 -2.015 161 2HB ALA 20 2HB ALA 20 -14.510 -14.735 -0.618 162 3HB ALA 20 3HB ALA 20 -15.487 -15.599 -1.805 163 H ARG 21 H ARG 21 -11.580 -16.704 -3.143 164 HA ARG 21 HA ARG 21 -12.980 -18.704 -4.642 165 1HB ARG 21 1HB ARG 21 -10.350 -18.072 -3.783 166 2HB ARG 21 2HB ARG 21 -10.671 -19.716 -3.237 167 1HG ARG 21 1HG ARG 21 -10.852 -20.543 -5.374 168 2HG ARG 21 2HG ARG 21 -11.508 -19.035 -6.012 169 1HD ARG 21 1HD ARG 21 -9.445 -18.394 -6.698 170 2HD ARG 21 2HD ARG 21 -8.797 -18.619 -5.062 171 HE ARG 21 HE ARG 21 -8.671 -20.567 -7.244 172 1HH1 ARG 21 1HH1 ARG 21 -8.739 -20.098 -3.795 173 2HH1 ARG 21 2HH1 ARG 21 -7.953 -21.603 -3.465 174 1HH2 ARG 21 1HH2 ARG 21 -7.651 -22.515 -6.789 175 2HH2 ARG 21 2HH2 ARG 21 -7.341 -22.962 -5.145 176 H LYS 22 H LYS 22 -12.546 -18.156 -1.228 177 HA LYS 22 HA LYS 22 -13.484 -20.854 -0.456 178 1HB LYS 22 1HB LYS 22 -12.863 -18.353 1.174 179 2HB LYS 22 2HB LYS 22 -12.970 -19.996 1.792 180 1HG LYS 22 1HG LYS 22 -11.125 -20.388 -0.126 181 2HG LYS 22 2HG LYS 22 -10.789 -18.699 0.253 182 1HD LYS 22 1HD LYS 22 -10.234 -19.173 2.475 183 2HD LYS 22 2HD LYS 22 -11.124 -20.692 2.478 184 1HE LYS 22 1HE LYS 22 -8.719 -20.322 0.685 185 2HE LYS 22 2HE LYS 22 -8.541 -20.853 2.368 186 1HZ LYS 22 1HZ LYS 22 -10.122 -22.621 1.956 187 2HZ LYS 22 2HZ LYS 22 -8.847 -22.736 0.840 188 3HZ LYS 22 3HZ LYS 22 -10.345 -22.101 0.355 189 H SER 23 H SER 23 -16.696 -19.637 0.955 190 HA SER 23 HA SER 23 -14.295 -21.349 1.434 191 1HB SER 23 1HB SER 23 -16.695 -21.928 2.975 192 2HB SER 23 2HB SER 23 -17.074 -21.783 1.258 193 HG SER 23 HG SER 23 -15.217 -23.214 0.934 194 H PHE 24 H PHE 24 -16.189 -18.739 2.752 195 HA PHE 24 HA PHE 24 -14.483 -18.792 5.217 196 1HB PHE 24 1HB PHE 24 -15.539 -16.730 3.334 197 2HB PHE 24 2HB PHE 24 -15.427 -16.259 5.030 198 HD1 PHE 24 HD1 PHE 24 -13.097 -17.423 6.106 199 HD2 PHE 24 HD2 PHE 24 -13.711 -15.989 2.104 200 HE1 PHE 24 HE1 PHE 24 -10.654 -17.081 5.854 201 HE2 PHE 24 HE2 PHE 24 -11.269 -15.647 1.851 202 HZ PHE 24 HZ PHE 24 -9.739 -16.193 3.727 203 H GLU 25 H GLU 25 -15.507 -18.287 7.237 204 HA GLU 25 HA GLU 25 -18.406 -18.933 7.320 205 1HB GLU 25 1HB GLU 25 -16.027 -19.027 9.111 206 2HB GLU 25 2HB GLU 25 -17.574 -18.725 9.901 207 1HG GLU 25 1HG GLU 25 -18.487 -20.768 9.166 208 2HG GLU 25 2HG GLU 25 -17.282 -20.951 7.892 209 H LYS 26 H LYS 26 -19.147 -17.608 9.643 210 HA LYS 26 HA LYS 26 -19.265 -14.797 8.689 211 1HB LYS 26 1HB LYS 26 -21.239 -16.329 9.362 212 2HB LYS 26 2HB LYS 26 -20.713 -16.072 11.018 213 1HG LYS 26 1HG LYS 26 -21.062 -13.710 10.869 214 2HG LYS 26 2HG LYS 26 -21.268 -13.788 9.120 215 1HD LYS 26 1HD LYS 26 -23.323 -15.124 9.420 216 2HD LYS 26 2HD LYS 26 -23.117 -15.046 11.170 217 1HE LYS 26 1HE LYS 26 -24.356 -13.137 11.089 218 2HE LYS 26 2HE LYS 26 -22.945 -12.373 10.332 219 1HZ LYS 26 1HZ LYS 26 -24.756 -12.148 8.823 220 2HZ LYS 26 2HZ LYS 26 -25.187 -13.783 8.983 221 3HZ LYS 26 3HZ LYS 26 -23.746 -13.358 8.191 222 H GLY 27 H GLY 27 -17.846 -13.353 9.570 223 1HA GLY 27 1HA GLY 27 -16.807 -12.146 11.342 224 2HA GLY 27 2HA GLY 27 -17.326 -13.400 12.467 225 H GLU 28 H GLU 28 -15.422 -13.630 9.453 226 HA GLU 28 HA GLU 28 -13.193 -14.807 11.085 227 1HB GLU 28 1HB GLU 28 -14.891 -15.942 9.081 228 2HB GLU 28 2HB GLU 28 -13.273 -15.816 8.391 229 1HG GLU 28 1HG GLU 28 -13.894 -17.049 11.093 230 2HG GLU 28 2HG GLU 28 -13.652 -17.971 9.609 231 H LEU 29 H LEU 29 -11.260 -13.767 10.758 232 HA LEU 29 HA LEU 29 -10.898 -11.463 9.177 233 1HB LEU 29 1HB LEU 29 -9.458 -12.352 11.046 234 2HB LEU 29 2HB LEU 29 -8.835 -13.567 9.931 235 HG LEU 29 HG LEU 29 -8.025 -11.761 8.435 236 1HD1 LEU 29 1HD1 LEU 29 -9.057 -9.760 8.658 237 2HD1 LEU 29 2HD1 LEU 29 -8.022 -9.499 10.064 238 3HD1 LEU 29 3HD1 LEU 29 -9.643 -10.164 10.270 239 1HD2 LEU 29 1HD2 LEU 29 -6.244 -12.348 9.758 240 2HD2 LEU 29 2HD2 LEU 29 -7.135 -12.077 11.256 241 3HD2 LEU 29 3HD2 LEU 29 -6.463 -10.708 10.369 242 H VAL 30 H VAL 30 -9.459 -11.267 7.210 243 HA VAL 30 HA VAL 30 -9.629 -13.671 5.429 244 HB VAL 30 HB VAL 30 -10.379 -10.779 4.858 245 1HG1 VAL 30 1HG1 VAL 30 -9.650 -11.352 2.764 246 2HG1 VAL 30 2HG1 VAL 30 -11.205 -12.180 2.684 247 3HG1 VAL 30 3HG1 VAL 30 -9.745 -13.082 3.094 248 1HG2 VAL 30 1HG2 VAL 30 -11.916 -13.346 5.227 249 2HG2 VAL 30 2HG2 VAL 30 -12.590 -12.021 4.277 250 3HG2 VAL 30 3HG2 VAL 30 -12.196 -11.776 5.979 251 H GLU 31 H GLU 31 -8.468 -10.310 5.017 252 HA GLU 31 HA GLU 31 -5.696 -11.378 4.672 253 1HB GLU 31 1HB GLU 31 -7.088 -11.112 2.515 254 2HB GLU 31 2HB GLU 31 -6.998 -9.375 2.806 255 1HG GLU 31 1HG GLU 31 -5.043 -9.475 1.656 256 2HG GLU 31 2HG GLU 31 -4.376 -10.157 3.140 257 H GLU 32 H GLU 32 -5.938 -10.223 6.965 258 HA GLU 32 HA GLU 32 -6.141 -7.405 7.206 259 1HB GLU 32 1HB GLU 32 -4.834 -7.832 9.302 260 2HB GLU 32 2HB GLU 32 -6.138 -8.997 9.080 261 1HG GLU 32 1HG GLU 32 -4.643 -10.680 9.122 262 2HG GLU 32 2HG GLU 32 -3.825 -9.988 7.721 263 H CYS 33 H CYS 33 -4.531 -5.759 7.165 264 HA CYS 33 HA CYS 33 -1.786 -6.495 6.303 265 1HB CYS 33 1HB CYS 33 -3.937 -5.243 4.666 266 2HB CYS 33 2HB CYS 33 -2.335 -4.521 4.516 267 HG CYS 33 HG CYS 33 -1.850 -7.397 4.253 268 H LEU 34 H LEU 34 -0.871 -3.964 5.668 269 HA LEU 34 HA LEU 34 -1.193 -2.541 8.276 270 1HB LEU 34 1HB LEU 34 0.976 -3.299 6.526 271 2HB LEU 34 2HB LEU 34 0.986 -1.563 6.749 272 HG LEU 34 HG LEU 34 0.532 -2.294 9.289 273 1HD1 LEU 34 1HD1 LEU 34 1.868 -4.564 7.864 274 2HD1 LEU 34 2HD1 LEU 34 0.565 -4.620 9.050 275 3HD1 LEU 34 3HD1 LEU 34 2.214 -4.261 9.568 276 1HD2 LEU 34 1HD2 LEU 34 3.274 -2.313 7.985 277 2HD2 LEU 34 2HD2 LEU 34 2.917 -1.941 9.672 278 3HD2 LEU 34 3HD2 LEU 34 2.377 -0.850 8.395 279 H CYS 35 H CYS 35 -1.227 -0.144 8.183 280 HA CYS 35 HA CYS 35 -2.197 0.956 5.568 281 1HB CYS 35 1HB CYS 35 -3.401 1.073 8.344 282 2HB CYS 35 2HB CYS 35 -3.834 2.253 7.108 283 HG CYS 35 HG CYS 35 -4.385 -0.072 5.637 284 H ILE 36 H ILE 36 -2.404 3.528 5.965 285 HA ILE 36 HA ILE 36 0.174 4.365 7.271 286 HB ILE 36 HB ILE 36 -1.412 5.514 4.945 287 1HG1 ILE 36 1HG1 ILE 36 1.311 4.181 5.052 288 2HG1 ILE 36 2HG1 ILE 36 -0.166 3.420 4.459 289 1HG2 ILE 36 1HG2 ILE 36 1.272 6.392 6.051 290 2HG2 ILE 36 2HG2 ILE 36 -0.246 7.239 6.344 291 3HG2 ILE 36 3HG2 ILE 36 0.397 7.124 4.706 292 1HD1 ILE 36 1HD1 ILE 36 -0.200 4.678 2.528 293 2HD1 ILE 36 2HD1 ILE 36 1.541 4.676 2.813 294 3HD1 ILE 36 3HD1 ILE 36 0.570 6.067 3.294 295 H VAL 37 H VAL 37 0.120 6.326 8.517 296 HA VAL 37 HA VAL 37 -2.640 7.265 9.237 297 HB VAL 37 HB VAL 37 -0.151 6.963 10.957 298 1HG1 VAL 37 1HG1 VAL 37 -1.855 7.309 12.813 299 2HG1 VAL 37 2HG1 VAL 37 -2.986 7.829 11.563 300 3HG1 VAL 37 3HG1 VAL 37 -1.500 8.738 11.841 301 1HG2 VAL 37 1HG2 VAL 37 -2.695 5.378 11.231 302 2HG2 VAL 37 2HG2 VAL 37 -1.081 4.990 11.826 303 3HG2 VAL 37 3HG2 VAL 37 -1.440 4.860 10.105 304 H ARG 38 H ARG 38 -2.648 9.176 7.998 305 HA ARG 38 HA ARG 38 -0.541 11.196 8.701 306 1HB ARG 38 1HB ARG 38 -1.192 9.928 6.208 307 2HB ARG 38 2HB ARG 38 -1.574 11.639 6.077 308 1HG ARG 38 1HG ARG 38 1.069 10.487 7.018 309 2HG ARG 38 2HG ARG 38 0.767 11.181 5.424 310 1HD ARG 38 1HD ARG 38 0.059 13.319 6.619 311 2HD ARG 38 2HD ARG 38 0.711 12.592 8.094 312 HE ARG 38 HE ARG 38 2.583 12.378 5.891 313 1HH1 ARG 38 1HH1 ARG 38 1.323 14.543 8.309 314 2HH1 ARG 38 2HH1 ARG 38 2.757 15.508 8.350 315 1HH2 ARG 38 1HH2 ARG 38 4.434 13.647 5.963 316 2HH2 ARG 38 2HH2 ARG 38 4.506 15.007 7.033 317 H HIS 39 H HIS 39 -1.399 13.150 9.340 318 HA HIS 39 HA HIS 39 -4.093 13.581 9.957 319 1HB HIS 39 1HB HIS 39 -1.615 15.126 9.631 320 2HB HIS 39 2HB HIS 39 -3.062 16.096 9.355 321 HD1 HIS 39 HD1 HIS 39 -2.838 17.363 11.610 322 HD2 HIS 39 HD2 HIS 39 -3.159 13.229 12.042 323 HE1 HIS 39 HE1 HIS 39 -3.267 16.931 14.069 324 H ASN 40 H ASN 40 -5.369 15.536 8.885 325 HA ASN 40 HA ASN 40 -6.078 14.698 6.193 326 1HB ASN 40 1HB ASN 40 -7.437 15.700 8.225 327 2HB ASN 40 2HB ASN 40 -6.968 17.249 7.524 328 1HD2 ASN 40 1HD2 ASN 40 -8.795 17.967 6.391 329 2HD2 ASN 40 2HD2 ASN 40 -9.676 17.026 5.286 330 H ASP 41 H ASP 41 -6.552 17.832 5.713 331 HA ASP 41 HA ASP 41 -5.512 19.499 4.463 332 1HB ASP 41 1HB ASP 41 -2.989 18.349 5.702 333 2HB ASP 41 2HB ASP 41 -3.260 19.992 5.147 334 H ASP 42 H ASP 42 -2.691 19.145 3.425 335 HA ASP 42 HA ASP 42 -3.137 18.332 0.824 336 1HB ASP 42 1HB ASP 42 -0.746 18.162 2.665 337 2HB ASP 42 2HB ASP 42 -0.612 17.711 0.965 338 H TRP 43 H TRP 43 -2.663 16.219 3.606 339 HA TRP 43 HA TRP 43 -1.995 13.791 2.305 340 1HB TRP 43 1HB TRP 43 -1.966 14.112 4.726 341 2HB TRP 43 2HB TRP 43 -3.701 14.420 4.741 342 HD1 TRP 43 HD1 TRP 43 -4.913 12.418 5.695 343 HE1 TRP 43 HE1 TRP 43 -4.722 9.857 5.473 344 HE3 TRP 43 HE3 TRP 43 -0.818 12.096 2.661 345 HZ2 TRP 43 HZ2 TRP 43 -3.055 7.930 4.183 346 HZ3 TRP 43 HZ3 TRP 43 0.047 9.885 1.953 347 HH2 TRP 43 HH2 TRP 43 -1.064 7.803 2.708 348 H GLY 44 H GLY 44 -5.264 14.948 3.235 349 1HA GLY 44 1HA GLY 44 -6.631 12.836 1.848 350 2HA GLY 44 2HA GLY 44 -7.374 14.331 2.416 351 H THR 45 H THR 45 -6.103 16.272 0.983 352 HA THR 45 HA THR 45 -7.402 16.377 -1.478 353 HB THR 45 HB THR 45 -4.648 17.515 -0.913 354 HG1 THR 45 HG1 THR 45 -5.529 18.832 0.493 355 1HG2 THR 45 1HG2 THR 45 -6.796 19.153 -2.106 356 2HG2 THR 45 2HG2 THR 45 -6.270 17.795 -3.101 357 3HG2 THR 45 3HG2 THR 45 -5.102 19.006 -2.574 358 H ALA 46 H ALA 46 -4.083 15.170 -0.890 359 HA ALA 46 HA ALA 46 -3.669 14.508 -3.708 360 1HB ALA 46 1HB ALA 46 -2.241 14.254 -1.083 361 2HB ALA 46 2HB ALA 46 -1.693 15.002 -2.583 362 3HB ALA 46 3HB ALA 46 -1.689 13.246 -2.421 363 H LEU 47 H LEU 47 -4.151 12.585 -0.719 364 HA LEU 47 HA LEU 47 -4.477 10.126 -2.333 365 1HB LEU 47 1HB LEU 47 -4.264 10.866 0.591 366 2HB LEU 47 2HB LEU 47 -4.756 9.242 0.117 367 HG LEU 47 HG LEU 47 -2.337 9.294 0.472 368 1HD1 LEU 47 1HD1 LEU 47 -3.573 8.218 -1.682 369 2HD1 LEU 47 2HD1 LEU 47 -1.845 8.041 -1.377 370 3HD1 LEU 47 3HD1 LEU 47 -2.421 9.277 -2.495 371 1HD2 LEU 47 1HD2 LEU 47 -1.919 11.143 -1.832 372 2HD2 LEU 47 2HD2 LEU 47 -0.919 10.885 -0.403 373 3HD2 LEU 47 3HD2 LEU 47 -2.385 11.859 -0.289 374 H GLU 48 H GLU 48 -6.549 12.353 -2.376 375 HA GLU 48 HA GLU 48 -8.848 11.551 -0.853 376 1HB GLU 48 1HB GLU 48 -10.015 12.994 -2.562 377 2HB GLU 48 2HB GLU 48 -8.595 13.766 -1.857 378 1HG GLU 48 1HG GLU 48 -7.811 14.052 -3.949 379 2HG GLU 48 2HG GLU 48 -7.628 12.302 -4.056 380 H ASP 49 H ASP 49 -8.612 9.123 -1.304 381 HA ASP 49 HA ASP 49 -10.595 8.291 -3.226 382 1HB ASP 49 1HB ASP 49 -8.081 8.868 -4.281 383 2HB ASP 49 2HB ASP 49 -8.049 7.115 -4.092 384 H TYR 50 H TYR 50 -7.727 7.323 -1.340 385 HA TYR 50 HA TYR 50 -9.220 4.844 -0.543 386 1HB TYR 50 1HB TYR 50 -6.254 5.122 -1.160 387 2HB TYR 50 2HB TYR 50 -7.101 3.627 -0.774 388 HD1 TYR 50 HD1 TYR 50 -9.376 3.361 -2.322 389 HD2 TYR 50 HD2 TYR 50 -5.768 5.428 -3.404 390 HE1 TYR 50 HE1 TYR 50 -9.930 3.075 -4.722 391 HE2 TYR 50 HE2 TYR 50 -6.323 5.141 -5.803 392 HH TYR 50 HH TYR 50 -8.880 3.068 -6.862 393 H LEU 51 H LEU 51 -9.297 7.105 1.068 394 HA LEU 51 HA LEU 51 -7.328 6.458 3.241 395 1HB LEU 51 1HB LEU 51 -8.611 9.067 2.355 396 2HB LEU 51 2HB LEU 51 -7.627 8.908 3.807 397 HG LEU 51 HG LEU 51 -6.731 8.409 0.954 398 1HD1 LEU 51 1HD1 LEU 51 -6.269 10.617 1.040 399 2HD1 LEU 51 2HD1 LEU 51 -5.076 10.248 2.285 400 3HD1 LEU 51 3HD1 LEU 51 -6.719 10.699 2.743 401 1HD2 LEU 51 1HD2 LEU 51 -5.582 7.663 3.595 402 2HD2 LEU 51 2HD2 LEU 51 -4.464 8.360 2.423 403 3HD2 LEU 51 3HD2 LEU 51 -5.366 6.901 2.019 404 H PHE 52 H PHE 52 -8.231 5.885 5.170 405 HA PHE 52 HA PHE 52 -11.169 6.139 5.548 406 1HB PHE 52 1HB PHE 52 -8.883 4.727 6.959 407 2HB PHE 52 2HB PHE 52 -10.508 4.781 7.643 408 HD1 PHE 52 HD1 PHE 52 -8.329 3.024 5.452 409 HD2 PHE 52 HD2 PHE 52 -12.456 4.073 6.024 410 HE1 PHE 52 HE1 PHE 52 -9.010 1.148 3.980 411 HE2 PHE 52 HE2 PHE 52 -13.136 2.196 4.552 412 HZ PHE 52 HZ PHE 52 -11.414 0.734 3.530 413 H SER 53 H SER 53 -11.618 8.252 6.199 414 HA SER 53 HA SER 53 -9.719 9.716 7.890 415 1HB SER 53 1HB SER 53 -11.358 11.542 7.504 416 2HB SER 53 2HB SER 53 -10.943 10.730 5.993 417 HG SER 53 HG SER 53 -13.324 10.822 7.360 418 H ARG 54 H ARG 54 -9.724 9.258 10.043 419 HA ARG 54 HA ARG 54 -12.295 8.617 11.407 420 1HB ARG 54 1HB ARG 54 -9.974 7.353 11.526 421 2HB ARG 54 2HB ARG 54 -9.559 8.629 12.670 422 1HG ARG 54 1HG ARG 54 -10.876 7.743 14.285 423 2HG ARG 54 2HG ARG 54 -12.212 7.490 13.162 424 1HD ARG 54 1HD ARG 54 -11.735 5.274 13.158 425 2HD ARG 54 2HD ARG 54 -10.147 5.642 12.459 426 HE ARG 54 HE ARG 54 -9.955 6.289 15.188 427 1HH1 ARG 54 1HH1 ARG 54 -10.635 3.471 13.260 428 2HH1 ARG 54 2HH1 ARG 54 -9.989 2.377 14.433 429 1HH2 ARG 54 1HH2 ARG 54 -9.121 4.847 16.695 430 2HH2 ARG 54 2HH2 ARG 54 -9.137 3.147 16.362 431 H LYS 55 H LYS 55 -12.199 9.601 13.814 432 HA LYS 55 HA LYS 55 -12.255 12.489 13.479 433 1HB LYS 55 1HB LYS 55 -13.796 10.946 14.848 434 2HB LYS 55 2HB LYS 55 -12.491 10.861 16.031 435 1HG LYS 55 1HG LYS 55 -12.843 12.991 16.759 436 2HG LYS 55 2HG LYS 55 -13.176 13.593 15.135 437 1HD LYS 55 1HD LYS 55 -15.373 12.123 15.414 438 2HD LYS 55 2HD LYS 55 -15.047 12.374 17.129 439 1HE LYS 55 1HE LYS 55 -15.468 14.646 17.009 440 2HE LYS 55 2HE LYS 55 -14.892 14.766 15.335 441 1HZ LYS 55 1HZ LYS 55 -17.311 13.221 16.082 442 2HZ LYS 55 2HZ LYS 55 -16.834 13.735 14.535 443 3HZ LYS 55 3HZ LYS 55 -17.390 14.867 15.672 444 H ASN 56 H ASN 56 -9.972 12.857 13.027 445 HA ASN 56 HA ASN 56 -8.017 12.329 15.175 446 1HB ASN 56 1HB ASN 56 -7.576 14.791 15.390 447 2HB ASN 56 2HB ASN 56 -8.948 15.099 14.326 448 1HD2 ASN 56 1HD2 ASN 56 -8.074 13.697 17.503 449 2HD2 ASN 56 2HD2 ASN 56 -9.619 13.872 18.184 450 H MET 57 H MET 57 -8.459 11.777 12.206 451 HA MET 57 HA MET 57 -6.624 13.392 10.680 452 1HB MET 57 1HB MET 57 -4.680 11.857 10.743 453 2HB MET 57 2HB MET 57 -5.042 12.447 12.355 454 1HG MET 57 1HG MET 57 -6.304 9.915 11.442 455 2HG MET 57 2HG MET 57 -4.613 9.877 11.882 456 1HE MET 57 1HE MET 57 -3.650 10.718 13.567 457 2HE MET 57 2HE MET 57 -4.027 9.511 14.799 458 3HE MET 57 3HE MET 57 -4.245 11.227 15.150 459 H SER 58 H SER 58 -5.500 11.391 9.042 460 HA SER 58 HA SER 58 -7.804 9.722 8.144 461 1HB SER 58 1HB SER 58 -6.478 12.032 6.800 462 2HB SER 58 2HB SER 58 -6.856 10.647 5.776 463 HG SER 58 HG SER 58 -8.500 12.480 6.386 464 H ALA 59 H ALA 59 -7.050 7.673 7.773 465 HA ALA 59 HA ALA 59 -4.112 7.326 7.324 466 1HB ALA 59 1HB ALA 59 -5.371 4.879 7.970 467 2HB ALA 59 2HB ALA 59 -6.176 6.097 8.960 468 3HB ALA 59 3HB ALA 59 -4.425 5.897 9.059 469 H MET 60 H MET 60 -3.436 5.723 5.731 470 HA MET 60 HA MET 60 -5.273 5.552 3.415 471 1HB MET 60 1HB MET 60 -2.751 6.173 3.441 472 2HB MET 60 2HB MET 60 -2.463 4.452 3.679 473 1HG MET 60 1HG MET 60 -3.325 3.886 1.578 474 2HG MET 60 2HG MET 60 -4.263 5.374 1.453 475 1HE MET 60 1HE MET 60 -2.033 6.099 -1.486 476 2HE MET 60 2HE MET 60 -3.616 6.336 -0.746 477 3HE MET 60 3HE MET 60 -3.005 4.704 -1.018 478 H ALA 61 H ALA 61 -5.433 3.385 2.280 479 HA ALA 61 HA ALA 61 -6.135 1.303 4.216 480 1HB ALA 61 1HB ALA 61 -7.607 1.086 2.492 481 2HB ALA 61 2HB ALA 61 -6.305 0.296 1.602 482 3HB ALA 61 3HB ALA 61 -6.574 2.029 1.416 483 H LEU 62 H LEU 62 -3.440 1.953 2.068 484 HA LEU 62 HA LEU 62 -1.725 0.066 3.337 485 1HB LEU 62 1HB LEU 62 -0.921 0.651 0.629 486 2HB LEU 62 2HB LEU 62 -1.645 2.092 1.344 487 HG LEU 62 HG LEU 62 -0.167 1.732 3.358 488 1HD1 LEU 62 1HD1 LEU 62 1.932 0.262 2.429 489 2HD1 LEU 62 2HD1 LEU 62 0.581 -0.603 1.698 490 3HD1 LEU 62 3HD1 LEU 62 0.652 -0.397 3.448 491 1HD2 LEU 62 1HD2 LEU 62 1.711 2.793 2.365 492 2HD2 LEU 62 2HD2 LEU 62 0.349 3.241 1.338 493 3HD2 LEU 62 3HD2 LEU 62 1.462 1.971 0.825 494 H GLY 63 H GLY 63 -2.735 -2.020 3.319 495 1HA GLY 63 1HA GLY 63 -2.027 -3.700 1.130 496 2HA GLY 63 2HA GLY 63 -3.085 -4.170 2.458 497 H PHE 64 H PHE 64 -4.641 -5.219 1.202 498 HA PHE 64 HA PHE 64 -5.814 -3.943 -1.162 499 1HB PHE 64 1HB PHE 64 -6.530 -6.411 0.466 500 2HB PHE 64 2HB PHE 64 -7.171 -6.032 -1.132 501 HD1 PHE 64 HD1 PHE 64 -5.575 -5.851 -3.090 502 HD2 PHE 64 HD2 PHE 64 -4.386 -7.411 0.731 503 HE1 PHE 64 HE1 PHE 64 -3.586 -6.898 -4.137 504 HE2 PHE 64 HE2 PHE 64 -2.396 -8.458 -0.315 505 HZ PHE 64 HZ PHE 64 -1.996 -8.202 -2.750 506 H GLY 65 H GLY 65 -6.218 -2.150 0.896 507 1HA GLY 65 1HA GLY 65 -8.908 -2.636 2.026 508 2HA GLY 65 2HA GLY 65 -7.865 -1.264 2.399 509 H ALA 66 H ALA 66 -7.364 -0.864 -0.556 510 HA ALA 66 HA ALA 66 -9.743 0.827 -1.036 511 1HB ALA 66 1HB ALA 66 -7.866 2.041 -1.567 512 2HB ALA 66 2HB ALA 66 -8.026 1.226 -3.122 513 3HB ALA 66 3HB ALA 66 -6.912 0.598 -1.907 514 H ILE 67 H ILE 67 -7.948 -1.768 -2.704 515 HA ILE 67 HA ILE 67 -9.283 -2.006 -5.085 516 HB ILE 67 HB ILE 67 -8.885 -4.525 -4.780 517 1HG1 ILE 67 1HG1 ILE 67 -7.417 -5.031 -2.771 518 2HG1 ILE 67 2HG1 ILE 67 -7.982 -3.521 -2.068 519 1HG2 ILE 67 1HG2 ILE 67 -6.545 -2.760 -4.038 520 2HG2 ILE 67 2HG2 ILE 67 -7.239 -2.799 -5.659 521 3HG2 ILE 67 3HG2 ILE 67 -6.516 -4.255 -4.974 522 1HD1 ILE 67 1HD1 ILE 67 -10.157 -5.191 -3.104 523 2HD1 ILE 67 2HD1 ILE 67 -9.993 -4.406 -1.532 524 3HD1 ILE 67 3HD1 ILE 67 -9.230 -5.964 -1.819 525 H PHE 68 H PHE 68 -10.736 -2.684 -1.948 526 HA PHE 68 HA PHE 68 -12.867 -4.386 -2.705 527 1HB PHE 68 1HB PHE 68 -12.687 -2.072 -0.747 528 2HB PHE 68 2HB PHE 68 -14.030 -3.212 -0.778 529 HD1 PHE 68 HD1 PHE 68 -12.719 -5.768 -1.345 530 HD2 PHE 68 HD2 PHE 68 -11.459 -2.547 1.202 531 HE1 PHE 68 HE1 PHE 68 -11.401 -7.363 0.020 532 HE2 PHE 68 HE2 PHE 68 -10.140 -4.143 2.566 533 HZ PHE 68 HZ PHE 68 -10.111 -6.551 1.975 534 H ASN 69 H ASN 69 -14.875 -3.992 -3.712 535 HA ASN 69 HA ASN 69 -15.213 -1.254 -4.898 536 1HB ASN 69 1HB ASN 69 -15.716 -4.069 -5.888 537 2HB ASN 69 2HB ASN 69 -16.447 -2.674 -6.683 538 1HD2 ASN 69 1HD2 ASN 69 -14.253 -4.563 -7.644 539 2HD2 ASN 69 2HD2 ASN 69 -12.960 -3.540 -8.055 540 H HIS 70 H HIS 70 -17.740 -1.422 -5.863 541 HA HIS 70 HA HIS 70 -19.400 -1.695 -3.392 542 1HB HIS 70 1HB HIS 70 -19.189 0.487 -4.675 543 2HB HIS 70 2HB HIS 70 -19.987 -0.308 -6.032 544 HD1 HIS 70 HD1 HIS 70 -21.923 1.533 -5.604 545 HD2 HIS 70 HD2 HIS 70 -21.470 -1.356 -2.632 546 HE1 HIS 70 HE1 HIS 70 -24.035 1.604 -4.208 547 H SER 71 H SER 71 -20.373 -3.710 -3.341 548 HA SER 71 HA SER 71 -21.461 -4.783 -5.925 549 1HB SER 71 1HB SER 71 -19.544 -5.979 -4.746 550 2HB SER 71 2HB SER 71 -20.659 -6.299 -3.418 551 HG SER 71 HG SER 71 -22.027 -7.331 -4.961 552 H LYS 72 H LYS 72 -22.665 -3.031 -3.625 553 HA LYS 72 HA LYS 72 -24.740 -2.898 -2.499 554 1HB LYS 72 1HB LYS 72 -25.378 -4.967 -4.638 555 2HB LYS 72 2HB LYS 72 -26.560 -3.975 -3.785 556 1HG LYS 72 1HG LYS 72 -24.287 -2.702 -5.305 557 2HG LYS 72 2HG LYS 72 -25.766 -3.188 -6.133 558 1HD LYS 72 1HD LYS 72 -26.903 -1.887 -4.105 559 2HD LYS 72 2HD LYS 72 -25.352 -1.048 -4.086 560 1HE LYS 72 1HE LYS 72 -25.619 -0.508 -6.494 561 2HE LYS 72 2HE LYS 72 -27.192 -1.328 -6.493 562 1HZ LYS 72 1HZ LYS 72 -26.463 0.849 -4.605 563 2HZ LYS 72 2HZ LYS 72 -28.000 0.166 -4.844 564 3HZ LYS 72 3HZ LYS 72 -27.297 1.122 -6.059 565 H ASP 73 H ASP 73 -22.721 -5.112 -1.791 566 HA ASP 73 HA ASP 73 -24.304 -6.410 0.247 567 1HB ASP 73 1HB ASP 73 -24.104 -7.577 -2.438 568 2HB ASP 73 2HB ASP 73 -23.548 -8.687 -1.186 569 HA PRO 74 HA PRO 74 -19.588 -6.252 0.456 570 1HB PRO 74 1HB PRO 74 -19.654 -5.122 3.022 571 2HB PRO 74 2HB PRO 74 -19.402 -4.223 1.516 572 1HG PRO 74 1HG PRO 74 -21.859 -4.548 3.147 573 2HG PRO 74 2HG PRO 74 -21.309 -3.163 2.195 574 1HD PRO 74 1HD PRO 74 -23.288 -4.816 1.372 575 2HD PRO 74 2HD PRO 74 -22.192 -3.995 0.241 576 H ASN 75 H ASN 75 -20.005 -8.619 0.629 577 HA ASN 75 HA ASN 75 -20.962 -9.933 2.959 578 1HB ASN 75 1HB ASN 75 -19.001 -10.629 0.757 579 2HB ASN 75 2HB ASN 75 -19.461 -11.803 1.990 580 1HD2 ASN 75 1HD2 ASN 75 -21.938 -12.123 2.223 581 2HD2 ASN 75 2HD2 ASN 75 -22.866 -12.047 0.804 582 H ALA 76 H ALA 76 -17.991 -8.227 2.424 583 HA ALA 76 HA ALA 76 -16.982 -9.227 5.062 584 1HB ALA 76 1HB ALA 76 -15.901 -10.063 2.814 585 2HB ALA 76 2HB ALA 76 -14.841 -9.535 4.120 586 3HB ALA 76 3HB ALA 76 -15.180 -8.454 2.768 587 H ARG 77 H ARG 77 -16.082 -7.606 6.381 588 HA ARG 77 HA ARG 77 -16.244 -4.813 5.295 589 1HB ARG 77 1HB ARG 77 -17.717 -5.962 7.275 590 2HB ARG 77 2HB ARG 77 -16.362 -5.345 8.220 591 1HG ARG 77 1HG ARG 77 -16.700 -3.111 7.105 592 2HG ARG 77 2HG ARG 77 -18.164 -3.761 6.367 593 1HD ARG 77 1HD ARG 77 -19.234 -3.072 8.258 594 2HD ARG 77 2HD ARG 77 -18.425 -4.424 9.074 595 HE ARG 77 HE ARG 77 -16.482 -2.454 8.999 596 1HH1 ARG 77 1HH1 ARG 77 -19.778 -2.594 10.112 597 2HH1 ARG 77 2HH1 ARG 77 -19.527 -1.407 11.345 598 1HH2 ARG 77 1HH2 ARG 77 -16.182 -0.917 10.606 599 2HH2 ARG 77 2HH2 ARG 77 -17.507 -0.463 11.624 600 H HIS 78 H HIS 78 -14.737 -3.278 6.482 601 HA HIS 78 HA HIS 78 -12.105 -4.621 6.951 602 1HB HIS 78 1HB HIS 78 -11.228 -2.356 6.336 603 2HB HIS 78 2HB HIS 78 -12.256 -3.035 5.074 604 HD1 HIS 78 HD1 HIS 78 -14.600 -1.963 4.726 605 HD2 HIS 78 HD2 HIS 78 -12.331 -0.107 7.691 606 HE1 HIS 78 HE1 HIS 78 -15.774 0.214 5.268 607 H GLU 79 H GLU 79 -11.107 -4.370 8.930 608 HA GLU 79 HA GLU 79 -12.373 -2.488 10.896 609 1HB GLU 79 1HB GLU 79 -12.792 -4.995 11.146 610 2HB GLU 79 2HB GLU 79 -11.065 -5.165 11.463 611 1HG GLU 79 1HG GLU 79 -11.202 -3.765 13.405 612 2HG GLU 79 2HG GLU 79 -12.857 -3.293 13.025 613 H LEU 80 H LEU 80 -10.802 -1.894 12.688 614 HA LEU 80 HA LEU 80 -7.981 -1.800 11.663 615 1HB LEU 80 1HB LEU 80 -9.786 0.291 12.908 616 2HB LEU 80 2HB LEU 80 -8.035 0.496 12.856 617 HG LEU 80 HG LEU 80 -9.553 -0.211 10.354 618 1HD1 LEU 80 1HD1 LEU 80 -9.656 2.311 11.870 619 2HD1 LEU 80 2HD1 LEU 80 -10.700 1.737 10.569 620 3HD1 LEU 80 3HD1 LEU 80 -9.160 2.509 10.189 621 1HD2 LEU 80 1HD2 LEU 80 -7.570 0.218 9.337 622 2HD2 LEU 80 2HD2 LEU 80 -6.876 0.085 10.953 623 3HD2 LEU 80 3HD2 LEU 80 -7.293 1.669 10.300 624 H THR 81 H THR 81 -6.349 -1.981 13.271 625 HA THR 81 HA THR 81 -7.059 -3.437 15.673 626 HB THR 81 HB THR 81 -4.600 -3.264 16.062 627 HG1 THR 81 HG1 THR 81 -4.467 -1.760 13.685 628 1HG2 THR 81 1HG2 THR 81 -3.924 -4.475 14.090 629 2HG2 THR 81 2HG2 THR 81 -5.208 -3.739 13.132 630 3HG2 THR 81 3HG2 THR 81 -5.608 -4.891 14.406 631 H ALA 82 H ALA 82 -4.953 -0.576 15.686 632 HA ALA 82 HA ALA 82 -6.750 1.032 17.319 633 1HB ALA 82 1HB ALA 82 -4.721 0.678 19.171 634 2HB ALA 82 2HB ALA 82 -4.898 -0.939 18.491 635 3HB ALA 82 3HB ALA 82 -6.284 -0.135 19.226 636 H GLY 83 H GLY 83 -6.136 2.795 16.007 637 1HA GLY 83 1HA GLY 83 -4.604 4.761 16.232 638 2HA GLY 83 2HA GLY 83 -3.267 3.612 16.233 639 H LEU 84 H LEU 84 -5.948 3.038 14.089 640 HA LEU 84 HA LEU 84 -6.018 2.978 11.725 641 1HB LEU 84 1HB LEU 84 -4.561 5.531 12.452 642 2HB LEU 84 2HB LEU 84 -4.951 5.144 10.777 643 HG LEU 84 HG LEU 84 -6.961 5.298 13.042 644 1HD1 LEU 84 1HD1 LEU 84 -5.881 7.283 11.135 645 2HD1 LEU 84 2HD1 LEU 84 -6.682 7.533 12.686 646 3HD1 LEU 84 3HD1 LEU 84 -7.641 7.233 11.237 647 1HD2 LEU 84 1HD2 LEU 84 -8.219 5.482 10.543 648 2HD2 LEU 84 2HD2 LEU 84 -8.244 4.092 11.629 649 3HD2 LEU 84 3HD2 LEU 84 -7.031 4.192 10.353 650 H LYS 85 H LYS 85 -3.822 1.494 12.992 651 HA LYS 85 HA LYS 85 -1.568 1.943 11.087 652 1HB LYS 85 1HB LYS 85 -1.959 0.665 13.784 653 2HB LYS 85 2HB LYS 85 -0.569 0.199 12.803 654 1HG LYS 85 1HG LYS 85 -0.185 2.759 12.537 655 2HG LYS 85 2HG LYS 85 -1.258 2.910 13.928 656 1HD LYS 85 1HD LYS 85 0.232 1.286 15.153 657 2HD LYS 85 2HD LYS 85 1.352 1.376 13.793 658 1HE LYS 85 1HE LYS 85 0.668 4.058 14.530 659 2HE LYS 85 2HE LYS 85 1.137 3.183 16.001 660 1HZ LYS 85 1HZ LYS 85 2.643 3.080 13.437 661 2HZ LYS 85 2HZ LYS 85 3.115 2.408 14.924 662 3HZ LYS 85 3HZ LYS 85 3.056 4.095 14.735 663 H ARG 86 H ARG 86 -2.808 -1.028 12.652 664 HA ARG 86 HA ARG 86 -2.316 -2.545 10.177 665 1HB ARG 86 1HB ARG 86 -2.998 -3.048 13.046 666 2HB ARG 86 2HB ARG 86 -3.415 -4.310 11.887 667 1HG ARG 86 1HG ARG 86 -0.868 -3.637 11.098 668 2HG ARG 86 2HG ARG 86 -0.768 -3.443 12.848 669 1HD ARG 86 1HD ARG 86 -1.642 -5.729 13.167 670 2HD ARG 86 2HD ARG 86 -1.783 -5.925 11.410 671 HE ARG 86 HE ARG 86 0.872 -5.042 12.118 672 1HH1 ARG 86 1HH1 ARG 86 -1.220 -7.825 12.132 673 2HH1 ARG 86 2HH1 ARG 86 0.091 -8.948 12.033 674 1HH2 ARG 86 1HH2 ARG 86 2.557 -6.521 11.991 675 2HH2 ARG 86 2HH2 ARG 86 2.213 -8.218 11.954 676 H MET 87 H MET 87 -4.219 -4.257 9.729 677 HA MET 87 HA MET 87 -6.893 -2.972 9.943 678 1HB MET 87 1HB MET 87 -5.125 -2.986 7.630 679 2HB MET 87 2HB MET 87 -6.648 -3.794 7.259 680 1HG MET 87 1HG MET 87 -7.849 -1.805 8.247 681 2HG MET 87 2HG MET 87 -6.287 -0.995 8.367 682 1HE MET 87 1HE MET 87 -8.589 -2.753 5.153 683 2HE MET 87 2HE MET 87 -9.243 -1.121 5.299 684 3HE MET 87 3HE MET 87 -9.104 -2.147 6.727 685 H ARG 88 H ARG 88 -8.381 -4.536 10.368 686 HA ARG 88 HA ARG 88 -7.713 -7.378 9.676 687 1HB ARG 88 1HB ARG 88 -7.782 -6.926 12.056 688 2HB ARG 88 2HB ARG 88 -9.322 -6.084 11.903 689 1HG ARG 88 1HG ARG 88 -10.110 -8.403 10.892 690 2HG ARG 88 2HG ARG 88 -8.736 -9.022 11.801 691 1HD ARG 88 1HD ARG 88 -10.129 -7.197 13.501 692 2HD ARG 88 2HD ARG 88 -11.323 -8.305 12.803 693 HE ARG 88 HE ARG 88 -9.005 -9.803 13.553 694 1HH1 ARG 88 1HH1 ARG 88 -11.652 -8.038 14.965 695 2HH1 ARG 88 2HH1 ARG 88 -11.659 -8.989 16.410 696 1HH2 ARG 88 1HH2 ARG 88 -9.034 -11.023 15.436 697 2HH2 ARG 88 2HH2 ARG 88 -10.190 -10.667 16.677 698 H ILE 89 H ILE 89 -8.820 -7.760 7.758 699 HA ILE 89 HA ILE 89 -11.526 -6.638 7.354 700 HB ILE 89 HB ILE 89 -9.672 -8.399 5.706 701 1HG1 ILE 89 1HG1 ILE 89 -10.423 -5.585 5.018 702 2HG1 ILE 89 2HG1 ILE 89 -9.239 -5.841 6.299 703 1HG2 ILE 89 1HG2 ILE 89 -11.844 -8.873 4.890 704 2HG2 ILE 89 2HG2 ILE 89 -11.259 -7.589 3.832 705 3HG2 ILE 89 3HG2 ILE 89 -12.388 -7.213 5.134 706 1HD1 ILE 89 1HD1 ILE 89 -8.969 -7.277 3.665 707 2HD1 ILE 89 2HD1 ILE 89 -7.720 -6.903 4.853 708 3HD1 ILE 89 3HD1 ILE 89 -8.388 -5.621 3.843 709 H PHE 90 H PHE 90 -13.184 -7.744 8.325 710 HA PHE 90 HA PHE 90 -12.947 -10.697 8.682 711 1HB PHE 90 1HB PHE 90 -14.182 -8.394 10.052 712 2HB PHE 90 2HB PHE 90 -15.236 -9.805 9.967 713 HD1 PHE 90 HD1 PHE 90 -11.507 -9.642 10.199 714 HD2 PHE 90 HD2 PHE 90 -15.183 -10.726 12.136 715 HE1 PHE 90 HE1 PHE 90 -10.225 -10.704 12.040 716 HE2 PHE 90 HE2 PHE 90 -13.902 -11.786 13.976 717 HZ PHE 90 HZ PHE 90 -11.423 -11.773 13.927 718 H THR 91 H THR 91 -15.258 -11.771 8.542 719 HA THR 91 HA THR 91 -16.512 -10.891 5.963 720 HB THR 91 HB THR 91 -17.158 -13.391 5.943 721 HG1 THR 91 HG1 THR 91 -16.805 -14.080 7.944 722 1HG2 THR 91 1HG2 THR 91 -15.326 -13.718 4.646 723 2HG2 THR 91 2HG2 THR 91 -14.218 -13.393 5.979 724 3HG2 THR 91 3HG2 THR 91 -14.910 -12.055 5.059 725 H ILE 92 H ILE 92 -18.231 -9.616 6.776 726 HA ILE 92 HA ILE 92 -19.753 -10.035 9.100 727 HB ILE 92 HB ILE 92 -21.483 -8.722 7.832 728 1HG1 ILE 92 1HG1 ILE 92 -19.675 -8.566 5.475 729 2HG1 ILE 92 2HG1 ILE 92 -20.622 -10.044 5.641 730 1HG2 ILE 92 1HG2 ILE 92 -20.201 -6.935 8.313 731 2HG2 ILE 92 2HG2 ILE 92 -19.179 -7.257 6.912 732 3HG2 ILE 92 3HG2 ILE 92 -18.812 -8.012 8.463 733 1HD1 ILE 92 1HD1 ILE 92 -21.553 -7.232 5.213 734 2HD1 ILE 92 2HD1 ILE 92 -22.585 -8.321 6.140 735 3HD1 ILE 92 3HD1 ILE 92 -22.138 -8.727 4.483 736 H LYS 93 H LYS 93 -19.801 -11.826 6.104 737 HA LYS 93 HA LYS 93 -21.835 -13.654 7.271 738 1HB LYS 93 1HB LYS 93 -22.032 -12.459 4.488 739 2HB LYS 93 2HB LYS 93 -23.210 -13.514 5.261 740 1HG LYS 93 1HG LYS 93 -23.477 -11.750 7.054 741 2HG LYS 93 2HG LYS 93 -22.477 -10.686 6.066 742 1HD LYS 93 1HD LYS 93 -24.145 -11.206 4.161 743 2HD LYS 93 2HD LYS 93 -25.201 -11.823 5.432 744 1HE LYS 93 1HE LYS 93 -24.609 -9.491 6.583 745 2HE LYS 93 2HE LYS 93 -24.324 -9.008 4.900 746 1HZ LYS 93 1HZ LYS 93 -26.730 -10.523 5.750 747 2HZ LYS 93 2HZ LYS 93 -26.475 -9.709 4.281 748 3HZ LYS 93 3HZ LYS 93 -26.698 -8.825 5.714 749 HA PRO 94 HA PRO 94 -19.122 -16.718 5.648 750 1HB PRO 94 1HB PRO 94 -21.568 -18.276 4.966 751 2HB PRO 94 2HB PRO 94 -20.207 -18.723 6.011 752 1HG PRO 94 1HG PRO 94 -22.612 -18.062 6.999 753 2HG PRO 94 2HG PRO 94 -21.104 -17.686 7.844 754 1HD PRO 94 1HD PRO 94 -22.925 -15.888 6.326 755 2HD PRO 94 2HD PRO 94 -21.921 -15.543 7.752 756 H ILE 95 H ILE 95 -18.210 -16.783 3.625 757 HA ILE 95 HA ILE 95 -19.932 -16.047 1.296 758 HB ILE 95 HB ILE 95 -16.933 -15.999 1.804 759 1HG1 ILE 95 1HG1 ILE 95 -18.784 -13.660 1.332 760 2HG1 ILE 95 2HG1 ILE 95 -18.537 -14.321 2.948 761 1HG2 ILE 95 1HG2 ILE 95 -18.544 -15.075 -0.598 762 2HG2 ILE 95 2HG2 ILE 95 -17.392 -16.410 -0.571 763 3HG2 ILE 95 3HG2 ILE 95 -16.828 -14.754 -0.349 764 1HD1 ILE 95 1HD1 ILE 95 -16.996 -12.413 2.397 765 2HD1 ILE 95 2HD1 ILE 95 -16.291 -13.412 1.126 766 3HD1 ILE 95 3HD1 ILE 95 -16.151 -13.904 2.814 767 H ALA 96 H ALA 96 -19.879 -17.326 -0.605 768 HA ALA 96 HA ALA 96 -19.075 -20.151 -0.176 769 1HB ALA 96 1HB ALA 96 -21.344 -19.612 -0.938 770 2HB ALA 96 2HB ALA 96 -20.485 -20.442 -2.235 771 3HB ALA 96 3HB ALA 96 -20.694 -18.692 -2.296 772 H ILE 97 H ILE 97 -18.067 -21.278 -2.108 773 HA ILE 97 HA ILE 97 -15.654 -19.918 -2.935 774 HB ILE 97 HB ILE 97 -17.010 -22.488 -3.836 775 1HG1 ILE 97 1HG1 ILE 97 -14.724 -22.976 -2.252 776 2HG1 ILE 97 2HG1 ILE 97 -15.626 -21.709 -1.420 777 1HG2 ILE 97 1HG2 ILE 97 -15.361 -22.667 -5.356 778 2HG2 ILE 97 2HG2 ILE 97 -14.177 -22.606 -4.050 779 3HG2 ILE 97 3HG2 ILE 97 -14.694 -21.117 -4.842 780 1HD1 ILE 97 1HD1 ILE 97 -16.860 -23.437 -0.597 781 2HD1 ILE 97 2HD1 ILE 97 -16.331 -24.541 -1.867 782 3HD1 ILE 97 3HD1 ILE 97 -17.643 -23.405 -2.177 783 H GLY 98 H GLY 98 -15.477 -18.516 -4.630 784 1HA GLY 98 1HA GLY 98 -15.693 -18.064 -7.019 785 2HA GLY 98 2HA GLY 98 -17.221 -18.943 -7.008 786 H GLU 99 H GLU 99 -16.156 -16.445 -4.711 787 HA GLU 99 HA GLU 99 -18.415 -14.730 -5.699 788 1HB GLU 99 1HB GLU 99 -17.500 -15.597 -2.964 789 2HB GLU 99 2HB GLU 99 -18.351 -14.062 -3.143 790 1HG GLU 99 1HG GLU 99 -19.417 -16.656 -4.278 791 2HG GLU 99 2HG GLU 99 -19.817 -16.098 -2.654 792 H GLU 100 H GLU 100 -17.950 -12.458 -4.269 793 HA GLU 100 HA GLU 100 -15.096 -11.717 -4.787 794 1HB GLU 100 1HB GLU 100 -16.659 -11.115 -6.679 795 2HB GLU 100 2HB GLU 100 -17.557 -10.101 -5.549 796 1HG GLU 100 1HG GLU 100 -15.174 -9.070 -5.059 797 2HG GLU 100 2HG GLU 100 -14.791 -9.721 -6.652 798 H ILE 101 H ILE 101 -14.264 -10.767 -2.967 799 HA ILE 101 HA ILE 101 -16.100 -9.878 -0.829 800 HB ILE 101 HB ILE 101 -13.083 -10.134 -1.078 801 1HG1 ILE 101 1HG1 ILE 101 -15.078 -11.815 0.462 802 2HG1 ILE 101 2HG1 ILE 101 -14.455 -12.243 -1.131 803 1HG2 ILE 101 1HG2 ILE 101 -14.580 -8.639 0.797 804 2HG2 ILE 101 2HG2 ILE 101 -12.874 -9.075 0.899 805 3HG2 ILE 101 3HG2 ILE 101 -14.096 -10.118 1.628 806 1HD1 ILE 101 1HD1 ILE 101 -12.776 -11.791 1.356 807 2HD1 ILE 101 2HD1 ILE 101 -12.154 -12.221 -0.237 808 3HD1 ILE 101 3HD1 ILE 101 -13.163 -13.361 0.653 809 H THR 102 H THR 102 -16.409 -7.756 -0.261 810 HA THR 102 HA THR 102 -14.655 -5.625 -1.323 811 HB THR 102 HB THR 102 -16.663 -4.533 -2.382 812 HG1 THR 102 HG1 THR 102 -18.233 -5.650 -1.176 813 1HG2 THR 102 1HG2 THR 102 -16.559 -5.813 -4.376 814 2HG2 THR 102 2HG2 THR 102 -16.290 -7.315 -3.493 815 3HG2 THR 102 3HG2 THR 102 -15.010 -6.105 -3.584 816 H ILE 103 H ILE 103 -15.995 -3.405 -0.660 817 HA ILE 103 HA ILE 103 -17.321 -3.774 1.971 818 HB ILE 103 HB ILE 103 -15.647 -2.318 3.059 819 1HG1 ILE 103 1HG1 ILE 103 -13.509 -2.288 1.251 820 2HG1 ILE 103 2HG1 ILE 103 -14.913 -1.837 0.284 821 1HG2 ILE 103 1HG2 ILE 103 -15.318 -4.845 2.833 822 2HG2 ILE 103 2HG2 ILE 103 -13.864 -3.906 3.175 823 3HG2 ILE 103 3HG2 ILE 103 -14.178 -4.483 1.537 824 1HD1 ILE 103 1HD1 ILE 103 -13.505 -0.070 1.802 825 2HD1 ILE 103 2HD1 ILE 103 -14.746 -0.563 2.954 826 3HD1 ILE 103 3HD1 ILE 103 -15.211 0.133 1.402 827 H SER 104 H SER 104 -18.353 -1.761 2.711 828 HA SER 104 HA SER 104 -19.106 -0.008 0.432 829 1HB SER 104 1HB SER 104 -20.795 -1.159 1.878 830 2HB SER 104 2HB SER 104 -20.179 -0.264 3.267 831 HG SER 104 HG SER 104 -21.413 1.301 2.671 832 H TYR 105 H TYR 105 -19.824 2.301 1.820 833 HA TYR 105 HA TYR 105 -17.264 3.230 3.074 834 1HB TYR 105 1HB TYR 105 -18.925 4.785 1.061 835 2HB TYR 105 2HB TYR 105 -17.314 5.185 1.650 836 HD1 TYR 105 HD1 TYR 105 -15.818 2.718 1.486 837 HD2 TYR 105 HD2 TYR 105 -18.797 4.250 -1.201 838 HE1 TYR 105 HE1 TYR 105 -14.830 1.395 -0.367 839 HE2 TYR 105 HE2 TYR 105 -17.809 2.930 -3.052 840 HH TYR 105 HH TYR 105 -14.785 1.177 -2.648 841 H GLY 106 H GLY 106 -20.452 4.662 2.239 842 1HA GLY 106 1HA GLY 106 -22.073 5.639 3.634 843 2HA GLY 106 2HA GLY 106 -21.304 4.828 4.997 844 H ASP 107 H ASP 107 -21.615 6.845 6.198 845 HA ASP 107 HA ASP 107 -20.853 8.891 7.074 846 1HB ASP 107 1HB ASP 107 -18.806 7.594 7.272 847 2HB ASP 107 2HB ASP 107 -18.414 7.875 5.579 848 H ASP 108 H ASP 108 -18.794 9.193 4.210 849 HA ASP 108 HA ASP 108 -20.564 11.434 3.289 850 1HB ASP 108 1HB ASP 108 -18.399 12.054 4.415 851 2HB ASP 108 2HB ASP 108 -17.537 11.180 3.149 852 H TYR 109 H TYR 109 -18.453 8.752 2.351 853 HA TYR 109 HA TYR 109 -18.252 9.094 -0.418 854 1HB TYR 109 1HB TYR 109 -18.230 6.919 1.559 855 2HB TYR 109 2HB TYR 109 -18.717 6.378 -0.047 856 HD1 TYR 109 HD1 TYR 109 -16.123 8.483 1.659 857 HD2 TYR 109 HD2 TYR 109 -17.077 5.919 -1.653 858 HE1 TYR 109 HE1 TYR 109 -13.759 8.564 0.915 859 HE2 TYR 109 HE2 TYR 109 -14.713 6.000 -2.397 860 HH TYR 109 HH TYR 109 -12.210 7.204 -0.432 861 H TRP 110 H TRP 110 -20.124 9.982 -1.380 862 HA TRP 110 HA TRP 110 -22.810 9.255 -1.030 863 1HB TRP 110 1HB TRP 110 -23.037 10.161 -3.348 864 2HB TRP 110 2HB TRP 110 -21.985 11.162 -2.347 865 HD1 TRP 110 HD1 TRP 110 -19.548 11.484 -3.123 866 HE1 TRP 110 HE1 TRP 110 -18.137 10.567 -5.079 867 HE3 TRP 110 HE3 TRP 110 -22.732 7.928 -4.898 868 HZ2 TRP 110 HZ2 TRP 110 -18.343 8.574 -7.131 869 HZ3 TRP 110 HZ3 TRP 110 -22.114 6.536 -6.838 870 HH2 TRP 110 HH2 TRP 110 -19.924 6.850 -7.966 871 H LEU 111 H LEU 111 -24.146 7.661 -1.921 872 HA LEU 111 HA LEU 111 -22.761 5.239 -2.928 873 1HB LEU 111 1HB LEU 111 -24.497 5.348 -1.043 874 2HB LEU 111 2HB LEU 111 -25.694 5.683 -2.294 875 HG LEU 111 HG LEU 111 -24.897 3.567 -3.459 876 1HD1 LEU 111 1HD1 LEU 111 -22.743 3.278 -2.413 877 2HD1 LEU 111 2HD1 LEU 111 -23.757 1.929 -1.901 878 3HD1 LEU 111 3HD1 LEU 111 -23.466 3.278 -0.804 879 1HD2 LEU 111 1HD2 LEU 111 -25.953 2.097 -1.513 880 2HD2 LEU 111 2HD2 LEU 111 -26.941 3.249 -2.411 881 3HD2 LEU 111 3HD2 LEU 111 -26.310 3.680 -0.821 882 H SER 112 H SER 112 -23.543 4.162 -4.881 883 HA SER 112 HA SER 112 -23.984 5.898 -7.115 884 1HB SER 112 1HB SER 112 -24.413 2.916 -6.700 885 2HB SER 112 2HB SER 112 -24.347 3.703 -8.277 886 HG SER 112 HG SER 112 -22.255 3.974 -8.083 887 H ARG 113 H ARG 113 -26.019 4.655 -8.586 888 HA ARG 113 HA ARG 113 -28.344 6.060 -7.911 889 1HB ARG 113 1HB ARG 113 -27.445 4.149 -9.804 890 2HB ARG 113 2HB ARG 113 -28.968 3.530 -9.165 891 1HG ARG 113 1HG ARG 113 -29.880 4.921 -10.733 892 2HG ARG 113 2HG ARG 113 -29.611 6.150 -9.497 893 1HD ARG 113 1HD ARG 113 -27.142 6.012 -10.750 894 2HD ARG 113 2HD ARG 113 -28.281 5.807 -12.094 895 HE ARG 113 HE ARG 113 -27.984 8.207 -10.448 896 1HH1 ARG 113 1HH1 ARG 113 -30.142 6.302 -12.405 897 2HH1 ARG 113 2HH1 ARG 113 -31.168 7.644 -12.775 898 1HH2 ARG 113 1HH2 ARG 113 -29.330 9.934 -10.943 899 2HH2 ARG 113 2HH2 ARG 113 -30.714 9.686 -11.955 900 HA PRO 114 HA PRO 114 -29.370 3.726 -4.172 901 1HB PRO 114 1HB PRO 114 -31.785 5.460 -4.276 902 2HB PRO 114 2HB PRO 114 -30.619 5.240 -2.960 903 1HG PRO 114 1HG PRO 114 -30.701 7.472 -4.449 904 2HG PRO 114 2HG PRO 114 -29.194 6.831 -3.783 905 1HD PRO 114 1HD PRO 114 -30.219 6.745 -6.574 906 2HD PRO 114 2HD PRO 114 -28.549 6.866 -5.982 907 H ARG 115 H ARG 115 -29.874 1.753 -5.296 908 HA ARG 115 HA ARG 115 -32.782 1.426 -5.902 909 1HB ARG 115 1HB ARG 115 -30.368 0.838 -7.630 910 2HB ARG 115 2HB ARG 115 -31.898 0.001 -7.892 911 1HG ARG 115 1HG ARG 115 -33.048 2.109 -8.255 912 2HG ARG 115 2HG ARG 115 -31.601 3.018 -7.823 913 1HD ARG 115 1HD ARG 115 -31.665 2.983 -10.229 914 2HD ARG 115 2HD ARG 115 -30.448 1.779 -9.769 915 HE ARG 115 HE ARG 115 -32.854 0.374 -9.780 916 1HH1 ARG 115 1HH1 ARG 115 -31.079 2.306 -12.069 917 2HH1 ARG 115 2HH1 ARG 115 -31.678 1.432 -13.436 918 1HH2 ARG 115 1HH2 ARG 115 -33.617 -0.744 -11.570 919 2HH2 ARG 115 2HH2 ARG 115 -33.105 -0.281 -13.159 920 H LEU 116 H LEU 116 -29.685 -0.380 -5.748 921 HA LEU 116 HA LEU 116 -29.199 -2.500 -4.846 922 1HB LEU 116 1HB LEU 116 -30.391 -0.734 -3.013 923 2HB LEU 116 2HB LEU 116 -31.188 -2.278 -2.741 924 HG LEU 116 HG LEU 116 -28.520 -2.984 -3.042 925 1HD1 LEU 116 1HD1 LEU 116 -28.410 -0.806 -1.019 926 2HD1 LEU 116 2HD1 LEU 116 -28.359 -0.309 -2.711 927 3HD1 LEU 116 3HD1 LEU 116 -27.143 -1.421 -2.081 928 1HD2 LEU 116 1HD2 LEU 116 -29.207 -4.088 -1.205 929 2HD2 LEU 116 2HD2 LEU 116 -30.567 -2.982 -1.017 930 3HD2 LEU 116 3HD2 LEU 116 -29.013 -2.602 -0.275 931 H THR 117 H THR 117 -30.067 -3.907 -6.450 932 HA THR 117 HA THR 117 -32.749 -4.532 -6.972 933 HB THR 117 HB THR 117 -30.194 -6.168 -7.006 934 HG1 THR 117 HG1 THR 117 -30.327 -4.390 -8.411 935 1HG2 THR 117 1HG2 THR 117 -32.962 -6.855 -8.009 936 2HG2 THR 117 2HG2 THR 117 -31.918 -7.817 -6.960 937 3HG2 THR 117 3HG2 THR 117 -31.511 -7.613 -8.666 938 H GLN 118 H GLN 118 -30.850 -7.045 -5.372 939 HA GLN 118 HA GLN 118 -31.584 -8.698 -3.852 940 1HB GLN 118 1HB GLN 118 -31.809 -7.681 -1.657 941 2HB GLN 118 2HB GLN 118 -30.618 -6.772 -2.579 942 1HG GLN 118 1HG GLN 118 -32.154 -4.998 -3.000 943 2HG GLN 118 2HG GLN 118 -33.530 -5.964 -2.468 944 1HE2 GLN 118 1HE2 GLN 118 -34.239 -5.068 -0.522 945 2HE2 GLN 118 2HE2 GLN 118 -33.229 -4.628 0.768 946 H ASN 119 H ASN 119 -33.627 -8.401 -1.826 947 HA ASN 119 HA ASN 119 -36.118 -8.268 -3.485 948 1HB ASN 119 1HB ASN 119 -35.292 -10.594 -3.237 949 2HB ASN 119 2HB ASN 119 -35.277 -10.400 -1.484 950 1HD2 ASN 119 1HD2 ASN 119 -37.397 -10.173 -0.391 951 2HD2 ASN 119 2HD2 ASN 119 -38.819 -10.697 -1.157 952 1H GLY 201 1H GLY 201 -20.234 41.349 -5.942 953 2H GLY 201 2H GLY 201 -21.082 42.388 -4.901 954 3H GLY 201 3H GLY 201 -21.733 41.988 -6.418 955 1HA GLY 201 1HA GLY 201 -21.221 39.999 -4.279 956 2HA GLY 201 2HA GLY 201 -22.778 40.793 -4.522 957 H LYS 202 H LYS 202 -21.319 37.974 -5.125 958 HA LYS 202 HA LYS 202 -22.983 37.484 -7.545 959 1HB LYS 202 1HB LYS 202 -20.482 38.143 -7.971 960 2HB LYS 202 2HB LYS 202 -20.126 36.519 -7.384 961 1HG LYS 202 1HG LYS 202 -21.139 35.494 -9.196 962 2HG LYS 202 2HG LYS 202 -22.261 36.830 -9.457 963 1HD LYS 202 1HD LYS 202 -20.160 38.202 -10.099 964 2HD LYS 202 2HD LYS 202 -19.351 36.640 -10.235 965 1HE LYS 202 1HE LYS 202 -20.284 36.322 -12.275 966 2HE LYS 202 2HE LYS 202 -21.906 36.515 -11.582 967 1HZ LYS 202 1HZ LYS 202 -20.096 38.806 -12.118 968 2HZ LYS 202 2HZ LYS 202 -21.757 38.852 -11.766 969 3HZ LYS 202 3HZ LYS 202 -21.222 38.252 -13.262 970 H ALA 203 H ALA 203 -23.572 36.616 -4.945 971 HA ALA 203 HA ALA 203 -23.649 33.728 -5.310 972 1HB ALA 203 1HB ALA 203 -21.285 34.544 -4.410 973 2HB ALA 203 2HB ALA 203 -22.036 33.097 -3.736 974 3HB ALA 203 3HB ALA 203 -22.140 34.629 -2.870 975 HA PRO 204 HA PRO 204 -26.836 35.788 -2.573 976 1HB PRO 204 1HB PRO 204 -28.994 34.679 -3.920 977 2HB PRO 204 2HB PRO 204 -28.314 36.277 -4.276 978 1HG PRO 204 1HG PRO 204 -27.917 33.685 -5.679 979 2HG PRO 204 2HG PRO 204 -28.035 35.321 -6.342 980 1HD PRO 204 1HD PRO 204 -25.681 33.989 -6.059 981 2HD PRO 204 2HD PRO 204 -25.811 35.759 -5.986 982 H ARG 205 H ARG 205 -27.030 32.536 -4.073 983 HA ARG 205 HA ARG 205 -27.263 31.369 -1.338 984 1HB ARG 205 1HB ARG 205 -29.203 30.035 -2.130 985 2HB ARG 205 2HB ARG 205 -29.537 31.762 -2.248 986 1HG ARG 205 1HG ARG 205 -28.255 30.890 -4.669 987 2HG ARG 205 2HG ARG 205 -29.623 29.830 -4.331 988 1HD ARG 205 1HD ARG 205 -30.329 32.605 -3.813 989 2HD ARG 205 2HD ARG 205 -29.760 32.388 -5.480 990 HE ARG 205 HE ARG 205 -32.187 31.238 -4.343 991 1HH1 ARG 205 1HH1 ARG 205 -29.625 30.791 -6.659 992 2HH1 ARG 205 2HH1 ARG 205 -30.574 29.760 -7.672 993 1HH2 ARG 205 1HH2 ARG 205 -33.397 29.897 -5.676 994 2HH2 ARG 205 2HH2 ARG 205 -32.693 29.256 -7.122 995 H LYS 206 H LYS 206 -24.921 31.186 -2.688 996 HA LYS 206 HA LYS 206 -24.956 28.406 -3.818 997 1HB LYS 206 1HB LYS 206 -23.590 30.958 -4.674 998 2HB LYS 206 2HB LYS 206 -22.906 29.396 -5.122 999 1HG LYS 206 1HG LYS 206 -25.423 28.906 -5.846 1000 2HG LYS 206 2HG LYS 206 -25.474 30.663 -5.986 1001 1HD LYS 206 1HD LYS 206 -23.331 28.947 -7.268 1002 2HD LYS 206 2HD LYS 206 -24.794 29.464 -8.107 1003 1HE LYS 206 1HE LYS 206 -24.056 31.631 -8.309 1004 2HE LYS 206 2HE LYS 206 -23.265 31.611 -6.721 1005 1HZ LYS 206 1HZ LYS 206 -21.512 30.269 -7.586 1006 2HZ LYS 206 2HZ LYS 206 -21.697 31.580 -8.650 1007 3HZ LYS 206 3HZ LYS 206 -22.313 30.053 -9.068 1008 H GLN 207 H GLN 207 -22.964 27.189 -3.403 1009 HA GLN 207 HA GLN 207 -20.982 28.301 -1.531 1010 1HB GLN 207 1HB GLN 207 -23.340 27.228 -0.540 1011 2HB GLN 207 2HB GLN 207 -22.233 25.858 -0.461 1012 1HG GLN 207 1HG GLN 207 -21.470 26.766 1.465 1013 2HG GLN 207 2HG GLN 207 -20.695 27.985 0.454 1014 1HE2 GLN 207 1HE2 GLN 207 -21.252 30.085 1.040 1015 2HE2 GLN 207 2HE2 GLN 207 -22.719 30.544 1.758 1016 H LEU 208 H LEU 208 -19.255 26.655 -1.078 1017 HA LEU 208 HA LEU 208 -19.151 24.554 -3.221 1018 1HB LEU 208 1HB LEU 208 -17.519 26.834 -2.656 1019 2HB LEU 208 2HB LEU 208 -16.556 25.398 -2.310 1020 HG LEU 208 HG LEU 208 -18.097 25.865 -4.881 1021 1HD1 LEU 208 1HD1 LEU 208 -15.245 26.362 -4.068 1022 2HD1 LEU 208 2HD1 LEU 208 -16.316 27.376 -5.034 1023 3HD1 LEU 208 3HD1 LEU 208 -15.614 25.918 -5.734 1024 1HD2 LEU 208 1HD2 LEU 208 -17.838 23.626 -5.070 1025 2HD2 LEU 208 2HD2 LEU 208 -16.761 23.561 -3.675 1026 3HD2 LEU 208 3HD2 LEU 208 -16.115 23.950 -5.269 1027 H ALA 209 H ALA 209 -19.554 22.670 -2.070 1028 HA ALA 209 HA ALA 209 -17.555 21.759 -0.152 1029 1HB ALA 209 1HB ALA 209 -18.595 22.681 1.650 1030 2HB ALA 209 2HB ALA 209 -19.883 21.505 1.385 1031 3HB ALA 209 3HB ALA 209 -20.006 23.121 0.688 1032 H THR 210 H THR 210 -17.588 20.083 -1.872 1033 HA THR 210 HA THR 210 -19.966 18.263 -1.688 1034 HB THR 210 HB THR 210 -17.880 18.343 -3.880 1035 HG1 THR 210 HG1 THR 210 -20.301 19.808 -3.816 1036 1HG2 THR 210 1HG2 THR 210 -19.336 17.011 -5.040 1037 2HG2 THR 210 2HG2 THR 210 -20.759 17.811 -4.374 1038 3HG2 THR 210 3HG2 THR 210 -19.903 16.598 -3.422 1039 H LYS 211 H LYS 211 -16.500 18.546 -1.314 1040 HA LYS 211 HA LYS 211 -16.398 15.645 -0.552 1041 1HB LYS 211 1HB LYS 211 -15.021 17.146 -2.588 1042 2HB LYS 211 2HB LYS 211 -13.842 16.600 -1.395 1043 1HG LYS 211 1HG LYS 211 -14.056 14.435 -2.027 1044 2HG LYS 211 2HG LYS 211 -15.816 14.541 -2.075 1045 1HD LYS 211 1HD LYS 211 -14.026 15.712 -4.220 1046 2HD LYS 211 2HD LYS 211 -14.718 14.092 -4.317 1047 1HE LYS 211 1HE LYS 211 -16.748 16.068 -3.616 1048 2HE LYS 211 2HE LYS 211 -15.962 16.452 -5.160 1049 1HZ LYS 211 1HZ LYS 211 -17.715 14.880 -5.568 1050 2HZ LYS 211 2HZ LYS 211 -17.145 13.844 -4.349 1051 3HZ LYS 211 3HZ LYS 211 -16.232 14.075 -5.762 1052 H ALA 212 H ALA 212 -16.226 15.702 1.668 1053 HA ALA 212 HA ALA 212 -14.152 17.526 2.838 1054 1HB ALA 212 1HB ALA 212 -17.033 17.028 3.493 1055 2HB ALA 212 2HB ALA 212 -16.118 18.535 3.560 1056 3HB ALA 212 3HB ALA 212 -15.934 17.334 4.838 1057 H ALA 213 H ALA 213 -16.263 14.807 3.862 1058 HA ALA 213 HA ALA 213 -14.031 13.676 5.441 1059 1HB ALA 213 1HB ALA 213 -16.357 12.031 5.434 1060 2HB ALA 213 2HB ALA 213 -16.917 13.703 5.434 1061 3HB ALA 213 3HB ALA 213 -15.834 13.136 6.705 1062 H ARG 214 H ARG 214 -14.147 11.058 5.277 1063 HA ARG 214 HA ARG 214 -14.094 10.314 2.374 1064 1HB ARG 214 1HB ARG 214 -12.065 9.600 4.527 1065 2HB ARG 214 2HB ARG 214 -11.963 9.165 2.821 1066 1HG ARG 214 1HG ARG 214 -12.309 11.880 2.668 1067 2HG ARG 214 2HG ARG 214 -11.357 11.730 4.145 1068 1HD ARG 214 1HD ARG 214 -9.528 10.796 3.023 1069 2HD ARG 214 2HD ARG 214 -10.531 10.182 1.696 1070 HE ARG 214 HE ARG 214 -10.372 12.313 0.676 1071 1HH1 ARG 214 1HH1 ARG 214 -9.518 12.487 4.046 1072 2HH1 ARG 214 2HH1 ARG 214 -9.029 14.143 3.950 1073 1HH2 ARG 214 1HH2 ARG 214 -9.732 14.462 0.576 1074 2HH2 ARG 214 2HH2 ARG 214 -9.148 15.255 2.001 1075 1HN MLZ 215 1HN MLZ 215 -13.083 7.628 3.145 1076 HA MLZ 215 HA MLZ 215 -15.561 6.261 3.500 1077 1HB MLZ 215 1HB MLZ 215 -12.626 5.593 3.722 1078 2HB MLZ 215 2HB MLZ 215 -13.839 4.368 4.098 1079 1HG MLZ 215 1HG MLZ 215 -13.789 5.942 1.508 1080 2HG MLZ 215 2HG MLZ 215 -14.802 4.549 1.888 1081 1HD MLZ 215 1HD MLZ 215 -11.791 4.594 1.549 1082 2HD MLZ 215 2HD MLZ 215 -12.672 3.212 2.203 1083 1HE MLZ 215 1HE MLZ 215 -13.830 4.236 -0.302 1084 2HE MLZ 215 2HE MLZ 215 -13.382 2.577 0.136 1085 HZ MLZ 215 HZ MLZ 215 -11.089 3.078 -0.255 1086 1HCM MLZ 215 1HCM MLZ 215 -11.940 2.418 -2.260 1087 2HCM MLZ 215 2HCM MLZ 215 -11.307 4.008 -2.669 1088 3HCM MLZ 215 3HCM MLZ 215 -13.024 3.802 -2.342 1089 H SER 216 H SER 216 -16.739 5.972 5.347 1090 HA SER 216 HA SER 216 -17.268 5.786 7.641 1091 1HB SER 216 1HB SER 216 -15.075 7.422 8.607 1092 2HB SER 216 2HB SER 216 -15.722 8.101 7.113 1093 HG SER 216 HG SER 216 -16.843 8.838 8.969 1094 H ALA 217 H ALA 217 -15.952 5.478 9.915 1095 HA ALA 217 HA ALA 217 -14.013 3.260 9.377 1096 1HB ALA 217 1HB ALA 217 -13.751 5.787 10.946 1097 2HB ALA 217 2HB ALA 217 -12.518 4.888 10.061 1098 3HB ALA 217 3HB ALA 217 -13.034 4.341 11.656 1099 HA PRO 218 HA PRO 218 -16.148 0.852 12.352 1100 1HB PRO 218 1HB PRO 218 -13.737 0.608 14.075 1101 2HB PRO 218 2HB PRO 218 -14.664 -0.662 13.257 1102 1HG PRO 218 1HG PRO 218 -12.230 0.113 12.423 1103 2HG PRO 218 2HG PRO 218 -13.485 -0.446 11.308 1104 1HD PRO 218 1HD PRO 218 -12.513 2.316 11.836 1105 2HD PRO 218 2HD PRO 218 -13.118 1.593 10.330 1106 H ALA 219 H ALA 219 -14.142 3.464 13.617 1107 HA ALA 219 HA ALA 219 -14.466 4.911 15.458 1108 1HB ALA 219 1HB ALA 219 -16.524 5.216 14.019 1109 2HB ALA 219 2HB ALA 219 -16.805 5.550 15.727 1110 3HB ALA 219 3HB ALA 219 -17.342 4.023 15.028 1111 H THR 220 H THR 220 -13.399 3.531 17.028 1112 HA THR 220 HA THR 220 -14.472 1.309 18.376 1113 HB THR 220 HB THR 220 -12.941 2.239 20.259 1114 HG1 THR 220 HG1 THR 220 -11.768 4.031 19.704 1115 1HG2 THR 220 1HG2 THR 220 -12.242 1.483 17.469 1116 2HG2 THR 220 2HG2 THR 220 -11.788 0.714 18.990 1117 3HG2 THR 220 3HG2 THR 220 -10.940 2.161 18.445 1118 H GLY 221 H GLY 221 -14.981 1.521 20.907 1119 1HA GLY 221 1HA GLY 221 -17.468 3.046 21.085 1120 2HA GLY 221 2HA GLY 221 -16.807 1.994 22.337 1121 1H MET 1 1H MET 1 0.390 -13.439 5.646 1122 2H MET 1 2H MET 1 -0.158 -12.225 6.699 1123 3H MET 1 3H MET 1 0.748 -13.528 7.304 1124 HA MET 1 HA MET 1 1.683 -11.266 5.632 1125 1HB MET 1 1HB MET 1 2.560 -12.514 8.263 1126 2HB MET 1 2HB MET 1 3.186 -11.021 7.566 1127 1HG MET 1 1HG MET 1 0.320 -11.504 8.435 1128 2HG MET 1 2HG MET 1 1.506 -10.528 9.297 1129 1HE MET 1 1HE MET 1 1.903 -7.347 7.523 1130 2HE MET 1 2HE MET 1 3.027 -8.692 7.330 1131 3HE MET 1 3HE MET 1 2.237 -8.419 8.883 1132 H PHE 2 H PHE 2 1.875 -14.665 5.893 1133 HA PHE 2 HA PHE 2 4.491 -14.619 4.450 1134 1HB PHE 2 1HB PHE 2 5.096 -16.656 5.764 1135 2HB PHE 2 2HB PHE 2 4.832 -15.259 6.805 1136 HD1 PHE 2 HD1 PHE 2 3.775 -18.615 5.987 1137 HD2 PHE 2 HD2 PHE 2 2.578 -14.987 7.950 1138 HE1 PHE 2 HE1 PHE 2 2.025 -19.862 7.224 1139 HE2 PHE 2 HE2 PHE 2 0.828 -16.234 9.188 1140 HZ PHE 2 HZ PHE 2 0.551 -18.672 8.824 1141 H ASN 3 H ASN 3 3.871 -15.240 2.410 1142 HA ASN 3 HA ASN 3 2.551 -17.867 2.100 1143 1HB ASN 3 1HB ASN 3 0.734 -16.869 0.731 1144 2HB ASN 3 2HB ASN 3 0.719 -16.219 2.369 1145 1HD2 ASN 3 1HD2 ASN 3 1.240 -13.970 2.656 1146 2HD2 ASN 3 2HD2 ASN 3 1.483 -12.915 1.349 1147 H ASP 4 H ASP 4 2.068 -17.975 -0.506 1148 HA ASP 4 HA ASP 4 3.086 -18.204 -2.613 1149 1HB ASP 4 1HB ASP 4 3.846 -15.477 -1.583 1150 2HB ASP 4 2HB ASP 4 4.445 -16.021 -3.150 1151 H ARG 5 H ARG 5 5.801 -16.335 -1.323 1152 HA ARG 5 HA ARG 5 7.444 -18.784 -0.996 1153 1HB ARG 5 1HB ARG 5 7.673 -16.713 -3.190 1154 2HB ARG 5 2HB ARG 5 9.066 -17.680 -2.709 1155 1HG ARG 5 1HG ARG 5 7.227 -19.643 -2.961 1156 2HG ARG 5 2HG ARG 5 6.591 -18.498 -4.140 1157 1HD ARG 5 1HD ARG 5 9.481 -18.717 -4.385 1158 2HD ARG 5 2HD ARG 5 8.703 -20.301 -4.560 1159 HE ARG 5 HE ARG 5 8.396 -18.033 -6.376 1160 1HH1 ARG 5 1HH1 ARG 5 6.886 -20.878 -5.056 1161 2HH1 ARG 5 2HH1 ARG 5 5.834 -21.084 -6.413 1162 1HH2 ARG 5 1HH2 ARG 5 7.021 -18.321 -8.126 1163 2HH2 ARG 5 2HH2 ARG 5 5.908 -19.648 -8.139 1164 H VAL 6 H VAL 6 6.582 -16.071 0.419 1165 HA VAL 6 HA VAL 6 9.252 -15.626 1.624 1166 HB VAL 6 HB VAL 6 7.597 -13.509 0.200 1167 1HG1 VAL 6 1HG1 VAL 6 9.813 -12.188 0.786 1168 2HG1 VAL 6 2HG1 VAL 6 9.909 -13.357 2.102 1169 3HG1 VAL 6 3HG1 VAL 6 8.505 -12.298 1.964 1170 1HG2 VAL 6 1HG2 VAL 6 8.841 -14.746 -1.415 1171 2HG2 VAL 6 2HG2 VAL 6 10.255 -14.835 -0.365 1172 3HG2 VAL 6 3HG2 VAL 6 9.798 -13.298 -1.100 1173 H ILE 7 H ILE 7 9.101 -14.306 3.601 1174 HA ILE 7 HA ILE 7 6.336 -14.235 4.759 1175 HB ILE 7 HB ILE 7 7.695 -16.068 5.656 1176 1HG1 ILE 7 1HG1 ILE 7 8.009 -14.169 7.895 1177 2HG1 ILE 7 2HG1 ILE 7 6.408 -14.173 7.158 1178 1HG2 ILE 7 1HG2 ILE 7 9.743 -14.752 7.065 1179 2HG2 ILE 7 2HG2 ILE 7 9.772 -14.054 5.445 1180 3HG2 ILE 7 3HG2 ILE 7 9.934 -15.797 5.658 1181 1HD1 ILE 7 1HD1 ILE 7 7.620 -16.153 8.891 1182 2HD1 ILE 7 2HD1 ILE 7 7.149 -16.883 7.356 1183 3HD1 ILE 7 3HD1 ILE 7 5.950 -16.039 8.336 1184 H VAL 8 H VAL 8 5.959 -12.491 6.282 1185 HA VAL 8 HA VAL 8 7.736 -10.144 5.800 1186 HB VAL 8 HB VAL 8 4.892 -10.478 6.816 1187 1HG1 VAL 8 1HG1 VAL 8 5.635 -8.486 7.843 1188 2HG1 VAL 8 2HG1 VAL 8 4.891 -7.923 6.345 1189 3HG1 VAL 8 3HG1 VAL 8 6.646 -8.050 6.466 1190 1HG2 VAL 8 1HG2 VAL 8 6.044 -10.424 4.206 1191 2HG2 VAL 8 2HG2 VAL 8 5.150 -8.920 4.429 1192 3HG2 VAL 8 3HG2 VAL 8 4.334 -10.469 4.637 1193 H LYS 9 H LYS 9 8.723 -9.076 7.495 1194 HA LYS 9 HA LYS 9 8.068 -9.834 10.282 1195 1HB LYS 9 1HB LYS 9 10.694 -10.208 8.837 1196 2HB LYS 9 2HB LYS 9 10.601 -10.169 10.598 1197 1HG LYS 9 1HG LYS 9 8.670 -11.927 10.235 1198 2HG LYS 9 2HG LYS 9 9.462 -12.182 8.683 1199 1HD LYS 9 1HD LYS 9 11.600 -12.613 9.872 1200 2HD LYS 9 2HD LYS 9 10.767 -12.410 11.410 1201 1HE LYS 9 1HE LYS 9 9.299 -14.311 10.904 1202 2HE LYS 9 2HE LYS 9 10.057 -14.489 9.311 1203 1HZ LYS 9 1HZ LYS 9 11.457 -14.635 11.935 1204 2HZ LYS 9 2HZ LYS 9 12.198 -14.779 10.414 1205 3HZ LYS 9 3HZ LYS 9 11.097 -15.961 10.937 1206 H LYS 10 H LYS 10 9.188 -6.504 11.135 1207 HA LYS 10 HA LYS 10 8.468 -7.548 13.074 1208 1HB LYS 10 1HB LYS 10 6.360 -7.556 12.113 1209 2HB LYS 10 2HB LYS 10 6.818 -8.641 10.816 1210 1HG LYS 10 1HG LYS 10 5.295 -9.682 12.510 1211 2HG LYS 10 2HG LYS 10 6.822 -10.534 12.347 1212 1HD LYS 10 1HD LYS 10 6.251 -10.252 14.723 1213 2HD LYS 10 2HD LYS 10 7.693 -9.317 14.333 1214 1HE LYS 10 1HE LYS 10 6.634 -7.314 14.688 1215 2HE LYS 10 2HE LYS 10 5.114 -7.884 13.974 1216 1HZ LYS 10 1HZ LYS 10 4.817 -9.307 15.944 1217 2HZ LYS 10 2HZ LYS 10 4.853 -7.660 16.354 1218 3HZ LYS 10 3HZ LYS 10 6.214 -8.635 16.636 1219 H SER 11 H SER 11 10.633 -8.395 13.417 1220 HA SER 11 HA SER 11 10.809 -11.364 13.025 1221 1HB SER 11 1HB SER 11 13.255 -9.684 13.371 1222 2HB SER 11 2HB SER 11 12.995 -11.071 12.316 1223 HG SER 11 HG SER 11 13.176 -9.041 11.206 1224 HA PRO 12 HA PRO 12 11.796 -12.127 17.238 1225 1HB PRO 12 1HB PRO 12 14.746 -12.247 16.822 1226 2HB PRO 12 2HB PRO 12 13.657 -13.471 17.500 1227 1HG PRO 12 1HG PRO 12 14.707 -13.683 15.037 1228 2HG PRO 12 2HG PRO 12 13.100 -14.301 15.442 1229 1HD PRO 12 1HD PRO 12 13.864 -11.900 13.875 1230 2HD PRO 12 2HD PRO 12 12.429 -12.937 13.736 1231 H LEU 13 H LEU 13 14.620 -10.214 16.099 1232 HA LEU 13 HA LEU 13 14.685 -8.620 18.538 1233 1HB LEU 13 1HB LEU 13 16.179 -9.000 16.031 1234 2HB LEU 13 2HB LEU 13 16.178 -7.326 16.584 1235 HG LEU 13 HG LEU 13 18.081 -8.584 17.543 1236 1HD1 LEU 13 1HD1 LEU 13 16.448 -6.858 18.841 1237 2HD1 LEU 13 2HD1 LEU 13 17.887 -7.559 19.584 1238 3HD1 LEU 13 3HD1 LEU 13 16.300 -8.261 19.900 1239 1HD2 LEU 13 1HD2 LEU 13 17.084 -10.816 17.562 1240 2HD2 LEU 13 2HD2 LEU 13 15.882 -10.296 18.742 1241 3HD2 LEU 13 3HD2 LEU 13 17.583 -10.384 19.197 1242 H GLY 14 H GLY 14 13.312 -8.253 15.306 1243 1HA GLY 14 1HA GLY 14 11.232 -6.696 15.484 1244 2HA GLY 14 2HA GLY 14 12.412 -5.500 16.022 1245 H GLY 15 H GLY 15 12.387 -4.092 14.275 1246 1HA GLY 15 1HA GLY 15 13.013 -3.321 12.144 1247 2HA GLY 15 2HA GLY 15 13.812 -4.873 11.890 1248 H TYR 16 H TYR 16 11.968 -3.239 10.127 1249 HA TYR 16 HA TYR 16 9.853 -5.325 9.703 1250 1HB TYR 16 1HB TYR 16 9.926 -2.373 9.749 1251 2HB TYR 16 2HB TYR 16 9.032 -3.047 8.387 1252 HD1 TYR 16 HD1 TYR 16 8.419 -1.711 11.409 1253 HD2 TYR 16 HD2 TYR 16 7.810 -5.450 9.383 1254 HE1 TYR 16 HE1 TYR 16 6.511 -2.214 12.912 1255 HE2 TYR 16 HE2 TYR 16 5.902 -5.953 10.886 1256 HH TYR 16 HH TYR 16 4.252 -3.928 12.502 1257 H GLY 17 H GLY 17 11.425 -6.513 8.342 1258 1HA GLY 17 1HA GLY 17 11.640 -5.304 5.618 1259 2HA GLY 17 2HA GLY 17 13.022 -6.138 6.331 1260 H VAL 18 H VAL 18 12.587 -7.464 4.216 1261 HA VAL 18 HA VAL 18 10.351 -9.399 4.559 1262 HB VAL 18 HB VAL 18 12.375 -8.871 2.353 1263 1HG1 VAL 18 1HG1 VAL 18 10.680 -10.296 1.024 1264 2HG1 VAL 18 2HG1 VAL 18 10.100 -10.847 2.595 1265 3HG1 VAL 18 3HG1 VAL 18 11.768 -11.157 2.113 1266 1HG2 VAL 18 1HG2 VAL 18 10.156 -8.163 1.207 1267 2HG2 VAL 18 2HG2 VAL 18 10.869 -7.062 2.386 1268 3HG2 VAL 18 3HG2 VAL 18 9.509 -8.086 2.846 1269 H PHE 19 H PHE 19 10.724 -11.652 4.701 1270 HA PHE 19 HA PHE 19 13.523 -12.445 5.431 1271 1HB PHE 19 1HB PHE 19 10.850 -12.873 6.597 1272 2HB PHE 19 2HB PHE 19 11.795 -14.356 6.453 1273 HD1 PHE 19 HD1 PHE 19 12.279 -10.767 7.461 1274 HD2 PHE 19 HD2 PHE 19 13.231 -14.890 8.203 1275 HE1 PHE 19 HE1 PHE 19 13.626 -10.101 9.434 1276 HE2 PHE 19 HE2 PHE 19 14.579 -14.224 10.175 1277 HZ PHE 19 HZ PHE 19 14.776 -11.829 10.791 1278 H ALA 20 H ALA 20 14.422 -13.764 3.902 1279 HA ALA 20 HA ALA 20 12.701 -14.986 1.844 1280 1HB ALA 20 1HB ALA 20 15.243 -13.839 1.997 1281 2HB ALA 20 2HB ALA 20 14.585 -14.698 0.605 1282 3HB ALA 20 3HB ALA 20 15.574 -15.558 1.785 1283 H ARG 21 H ARG 21 11.680 -16.680 3.150 1284 HA ARG 21 HA ARG 21 13.103 -18.672 4.639 1285 1HB ARG 21 1HB ARG 21 10.461 -18.053 3.797 1286 2HB ARG 21 2HB ARG 21 10.781 -19.696 3.245 1287 1HG ARG 21 1HG ARG 21 10.984 -20.523 5.383 1288 2HG ARG 21 2HG ARG 21 11.637 -19.012 6.017 1289 1HD ARG 21 1HD ARG 21 9.576 -18.380 6.717 1290 2HD ARG 21 2HD ARG 21 8.918 -18.608 5.086 1291 HE ARG 21 HE ARG 21 8.816 -20.556 7.268 1292 1HH1 ARG 21 1HH1 ARG 21 8.858 -20.086 3.819 1293 2HH1 ARG 21 2HH1 ARG 21 8.076 -21.594 3.493 1294 1HH2 ARG 21 1HH2 ARG 21 7.801 -22.508 6.819 1295 2HH2 ARG 21 2HH2 ARG 21 7.481 -22.956 5.177 1296 H LYS 22 H LYS 22 12.639 -18.128 1.226 1297 HA LYS 22 HA LYS 22 13.583 -20.822 0.447 1298 1HB LYS 22 1HB LYS 22 12.946 -18.321 -1.176 1299 2HB LYS 22 2HB LYS 22 13.051 -19.964 -1.797 1300 1HG LYS 22 1HG LYS 22 11.220 -20.365 0.133 1301 2HG LYS 22 2HG LYS 22 10.874 -18.677 -0.244 1302 1HD LYS 22 1HD LYS 22 10.304 -19.154 -2.463 1303 2HD LYS 22 2HD LYS 22 11.205 -20.669 -2.472 1304 1HE LYS 22 1HE LYS 22 8.810 -20.308 -0.662 1305 2HE LYS 22 2HE LYS 22 8.621 -20.840 -2.343 1306 1HZ LYS 22 1HZ LYS 22 10.212 -22.602 -1.943 1307 2HZ LYS 22 2HZ LYS 22 8.946 -22.722 -0.818 1308 3HZ LYS 22 3HZ LYS 22 10.444 -22.081 -0.343 1309 H SER 23 H SER 23 16.780 -19.591 -0.986 1310 HA SER 23 HA SER 23 14.383 -21.312 -1.449 1311 1HB SER 23 1HB SER 23 16.776 -21.880 -3.006 1312 2HB SER 23 2HB SER 23 17.166 -21.734 -1.292 1313 HG SER 23 HG SER 23 15.317 -23.173 -0.955 1314 H PHE 24 H PHE 24 16.256 -18.694 -2.779 1315 HA PHE 24 HA PHE 24 14.536 -18.754 -5.231 1316 1HB PHE 24 1HB PHE 24 15.596 -16.687 -3.356 1317 2HB PHE 24 2HB PHE 24 15.470 -16.217 -5.050 1318 HD1 PHE 24 HD1 PHE 24 13.138 -17.389 -6.111 1319 HD2 PHE 24 HD2 PHE 24 13.772 -15.954 -2.113 1320 HE1 PHE 24 HE1 PHE 24 10.695 -17.058 -5.842 1321 HE2 PHE 24 HE2 PHE 24 11.330 -15.622 -1.844 1322 HZ PHE 24 HZ PHE 24 9.791 -16.174 -3.708 1323 H GLU 25 H GLU 25 15.542 -18.243 -7.259 1324 HA GLU 25 HA GLU 25 18.443 -18.877 -7.361 1325 1HB GLU 25 1HB GLU 25 16.054 -18.981 -9.137 1326 2HB GLU 25 2HB GLU 25 17.594 -18.671 -9.937 1327 1HG GLU 25 1HG GLU 25 18.521 -20.711 -9.209 1328 2HG GLU 25 2HG GLU 25 17.325 -20.900 -7.926 1329 H LYS 26 H LYS 26 19.164 -17.548 -9.689 1330 HA LYS 26 HA LYS 26 19.278 -14.738 -8.735 1331 1HB LYS 26 1HB LYS 26 21.253 -16.262 -9.426 1332 2HB LYS 26 2HB LYS 26 20.711 -16.006 -11.082 1333 1HG LYS 26 1HG LYS 26 21.055 -13.641 -10.927 1334 2HG LYS 26 2HG LYS 26 21.272 -13.721 -9.179 1335 1HD LYS 26 1HD LYS 26 23.331 -15.047 -9.494 1336 2HD LYS 26 2HD LYS 26 23.113 -14.970 -11.243 1337 1HE LYS 26 1HE LYS 26 24.344 -13.055 -11.169 1338 2HE LYS 26 2HE LYS 26 22.935 -12.298 -10.402 1339 1HZ LYS 26 1HZ LYS 26 24.756 -12.065 -8.905 1340 2HZ LYS 26 2HZ LYS 26 25.193 -13.698 -9.068 1341 3HZ LYS 26 3HZ LYS 26 23.755 -13.280 -8.267 1342 H GLY 27 H GLY 27 17.846 -13.299 -9.606 1343 1HA GLY 27 1HA GLY 27 16.790 -12.095 -11.370 1344 2HA GLY 27 2HA GLY 27 17.307 -13.347 -12.499 1345 H GLU 28 H GLU 28 15.424 -13.586 -9.473 1346 HA GLU 28 HA GLU 28 13.189 -14.771 -11.090 1347 1HB GLU 28 1HB GLU 28 14.905 -15.900 -9.097 1348 2HB GLU 28 2HB GLU 28 13.291 -15.781 -8.398 1349 1HG GLU 28 1HG GLU 28 13.899 -17.012 -11.103 1350 2HG GLU 28 2HG GLU 28 13.671 -17.934 -9.618 1351 H LEU 29 H LEU 29 11.254 -13.740 -10.749 1352 HA LEU 29 HA LEU 29 10.893 -11.438 -9.165 1353 1HB LEU 29 1HB LEU 29 9.444 -12.332 -11.024 1354 2HB LEU 29 2HB LEU 29 8.834 -13.551 -9.906 1355 HG LEU 29 HG LEU 29 8.026 -11.749 -8.404 1356 1HD1 LEU 29 1HD1 LEU 29 9.049 -9.744 -8.632 1357 2HD1 LEU 29 2HD1 LEU 29 8.003 -9.489 -10.029 1358 3HD1 LEU 29 3HD1 LEU 29 9.625 -10.145 -10.249 1359 1HD2 LEU 29 1HD2 LEU 29 6.239 -12.342 -9.715 1360 2HD2 LEU 29 2HD2 LEU 29 7.118 -12.067 -11.219 1361 3HD2 LEU 29 3HD2 LEU 29 6.448 -10.701 -10.327 1362 H VAL 30 H VAL 30 9.467 -11.249 -7.188 1363 HA VAL 30 HA VAL 30 9.659 -13.652 -5.409 1364 HB VAL 30 HB VAL 30 10.401 -10.758 -4.842 1365 1HG1 VAL 30 1HG1 VAL 30 9.688 -11.334 -2.744 1366 2HG1 VAL 30 2HG1 VAL 30 11.247 -12.156 -2.675 1367 3HG1 VAL 30 3HG1 VAL 30 9.789 -13.063 -3.075 1368 1HG2 VAL 30 1HG2 VAL 30 11.946 -13.318 -5.222 1369 2HG2 VAL 30 2HG2 VAL 30 12.620 -11.990 -4.277 1370 3HG2 VAL 30 3HG2 VAL 30 12.215 -11.746 -5.976 1371 H GLU 31 H GLU 31 8.486 -10.296 -4.988 1372 HA GLU 31 HA GLU 31 5.722 -11.376 -4.625 1373 1HB GLU 31 1HB GLU 31 7.127 -11.105 -2.477 1374 2HB GLU 31 2HB GLU 31 7.028 -9.369 -2.767 1375 1HG GLU 31 1HG GLU 31 5.081 -9.477 -1.604 1376 2HG GLU 31 2HG GLU 31 4.407 -10.161 -3.083 1377 H GLU 32 H GLU 32 5.944 -10.220 -6.918 1378 HA GLU 32 HA GLU 32 6.133 -7.401 -7.160 1379 1HB GLU 32 1HB GLU 32 4.813 -7.831 -9.248 1380 2HB GLU 32 2HB GLU 32 6.124 -8.992 -9.035 1381 1HG GLU 32 1HG GLU 32 4.636 -10.680 -9.067 1382 2HG GLU 32 2HG GLU 32 3.824 -9.993 -7.661 1383 H CYS 33 H CYS 33 4.515 -5.761 -7.107 1384 HA CYS 33 HA CYS 33 1.780 -6.509 -6.227 1385 1HB CYS 33 1HB CYS 33 3.937 -5.249 -4.605 1386 2HB CYS 33 2HB CYS 33 2.334 -4.533 -4.443 1387 HG CYS 33 HG CYS 33 1.862 -7.411 -4.178 1388 H LEU 34 H LEU 34 0.859 -3.981 -5.585 1389 HA LEU 34 HA LEU 34 1.161 -2.552 -8.193 1390 1HB LEU 34 1HB LEU 34 -0.996 -3.318 -6.425 1391 2HB LEU 34 2HB LEU 34 -1.009 -1.569 -6.645 1392 HG LEU 34 HG LEU 34 -0.577 -2.317 -9.195 1393 1HD1 LEU 34 1HD1 LEU 34 -1.900 -4.612 -7.772 1394 2HD1 LEU 34 2HD1 LEU 34 -0.602 -4.653 -8.965 1395 3HD1 LEU 34 3HD1 LEU 34 -2.254 -4.294 -9.470 1396 1HD2 LEU 34 1HD2 LEU 34 -3.309 -2.347 -7.873 1397 2HD2 LEU 34 2HD2 LEU 34 -2.964 -1.974 -9.562 1398 3HD2 LEU 34 3HD2 LEU 34 -2.421 -0.881 -8.289 1399 H CYS 35 H CYS 35 1.182 -0.159 -8.101 1400 HA CYS 35 HA CYS 35 2.164 0.945 -5.493 1401 1HB CYS 35 1HB CYS 35 3.349 1.067 -8.276 1402 2HB CYS 35 2HB CYS 35 3.786 2.248 -7.043 1403 HG CYS 35 HG CYS 35 4.357 -0.075 -5.577 1404 H ILE 36 H ILE 36 2.350 3.518 -5.891 1405 HA ILE 36 HA ILE 36 -0.233 4.344 -7.179 1406 HB ILE 36 HB ILE 36 1.365 5.498 -4.863 1407 1HG1 ILE 36 1HG1 ILE 36 -1.353 4.153 -4.951 1408 2HG1 ILE 36 2HG1 ILE 36 0.132 3.399 -4.369 1409 1HG2 ILE 36 1HG2 ILE 36 -1.330 6.365 -5.950 1410 2HG2 ILE 36 2HG2 ILE 36 0.183 7.219 -6.253 1411 3HG2 ILE 36 3HG2 ILE 36 -0.449 7.100 -4.611 1412 1HD1 ILE 36 1HD1 ILE 36 0.173 4.656 -2.437 1413 2HD1 ILE 36 2HD1 ILE 36 -1.569 4.647 -2.711 1414 3HD1 ILE 36 3HD1 ILE 36 -0.607 6.042 -3.198 1415 H VAL 37 H VAL 37 -0.194 6.306 -8.424 1416 HA VAL 37 HA VAL 37 2.557 7.256 -9.163 1417 HB VAL 37 HB VAL 37 0.055 6.945 -10.867 1418 1HG1 VAL 37 1HG1 VAL 37 1.748 7.301 -12.733 1419 2HG1 VAL 37 2HG1 VAL 37 2.885 7.823 -11.489 1420 3HG1 VAL 37 3HG1 VAL 37 1.393 8.727 -11.757 1421 1HG2 VAL 37 1HG2 VAL 37 2.605 5.369 -11.157 1422 2HG2 VAL 37 2HG2 VAL 37 0.989 4.974 -11.742 1423 3HG2 VAL 37 3HG2 VAL 37 1.361 4.847 -10.023 1424 H ARG 38 H ARG 38 2.566 9.166 -7.923 1425 HA ARG 38 HA ARG 38 0.446 11.175 -8.612 1426 1HB ARG 38 1HB ARG 38 1.125 9.905 -6.117 1427 2HB ARG 38 2HB ARG 38 1.494 11.624 -5.994 1428 1HG ARG 38 1HG ARG 38 -1.150 10.461 -6.918 1429 2HG ARG 38 2HG ARG 38 -0.841 11.155 -5.326 1430 1HD ARG 38 1HD ARG 38 -0.151 13.299 -6.524 1431 2HD ARG 38 2HD ARG 38 -0.812 12.576 -8.001 1432 HE ARG 38 HE ARG 38 -2.664 12.346 -5.779 1433 1HH1 ARG 38 1HH1 ARG 38 -1.430 14.517 -8.205 1434 2HH1 ARG 38 2HH1 ARG 38 -2.869 15.476 -8.236 1435 1HH2 ARG 38 1HH2 ARG 38 -4.521 13.607 -5.838 1436 2HH2 ARG 38 2HH2 ARG 38 -4.607 14.967 -6.907 1437 H HIS 39 H HIS 39 1.291 13.135 -9.255 1438 HA HIS 39 HA HIS 39 3.978 13.578 -9.891 1439 1HB HIS 39 1HB HIS 39 1.496 15.113 -9.547 1440 2HB HIS 39 2HB HIS 39 2.941 16.088 -9.281 1441 HD1 HIS 39 HD1 HIS 39 2.697 17.355 -11.534 1442 HD2 HIS 39 HD2 HIS 39 3.032 13.222 -11.969 1443 HE1 HIS 39 HE1 HIS 39 3.111 16.925 -13.995 1444 H ASN 40 H ASN 40 5.254 15.538 -8.826 1445 HA ASN 40 HA ASN 40 5.985 14.701 -6.139 1446 1HB ASN 40 1HB ASN 40 7.325 15.710 -8.181 1447 2HB ASN 40 2HB ASN 40 6.855 17.256 -7.476 1448 1HD2 ASN 40 1HD2 ASN 40 8.686 17.982 -6.355 1449 2HD2 ASN 40 2HD2 ASN 40 9.579 17.044 -5.256 1450 H ASP 41 H ASP 41 6.462 17.827 -5.658 1451 HA ASP 41 HA ASP 41 5.410 19.501 -4.404 1452 1HB ASP 41 1HB ASP 41 2.884 18.339 -5.627 1453 2HB ASP 41 2HB ASP 41 3.137 19.990 -5.071 1454 H ASP 42 H ASP 42 2.598 19.134 -3.346 1455 HA ASP 42 HA ASP 42 3.065 18.322 -0.749 1456 1HB ASP 42 1HB ASP 42 0.662 18.142 -2.574 1457 2HB ASP 42 2HB ASP 42 0.542 17.691 -0.873 1458 H TRP 43 H TRP 43 2.581 16.208 -3.528 1459 HA TRP 43 HA TRP 43 1.932 13.777 -2.223 1460 1HB TRP 43 1HB TRP 43 1.885 14.098 -4.644 1461 2HB TRP 43 2HB TRP 43 3.619 14.414 -4.671 1462 HD1 TRP 43 HD1 TRP 43 4.833 12.416 -5.634 1463 HE1 TRP 43 HE1 TRP 43 4.654 9.855 -5.412 1464 HE3 TRP 43 HE3 TRP 43 0.760 12.077 -2.572 1465 HZ2 TRP 43 HZ2 TRP 43 3.004 7.921 -4.112 1466 HZ3 TRP 43 HZ3 TRP 43 -0.091 9.862 -1.859 1467 HH2 TRP 43 HH2 TRP 43 1.023 7.785 -2.623 1468 H GLY 44 H GLY 44 5.190 14.948 -3.176 1469 1HA GLY 44 1HA GLY 44 6.575 12.841 -1.799 1470 2HA GLY 44 2HA GLY 44 7.308 14.339 -2.371 1471 H THR 45 H THR 45 6.040 16.274 -0.928 1472 HA THR 45 HA THR 45 7.354 16.385 1.523 1473 HB THR 45 HB THR 45 4.590 17.512 0.977 1474 HG1 THR 45 HG1 THR 45 5.457 18.832 -0.435 1475 1HG2 THR 45 1HG2 THR 45 6.741 19.157 2.156 1476 2HG2 THR 45 2HG2 THR 45 6.227 17.797 3.154 1477 3HG2 THR 45 3HG2 THR 45 5.051 19.004 2.635 1478 H ALA 46 H ALA 46 4.036 15.163 0.958 1479 HA ALA 46 HA ALA 46 3.642 14.497 3.780 1480 1HB ALA 46 1HB ALA 46 2.200 14.240 1.163 1481 2HB ALA 46 2HB ALA 46 1.658 14.985 2.666 1482 3HB ALA 46 3HB ALA 46 1.660 13.229 2.503 1483 H LEU 47 H LEU 47 4.115 12.579 0.785 1484 HA LEU 47 HA LEU 47 4.461 10.122 2.397 1485 1HB LEU 47 1HB LEU 47 4.225 10.861 -0.525 1486 2HB LEU 47 2HB LEU 47 4.726 9.238 -0.055 1487 HG LEU 47 HG LEU 47 2.306 9.281 -0.395 1488 1HD1 LEU 47 1HD1 LEU 47 3.560 8.210 1.750 1489 2HD1 LEU 47 2HD1 LEU 47 1.831 8.025 1.457 1490 3HD1 LEU 47 3HD1 LEU 47 2.409 9.263 2.572 1491 1HD2 LEU 47 1HD2 LEU 47 1.896 11.128 1.913 1492 2HD2 LEU 47 2HD2 LEU 47 0.887 10.866 0.491 1493 3HD2 LEU 47 3HD2 LEU 47 2.348 11.846 0.367 1494 H GLU 48 H GLU 48 6.524 12.355 2.426 1495 HA GLU 48 HA GLU 48 8.816 11.565 0.886 1496 1HB GLU 48 1HB GLU 48 9.989 13.011 2.588 1497 2HB GLU 48 2HB GLU 48 8.562 13.776 1.893 1498 1HG GLU 48 1HG GLU 48 7.789 14.059 3.991 1499 2HG GLU 48 2HG GLU 48 7.615 12.308 4.099 1500 H ASP 49 H ASP 49 8.593 9.135 1.338 1501 HA ASP 49 HA ASP 49 10.593 8.311 3.247 1502 1HB ASP 49 1HB ASP 49 8.084 8.877 4.319 1503 2HB ASP 49 2HB ASP 49 8.057 7.124 4.130 1504 H TYR 50 H TYR 50 7.716 7.332 1.380 1505 HA TYR 50 HA TYR 50 9.214 4.860 0.573 1506 1HB TYR 50 1HB TYR 50 6.250 5.125 1.209 1507 2HB TYR 50 2HB TYR 50 7.101 3.633 0.817 1508 HD1 TYR 50 HD1 TYR 50 9.387 3.378 2.348 1509 HD2 TYR 50 HD2 TYR 50 5.778 5.428 3.456 1510 HE1 TYR 50 HE1 TYR 50 9.959 3.092 4.745 1511 HE2 TYR 50 HE2 TYR 50 6.351 5.142 5.852 1512 HH TYR 50 HH TYR 50 8.924 3.080 6.892 1513 H LEU 51 H LEU 51 9.273 7.122 -1.040 1514 HA LEU 51 HA LEU 51 7.289 6.466 -3.197 1515 1HB LEU 51 1HB LEU 51 8.567 9.081 -2.321 1516 2HB LEU 51 2HB LEU 51 7.574 8.917 -3.766 1517 HG LEU 51 HG LEU 51 6.699 8.414 -0.907 1518 1HD1 LEU 51 1HD1 LEU 51 6.227 10.620 -0.989 1519 2HD1 LEU 51 2HD1 LEU 51 5.028 10.247 -2.226 1520 3HD1 LEU 51 3HD1 LEU 51 6.666 10.705 -2.695 1521 1HD2 LEU 51 1HD2 LEU 51 5.536 7.664 -3.541 1522 2HD2 LEU 51 2HD2 LEU 51 4.423 8.356 -2.361 1523 3HD2 LEU 51 3HD2 LEU 51 5.334 6.900 -1.964 1524 H PHE 52 H PHE 52 8.179 5.898 -5.134 1525 HA PHE 52 HA PHE 52 11.115 6.163 -5.531 1526 1HB PHE 52 1HB PHE 52 8.825 4.742 -6.928 1527 2HB PHE 52 2HB PHE 52 10.446 4.803 -7.623 1528 HD1 PHE 52 HD1 PHE 52 8.290 3.037 -5.418 1529 HD2 PHE 52 HD2 PHE 52 12.407 4.103 -6.018 1530 HE1 PHE 52 HE1 PHE 52 8.988 1.163 -3.951 1531 HE2 PHE 52 HE2 PHE 52 13.106 2.229 -4.551 1532 HZ PHE 52 HZ PHE 52 11.396 0.760 -3.518 1533 H SER 53 H SER 53 11.548 8.279 -6.182 1534 HA SER 53 HA SER 53 9.637 9.739 -7.862 1535 1HB SER 53 1HB SER 53 11.270 11.569 -7.487 1536 2HB SER 53 2HB SER 53 10.868 10.755 -5.974 1537 HG SER 53 HG SER 53 13.240 10.857 -7.357 1538 H ARG 54 H ARG 54 9.626 9.279 -10.016 1539 HA ARG 54 HA ARG 54 12.190 8.652 -11.400 1540 1HB ARG 54 1HB ARG 54 9.875 7.374 -11.500 1541 2HB ARG 54 2HB ARG 54 9.445 8.647 -12.642 1542 1HG ARG 54 1HG ARG 54 10.756 7.770 -14.265 1543 2HG ARG 54 2HG ARG 54 12.101 7.522 -13.151 1544 1HD ARG 54 1HD ARG 54 11.633 5.304 -13.145 1545 2HD ARG 54 2HD ARG 54 10.048 5.665 -12.435 1546 HE ARG 54 HE ARG 54 9.835 6.312 -15.163 1547 1HH1 ARG 54 1HH1 ARG 54 10.540 3.496 -13.241 1548 2HH1 ARG 54 2HH1 ARG 54 9.890 2.400 -14.410 1549 1HH2 ARG 54 1HH2 ARG 54 8.997 4.867 -16.665 1550 2HH2 ARG 54 2HH2 ARG 54 9.023 3.167 -16.333 1551 H LYS 55 H LYS 55 12.079 9.631 -13.801 1552 HA LYS 55 HA LYS 55 12.127 12.524 -13.478 1553 1HB LYS 55 1HB LYS 55 13.660 10.984 -14.852 1554 2HB LYS 55 2HB LYS 55 12.346 10.894 -16.025 1555 1HG LYS 55 1HG LYS 55 12.686 13.027 -16.753 1556 2HG LYS 55 2HG LYS 55 13.026 13.628 -15.130 1557 1HD LYS 55 1HD LYS 55 15.228 12.168 -15.425 1558 2HD LYS 55 2HD LYS 55 14.889 12.419 -17.137 1559 1HE LYS 55 1HE LYS 55 15.301 14.693 -17.019 1560 2HE LYS 55 2HE LYS 55 14.736 14.809 -15.341 1561 1HZ LYS 55 1HZ LYS 55 17.157 13.275 -16.105 1562 2HZ LYS 55 2HZ LYS 55 16.688 13.786 -14.555 1563 3HZ LYS 55 3HZ LYS 55 17.232 14.921 -15.695 1564 H ASN 56 H ASN 56 9.839 12.881 -12.996 1565 HA ASN 56 HA ASN 56 7.873 12.343 -15.134 1566 1HB ASN 56 1HB ASN 56 7.419 14.804 -15.346 1567 2HB ASN 56 2HB ASN 56 8.798 15.118 -14.292 1568 1HD2 ASN 56 1HD2 ASN 56 7.908 13.712 -17.463 1569 2HD2 ASN 56 2HD2 ASN 56 9.447 13.894 -18.154 1570 H MET 57 H MET 57 8.322 11.792 -12.174 1571 HA MET 57 HA MET 57 6.505 13.402 -10.630 1572 1HB MET 57 1HB MET 57 4.561 11.870 -10.672 1573 2HB MET 57 2HB MET 57 4.916 12.450 -12.294 1574 1HG MET 57 1HG MET 57 6.209 9.911 -11.388 1575 2HG MET 57 2HG MET 57 4.504 9.872 -11.815 1576 1HE MET 57 1HE MET 57 3.511 10.714 -13.511 1577 2HE MET 57 2HE MET 57 3.896 9.510 -14.741 1578 3HE MET 57 3HE MET 57 4.105 11.226 -15.091 1579 H SER 58 H SER 58 5.401 11.393 -8.985 1580 HA SER 58 HA SER 58 7.718 9.734 -8.104 1581 1HB SER 58 1HB SER 58 6.392 12.038 -6.750 1582 2HB SER 58 2HB SER 58 6.782 10.653 -5.729 1583 HG SER 58 HG SER 58 8.415 12.495 -6.350 1584 H ALA 59 H ALA 59 6.975 7.682 -7.728 1585 HA ALA 59 HA ALA 59 4.042 7.321 -7.258 1586 1HB ALA 59 1HB ALA 59 5.307 4.880 -7.915 1587 2HB ALA 59 2HB ALA 59 6.101 6.102 -8.909 1588 3HB ALA 59 3HB ALA 59 4.352 5.894 -8.996 1589 H MET 60 H MET 60 3.384 5.716 -5.662 1590 HA MET 60 HA MET 60 5.236 5.547 -3.358 1591 1HB MET 60 1HB MET 60 2.715 6.165 -3.368 1592 2HB MET 60 2HB MET 60 2.427 4.442 -3.604 1593 1HG MET 60 1HG MET 60 3.308 3.877 -1.509 1594 2HG MET 60 2HG MET 60 4.241 5.369 -1.391 1595 1HE MET 60 1HE MET 60 2.028 6.084 1.565 1596 2HE MET 60 2HE MET 60 3.605 6.328 0.814 1597 3HE MET 60 3HE MET 60 3.002 4.693 1.090 1598 H ALA 61 H ALA 61 5.404 3.379 -2.227 1599 HA ALA 61 HA ALA 61 6.116 1.302 -4.163 1600 1HB ALA 61 1HB ALA 61 7.595 1.094 -2.451 1601 2HB ALA 61 2HB ALA 61 6.303 0.297 -1.554 1602 3HB ALA 61 3HB ALA 61 6.566 2.032 -1.368 1603 H LEU 62 H LEU 62 3.428 1.944 -2.000 1604 HA LEU 62 HA LEU 62 1.712 0.051 -3.260 1605 1HB LEU 62 1HB LEU 62 0.924 0.633 -0.545 1606 2HB LEU 62 2HB LEU 62 1.637 2.076 -1.265 1607 HG LEU 62 HG LEU 62 0.147 1.710 -3.269 1608 1HD1 LEU 62 1HD1 LEU 62 -1.940 0.231 -2.326 1609 2HD1 LEU 62 2HD1 LEU 62 -0.580 -0.628 -1.604 1610 3HD1 LEU 62 3HD1 LEU 62 -0.664 -0.422 -3.353 1611 1HD2 LEU 62 1HD2 LEU 62 -1.729 2.763 -2.263 1612 2HD2 LEU 62 2HD2 LEU 62 -0.363 3.215 -1.243 1613 3HD2 LEU 62 3HD2 LEU 62 -1.467 1.941 -0.725 1614 H GLY 63 H GLY 63 2.731 -2.030 -3.248 1615 1HA GLY 63 1HA GLY 63 2.045 -3.715 -1.055 1616 2HA GLY 63 2HA GLY 63 3.096 -4.180 -2.390 1617 H PHE 64 H PHE 64 4.664 -5.223 -1.145 1618 HA PHE 64 HA PHE 64 5.849 -3.942 1.210 1619 1HB PHE 64 1HB PHE 64 6.564 -6.408 -0.423 1620 2HB PHE 64 2HB PHE 64 7.214 -6.026 1.171 1621 HD1 PHE 64 HD1 PHE 64 5.631 -5.852 3.140 1622 HD2 PHE 64 HD2 PHE 64 4.422 -7.415 -0.674 1623 HE1 PHE 64 HE1 PHE 64 3.653 -6.908 4.200 1624 HE2 PHE 64 HE2 PHE 64 2.444 -8.471 0.386 1625 HZ PHE 64 HZ PHE 64 2.059 -8.217 2.823 1626 H GLY 65 H GLY 65 6.231 -2.147 -0.848 1627 1HA GLY 65 1HA GLY 65 8.915 -2.622 -1.996 1628 2HA GLY 65 2HA GLY 65 7.863 -1.256 -2.364 1629 H ALA 66 H ALA 66 7.382 -0.858 0.596 1630 HA ALA 66 HA ALA 66 9.757 0.844 1.060 1631 1HB ALA 66 1HB ALA 66 7.878 2.050 1.604 1632 2HB ALA 66 2HB ALA 66 8.052 1.235 3.158 1633 3HB ALA 66 3HB ALA 66 6.932 0.603 1.950 1634 H ILE 67 H ILE 67 7.983 -1.759 2.739 1635 HA ILE 67 HA ILE 67 9.336 -1.992 5.111 1636 HB ILE 67 HB ILE 67 8.947 -4.512 4.808 1637 1HG1 ILE 67 1HG1 ILE 67 7.467 -5.024 2.809 1638 2HG1 ILE 67 2HG1 ILE 67 8.021 -3.512 2.102 1639 1HG2 ILE 67 1HG2 ILE 67 6.593 -2.757 4.083 1640 2HG2 ILE 67 2HG2 ILE 67 7.299 -2.794 5.698 1641 3HG2 ILE 67 3HG2 ILE 67 6.578 -4.253 5.018 1642 1HD1 ILE 67 1HD1 ILE 67 10.209 -5.173 3.123 1643 2HD1 ILE 67 2HD1 ILE 67 10.031 -4.388 1.553 1644 3HD1 ILE 67 3HD1 ILE 67 9.277 -5.950 1.844 1645 H PHE 68 H PHE 68 10.771 -2.663 1.964 1646 HA PHE 68 HA PHE 68 12.913 -4.356 2.706 1647 1HB PHE 68 1HB PHE 68 12.711 -2.042 0.750 1648 2HB PHE 68 2HB PHE 68 14.059 -3.177 0.772 1649 HD1 PHE 68 HD1 PHE 68 12.762 -5.739 1.347 1650 HD2 PHE 68 HD2 PHE 68 11.471 -2.522 -1.190 1651 HE1 PHE 68 HE1 PHE 68 11.441 -7.339 -0.010 1652 HE2 PHE 68 HE2 PHE 68 10.150 -4.123 -2.547 1653 HZ PHE 68 HZ PHE 68 10.134 -6.532 -1.956 1654 H ASN 69 H ASN 69 14.927 -3.954 3.699 1655 HA ASN 69 HA ASN 69 15.261 -1.214 4.883 1656 1HB ASN 69 1HB ASN 69 15.782 -4.028 5.869 1657 2HB ASN 69 2HB ASN 69 16.513 -2.631 6.659 1658 1HD2 ASN 69 1HD2 ASN 69 14.334 -4.527 7.636 1659 2HD2 ASN 69 2HD2 ASN 69 13.040 -3.511 8.056 1660 H HIS 70 H HIS 70 17.796 -1.376 5.832 1661 HA HIS 70 HA HIS 70 19.439 -1.640 3.348 1662 1HB HIS 70 1HB HIS 70 19.228 0.542 4.634 1663 2HB HIS 70 2HB HIS 70 20.039 -0.250 5.986 1664 HD1 HIS 70 HD1 HIS 70 21.964 1.599 5.545 1665 HD2 HIS 70 HD2 HIS 70 21.503 -1.291 2.576 1666 HE1 HIS 70 HE1 HIS 70 24.066 1.680 4.135 1667 H SER 71 H SER 71 20.420 -3.650 3.292 1668 HA SER 71 HA SER 71 21.531 -4.719 5.867 1669 1HB SER 71 1HB SER 71 19.611 -5.922 4.701 1670 2HB SER 71 2HB SER 71 20.719 -6.237 3.365 1671 HG SER 71 HG SER 71 22.101 -7.264 4.898 1672 H LYS 72 H LYS 72 22.711 -2.961 3.559 1673 HA LYS 72 HA LYS 72 24.779 -2.819 2.420 1674 1HB LYS 72 1HB LYS 72 25.439 -4.886 4.553 1675 2HB LYS 72 2HB LYS 72 26.611 -3.888 3.693 1676 1HG LYS 72 1HG LYS 72 24.344 -2.626 5.228 1677 2HG LYS 72 2HG LYS 72 25.830 -3.106 6.046 1678 1HD LYS 72 1HD LYS 72 26.948 -1.799 4.012 1679 2HD LYS 72 2HD LYS 72 25.394 -0.967 4.003 1680 1HE LYS 72 1HE LYS 72 25.674 -0.427 6.410 1681 2HE LYS 72 2HE LYS 72 27.251 -1.240 6.397 1682 1HZ LYS 72 1HZ LYS 72 26.501 0.934 4.515 1683 2HZ LYS 72 2HZ LYS 72 28.042 0.258 4.744 1684 3HZ LYS 72 3HZ LYS 72 27.342 1.211 5.963 1685 H ASP 73 H ASP 73 22.764 -5.041 1.724 1686 HA ASP 73 HA ASP 73 24.338 -6.332 -0.324 1687 1HB ASP 73 1HB ASP 73 24.162 -7.500 2.361 1688 2HB ASP 73 2HB ASP 73 23.602 -8.613 1.113 1689 HA PRO 74 HA PRO 74 19.620 -6.193 -0.501 1690 1HB PRO 74 1HB PRO 74 19.664 -5.062 -3.068 1691 2HB PRO 74 2HB PRO 74 19.419 -4.165 -1.559 1692 1HG PRO 74 1HG PRO 74 21.866 -4.479 -3.207 1693 2HG PRO 74 2HG PRO 74 21.317 -3.096 -2.251 1694 1HD PRO 74 1HD PRO 74 23.308 -4.741 -1.443 1695 2HD PRO 74 2HD PRO 74 22.217 -3.925 -0.303 1696 H ASN 75 H ASN 75 20.046 -8.558 -0.678 1697 HA ASN 75 HA ASN 75 20.993 -9.868 -3.015 1698 1HB ASN 75 1HB ASN 75 19.050 -10.573 -0.800 1699 2HB ASN 75 2HB ASN 75 19.506 -11.744 -2.037 1700 1HD2 ASN 75 1HD2 ASN 75 21.983 -12.054 -2.287 1701 2HD2 ASN 75 2HD2 ASN 75 22.920 -11.975 -0.873 1702 H ALA 76 H ALA 76 18.019 -8.174 -2.459 1703 HA ALA 76 HA ALA 76 16.996 -9.178 -5.091 1704 1HB ALA 76 1HB ALA 76 15.934 -10.019 -2.835 1705 2HB ALA 76 2HB ALA 76 14.862 -9.495 -4.134 1706 3HB ALA 76 3HB ALA 76 15.206 -8.413 -2.785 1707 H ARG 77 H ARG 77 16.080 -7.560 -6.403 1708 HA ARG 77 HA ARG 77 16.237 -4.767 -5.317 1709 1HB ARG 77 1HB ARG 77 17.702 -5.909 -7.308 1710 2HB ARG 77 2HB ARG 77 16.337 -5.298 -8.243 1711 1HG ARG 77 1HG ARG 77 16.674 -3.063 -7.130 1712 2HG ARG 77 2HG ARG 77 18.146 -3.707 -6.402 1713 1HD ARG 77 1HD ARG 77 19.200 -3.012 -8.300 1714 2HD ARG 77 2HD ARG 77 18.392 -4.367 -9.110 1715 HE ARG 77 HE ARG 77 16.440 -2.406 -9.022 1716 1HH1 ARG 77 1HH1 ARG 77 19.729 -2.532 -10.157 1717 2HH1 ARG 77 2HH1 ARG 77 19.465 -1.346 -11.388 1718 1HH2 ARG 77 1HH2 ARG 77 16.123 -0.869 -10.626 1719 2HH2 ARG 77 2HH2 ARG 77 17.440 -0.410 -11.653 1720 H HIS 78 H HIS 78 14.717 -3.238 -6.493 1721 HA HIS 78 HA HIS 78 12.086 -4.591 -6.944 1722 1HB HIS 78 1HB HIS 78 11.205 -2.331 -6.323 1723 2HB HIS 78 2HB HIS 78 12.244 -3.006 -5.068 1724 HD1 HIS 78 HD1 HIS 78 14.585 -1.924 -4.736 1725 HD2 HIS 78 HD2 HIS 78 12.289 -0.076 -7.684 1726 HE1 HIS 78 HE1 HIS 78 15.747 0.258 -5.285 1727 H GLU 79 H GLU 79 11.073 -4.345 -8.916 1728 HA GLU 79 HA GLU 79 12.320 -2.455 -10.887 1729 1HB GLU 79 1HB GLU 79 12.746 -4.962 -11.145 1730 2HB GLU 79 2HB GLU 79 11.018 -5.139 -11.450 1731 1HG GLU 79 1HG GLU 79 11.135 -3.739 -13.397 1732 2HG GLU 79 2HG GLU 79 12.791 -3.258 -13.025 1733 H LEU 80 H LEU 80 10.733 -1.868 -12.672 1734 HA LEU 80 HA LEU 80 7.919 -1.786 -11.628 1735 1HB LEU 80 1HB LEU 80 9.706 0.313 -12.885 1736 2HB LEU 80 2HB LEU 80 7.955 0.511 -12.821 1737 HG LEU 80 HG LEU 80 9.493 -0.191 -10.329 1738 1HD1 LEU 80 1HD1 LEU 80 9.576 2.331 -11.844 1739 2HD1 LEU 80 2HD1 LEU 80 10.631 1.762 -10.551 1740 3HD1 LEU 80 3HD1 LEU 80 9.091 2.528 -10.160 1741 1HD2 LEU 80 1HD2 LEU 80 7.515 0.229 -9.298 1742 2HD2 LEU 80 2HD2 LEU 80 6.811 0.094 -10.909 1743 3HD2 LEU 80 3HD2 LEU 80 7.226 1.680 -10.259 1744 H THR 81 H THR 81 6.277 -1.973 -13.224 1745 HA THR 81 HA THR 81 6.977 -3.426 -15.632 1746 HB THR 81 HB THR 81 4.515 -3.263 -16.004 1747 HG1 THR 81 HG1 THR 81 4.392 -1.761 -13.626 1748 1HG2 THR 81 1HG2 THR 81 3.856 -4.477 -14.028 1749 2HG2 THR 81 2HG2 THR 81 5.144 -3.736 -13.078 1750 3HG2 THR 81 3HG2 THR 81 5.540 -4.887 -14.355 1751 H ALA 82 H ALA 82 4.859 -0.573 -15.629 1752 HA ALA 82 HA ALA 82 6.638 1.043 -17.274 1753 1HB ALA 82 1HB ALA 82 4.597 0.681 -19.112 1754 2HB ALA 82 2HB ALA 82 4.786 -0.936 -18.434 1755 3HB ALA 82 3HB ALA 82 6.164 -0.126 -19.179 1756 H GLY 83 H GLY 83 6.026 2.802 -15.958 1757 1HA GLY 83 1HA GLY 83 4.484 4.762 -16.172 1758 2HA GLY 83 2HA GLY 83 3.151 3.607 -16.164 1759 H LEU 84 H LEU 84 5.850 3.044 -14.038 1760 HA LEU 84 HA LEU 84 5.936 2.983 -11.675 1761 1HB LEU 84 1HB LEU 84 4.464 5.531 -12.391 1762 2HB LEU 84 2HB LEU 84 4.867 5.145 -10.718 1763 HG LEU 84 HG LEU 84 6.861 5.307 -12.998 1764 1HD1 LEU 84 1HD1 LEU 84 5.785 7.287 -11.083 1765 2HD1 LEU 84 2HD1 LEU 84 6.575 7.541 -12.639 1766 3HD1 LEU 84 3HD1 LEU 84 7.544 7.245 -11.196 1767 1HD2 LEU 84 1HD2 LEU 84 8.134 5.496 -10.507 1768 2HD2 LEU 84 2HD2 LEU 84 8.158 4.107 -11.593 1769 3HD2 LEU 84 3HD2 LEU 84 6.953 4.202 -10.309 1770 H LYS 85 H LYS 85 3.738 1.490 -12.927 1771 HA LYS 85 HA LYS 85 1.495 1.927 -11.005 1772 1HB LYS 85 1HB LYS 85 1.872 0.654 -13.707 1773 2HB LYS 85 2HB LYS 85 0.491 0.182 -12.717 1774 1HG LYS 85 1HG LYS 85 0.099 2.741 -12.448 1775 2HG LYS 85 2HG LYS 85 1.162 2.896 -13.846 1776 1HD LYS 85 1HD LYS 85 -0.330 1.266 -15.060 1777 2HD LYS 85 2HD LYS 85 -1.441 1.351 -13.693 1778 1HE LYS 85 1HE LYS 85 -0.775 4.035 -14.434 1779 2HE LYS 85 2HE LYS 85 -1.249 3.159 -15.902 1780 1HZ LYS 85 1HZ LYS 85 -2.737 3.050 -13.328 1781 2HZ LYS 85 2HZ LYS 85 -3.217 2.377 -14.811 1782 3HZ LYS 85 3HZ LYS 85 -3.163 4.064 -14.623 1783 H ARG 86 H ARG 86 2.737 -1.036 -12.582 1784 HA ARG 86 HA ARG 86 2.268 -2.556 -10.103 1785 1HB ARG 86 1HB ARG 86 2.932 -3.054 -12.978 1786 2HB ARG 86 2HB ARG 86 3.363 -4.315 -11.822 1787 1HG ARG 86 1HG ARG 86 0.818 -3.653 -11.015 1788 2HG ARG 86 2HG ARG 86 0.705 -3.459 -12.764 1789 1HD ARG 86 1HD ARG 86 1.587 -5.741 -13.090 1790 2HD ARG 86 2HD ARG 86 1.740 -5.938 -11.333 1791 HE ARG 86 HE ARG 86 -0.923 -5.065 -12.024 1792 1HH1 ARG 86 1HH1 ARG 86 1.180 -7.839 -12.052 1793 2HH1 ARG 86 2HH1 ARG 86 -0.125 -8.968 -11.946 1794 1HH2 ARG 86 1HH2 ARG 86 -2.602 -6.551 -11.886 1795 2HH2 ARG 86 2HH2 ARG 86 -2.250 -8.247 -11.852 1796 H MET 87 H MET 87 4.181 -4.260 -9.669 1797 HA MET 87 HA MET 87 6.847 -2.963 -9.901 1798 1HB MET 87 1HB MET 87 5.096 -2.985 -7.576 1799 2HB MET 87 2HB MET 87 6.625 -3.787 -7.216 1800 1HG MET 87 1HG MET 87 7.810 -1.793 -8.211 1801 2HG MET 87 2HG MET 87 6.244 -0.989 -8.320 1802 1HE MET 87 1HE MET 87 8.575 -2.738 -5.123 1803 2HE MET 87 2HE MET 87 9.221 -1.104 -5.272 1804 3HE MET 87 3HE MET 87 9.078 -2.130 -6.700 1805 H ARG 88 H ARG 88 8.340 -4.521 -10.337 1806 HA ARG 88 HA ARG 88 7.683 -7.363 -9.638 1807 1HB ARG 88 1HB ARG 88 7.739 -6.907 -12.025 1808 2HB ARG 88 2HB ARG 88 9.278 -6.064 -11.877 1809 1HG ARG 88 1HG ARG 88 10.085 -8.381 -10.876 1810 2HG ARG 88 2HG ARG 88 8.703 -9.005 -11.773 1811 1HD ARG 88 1HD ARG 88 10.078 -7.174 -13.484 1812 2HD ARG 88 2HD ARG 88 11.280 -8.277 -12.793 1813 HE ARG 88 HE ARG 88 8.963 -9.784 -13.527 1814 1HH1 ARG 88 1HH1 ARG 88 11.593 -8.008 -14.958 1815 2HH1 ARG 88 2HH1 ARG 88 11.595 -8.959 -16.402 1816 1HH2 ARG 88 1HH2 ARG 88 8.985 -11.004 -15.412 1817 2HH2 ARG 88 2HH2 ARG 88 10.131 -10.643 -16.659 1818 H ILE 89 H ILE 89 8.809 -7.743 -7.731 1819 HA ILE 89 HA ILE 89 11.513 -6.611 -7.343 1820 HB ILE 89 HB ILE 89 9.678 -8.381 -5.685 1821 1HG1 ILE 89 1HG1 ILE 89 10.422 -5.563 -5.001 1822 2HG1 ILE 89 2HG1 ILE 89 9.230 -5.824 -6.274 1823 1HG2 ILE 89 1HG2 ILE 89 11.858 -8.845 -4.883 1824 2HG2 ILE 89 2HG2 ILE 89 11.275 -7.564 -3.821 1825 3HG2 ILE 89 3HG2 ILE 89 12.393 -7.183 -5.130 1826 1HD1 ILE 89 1HD1 ILE 89 8.984 -7.261 -3.638 1827 2HD1 ILE 89 2HD1 ILE 89 7.726 -6.893 -4.818 1828 3HD1 ILE 89 3HD1 ILE 89 8.395 -5.608 -3.812 1829 H PHE 90 H PHE 90 13.169 -7.709 -8.328 1830 HA PHE 90 HA PHE 90 12.942 -10.663 -8.684 1831 1HB PHE 90 1HB PHE 90 14.158 -8.355 -10.061 1832 2HB PHE 90 2HB PHE 90 15.218 -9.762 -9.984 1833 HD1 PHE 90 HD1 PHE 90 11.487 -9.614 -10.191 1834 HD2 PHE 90 HD2 PHE 90 15.155 -10.682 -12.153 1835 HE1 PHE 90 HE1 PHE 90 10.197 -10.680 -12.023 1836 HE2 PHE 90 HE2 PHE 90 13.866 -11.747 -13.984 1837 HZ PHE 90 HZ PHE 90 11.386 -11.744 -13.919 1838 H THR 91 H THR 91 15.258 -11.728 -8.559 1839 HA THR 91 HA THR 91 16.526 -10.843 -5.989 1840 HB THR 91 HB THR 91 17.183 -13.341 -5.974 1841 HG1 THR 91 HG1 THR 91 16.820 -14.031 -7.974 1842 1HG2 THR 91 1HG2 THR 91 15.361 -13.676 -4.664 1843 2HG2 THR 91 2HG2 THR 91 14.243 -13.354 -5.990 1844 3HG2 THR 91 3HG2 THR 91 14.935 -12.015 -5.074 1845 H ILE 92 H ILE 92 18.234 -9.561 -6.813 1846 HA ILE 92 HA ILE 92 19.742 -9.973 -9.148 1847 HB ILE 92 HB ILE 92 21.475 -8.653 -7.891 1848 1HG1 ILE 92 1HG1 ILE 92 19.683 -8.505 -5.522 1849 2HG1 ILE 92 2HG1 ILE 92 20.635 -9.980 -5.695 1850 1HG2 ILE 92 1HG2 ILE 92 20.183 -6.872 -8.363 1851 2HG2 ILE 92 2HG2 ILE 92 19.171 -7.199 -6.955 1852 3HG2 ILE 92 3HG2 ILE 92 18.797 -7.955 -8.504 1853 1HD1 ILE 92 1HD1 ILE 92 21.557 -7.164 -5.272 1854 2HD1 ILE 92 2HD1 ILE 92 22.587 -8.248 -6.206 1855 3HD1 ILE 92 3HD1 ILE 92 22.153 -8.657 -4.546 1856 H LYS 93 H LYS 93 19.818 -11.764 -6.153 1857 HA LYS 93 HA LYS 93 21.852 -13.584 -7.333 1858 1HB LYS 93 1HB LYS 93 22.063 -12.384 -4.549 1859 2HB LYS 93 2HB LYS 93 23.240 -13.437 -5.331 1860 1HG LYS 93 1HG LYS 93 23.488 -11.674 -7.128 1861 2HG LYS 93 2HG LYS 93 22.490 -10.613 -6.132 1862 1HD LYS 93 1HD LYS 93 24.173 -11.127 -4.239 1863 2HD LYS 93 2HD LYS 93 25.223 -11.739 -5.517 1864 1HE LYS 93 1HE LYS 93 24.613 -9.409 -6.663 1865 2HE LYS 93 2HE LYS 93 24.337 -8.928 -4.978 1866 1HZ LYS 93 1HZ LYS 93 26.744 -10.433 -5.845 1867 2HZ LYS 93 2HZ LYS 93 26.495 -9.620 -4.375 1868 3HZ LYS 93 3HZ LYS 93 26.706 -8.735 -5.809 1869 HA PRO 94 HA PRO 94 19.163 -16.659 -5.693 1870 1HB PRO 94 1HB PRO 94 21.620 -18.208 -5.029 1871 2HB PRO 94 2HB PRO 94 20.254 -18.660 -6.065 1872 1HG PRO 94 1HG PRO 94 22.649 -17.990 -7.068 1873 2HG PRO 94 2HG PRO 94 21.135 -17.618 -7.904 1874 1HD PRO 94 1HD PRO 94 22.958 -15.815 -6.396 1875 2HD PRO 94 2HD PRO 94 21.947 -15.474 -7.814 1876 H ILE 95 H ILE 95 18.265 -16.727 -3.663 1877 HA ILE 95 HA ILE 95 20.000 -15.986 -1.347 1878 HB ILE 95 HB ILE 95 16.999 -15.951 -1.834 1879 1HG1 ILE 95 1HG1 ILE 95 18.842 -13.604 -1.374 1880 2HG1 ILE 95 2HG1 ILE 95 18.586 -14.266 -2.989 1881 1HG2 ILE 95 1HG2 ILE 95 18.620 -15.021 0.557 1882 2HG2 ILE 95 2HG2 ILE 95 17.474 -16.361 0.537 1883 3HG2 ILE 95 3HG2 ILE 95 16.901 -14.707 0.319 1884 1HD1 ILE 95 1HD1 ILE 95 17.041 -12.365 -2.427 1885 2HD1 ILE 95 2HD1 ILE 95 16.348 -13.367 -1.152 1886 3HD1 ILE 95 3HD1 ILE 95 16.199 -13.859 -2.839 1887 H ALA 96 H ALA 96 19.964 -17.266 0.554 1888 HA ALA 96 HA ALA 96 19.169 -20.094 0.129 1889 1HB ALA 96 1HB ALA 96 21.442 -19.547 0.876 1890 2HB ALA 96 2HB ALA 96 20.595 -20.381 2.178 1891 3HB ALA 96 3HB ALA 96 20.799 -18.631 2.238 1892 H ILE 97 H ILE 97 18.179 -21.227 2.067 1893 HA ILE 97 HA ILE 97 15.767 -19.877 2.912 1894 HB ILE 97 HB ILE 97 17.140 -22.441 3.802 1895 1HG1 ILE 97 1HG1 ILE 97 14.844 -22.938 2.234 1896 2HG1 ILE 97 2HG1 ILE 97 15.736 -21.668 1.396 1897 1HG2 ILE 97 1HG2 ILE 97 15.501 -22.628 5.334 1898 2HG2 ILE 97 2HG2 ILE 97 14.309 -22.571 4.036 1899 3HG2 ILE 97 3HG2 ILE 97 14.825 -21.080 4.825 1900 1HD1 ILE 97 1HD1 ILE 97 16.971 -23.390 0.565 1901 2HD1 ILE 97 2HD1 ILE 97 16.455 -24.497 1.837 1902 3HD1 ILE 97 3HD1 ILE 97 17.765 -23.355 2.139 1903 H GLY 98 H GLY 98 15.595 -18.475 4.609 1904 1HA GLY 98 1HA GLY 98 15.825 -18.024 6.996 1905 2HA GLY 98 2HA GLY 98 17.357 -18.897 6.974 1906 H GLU 99 H GLU 99 16.267 -16.401 4.687 1907 HA GLU 99 HA GLU 99 18.525 -14.677 5.659 1908 1HB GLU 99 1HB GLU 99 17.593 -15.546 2.929 1909 2HB GLU 99 2HB GLU 99 18.440 -14.009 3.104 1910 1HG GLU 99 1HG GLU 99 19.524 -16.600 4.230 1911 2HG GLU 99 2HG GLU 99 19.911 -16.039 2.603 1912 H GLU 100 H GLU 100 18.041 -12.407 4.233 1913 HA GLU 100 HA GLU 100 15.187 -11.679 4.770 1914 1HB GLU 100 1HB GLU 100 16.760 -11.071 6.652 1915 2HB GLU 100 2HB GLU 100 17.647 -10.054 5.516 1916 1HG GLU 100 1HG GLU 100 15.257 -9.032 5.042 1917 2HG GLU 100 2HG GLU 100 14.886 -9.685 6.638 1918 H ILE 101 H ILE 101 14.339 -10.733 2.955 1919 HA ILE 101 HA ILE 101 16.157 -9.836 0.804 1920 HB ILE 101 HB ILE 101 13.142 -10.103 1.075 1921 1HG1 ILE 101 1HG1 ILE 101 15.134 -11.774 -0.480 1922 2HG1 ILE 101 2HG1 ILE 101 14.524 -12.207 1.118 1923 1HG2 ILE 101 1HG2 ILE 101 14.620 -8.603 -0.809 1924 2HG2 ILE 101 2HG2 ILE 101 12.915 -9.044 -0.900 1925 3HG2 ILE 101 3HG2 ILE 101 14.136 -10.083 -1.637 1926 1HD1 ILE 101 1HD1 ILE 101 12.826 -11.761 -1.357 1927 2HD1 ILE 101 2HD1 ILE 101 12.216 -12.194 0.240 1928 3HD1 ILE 101 3HD1 ILE 101 13.224 -13.329 -0.657 1929 H THR 102 H THR 102 16.455 -7.710 0.235 1930 HA THR 102 HA THR 102 14.697 -5.589 1.311 1931 HB THR 102 HB THR 102 16.707 -4.488 2.357 1932 HG1 THR 102 HG1 THR 102 18.274 -5.598 1.139 1933 1HG2 THR 102 1HG2 THR 102 16.622 -5.768 4.352 1934 2HG2 THR 102 2HG2 THR 102 16.354 -7.272 3.470 1935 3HG2 THR 102 3HG2 THR 102 15.070 -6.066 3.570 1936 H ILE 103 H ILE 103 16.023 -3.362 0.640 1937 HA ILE 103 HA ILE 103 17.333 -3.724 -2.000 1938 HB ILE 103 HB ILE 103 15.645 -2.274 -3.077 1939 1HG1 ILE 103 1HG1 ILE 103 13.519 -2.255 -1.254 1940 2HG1 ILE 103 2HG1 ILE 103 14.928 -1.798 -0.296 1941 1HG2 ILE 103 1HG2 ILE 103 15.329 -4.802 -2.849 1942 2HG2 ILE 103 2HG2 ILE 103 13.869 -3.870 -3.181 1943 3HG2 ILE 103 3HG2 ILE 103 14.196 -4.445 -1.546 1944 1HD1 ILE 103 1HD1 ILE 103 13.503 -0.037 -1.804 1945 2HD1 ILE 103 2HD1 ILE 103 14.738 -0.524 -2.965 1946 3HD1 ILE 103 3HD1 ILE 103 15.210 0.174 -1.415 1947 H SER 104 H SER 104 18.351 -1.707 -2.746 1948 HA SER 104 HA SER 104 19.113 0.047 -0.471 1949 1HB SER 104 1HB SER 104 20.797 -1.095 -1.930 1950 2HB SER 104 2HB SER 104 20.167 -0.202 -3.314 1951 HG SER 104 HG SER 104 21.398 1.368 -2.727 1952 H TYR 105 H TYR 105 19.811 2.360 -1.864 1953 HA TYR 105 HA TYR 105 17.239 3.279 -3.101 1954 1HB TYR 105 1HB TYR 105 18.908 4.841 -1.098 1955 2HB TYR 105 2HB TYR 105 17.291 5.234 -1.676 1956 HD1 TYR 105 HD1 TYR 105 15.806 2.761 -1.503 1957 HD2 TYR 105 HD2 TYR 105 18.797 4.305 1.165 1958 HE1 TYR 105 HE1 TYR 105 14.836 1.433 0.356 1959 HE2 TYR 105 HE2 TYR 105 17.827 2.979 3.022 1960 HH TYR 105 HH TYR 105 14.807 1.214 2.637 1961 H GLY 106 H GLY 106 20.427 4.722 -2.288 1962 1HA GLY 106 1HA GLY 106 22.034 5.709 -3.692 1963 2HA GLY 106 2HA GLY 106 21.260 4.895 -5.051 1964 H ASP 107 H ASP 107 21.554 6.914 -6.252 1965 HA ASP 107 HA ASP 107 20.778 8.957 -7.123 1966 1HB ASP 107 1HB ASP 107 18.734 7.651 -7.307 1967 2HB ASP 107 2HB ASP 107 18.351 7.930 -5.610 1968 H ASP 108 H ASP 108 18.737 9.249 -4.245 1969 HA ASP 108 HA ASP 108 20.504 11.497 -3.335 1970 1HB ASP 108 1HB ASP 108 18.328 12.109 -4.446 1971 2HB ASP 108 2HB ASP 108 17.479 11.230 -3.174 1972 H TYR 109 H TYR 109 18.411 8.807 -2.384 1973 HA TYR 109 HA TYR 109 18.226 9.147 0.386 1974 1HB TYR 109 1HB TYR 109 18.200 6.972 -1.591 1975 2HB TYR 109 2HB TYR 109 18.701 6.434 0.012 1976 HD1 TYR 109 HD1 TYR 109 16.086 8.528 -1.676 1977 HD2 TYR 109 HD2 TYR 109 17.073 5.966 1.628 1978 HE1 TYR 109 HE1 TYR 109 13.727 8.599 -0.915 1979 HE2 TYR 109 HE2 TYR 109 14.714 6.037 2.388 1980 HH TYR 109 HH TYR 109 12.192 7.231 0.441 1981 H TRP 110 H TRP 110 20.102 10.043 1.336 1982 HA TRP 110 HA TRP 110 22.788 9.327 0.967 1983 1HB TRP 110 1HB TRP 110 23.027 10.232 3.285 1984 2HB TRP 110 2HB TRP 110 21.964 11.229 2.291 1985 HD1 TRP 110 HD1 TRP 110 19.531 11.541 3.083 1986 HE1 TRP 110 HE1 TRP 110 18.137 10.618 5.049 1987 HE3 TRP 110 HE3 TRP 110 22.742 7.998 4.836 1988 HZ2 TRP 110 HZ2 TRP 110 18.365 8.625 7.099 1989 HZ3 TRP 110 HZ3 TRP 110 22.143 6.603 6.779 1990 HH2 TRP 110 HH2 TRP 110 19.959 6.907 7.923 1991 H LEU 111 H LEU 111 24.137 7.739 1.851 1992 HA LEU 111 HA LEU 111 22.767 5.311 2.866 1993 1HB LEU 111 1HB LEU 111 24.490 5.427 0.968 1994 2HB LEU 111 2HB LEU 111 25.695 5.766 2.211 1995 HG LEU 111 HG LEU 111 24.915 3.646 3.381 1996 1HD1 LEU 111 1HD1 LEU 111 22.755 3.348 2.349 1997 2HD1 LEU 111 2HD1 LEU 111 23.772 2.004 1.830 1998 3HD1 LEU 111 3HD1 LEU 111 23.467 3.352 0.735 1999 1HD2 LEU 111 1HD2 LEU 111 25.964 2.181 1.427 2000 2HD2 LEU 111 2HD2 LEU 111 26.953 3.338 2.318 2001 3HD2 LEU 111 3HD2 LEU 111 26.309 3.766 0.733 2002 H SER 112 H SER 112 23.568 4.235 4.812 2003 HA SER 112 HA SER 112 24.018 5.972 7.044 2004 1HB SER 112 1HB SER 112 24.456 2.992 6.625 2005 2HB SER 112 2HB SER 112 24.397 3.779 8.202 2006 HG SER 112 HG SER 112 22.303 4.040 8.023 2007 H ARG 113 H ARG 113 26.068 4.737 8.500 2008 HA ARG 113 HA ARG 113 28.382 6.153 7.810 2009 1HB ARG 113 1HB ARG 113 27.504 4.236 9.708 2010 2HB ARG 113 2HB ARG 113 29.024 3.624 9.059 2011 1HG ARG 113 1HG ARG 113 29.942 5.018 10.621 2012 2HG ARG 113 2HG ARG 113 29.659 6.247 9.388 2013 1HD ARG 113 1HD ARG 113 27.199 6.098 10.657 2014 2HD ARG 113 2HD ARG 113 28.348 5.898 11.994 2015 HE ARG 113 HE ARG 113 28.030 8.297 10.350 2016 1HH1 ARG 113 1HH1 ARG 113 30.209 6.400 12.292 2017 2HH1 ARG 113 2HH1 ARG 113 31.232 7.747 12.656 2018 1HH2 ARG 113 1HH2 ARG 113 29.373 10.029 10.836 2019 2HH2 ARG 113 2HH2 ARG 113 30.764 9.786 11.839 2020 HA PRO 114 HA PRO 114 29.392 3.824 4.063 2021 1HB PRO 114 1HB PRO 114 31.800 5.568 4.151 2022 2HB PRO 114 2HB PRO 114 30.626 5.343 2.843 2023 1HG PRO 114 1HG PRO 114 30.710 7.575 4.333 2024 2HG PRO 114 2HG PRO 114 29.200 6.927 3.676 2025 1HD PRO 114 1HD PRO 114 30.245 6.845 6.461 2026 2HD PRO 114 2HD PRO 114 28.570 6.959 5.880 2027 H ARG 115 H ARG 115 29.912 1.853 5.183 2028 HA ARG 115 HA ARG 115 32.825 1.537 5.770 2029 1HB ARG 115 1HB ARG 115 30.426 0.939 7.514 2030 2HB ARG 115 2HB ARG 115 31.961 0.108 7.765 2031 1HG ARG 115 1HG ARG 115 33.106 2.221 8.119 2032 2HG ARG 115 2HG ARG 115 31.651 3.124 7.698 2033 1HD ARG 115 1HD ARG 115 31.731 3.089 10.104 2034 2HD ARG 115 2HD ARG 115 30.515 1.879 9.653 2035 HE ARG 115 HE ARG 115 32.928 0.484 9.646 2036 1HH1 ARG 115 1HH1 ARG 115 31.161 2.408 11.948 2037 2HH1 ARG 115 2HH1 ARG 115 31.773 1.537 13.311 2038 1HH2 ARG 115 1HH2 ARG 115 33.708 -0.630 11.431 2039 2HH2 ARG 115 2HH2 ARG 115 33.204 -0.171 13.023 2040 H LEU 116 H LEU 116 29.733 -0.278 5.646 2041 HA LEU 116 HA LEU 116 29.251 -2.403 4.736 2042 1HB LEU 116 1HB LEU 116 30.426 -0.633 2.893 2043 2HB LEU 116 2HB LEU 116 31.228 -2.178 2.610 2044 HG LEU 116 HG LEU 116 28.563 -2.890 2.937 2045 1HD1 LEU 116 1HD1 LEU 116 28.429 -0.711 0.916 2046 2HD1 LEU 116 2HD1 LEU 116 28.388 -0.215 2.607 2047 3HD1 LEU 116 3HD1 LEU 116 27.172 -1.331 1.986 2048 1HD2 LEU 116 1HD2 LEU 116 29.241 -3.990 1.095 2049 2HD2 LEU 116 2HD2 LEU 116 30.595 -2.878 0.897 2050 3HD2 LEU 116 3HD2 LEU 116 29.034 -2.505 0.166 2051 H THR 117 H THR 117 30.136 -3.807 6.334 2052 HA THR 117 HA THR 117 32.825 -4.418 6.836 2053 HB THR 117 HB THR 117 30.277 -6.068 6.888 2054 HG1 THR 117 HG1 THR 117 30.411 -4.290 8.293 2055 1HG2 THR 117 1HG2 THR 117 33.055 -6.747 7.873 2056 2HG2 THR 117 2HG2 THR 117 32.007 -7.710 6.831 2057 3HG2 THR 117 3HG2 THR 117 31.609 -7.508 8.539 2058 H GLN 118 H GLN 118 30.925 -6.942 5.250 2059 HA GLN 118 HA GLN 118 31.655 -8.591 3.724 2060 1HB GLN 118 1HB GLN 118 31.861 -7.573 1.528 2061 2HB GLN 118 2HB GLN 118 30.673 -6.669 2.458 2062 1HG GLN 118 1HG GLN 118 32.205 -4.889 2.870 2063 2HG GLN 118 2HG GLN 118 33.581 -5.848 2.328 2064 1HE2 GLN 118 1HE2 GLN 118 34.273 -4.949 0.378 2065 2HE2 GLN 118 2HE2 GLN 118 33.252 -4.512 -0.906 2066 H ASN 119 H ASN 119 33.683 -8.284 1.684 2067 HA ASN 119 HA ASN 119 36.185 -8.142 3.326 2068 1HB ASN 119 1HB ASN 119 35.367 -10.471 3.083 2069 2HB ASN 119 2HB ASN 119 35.340 -10.277 1.330 2070 1HD2 ASN 119 1HD2 ASN 119 37.451 -10.040 0.223 2071 2HD2 ASN 119 2HD2 ASN 119 38.880 -10.559 0.980 2072 1H GLY 201 1H GLY 201 20.112 41.407 5.908 2073 2H GLY 201 2H GLY 201 20.948 42.450 4.862 2074 3H GLY 201 3H GLY 201 21.612 42.053 6.374 2075 1HA GLY 201 1HA GLY 201 21.094 40.062 4.238 2076 2HA GLY 201 2HA GLY 201 22.648 40.863 4.471 2077 H LYS 202 H LYS 202 21.206 38.037 5.082 2078 HA LYS 202 HA LYS 202 22.888 37.553 7.492 2079 1HB LYS 202 1HB LYS 202 20.387 38.202 7.935 2080 2HB LYS 202 2HB LYS 202 20.034 36.577 7.350 2081 1HG LYS 202 1HG LYS 202 21.064 35.555 9.154 2082 2HG LYS 202 2HG LYS 202 22.181 36.896 9.408 2083 1HD LYS 202 1HD LYS 202 20.079 38.259 10.064 2084 2HD LYS 202 2HD LYS 202 19.278 36.694 10.205 2085 1HE LYS 202 1HE LYS 202 20.226 36.379 12.239 2086 2HE LYS 202 2HE LYS 202 21.842 36.579 11.535 2087 1HZ LYS 202 1HZ LYS 202 20.027 38.863 12.084 2088 2HZ LYS 202 2HZ LYS 202 21.685 38.915 11.721 2089 3HZ LYS 202 3HZ LYS 202 21.163 38.313 13.220 2090 H ALA 203 H ALA 203 23.463 36.689 4.887 2091 HA ALA 203 HA ALA 203 23.555 33.802 5.250 2092 1HB ALA 203 1HB ALA 203 21.180 34.608 4.366 2093 2HB ALA 203 2HB ALA 203 21.933 33.164 3.688 2094 3HB ALA 203 3HB ALA 203 22.025 34.697 2.821 2095 HA PRO 204 HA PRO 204 26.714 35.875 2.493 2096 1HB PRO 204 1HB PRO 204 28.886 34.775 3.824 2097 2HB PRO 204 2HB PRO 204 28.201 36.370 4.186 2098 1HG PRO 204 1HG PRO 204 27.825 33.776 5.590 2099 2HG PRO 204 2HG PRO 204 27.940 35.412 6.253 2100 1HD PRO 204 1HD PRO 204 25.590 34.071 5.986 2101 2HD PRO 204 2HD PRO 204 25.712 35.841 5.912 2102 H ARG 205 H ARG 205 26.932 32.623 3.990 2103 HA ARG 205 HA ARG 205 27.150 31.459 1.253 2104 1HB ARG 205 1HB ARG 205 29.102 30.132 2.031 2105 2HB ARG 205 2HB ARG 205 29.429 31.861 2.147 2106 1HG ARG 205 1HG ARG 205 28.168 30.983 4.577 2107 2HG ARG 205 2HG ARG 205 29.538 29.928 4.229 2108 1HD ARG 205 1HD ARG 205 30.228 32.707 3.708 2109 2HD ARG 205 2HD ARG 205 29.672 32.487 5.378 2110 HE ARG 205 HE ARG 205 32.096 31.348 4.225 2111 1HH1 ARG 205 1HH1 ARG 205 29.552 30.889 6.557 2112 2HH1 ARG 205 2HH1 ARG 205 30.511 29.861 7.564 2113 1HH2 ARG 205 1HH2 ARG 205 33.320 30.011 5.549 2114 2HH2 ARG 205 2HH2 ARG 205 32.628 29.366 7.000 2115 H LYS 206 H LYS 206 24.819 31.265 2.618 2116 HA LYS 206 HA LYS 206 24.873 28.485 3.747 2117 1HB LYS 206 1HB LYS 206 23.502 31.031 4.614 2118 2HB LYS 206 2HB LYS 206 22.828 29.466 5.066 2119 1HG LYS 206 1HG LYS 206 25.352 28.986 5.772 2120 2HG LYS 206 2HG LYS 206 25.396 30.744 5.913 2121 1HD LYS 206 1HD LYS 206 23.270 29.018 7.209 2122 2HD LYS 206 2HD LYS 206 24.735 29.541 8.038 2123 1HE LYS 206 1HE LYS 206 23.991 31.705 8.246 2124 2HE LYS 206 2HE LYS 206 23.189 31.683 6.663 2125 1HZ LYS 206 1HZ LYS 206 21.447 30.333 7.539 2126 2HZ LYS 206 2HZ LYS 206 21.634 31.644 8.603 2127 3HZ LYS 206 3HZ LYS 206 22.259 30.120 9.016 2128 H GLN 207 H GLN 207 22.883 27.260 3.346 2129 HA GLN 207 HA GLN 207 20.884 28.364 1.488 2130 1HB GLN 207 1HB GLN 207 23.240 27.302 0.480 2131 2HB GLN 207 2HB GLN 207 22.138 25.927 0.409 2132 1HG GLN 207 1HG GLN 207 21.358 26.832 -1.512 2133 2HG GLN 207 2HG GLN 207 20.585 28.048 -0.495 2134 1HE2 GLN 207 1HE2 GLN 207 21.129 30.150 -1.084 2135 2HE2 GLN 207 2HE2 GLN 207 22.589 30.616 -1.812 2136 H LEU 208 H LEU 208 19.161 26.712 1.046 2137 HA LEU 208 HA LEU 208 19.080 24.609 3.189 2138 1HB LEU 208 1HB LEU 208 17.435 26.883 2.636 2139 2HB LEU 208 2HB LEU 208 16.476 25.442 2.296 2140 HG LEU 208 HG LEU 208 18.032 25.916 4.857 2141 1HD1 LEU 208 1HD1 LEU 208 15.172 26.401 4.063 2142 2HD1 LEU 208 2HD1 LEU 208 16.246 27.419 5.022 2143 3HD1 LEU 208 3HD1 LEU 208 15.555 25.957 5.726 2144 1HD2 LEU 208 1HD2 LEU 208 17.784 23.676 5.046 2145 2HD2 LEU 208 2HD2 LEU 208 16.698 23.607 3.658 2146 3HD2 LEU 208 3HD2 LEU 208 16.061 23.992 5.257 2147 H ALA 209 H ALA 209 19.483 22.727 2.034 2148 HA ALA 209 HA ALA 209 17.475 21.808 0.130 2149 1HB ALA 209 1HB ALA 209 18.499 22.735 -1.679 2150 2HB ALA 209 2HB ALA 209 19.794 21.565 -1.423 2151 3HB ALA 209 3HB ALA 209 19.915 23.180 -0.726 2152 H THR 210 H THR 210 17.526 20.132 1.848 2153 HA THR 210 HA THR 210 19.911 18.322 1.648 2154 HB THR 210 HB THR 210 17.840 18.393 3.854 2155 HG1 THR 210 HG1 THR 210 20.254 19.868 3.775 2156 1HG2 THR 210 1HG2 THR 210 19.309 17.066 5.004 2157 2HG2 THR 210 2HG2 THR 210 20.724 17.873 4.329 2158 3HG2 THR 210 3HG2 THR 210 19.867 16.657 3.382 2159 H LYS 211 H LYS 211 16.442 18.591 1.298 2160 HA LYS 211 HA LYS 211 16.346 15.690 0.536 2161 1HB LYS 211 1HB LYS 211 14.977 17.184 2.582 2162 2HB LYS 211 2HB LYS 211 13.792 16.634 1.397 2163 1HG LYS 211 1HG LYS 211 14.019 14.470 2.027 2164 2HG LYS 211 2HG LYS 211 15.779 14.583 2.062 2165 1HD LYS 211 1HD LYS 211 13.999 15.745 4.219 2166 2HD LYS 211 2HD LYS 211 14.698 14.129 4.312 2167 1HE LYS 211 1HE LYS 211 16.716 16.113 3.597 2168 2HE LYS 211 2HE LYS 211 15.939 16.493 5.146 2169 1HZ LYS 211 1HZ LYS 211 17.700 14.929 5.543 2170 2HZ LYS 211 2HZ LYS 211 17.127 13.891 4.327 2171 3HZ LYS 211 3HZ LYS 211 16.222 14.118 5.746 2172 H ALA 212 H ALA 212 16.159 15.746 -1.683 2173 HA ALA 212 HA ALA 212 14.070 17.562 -2.838 2174 1HB ALA 212 1HB ALA 212 16.948 17.077 -3.513 2175 2HB ALA 212 2HB ALA 212 16.027 18.580 -3.573 2176 3HB ALA 212 3HB ALA 212 15.839 17.378 -4.851 2177 H ALA 213 H ALA 213 16.185 14.853 -3.877 2178 HA ALA 213 HA ALA 213 13.947 13.713 -5.442 2179 1HB ALA 213 1HB ALA 213 16.279 12.077 -5.451 2180 2HB ALA 213 2HB ALA 213 16.833 13.752 -5.454 2181 3HB ALA 213 3HB ALA 213 15.743 13.181 -6.718 2182 H ARG 214 H ARG 214 14.074 11.095 -5.279 2183 HA ARG 214 HA ARG 214 14.045 10.350 -2.376 2184 1HB ARG 214 1HB ARG 214 12.005 9.629 -4.516 2185 2HB ARG 214 2HB ARG 214 11.915 9.192 -2.810 2186 1HG ARG 214 1HG ARG 214 12.252 11.909 -2.658 2187 2HG ARG 214 2HG ARG 214 11.289 11.755 -4.128 2188 1HD ARG 214 1HD ARG 214 9.472 10.814 -2.994 2189 2HD ARG 214 2HD ARG 214 10.487 10.203 -1.674 2190 HE ARG 214 HE ARG 214 10.326 12.333 -0.652 2191 1HH1 ARG 214 1HH1 ARG 214 9.448 12.504 -4.016 2192 2HH1 ARG 214 2HH1 ARG 214 8.953 14.158 -3.916 2193 1HH2 ARG 214 1HH2 ARG 214 9.677 14.480 -0.547 2194 2HH2 ARG 214 2HH2 ARG 214 9.081 15.270 -1.968 2195 1HN MLZ 215 1HN MLZ 215 13.040 7.661 -3.141 2196 HA MLZ 215 HA MLZ 215 15.521 6.304 -3.514 2197 1HB MLZ 215 1HB MLZ 215 12.588 5.623 -3.716 2198 2HB MLZ 215 2HB MLZ 215 13.802 4.404 -4.101 2199 1HG MLZ 215 1HG MLZ 215 13.764 5.976 -1.510 2200 2HG MLZ 215 2HG MLZ 215 14.780 4.588 -1.897 2201 1HD MLZ 215 1HD MLZ 215 11.772 4.620 -1.538 2202 2HD MLZ 215 2HD MLZ 215 12.653 3.243 -2.197 2203 1HE MLZ 215 1HE MLZ 215 13.824 4.270 0.300 2204 2HE MLZ 215 2HE MLZ 215 13.380 2.609 -0.136 2205 HZ MLZ 215 HZ MLZ 215 11.087 3.100 0.272 2206 1HCM MLZ 215 1HCM MLZ 215 11.954 2.442 2.265 2207 2HCM MLZ 215 2HCM MLZ 215 11.317 4.033 2.681 2208 3HCM MLZ 215 3HCM MLZ 215 13.035 3.833 2.341 2209 H SER 216 H SER 216 16.687 6.021 -5.369 2210 HA SER 216 HA SER 216 17.201 5.837 -7.667 2211 1HB SER 216 1HB SER 216 14.996 7.464 -8.617 2212 2HB SER 216 2HB SER 216 15.649 8.146 -7.127 2213 HG SER 216 HG SER 216 16.755 8.888 -8.990 2214 H ALA 217 H ALA 217 15.871 5.525 -9.931 2215 HA ALA 217 HA ALA 217 13.945 3.298 -9.382 2216 1HB ALA 217 1HB ALA 217 13.662 5.825 -10.948 2217 2HB ALA 217 2HB ALA 217 12.439 4.920 -10.054 2218 3HB ALA 217 3HB ALA 217 12.946 4.375 -11.653 2219 HA PRO 218 HA PRO 218 16.070 0.900 -12.371 2220 1HB PRO 218 1HB PRO 218 13.649 0.646 -14.078 2221 2HB PRO 218 2HB PRO 218 14.586 -0.620 -13.266 2222 1HG PRO 218 1HG PRO 218 12.155 0.144 -12.415 2223 2HG PRO 218 2HG PRO 218 13.420 -0.409 -11.310 2224 1HD PRO 218 1HD PRO 218 12.433 2.348 -11.830 2225 2HD PRO 218 2HD PRO 218 13.051 1.628 -10.328 2226 H ALA 219 H ALA 219 14.045 3.504 -13.622 2227 HA ALA 219 HA ALA 219 14.350 4.953 -15.464 2228 1HB ALA 219 1HB ALA 219 16.416 5.266 -14.039 2229 2HB ALA 219 2HB ALA 219 16.684 5.602 -15.749 2230 3HB ALA 219 3HB ALA 219 17.232 4.077 -15.054 2231 H THR 220 H THR 220 13.278 3.569 -17.028 2232 HA THR 220 HA THR 220 14.352 1.351 -18.383 2233 HB THR 220 HB THR 220 12.804 2.276 -20.256 2234 HG1 THR 220 HG1 THR 220 11.627 4.063 -19.693 2235 1HG2 THR 220 1HG2 THR 220 12.126 1.516 -17.461 2236 2HG2 THR 220 2HG2 THR 220 11.666 0.746 -18.979 2237 3HG2 THR 220 3HG2 THR 220 10.815 2.190 -18.429 2238 H GLY 221 H GLY 221 14.842 1.567 -20.918 2239 1HA GLY 221 1HA GLY 221 17.321 3.102 -21.113 2240 2HA GLY 221 2HA GLY 221 16.656 2.048 -22.360 2241 1HN SAH 301 1HN SAH 301 -11.049 -1.468 -7.274 2242 2HN SAH 301 2HN SAH 301 -9.798 -1.022 -8.335 2243 HA SAH 301 HA SAH 301 -10.180 1.355 -7.417 2244 1HB SAH 301 1HB SAH 301 -11.662 -0.542 -5.609 2245 2HB SAH 301 2HB SAH 301 -10.929 0.904 -4.920 2246 1HG SAH 301 1HG SAH 301 -13.421 0.748 -6.195 2247 2HG SAH 301 2HG SAH 301 -12.363 1.511 -7.381 2248 1H5* SAH 301 1H5* SAH 301 -14.823 2.009 -5.589 2249 2H5* SAH 301 2H5* SAH 301 -14.666 3.140 -4.247 2250 H4* SAH 301 H4* SAH 301 -14.114 4.762 -6.278 2251 H3* SAH 301 H3* SAH 301 -16.313 4.186 -4.506 2252 *HO3 SAH 301 *HO3 SAH 301 -16.686 6.530 -5.353 2253 H2* SAH 301 H2* SAH 301 -18.031 3.890 -5.907 2254 *HO2 SAH 301 *HO2 SAH 301 -17.361 6.007 -7.605 2255 H1* SAH 301 H1* SAH 301 -16.845 4.326 -8.495 2256 H8 SAH 301 H8 SAH 301 -16.426 1.103 -6.460 2257 1HN6 SAH 301 1HN6 SAH 301 -21.207 -1.113 -9.361 2258 2HN6 SAH 301 2HN6 SAH 301 -20.708 -1.067 -7.686 2259 H2 SAH 301 H2 SAH 301 -20.877 3.327 -10.482 2260 1HN SAH 302 1HN SAH 302 11.113 -1.444 7.287 2261 2HN SAH 302 2HN SAH 302 9.869 -1.007 8.358 2262 HA SAH 302 HA SAH 302 10.235 1.372 7.439 2263 1HB SAH 302 1HB SAH 302 11.713 -0.520 5.621 2264 2HB SAH 302 2HB SAH 302 10.969 0.924 4.935 2265 1HG SAH 302 1HG SAH 302 13.470 0.779 6.193 2266 2HG SAH 302 2HG SAH 302 12.417 1.537 7.388 2267 1H5* SAH 302 1H5* SAH 302 14.862 2.045 5.579 2268 2H5* SAH 302 2H5* SAH 302 14.690 3.176 4.238 2269 H4* SAH 302 H4* SAH 302 14.147 4.796 6.273 2270 H3* SAH 302 H3* SAH 302 16.336 4.229 4.487 2271 *HO3 SAH 302 *HO3 SAH 302 16.704 6.574 5.332 2272 H2* SAH 302 H2* SAH 302 18.065 3.940 5.876 2273 *HO2 SAH 302 *HO2 SAH 302 17.398 6.054 7.579 2274 H1* SAH 302 H1* SAH 302 16.895 4.370 8.471 2275 H8 SAH 302 H8 SAH 302 16.475 1.145 6.438 2276 1HN6 SAH 302 1HN6 SAH 302 21.284 -1.051 9.306 2277 2HN6 SAH 302 2HN6 SAH 302 20.774 -1.007 7.634 2278 H2 SAH 302 H2 SAH 302 20.943 3.388 10.431 Start of MODEL 5 1 1H MET 1 1H MET 1 1.743 -11.213 -8.985 2 2H MET 1 2H MET 1 1.966 -11.879 -7.439 3 3H MET 1 3H MET 1 2.289 -10.234 -7.709 4 HA MET 1 HA MET 1 0.216 -10.216 -6.651 5 1HB MET 1 1HB MET 1 0.674 -9.322 -9.213 6 2HB MET 1 2HB MET 1 -0.804 -10.260 -9.429 7 1HG MET 1 1HG MET 1 -1.428 -7.983 -8.870 8 2HG MET 1 2HG MET 1 -1.797 -9.009 -7.483 9 1HE MET 1 1HE MET 1 -1.450 -6.080 -8.122 10 2HE MET 1 2HE MET 1 -0.092 -5.216 -7.402 11 3HE MET 1 3HE MET 1 -1.397 -5.817 -6.379 12 H PHE 2 H PHE 2 -2.223 -10.924 -8.128 13 HA PHE 2 HA PHE 2 -3.829 -12.637 -7.849 14 1HB PHE 2 1HB PHE 2 -3.169 -14.589 -9.375 15 2HB PHE 2 2HB PHE 2 -3.141 -12.986 -10.101 16 HD1 PHE 2 HD1 PHE 2 -1.106 -15.816 -8.934 17 HD2 PHE 2 HD2 PHE 2 -1.027 -11.877 -10.645 18 HE1 PHE 2 HE1 PHE 2 1.272 -16.135 -9.559 19 HE2 PHE 2 HE2 PHE 2 1.351 -12.197 -11.271 20 HZ PHE 2 HZ PHE 2 2.500 -14.325 -10.728 21 H ASN 3 H ASN 3 -3.804 -13.173 -5.628 22 HA ASN 3 HA ASN 3 -1.871 -15.186 -4.645 23 1HB ASN 3 1HB ASN 3 -3.913 -13.292 -3.563 24 2HB ASN 3 2HB ASN 3 -3.574 -14.728 -2.596 25 1HD2 ASN 3 1HD2 ASN 3 -1.601 -14.775 -1.430 26 2HD2 ASN 3 2HD2 ASN 3 -0.422 -13.558 -1.523 27 H ASP 4 H ASP 4 -2.465 -17.304 -4.065 28 HA ASP 4 HA ASP 4 -4.383 -18.719 -5.509 29 1HB ASP 4 1HB ASP 4 -2.451 -19.480 -3.982 30 2HB ASP 4 2HB ASP 4 -3.599 -19.344 -2.649 31 H ARG 5 H ARG 5 -4.790 -17.318 -2.238 32 HA ARG 5 HA ARG 5 -7.490 -18.234 -1.874 33 1HB ARG 5 1HB ARG 5 -6.009 -15.844 -0.717 34 2HB ARG 5 2HB ARG 5 -7.432 -16.613 -0.014 35 1HG ARG 5 1HG ARG 5 -5.589 -18.698 -0.479 36 2HG ARG 5 2HG ARG 5 -4.651 -17.379 0.219 37 1HD ARG 5 1HD ARG 5 -5.590 -17.704 2.263 38 2HD ARG 5 2HD ARG 5 -7.224 -17.723 1.573 39 HE ARG 5 HE ARG 5 -5.719 -20.123 0.906 40 1HH1 ARG 5 1HH1 ARG 5 -7.646 -18.564 3.351 41 2HH1 ARG 5 2HH1 ARG 5 -8.153 -20.058 4.059 42 1HH2 ARG 5 1HH2 ARG 5 -6.390 -22.048 1.843 43 2HH2 ARG 5 2HH2 ARG 5 -7.449 -22.017 3.214 44 H VAL 6 H VAL 6 -6.117 -15.235 -3.212 45 HA VAL 6 HA VAL 6 -8.740 -14.645 -4.473 46 HB VAL 6 HB VAL 6 -7.240 -12.752 -2.622 47 1HG1 VAL 6 1HG1 VAL 6 -9.824 -11.807 -3.065 48 2HG1 VAL 6 2HG1 VAL 6 -9.303 -12.371 -4.653 49 3HG1 VAL 6 3HG1 VAL 6 -8.348 -11.166 -3.788 50 1HG2 VAL 6 1HG2 VAL 6 -9.766 -14.383 -2.291 51 2HG2 VAL 6 2HG2 VAL 6 -9.402 -12.988 -1.276 52 3HG2 VAL 6 3HG2 VAL 6 -8.331 -14.389 -1.266 53 H ILE 7 H ILE 7 -8.464 -13.557 -6.438 54 HA ILE 7 HA ILE 7 -5.638 -12.860 -7.162 55 HB ILE 7 HB ILE 7 -6.734 -14.779 -8.332 56 1HG1 ILE 7 1HG1 ILE 7 -6.523 -12.501 -10.294 57 2HG1 ILE 7 2HG1 ILE 7 -5.097 -13.080 -9.432 58 1HG2 ILE 7 1HG2 ILE 7 -8.688 -12.627 -9.197 59 2HG2 ILE 7 2HG2 ILE 7 -9.054 -14.051 -8.224 60 3HG2 ILE 7 3HG2 ILE 7 -8.598 -14.234 -9.917 61 1HD1 ILE 7 1HD1 ILE 7 -5.342 -14.226 -11.607 62 2HD1 ILE 7 2HD1 ILE 7 -6.945 -14.785 -11.132 63 3HD1 ILE 7 3HD1 ILE 7 -5.518 -15.364 -10.272 64 H VAL 8 H VAL 8 -5.314 -10.935 -8.439 65 HA VAL 8 HA VAL 8 -7.317 -8.819 -7.921 66 HB VAL 8 HB VAL 8 -4.513 -8.876 -9.098 67 1HG1 VAL 8 1HG1 VAL 8 -6.097 -6.448 -8.218 68 2HG1 VAL 8 2HG1 VAL 8 -5.992 -6.968 -9.900 69 3HG1 VAL 8 3HG1 VAL 8 -4.535 -6.473 -9.037 70 1HG2 VAL 8 1HG2 VAL 8 -3.934 -7.805 -6.918 71 2HG2 VAL 8 2HG2 VAL 8 -4.587 -9.432 -6.721 72 3HG2 VAL 8 3HG2 VAL 8 -5.604 -8.028 -6.398 73 H LYS 9 H LYS 9 -8.682 -8.053 -9.496 74 HA LYS 9 HA LYS 9 -8.006 -8.496 -12.336 75 1HB LYS 9 1HB LYS 9 -10.175 -9.719 -10.776 76 2HB LYS 9 2HB LYS 9 -10.530 -9.291 -12.439 77 1HG LYS 9 1HG LYS 9 -8.668 -10.645 -13.214 78 2HG LYS 9 2HG LYS 9 -8.152 -10.952 -11.557 79 1HD LYS 9 1HD LYS 9 -10.116 -12.246 -11.093 80 2HD LYS 9 2HD LYS 9 -10.876 -11.746 -12.604 81 1HE LYS 9 1HE LYS 9 -8.801 -12.835 -13.739 82 2HE LYS 9 2HE LYS 9 -8.589 -13.668 -12.188 83 1HZ LYS 9 1HZ LYS 9 -11.188 -13.537 -13.621 84 2HZ LYS 9 2HZ LYS 9 -10.778 -14.528 -12.304 85 3HZ LYS 9 3HZ LYS 9 -10.094 -14.820 -13.830 86 H LYS 10 H LYS 10 -9.663 -5.345 -12.838 87 HA LYS 10 HA LYS 10 -7.993 -5.646 -14.434 88 1HB LYS 10 1HB LYS 10 -7.023 -6.491 -11.882 89 2HB LYS 10 2HB LYS 10 -6.356 -7.578 -13.100 90 1HG LYS 10 1HG LYS 10 -4.880 -5.642 -12.820 91 2HG LYS 10 2HG LYS 10 -5.620 -5.602 -14.421 92 1HD LYS 10 1HD LYS 10 -7.439 -4.123 -13.341 93 2HD LYS 10 2HD LYS 10 -6.314 -3.942 -11.995 94 1HE LYS 10 1HE LYS 10 -4.921 -2.575 -13.195 95 2HE LYS 10 2HE LYS 10 -5.132 -3.515 -14.685 96 1HZ LYS 10 1HZ LYS 10 -7.125 -1.669 -13.467 97 2HZ LYS 10 2HZ LYS 10 -7.397 -2.622 -14.846 98 3HZ LYS 10 3HZ LYS 10 -6.239 -1.380 -14.887 99 H SER 11 H SER 11 -9.983 -6.936 -15.378 100 HA SER 11 HA SER 11 -8.876 -9.456 -16.427 101 1HB SER 11 1HB SER 11 -9.937 -10.525 -14.677 102 2HB SER 11 2HB SER 11 -11.130 -9.242 -14.479 103 HG SER 11 HG SER 11 -12.071 -11.112 -15.352 104 HA PRO 12 HA PRO 12 -12.826 -8.461 -18.973 105 1HB PRO 12 1HB PRO 12 -14.188 -6.150 -18.187 106 2HB PRO 12 2HB PRO 12 -14.688 -7.803 -17.789 107 1HG PRO 12 1HG PRO 12 -13.221 -5.812 -16.140 108 2HG PRO 12 2HG PRO 12 -14.434 -7.005 -15.655 109 1HD PRO 12 1HD PRO 12 -11.805 -7.347 -15.183 110 2HD PRO 12 2HD PRO 12 -12.888 -8.710 -15.521 111 H LEU 13 H LEU 13 -13.580 -5.964 -20.028 112 HA LEU 13 HA LEU 13 -11.270 -5.132 -21.441 113 1HB LEU 13 1HB LEU 13 -14.042 -4.600 -21.329 114 2HB LEU 13 2HB LEU 13 -13.257 -3.033 -21.136 115 HG LEU 13 HG LEU 13 -12.315 -4.933 -23.269 116 1HD1 LEU 13 1HD1 LEU 13 -14.941 -4.250 -23.189 117 2HD1 LEU 13 2HD1 LEU 13 -14.045 -4.469 -24.693 118 3HD1 LEU 13 3HD1 LEU 13 -14.284 -2.850 -24.036 119 1HD2 LEU 13 1HD2 LEU 13 -12.125 -2.453 -24.289 120 2HD2 LEU 13 2HD2 LEU 13 -10.875 -3.138 -23.251 121 3HD2 LEU 13 3HD2 LEU 13 -12.082 -2.044 -22.574 122 H GLY 14 H GLY 14 -12.603 -4.015 -18.366 123 1HA GLY 14 1HA GLY 14 -10.123 -2.783 -17.589 124 2HA GLY 14 2HA GLY 14 -11.281 -1.548 -18.084 125 H GLY 15 H GLY 15 -10.208 -2.070 -15.382 126 1HA GLY 15 1HA GLY 15 -12.080 -1.429 -13.619 127 2HA GLY 15 2HA GLY 15 -12.597 -3.085 -13.935 128 H TYR 16 H TYR 16 -11.504 -1.885 -11.428 129 HA TYR 16 HA TYR 16 -9.249 -3.818 -11.056 130 1HB TYR 16 1HB TYR 16 -8.895 -1.143 -11.324 131 2HB TYR 16 2HB TYR 16 -9.210 -1.223 -9.590 132 HD1 TYR 16 HD1 TYR 16 -6.590 -0.955 -11.675 133 HD2 TYR 16 HD2 TYR 16 -8.051 -3.700 -8.711 134 HE1 TYR 16 HE1 TYR 16 -4.279 -1.767 -11.287 135 HE2 TYR 16 HE2 TYR 16 -5.740 -4.511 -8.323 136 HH TYR 16 HH TYR 16 -3.539 -4.569 -9.813 137 H GLY 17 H GLY 17 -10.794 -5.218 -9.975 138 1HA GLY 17 1HA GLY 17 -11.477 -4.272 -7.225 139 2HA GLY 17 2HA GLY 17 -12.667 -5.158 -8.180 140 H VAL 18 H VAL 18 -12.377 -6.621 -6.115 141 HA VAL 18 HA VAL 18 -9.969 -8.371 -6.427 142 HB VAL 18 HB VAL 18 -12.056 -8.044 -4.240 143 1HG1 VAL 18 1HG1 VAL 18 -10.534 -9.476 -2.902 144 2HG1 VAL 18 2HG1 VAL 18 -9.520 -9.709 -4.325 145 3HG1 VAL 18 3HG1 VAL 18 -11.166 -10.339 -4.304 146 1HG2 VAL 18 1HG2 VAL 18 -9.607 -7.381 -3.197 147 2HG2 VAL 18 2HG2 VAL 18 -10.772 -6.214 -3.824 148 3HG2 VAL 18 3HG2 VAL 18 -9.459 -6.789 -4.852 149 H PHE 19 H PHE 19 -10.216 -10.533 -6.995 150 HA PHE 19 HA PHE 19 -12.999 -11.420 -7.666 151 1HB PHE 19 1HB PHE 19 -10.321 -11.619 -8.900 152 2HB PHE 19 2HB PHE 19 -11.245 -13.121 -8.941 153 HD1 PHE 19 HD1 PHE 19 -12.113 -9.477 -9.247 154 HD2 PHE 19 HD2 PHE 19 -12.357 -13.406 -10.966 155 HE1 PHE 19 HE1 PHE 19 -13.481 -8.577 -11.109 156 HE2 PHE 19 HE2 PHE 19 -13.725 -12.506 -12.828 157 HZ PHE 19 HZ PHE 19 -14.285 -10.091 -12.901 158 H ALA 20 H ALA 20 -13.805 -12.995 -6.350 159 HA ALA 20 HA ALA 20 -12.017 -14.331 -4.424 160 1HB ALA 20 1HB ALA 20 -13.916 -14.079 -3.217 161 2HB ALA 20 2HB ALA 20 -14.729 -15.219 -4.289 162 3HB ALA 20 3HB ALA 20 -14.758 -13.494 -4.653 163 H ARG 21 H ARG 21 -10.873 -15.938 -5.585 164 HA ARG 21 HA ARG 21 -12.105 -17.760 -7.469 165 1HB ARG 21 1HB ARG 21 -9.537 -17.247 -6.162 166 2HB ARG 21 2HB ARG 21 -9.850 -18.975 -6.325 167 1HG ARG 21 1HG ARG 21 -9.583 -18.914 -8.572 168 2HG ARG 21 2HG ARG 21 -10.564 -17.457 -8.729 169 1HD ARG 21 1HD ARG 21 -8.733 -16.064 -8.624 170 2HD ARG 21 2HD ARG 21 -7.878 -17.113 -7.477 171 HE ARG 21 HE ARG 21 -7.774 -17.316 -10.393 172 1HH1 ARG 21 1HH1 ARG 21 -7.527 -19.034 -7.375 173 2HH1 ARG 21 2HH1 ARG 21 -6.548 -20.292 -8.046 174 1HH2 ARG 21 1HH2 ARG 21 -6.503 -18.961 -11.239 175 2HH2 ARG 21 2HH2 ARG 21 -5.972 -20.253 -10.216 176 H LYS 22 H LYS 22 -11.986 -17.564 -4.006 177 HA LYS 22 HA LYS 22 -12.728 -20.412 -3.626 178 1HB LYS 22 1HB LYS 22 -12.392 -18.129 -1.637 179 2HB LYS 22 2HB LYS 22 -12.368 -19.850 -1.273 180 1HG LYS 22 1HG LYS 22 -10.425 -19.406 -3.298 181 2HG LYS 22 2HG LYS 22 -10.178 -18.180 -2.054 182 1HD LYS 22 1HD LYS 22 -9.842 -19.793 -0.365 183 2HD LYS 22 2HD LYS 22 -10.598 -21.072 -1.313 184 1HE LYS 22 1HE LYS 22 -8.444 -20.137 -2.884 185 2HE LYS 22 2HE LYS 22 -7.813 -20.303 -1.236 186 1HZ LYS 22 1HZ LYS 22 -9.022 -22.488 -1.168 187 2HZ LYS 22 2HZ LYS 22 -7.694 -22.444 -2.225 188 3HZ LYS 22 3HZ LYS 22 -9.273 -22.334 -2.841 189 H SER 23 H SER 23 -16.067 -19.617 -2.229 190 HA SER 23 HA SER 23 -13.575 -21.234 -1.914 191 1HB SER 23 1HB SER 23 -15.535 -22.478 -2.567 192 2HB SER 23 2HB SER 23 -15.281 -22.818 -0.855 193 HG SER 23 HG SER 23 -17.173 -22.024 -0.519 194 H PHE 24 H PHE 24 -15.606 -18.937 -0.288 195 HA PHE 24 HA PHE 24 -14.041 -19.395 2.228 196 1HB PHE 24 1HB PHE 24 -15.193 -16.980 0.820 197 2HB PHE 24 2HB PHE 24 -14.732 -16.902 2.520 198 HD1 PHE 24 HD1 PHE 24 -13.558 -15.862 -0.427 199 HD2 PHE 24 HD2 PHE 24 -12.354 -18.545 2.704 200 HE1 PHE 24 HE1 PHE 24 -11.186 -15.564 -1.085 201 HE2 PHE 24 HE2 PHE 24 -9.981 -18.248 2.046 202 HZ PHE 24 HZ PHE 24 -9.398 -16.756 0.151 203 H GLU 25 H GLU 25 -15.245 -18.761 4.248 204 HA GLU 25 HA GLU 25 -18.101 -19.628 4.057 205 1HB GLU 25 1HB GLU 25 -15.915 -20.432 5.612 206 2HB GLU 25 2HB GLU 25 -16.889 -19.456 6.713 207 1HG GLU 25 1HG GLU 25 -18.899 -20.821 5.782 208 2HG GLU 25 2HG GLU 25 -17.671 -21.950 5.213 209 H LYS 26 H LYS 26 -18.789 -18.621 6.663 210 HA LYS 26 HA LYS 26 -19.059 -15.730 5.992 211 1HB LYS 26 1HB LYS 26 -20.970 -17.423 6.493 212 2HB LYS 26 2HB LYS 26 -20.468 -17.278 8.172 213 1HG LYS 26 1HG LYS 26 -20.738 -14.800 7.998 214 2HG LYS 26 2HG LYS 26 -21.365 -15.019 6.364 215 1HD LYS 26 1HD LYS 26 -23.285 -16.181 7.141 216 2HD LYS 26 2HD LYS 26 -22.575 -16.453 8.732 217 1HE LYS 26 1HE LYS 26 -23.706 -14.589 9.393 218 2HE LYS 26 2HE LYS 26 -22.536 -13.667 8.431 219 1HZ LYS 26 1HZ LYS 26 -25.152 -14.771 7.561 220 2HZ LYS 26 2HZ LYS 26 -23.970 -14.250 6.458 221 3HZ LYS 26 3HZ LYS 26 -24.656 -13.147 7.553 222 H GLY 27 H GLY 27 -17.311 -14.629 6.872 223 1HA GLY 27 1HA GLY 27 -16.552 -13.480 8.904 224 2HA GLY 27 2HA GLY 27 -16.894 -14.955 9.809 225 H GLU 28 H GLU 28 -15.151 -14.638 6.718 226 HA GLU 28 HA GLU 28 -12.763 -15.831 8.089 227 1HB GLU 28 1HB GLU 28 -14.134 -16.228 5.448 228 2HB GLU 28 2HB GLU 28 -12.392 -16.497 5.529 229 1HG GLU 28 1HG GLU 28 -12.970 -17.911 7.655 230 2HG GLU 28 2HG GLU 28 -14.598 -17.943 6.978 231 H LEU 29 H LEU 29 -10.947 -14.572 8.071 232 HA LEU 29 HA LEU 29 -10.895 -11.930 6.967 233 1HB LEU 29 1HB LEU 29 -9.565 -13.095 8.889 234 2HB LEU 29 2HB LEU 29 -8.476 -13.630 7.612 235 HG LEU 29 HG LEU 29 -7.707 -11.514 8.662 236 1HD1 LEU 29 1HD1 LEU 29 -7.649 -12.138 6.054 237 2HD1 LEU 29 2HD1 LEU 29 -6.991 -10.622 6.669 238 3HD1 LEU 29 3HD1 LEU 29 -8.602 -10.658 5.954 239 1HD2 LEU 29 1HD2 LEU 29 -9.623 -9.744 7.436 240 2HD2 LEU 29 2HD2 LEU 29 -9.152 -9.858 9.132 241 3HD2 LEU 29 3HD2 LEU 29 -10.456 -10.867 8.510 242 H VAL 30 H VAL 30 -10.573 -11.342 4.873 243 HA VAL 30 HA VAL 30 -9.369 -13.320 2.988 244 HB VAL 30 HB VAL 30 -10.928 -10.747 2.531 245 1HG1 VAL 30 1HG1 VAL 30 -9.356 -12.284 0.774 246 2HG1 VAL 30 2HG1 VAL 30 -10.534 -11.049 0.331 247 3HG1 VAL 30 3HG1 VAL 30 -11.023 -12.740 0.426 248 1HG2 VAL 30 1HG2 VAL 30 -12.559 -12.785 1.746 249 2HG2 VAL 30 2HG2 VAL 30 -12.627 -12.039 3.343 250 3HG2 VAL 30 3HG2 VAL 30 -11.729 -13.538 3.108 251 H GLU 31 H GLU 31 -7.186 -12.753 3.885 252 HA GLU 31 HA GLU 31 -5.105 -11.671 3.642 253 1HB GLU 31 1HB GLU 31 -5.987 -11.767 1.234 254 2HB GLU 31 2HB GLU 31 -6.496 -10.093 1.456 255 1HG GLU 31 1HG GLU 31 -4.334 -9.297 1.510 256 2HG GLU 31 2HG GLU 31 -3.692 -10.784 2.209 257 H GLU 32 H GLU 32 -4.220 -9.999 4.810 258 HA GLU 32 HA GLU 32 -5.924 -7.591 5.315 259 1HB GLU 32 1HB GLU 32 -5.928 -8.963 7.280 260 2HB GLU 32 2HB GLU 32 -4.221 -9.360 7.097 261 1HG GLU 32 1HG GLU 32 -3.656 -6.985 7.536 262 2HG GLU 32 2HG GLU 32 -5.363 -6.647 7.827 263 H CYS 33 H CYS 33 -4.625 -5.625 5.777 264 HA CYS 33 HA CYS 33 -1.748 -5.740 5.063 265 1HB CYS 33 1HB CYS 33 -3.818 -5.181 3.218 266 2HB CYS 33 2HB CYS 33 -3.071 -3.626 3.583 267 HG CYS 33 HG CYS 33 -1.208 -4.323 2.117 268 H LEU 34 H LEU 34 -1.192 -3.085 4.848 269 HA LEU 34 HA LEU 34 -2.120 -1.983 7.475 270 1HB LEU 34 1HB LEU 34 0.402 -2.575 6.425 271 2HB LEU 34 2HB LEU 34 0.286 -0.831 6.292 272 HG LEU 34 HG LEU 34 -0.771 -1.277 8.786 273 1HD1 LEU 34 1HD1 LEU 34 1.315 -3.316 8.103 274 2HD1 LEU 34 2HD1 LEU 34 -0.210 -3.542 8.958 275 3HD1 LEU 34 3HD1 LEU 34 1.141 -2.739 9.762 276 1HD2 LEU 34 1HD2 LEU 34 1.892 -0.819 9.303 277 2HD2 LEU 34 2HD2 LEU 34 0.729 0.433 8.866 278 3HD2 LEU 34 3HD2 LEU 34 1.753 -0.291 7.626 279 H CYS 35 H CYS 35 -1.906 0.542 7.467 280 HA CYS 35 HA CYS 35 -2.711 1.693 4.824 281 1HB CYS 35 1HB CYS 35 -4.173 1.624 7.460 282 2HB CYS 35 2HB CYS 35 -4.431 2.979 6.363 283 HG CYS 35 HG CYS 35 -5.977 1.489 5.137 284 H ILE 36 H ILE 36 -3.077 4.270 5.429 285 HA ILE 36 HA ILE 36 -0.591 5.081 6.925 286 HB ILE 36 HB ILE 36 -1.961 6.478 4.600 287 1HG1 ILE 36 1HG1 ILE 36 0.553 4.790 4.515 288 2HG1 ILE 36 2HG1 ILE 36 -1.033 4.209 4.004 289 1HG2 ILE 36 1HG2 ILE 36 -0.196 7.492 6.419 290 2HG2 ILE 36 2HG2 ILE 36 -0.341 8.067 4.758 291 3HG2 ILE 36 3HG2 ILE 36 0.905 6.892 5.179 292 1HD1 ILE 36 1HD1 ILE 36 -0.358 6.814 2.847 293 2HD1 ILE 36 2HD1 ILE 36 -0.925 5.347 2.048 294 3HD1 ILE 36 3HD1 ILE 36 0.792 5.554 2.398 295 H VAL 37 H VAL 37 -0.850 6.761 8.430 296 HA VAL 37 HA VAL 37 -3.652 7.764 8.795 297 HB VAL 37 HB VAL 37 -1.330 7.414 10.721 298 1HG1 VAL 37 1HG1 VAL 37 -3.263 7.827 12.403 299 2HG1 VAL 37 2HG1 VAL 37 -4.106 8.548 11.032 300 3HG1 VAL 37 3HG1 VAL 37 -2.574 9.229 11.582 301 1HG2 VAL 37 1HG2 VAL 37 -3.578 5.734 9.843 302 2HG2 VAL 37 2HG2 VAL 37 -3.434 5.876 11.596 303 3HG2 VAL 37 3HG2 VAL 37 -2.077 5.269 10.646 304 H ARG 38 H ARG 38 -3.912 9.882 8.262 305 HA ARG 38 HA ARG 38 -1.731 11.819 8.821 306 1HB ARG 38 1HB ARG 38 -1.304 10.903 6.581 307 2HB ARG 38 2HB ARG 38 -2.967 11.231 6.106 308 1HG ARG 38 1HG ARG 38 -1.312 12.942 5.287 309 2HG ARG 38 2HG ARG 38 -2.611 13.614 6.264 310 1HD ARG 38 1HD ARG 38 -1.155 13.759 8.208 311 2HD ARG 38 2HD ARG 38 0.127 12.874 7.362 312 HE ARG 38 HE ARG 38 -0.593 15.083 5.735 313 1HH1 ARG 38 1HH1 ARG 38 0.829 14.453 8.850 314 2HH1 ARG 38 2HH1 ARG 38 1.771 15.903 8.835 315 1HH2 ARG 38 1HH2 ARG 38 0.639 16.959 5.740 316 2HH2 ARG 38 2HH2 ARG 38 1.666 17.313 7.089 317 H HIS 39 H HIS 39 -2.616 13.714 9.548 318 HA HIS 39 HA HIS 39 -5.332 14.073 10.136 319 1HB HIS 39 1HB HIS 39 -3.038 15.989 9.634 320 2HB HIS 39 2HB HIS 39 -4.596 16.533 10.259 321 HD1 HIS 39 HD1 HIS 39 -2.170 16.826 12.080 322 HD2 HIS 39 HD2 HIS 39 -4.562 13.412 12.042 323 HE1 HIS 39 HE1 HIS 39 -1.826 15.685 14.315 324 H ASN 40 H ASN 40 -6.427 16.298 9.213 325 HA ASN 40 HA ASN 40 -6.912 15.726 6.336 326 1HB ASN 40 1HB ASN 40 -8.951 17.075 6.778 327 2HB ASN 40 2HB ASN 40 -8.774 15.787 7.970 328 1HD2 ASN 40 1HD2 ASN 40 -9.538 19.011 7.756 329 2HD2 ASN 40 2HD2 ASN 40 -9.030 19.526 9.292 330 H ASP 41 H ASP 41 -5.806 16.951 4.898 331 HA ASP 41 HA ASP 41 -5.843 19.830 4.902 332 1HB ASP 41 1HB ASP 41 -3.453 20.183 5.450 333 2HB ASP 41 2HB ASP 41 -4.266 19.379 6.791 334 H ASP 42 H ASP 42 -3.030 19.774 3.597 335 HA ASP 42 HA ASP 42 -3.726 19.402 0.887 336 1HB ASP 42 1HB ASP 42 -1.064 18.917 2.282 337 2HB ASP 42 2HB ASP 42 -1.273 19.286 0.570 338 H TRP 43 H TRP 43 -2.940 17.066 3.357 339 HA TRP 43 HA TRP 43 -2.244 14.790 1.824 340 1HB TRP 43 1HB TRP 43 -2.077 14.819 4.226 341 2HB TRP 43 2HB TRP 43 -3.771 15.263 4.407 342 HD1 TRP 43 HD1 TRP 43 -5.400 13.356 4.823 343 HE1 TRP 43 HE1 TRP 43 -5.315 10.787 4.621 344 HE3 TRP 43 HE3 TRP 43 -0.817 12.798 2.654 345 HZ2 TRP 43 HZ2 TRP 43 -3.534 8.767 3.661 346 HZ3 TRP 43 HZ3 TRP 43 0.046 10.544 2.107 347 HH2 TRP 43 HH2 TRP 43 -1.303 8.534 2.614 348 H GLY 44 H GLY 44 -5.502 15.729 3.013 349 1HA GLY 44 1HA GLY 44 -6.907 13.732 1.534 350 2HA GLY 44 2HA GLY 44 -7.631 15.207 2.176 351 H THR 45 H THR 45 -5.696 16.902 0.646 352 HA THR 45 HA THR 45 -7.273 17.189 -1.771 353 HB THR 45 HB THR 45 -4.573 18.360 -1.022 354 HG1 THR 45 HG1 THR 45 -5.639 19.248 0.532 355 1HG2 THR 45 1HG2 THR 45 -4.817 19.368 -3.029 356 2HG2 THR 45 2HG2 THR 45 -6.159 20.260 -2.313 357 3HG2 THR 45 3HG2 THR 45 -6.466 18.769 -3.202 358 H ALA 46 H ALA 46 -3.936 16.052 -1.135 359 HA ALA 46 HA ALA 46 -3.450 15.444 -3.954 360 1HB ALA 46 1HB ALA 46 -1.444 15.856 -2.925 361 2HB ALA 46 2HB ALA 46 -1.520 14.151 -2.481 362 3HB ALA 46 3HB ALA 46 -2.059 15.384 -1.340 363 H LEU 47 H LEU 47 -4.204 13.565 -1.020 364 HA LEU 47 HA LEU 47 -4.226 11.037 -2.560 365 1HB LEU 47 1HB LEU 47 -4.503 11.901 0.322 366 2HB LEU 47 2HB LEU 47 -4.921 10.255 -0.149 367 HG LEU 47 HG LEU 47 -2.593 10.330 0.594 368 1HD1 LEU 47 1HD1 LEU 47 -3.480 9.207 -1.741 369 2HD1 LEU 47 2HD1 LEU 47 -1.874 8.945 -1.061 370 3HD1 LEU 47 3HD1 LEU 47 -2.113 10.163 -2.313 371 1HD2 LEU 47 1HD2 LEU 47 -1.784 12.062 -1.693 372 2HD2 LEU 47 2HD2 LEU 47 -1.055 11.893 -0.096 373 3HD2 LEU 47 3HD2 LEU 47 -2.519 12.856 -0.300 374 H GLU 48 H GLU 48 -6.309 13.306 -2.889 375 HA GLU 48 HA GLU 48 -8.809 12.424 -1.803 376 1HB GLU 48 1HB GLU 48 -9.707 13.944 -3.559 377 2HB GLU 48 2HB GLU 48 -8.330 14.670 -2.730 378 1HG GLU 48 1HG GLU 48 -7.330 14.924 -4.728 379 2HG GLU 48 2HG GLU 48 -7.245 13.168 -4.859 380 H ASP 49 H ASP 49 -8.527 10.022 -2.246 381 HA ASP 49 HA ASP 49 -10.015 9.261 -4.632 382 1HB ASP 49 1HB ASP 49 -7.152 9.511 -4.713 383 2HB ASP 49 2HB ASP 49 -7.565 7.804 -4.871 384 H TYR 50 H TYR 50 -7.493 7.725 -2.585 385 HA TYR 50 HA TYR 50 -9.551 5.682 -1.797 386 1HB TYR 50 1HB TYR 50 -6.547 5.305 -2.062 387 2HB TYR 50 2HB TYR 50 -7.768 4.045 -1.906 388 HD1 TYR 50 HD1 TYR 50 -5.682 5.622 -4.192 389 HD2 TYR 50 HD2 TYR 50 -9.758 4.331 -3.773 390 HE1 TYR 50 HE1 TYR 50 -5.917 5.566 -6.659 391 HE2 TYR 50 HE2 TYR 50 -9.993 4.275 -6.241 392 HH TYR 50 HH TYR 50 -8.502 4.049 -8.225 393 H LEU 51 H LEU 51 -9.499 7.818 -0.165 394 HA LEU 51 HA LEU 51 -7.601 7.183 2.056 395 1HB LEU 51 1HB LEU 51 -9.105 9.613 1.083 396 2HB LEU 51 2HB LEU 51 -8.541 9.552 2.751 397 HG LEU 51 HG LEU 51 -6.823 9.275 0.265 398 1HD1 LEU 51 1HD1 LEU 51 -7.488 11.479 2.155 399 2HD1 LEU 51 2HD1 LEU 51 -7.062 11.554 0.444 400 3HD1 LEU 51 3HD1 LEU 51 -5.800 11.345 1.659 401 1HD2 LEU 51 1HD2 LEU 51 -5.032 9.533 2.216 402 2HD2 LEU 51 2HD2 LEU 51 -5.664 7.949 1.769 403 3HD2 LEU 51 3HD2 LEU 51 -6.314 8.791 3.175 404 H PHE 52 H PHE 52 -8.555 5.857 3.550 405 HA PHE 52 HA PHE 52 -11.467 6.040 4.103 406 1HB PHE 52 1HB PHE 52 -9.263 4.131 4.393 407 2HB PHE 52 2HB PHE 52 -10.210 4.261 5.875 408 HD1 PHE 52 HD1 PHE 52 -9.940 2.277 3.152 409 HD2 PHE 52 HD2 PHE 52 -12.910 4.705 5.085 410 HE1 PHE 52 HE1 PHE 52 -11.731 0.899 2.131 411 HE2 PHE 52 HE2 PHE 52 -14.701 3.327 4.063 412 HZ PHE 52 HZ PHE 52 -14.112 1.424 2.586 413 H SER 53 H SER 53 -11.790 7.948 5.299 414 HA SER 53 HA SER 53 -9.891 8.555 7.509 415 1HB SER 53 1HB SER 53 -10.722 10.776 7.282 416 2HB SER 53 2HB SER 53 -10.685 10.158 5.630 417 HG SER 53 HG SER 53 -12.913 9.582 5.937 418 H ARG 54 H ARG 54 -10.539 8.630 9.650 419 HA ARG 54 HA ARG 54 -13.243 7.534 10.268 420 1HB ARG 54 1HB ARG 54 -10.597 7.083 11.168 421 2HB ARG 54 2HB ARG 54 -11.425 7.882 12.505 422 1HG ARG 54 1HG ARG 54 -13.255 6.222 12.352 423 2HG ARG 54 2HG ARG 54 -12.405 5.417 11.033 424 1HD ARG 54 1HD ARG 54 -10.412 5.242 12.684 425 2HD ARG 54 2HD ARG 54 -11.610 5.600 13.943 426 HE ARG 54 HE ARG 54 -12.516 3.546 12.081 427 1HH1 ARG 54 1HH1 ARG 54 -10.638 4.181 14.943 428 2HH1 ARG 54 2HH1 ARG 54 -10.817 2.572 15.550 429 1HH2 ARG 54 1HH2 ARG 54 -12.733 1.463 12.891 430 2HH2 ARG 54 2HH2 ARG 54 -11.993 1.044 14.400 431 H LYS 55 H LYS 55 -13.804 8.494 12.699 432 HA LYS 55 HA LYS 55 -14.370 11.312 12.225 433 1HB LYS 55 1HB LYS 55 -14.864 9.316 14.460 434 2HB LYS 55 2HB LYS 55 -15.431 10.983 14.551 435 1HG LYS 55 1HG LYS 55 -16.354 10.361 12.101 436 2HG LYS 55 2HG LYS 55 -16.372 8.750 12.819 437 1HD LYS 55 1HD LYS 55 -17.440 10.289 14.836 438 2HD LYS 55 2HD LYS 55 -18.077 11.081 13.395 439 1HE LYS 55 1HE LYS 55 -19.655 9.440 13.359 440 2HE LYS 55 2HE LYS 55 -18.355 8.338 12.864 441 1HZ LYS 55 1HZ LYS 55 -17.779 8.169 15.279 442 2HZ LYS 55 2HZ LYS 55 -19.276 7.480 14.871 443 3HZ LYS 55 3HZ LYS 55 -19.219 8.997 15.631 444 H ASN 56 H ASN 56 -12.094 12.044 12.182 445 HA ASN 56 HA ASN 56 -10.580 11.958 14.706 446 1HB ASN 56 1HB ASN 56 -11.741 14.498 13.511 447 2HB ASN 56 2HB ASN 56 -12.258 13.745 15.018 448 1HD2 ASN 56 1HD2 ASN 56 -10.953 16.455 14.534 449 2HD2 ASN 56 2HD2 ASN 56 -9.580 16.458 15.531 450 H MET 57 H MET 57 -10.357 11.394 11.633 451 HA MET 57 HA MET 57 -8.377 13.284 10.649 452 1HB MET 57 1HB MET 57 -6.430 11.741 11.002 453 2HB MET 57 2HB MET 57 -7.133 12.297 12.520 454 1HG MET 57 1HG MET 57 -8.520 9.930 11.653 455 2HG MET 57 2HG MET 57 -6.789 9.617 11.643 456 1HE MET 57 1HE MET 57 -5.795 11.619 14.377 457 2HE MET 57 2HE MET 57 -5.279 10.377 13.237 458 3HE MET 57 3HE MET 57 -5.452 9.986 14.948 459 H SER 58 H SER 58 -6.966 11.988 8.868 460 HA SER 58 HA SER 58 -8.858 10.169 7.415 461 1HB SER 58 1HB SER 58 -7.498 11.339 5.420 462 2HB SER 58 2HB SER 58 -8.918 12.103 6.129 463 HG SER 58 HG SER 58 -7.667 13.655 6.724 464 H ALA 59 H ALA 59 -7.920 8.349 6.433 465 HA ALA 59 HA ALA 59 -4.939 8.087 6.599 466 1HB ALA 59 1HB ALA 59 -7.149 6.441 7.784 467 2HB ALA 59 2HB ALA 59 -5.563 6.826 8.456 468 3HB ALA 59 3HB ALA 59 -5.717 5.589 7.206 469 H MET 60 H MET 60 -4.139 6.340 5.094 470 HA MET 60 HA MET 60 -5.835 6.229 2.648 471 1HB MET 60 1HB MET 60 -3.154 6.737 3.120 472 2HB MET 60 2HB MET 60 -3.131 5.052 2.607 473 1HG MET 60 1HG MET 60 -4.893 6.171 0.815 474 2HG MET 60 2HG MET 60 -3.740 7.483 1.058 475 1HE MET 60 1HE MET 60 -3.752 7.288 -1.221 476 2HE MET 60 2HE MET 60 -3.277 5.920 -2.228 477 3HE MET 60 3HE MET 60 -2.062 7.075 -1.678 478 H ALA 61 H ALA 61 -5.797 4.075 1.451 479 HA ALA 61 HA ALA 61 -6.561 1.948 3.303 480 1HB ALA 61 1HB ALA 61 -6.903 2.737 0.548 481 2HB ALA 61 2HB ALA 61 -7.848 1.572 1.475 482 3HB ALA 61 3HB ALA 61 -6.408 1.046 0.604 483 H LEU 62 H LEU 62 -3.623 2.803 1.701 484 HA LEU 62 HA LEU 62 -2.103 0.779 2.985 485 1HB LEU 62 1HB LEU 62 -0.925 1.746 0.508 486 2HB LEU 62 2HB LEU 62 -1.725 3.057 1.375 487 HG LEU 62 HG LEU 62 -0.496 2.407 3.437 488 1HD1 LEU 62 1HD1 LEU 62 1.607 0.866 2.597 489 2HD1 LEU 62 2HD1 LEU 62 0.279 0.174 1.666 490 3HD1 LEU 62 3HD1 LEU 62 0.185 0.234 3.426 491 1HD2 LEU 62 1HD2 LEU 62 1.696 2.660 1.459 492 2HD2 LEU 62 2HD2 LEU 62 1.306 3.679 2.845 493 3HD2 LEU 62 3HD2 LEU 62 0.417 3.870 1.335 494 H GLY 63 H GLY 63 -2.953 -1.313 2.556 495 1HA GLY 63 1HA GLY 63 -1.857 -2.667 0.301 496 2HA GLY 63 2HA GLY 63 -3.053 -3.347 1.401 497 H PHE 64 H PHE 64 -4.622 -4.172 0.098 498 HA PHE 64 HA PHE 64 -5.417 -2.791 -2.385 499 1HB PHE 64 1HB PHE 64 -6.235 -5.353 -0.973 500 2HB PHE 64 2HB PHE 64 -6.875 -4.860 -2.540 501 HD1 PHE 64 HD1 PHE 64 -4.823 -3.935 -4.157 502 HD2 PHE 64 HD2 PHE 64 -4.534 -6.929 -1.091 503 HE1 PHE 64 HE1 PHE 64 -2.818 -4.880 -5.270 504 HE2 PHE 64 HE2 PHE 64 -2.529 -7.875 -2.204 505 HZ PHE 64 HZ PHE 64 -1.671 -6.850 -4.293 506 H GLY 65 H GLY 65 -6.023 -1.272 -0.021 507 1HA GLY 65 1HA GLY 65 -8.851 -1.693 0.614 508 2HA GLY 65 2HA GLY 65 -7.848 -0.364 1.191 509 H ALA 66 H ALA 66 -7.011 0.009 -1.770 510 HA ALA 66 HA ALA 66 -9.154 1.930 -2.400 511 1HB ALA 66 1HB ALA 66 -6.507 1.194 -3.708 512 2HB ALA 66 2HB ALA 66 -6.766 2.513 -2.567 513 3HB ALA 66 3HB ALA 66 -7.502 2.575 -4.169 514 H ILE 67 H ILE 67 -7.543 -0.789 -4.099 515 HA ILE 67 HA ILE 67 -8.990 -0.888 -6.457 516 HB ILE 67 HB ILE 67 -8.580 -3.388 -6.291 517 1HG1 ILE 67 1HG1 ILE 67 -7.022 -3.830 -4.182 518 2HG1 ILE 67 2HG1 ILE 67 -8.021 -2.571 -3.463 519 1HG2 ILE 67 1HG2 ILE 67 -6.876 -1.674 -7.035 520 2HG2 ILE 67 2HG2 ILE 67 -6.191 -3.164 -6.387 521 3HG2 ILE 67 3HG2 ILE 67 -6.230 -1.707 -5.394 522 1HD1 ILE 67 1HD1 ILE 67 -9.498 -4.645 -4.970 523 2HD1 ILE 67 2HD1 ILE 67 -9.880 -3.890 -3.422 524 3HD1 ILE 67 3HD1 ILE 67 -8.704 -5.202 -3.496 525 H PHE 68 H PHE 68 -10.211 -1.675 -3.255 526 HA PHE 68 HA PHE 68 -12.402 -3.329 -3.848 527 1HB PHE 68 1HB PHE 68 -11.867 -1.109 -1.877 528 2HB PHE 68 2HB PHE 68 -13.428 -1.928 -1.878 529 HD1 PHE 68 HD1 PHE 68 -12.775 -4.691 -2.524 530 HD2 PHE 68 HD2 PHE 68 -10.666 -1.901 -0.031 531 HE1 PHE 68 HE1 PHE 68 -11.786 -6.575 -1.253 532 HE2 PHE 68 HE2 PHE 68 -9.677 -3.787 1.242 533 HZ PHE 68 HZ PHE 68 -10.238 -6.124 0.631 534 H ASN 69 H ASN 69 -14.469 -2.963 -4.692 535 HA ASN 69 HA ASN 69 -14.960 -0.229 -5.830 536 1HB ASN 69 1HB ASN 69 -15.593 -3.046 -6.756 537 2HB ASN 69 2HB ASN 69 -16.328 -1.628 -7.501 538 1HD2 ASN 69 1HD2 ASN 69 -13.983 -3.726 -8.194 539 2HD2 ASN 69 2HD2 ASN 69 -12.814 -2.705 -8.885 540 H HIS 70 H HIS 70 -17.448 0.032 -6.271 541 HA HIS 70 HA HIS 70 -18.859 -0.586 -3.724 542 1HB HIS 70 1HB HIS 70 -18.604 1.738 -4.815 543 2HB HIS 70 2HB HIS 70 -19.747 1.169 -6.032 544 HD1 HIS 70 HD1 HIS 70 -19.534 1.439 -2.228 545 HD2 HIS 70 HD2 HIS 70 -22.384 1.502 -5.270 546 HE1 HIS 70 HE1 HIS 70 -21.754 1.944 -1.119 547 H SER 71 H SER 71 -19.566 -2.746 -4.050 548 HA SER 71 HA SER 71 -21.326 -3.209 -6.435 549 1HB SER 71 1HB SER 71 -19.809 -5.150 -4.648 550 2HB SER 71 2HB SER 71 -20.685 -5.572 -6.119 551 HG SER 71 HG SER 71 -18.382 -3.950 -5.864 552 H LYS 72 H LYS 72 -23.412 -4.009 -6.065 553 HA LYS 72 HA LYS 72 -24.734 -3.474 -3.611 554 1HB LYS 72 1HB LYS 72 -25.272 -5.166 -6.053 555 2HB LYS 72 2HB LYS 72 -26.426 -5.144 -4.720 556 1HG LYS 72 1HG LYS 72 -25.427 -2.507 -5.686 557 2HG LYS 72 2HG LYS 72 -26.541 -3.375 -6.742 558 1HD LYS 72 1HD LYS 72 -28.295 -3.215 -5.250 559 2HD LYS 72 2HD LYS 72 -27.234 -3.213 -3.841 560 1HE LYS 72 1HE LYS 72 -26.948 -0.930 -3.905 561 2HE LYS 72 2HE LYS 72 -26.987 -0.877 -5.678 562 1HZ LYS 72 1HZ LYS 72 -29.303 -1.340 -3.865 563 2HZ LYS 72 2HZ LYS 72 -29.371 -1.428 -5.560 564 3HZ LYS 72 3HZ LYS 72 -29.024 0.051 -4.800 565 H ASP 73 H ASP 73 -25.012 -4.703 -1.762 566 HA ASP 73 HA ASP 73 -24.651 -6.456 -0.219 567 1HB ASP 73 1HB ASP 73 -26.202 -7.392 -2.079 568 2HB ASP 73 2HB ASP 73 -24.767 -8.229 -2.671 569 HA PRO 74 HA PRO 74 -20.203 -6.629 -1.748 570 1HB PRO 74 1HB PRO 74 -19.217 -5.659 0.684 571 2HB PRO 74 2HB PRO 74 -19.504 -4.673 -0.760 572 1HG PRO 74 1HG PRO 74 -21.174 -5.010 1.673 573 2HG PRO 74 2HG PRO 74 -20.921 -3.578 0.666 574 1HD PRO 74 1HD PRO 74 -23.180 -5.065 0.559 575 2HD PRO 74 2HD PRO 74 -22.530 -4.208 -0.854 576 H ASN 75 H ASN 75 -19.957 -8.859 -1.615 577 HA ASN 75 HA ASN 75 -20.589 -10.528 0.584 578 1HB ASN 75 1HB ASN 75 -18.483 -10.765 -1.598 579 2HB ASN 75 2HB ASN 75 -19.053 -12.110 -0.611 580 1HD2 ASN 75 1HD2 ASN 75 -19.904 -9.954 -3.265 581 2HD2 ASN 75 2HD2 ASN 75 -21.351 -10.736 -3.682 582 H ALA 76 H ALA 76 -17.900 -8.370 0.132 583 HA ALA 76 HA ALA 76 -16.581 -9.552 2.554 584 1HB ALA 76 1HB ALA 76 -15.170 -7.956 0.418 585 2HB ALA 76 2HB ALA 76 -15.517 -9.666 0.158 586 3HB ALA 76 3HB ALA 76 -14.500 -9.169 1.510 587 H ARG 77 H ARG 77 -15.740 -8.039 4.076 588 HA ARG 77 HA ARG 77 -16.556 -5.184 3.644 589 1HB ARG 77 1HB ARG 77 -17.288 -7.189 5.662 590 2HB ARG 77 2HB ARG 77 -16.697 -5.692 6.381 591 1HG ARG 77 1HG ARG 77 -18.362 -4.842 4.306 592 2HG ARG 77 2HG ARG 77 -19.218 -6.213 5.013 593 1HD ARG 77 1HD ARG 77 -18.059 -3.962 6.688 594 2HD ARG 77 2HD ARG 77 -19.737 -3.979 6.110 595 HE ARG 77 HE ARG 77 -19.312 -6.508 7.241 596 1HH1 ARG 77 1HH1 ARG 77 -19.149 -3.194 8.295 597 2HH1 ARG 77 2HH1 ARG 77 -19.566 -3.579 9.929 598 1HH2 ARG 77 1HH2 ARG 77 -19.851 -6.981 9.368 599 2HH2 ARG 77 2HH2 ARG 77 -19.960 -5.705 10.534 600 H HIS 78 H HIS 78 -15.449 -3.982 5.786 601 HA HIS 78 HA HIS 78 -12.596 -4.891 5.895 602 1HB HIS 78 1HB HIS 78 -11.992 -2.486 5.535 603 2HB HIS 78 2HB HIS 78 -12.877 -3.163 4.168 604 HD1 HIS 78 HD1 HIS 78 -15.438 -2.504 3.971 605 HD2 HIS 78 HD2 HIS 78 -13.310 -0.395 6.870 606 HE1 HIS 78 HE1 HIS 78 -16.872 -0.516 4.608 607 H GLU 79 H GLU 79 -11.443 -4.095 7.782 608 HA GLU 79 HA GLU 79 -13.129 -2.865 9.923 609 1HB GLU 79 1HB GLU 79 -13.194 -5.312 10.170 610 2HB GLU 79 2HB GLU 79 -11.434 -5.385 10.086 611 1HG GLU 79 1HG GLU 79 -11.338 -3.927 12.124 612 2HG GLU 79 2HG GLU 79 -13.093 -4.046 12.242 613 H LEU 80 H LEU 80 -12.007 -1.145 10.753 614 HA LEU 80 HA LEU 80 -9.105 -0.911 10.220 615 1HB LEU 80 1HB LEU 80 -11.315 0.873 11.257 616 2HB LEU 80 2HB LEU 80 -9.633 1.389 11.304 617 HG LEU 80 HG LEU 80 -10.732 0.290 8.742 618 1HD1 LEU 80 1HD1 LEU 80 -10.946 3.222 9.136 619 2HD1 LEU 80 2HD1 LEU 80 -12.153 2.251 9.979 620 3HD1 LEU 80 3HD1 LEU 80 -11.991 2.130 8.227 621 1HD2 LEU 80 1HD2 LEU 80 -8.299 1.227 9.508 622 2HD2 LEU 80 2HD2 LEU 80 -9.030 2.709 8.893 623 3HD2 LEU 80 3HD2 LEU 80 -8.887 1.296 7.847 624 H THR 81 H THR 81 -7.551 -0.653 11.901 625 HA THR 81 HA THR 81 -8.322 -1.897 14.486 626 HB THR 81 HB THR 81 -5.768 -1.862 14.716 627 HG1 THR 81 HG1 THR 81 -4.614 -1.094 13.083 628 1HG2 THR 81 1HG2 THR 81 -7.382 -3.634 13.493 629 2HG2 THR 81 2HG2 THR 81 -5.631 -3.842 13.552 630 3HG2 THR 81 3HG2 THR 81 -6.390 -3.167 12.111 631 H ALA 82 H ALA 82 -7.813 -0.847 16.508 632 HA ALA 82 HA ALA 82 -8.421 1.889 16.756 633 1HB ALA 82 1HB ALA 82 -7.713 -0.310 18.374 634 2HB ALA 82 2HB ALA 82 -8.281 1.263 18.934 635 3HB ALA 82 3HB ALA 82 -6.551 0.952 18.783 636 H GLY 83 H GLY 83 -7.224 3.241 15.342 637 1HA GLY 83 1HA GLY 83 -5.136 4.714 15.883 638 2HA GLY 83 2HA GLY 83 -4.258 3.205 15.646 639 H LEU 84 H LEU 84 -6.709 2.897 13.508 640 HA LEU 84 HA LEU 84 -6.835 3.138 11.164 641 1HB LEU 84 1HB LEU 84 -6.470 5.643 12.411 642 2HB LEU 84 2HB LEU 84 -5.353 5.651 11.049 643 HG LEU 84 HG LEU 84 -7.165 5.090 9.511 644 1HD1 LEU 84 1HD1 LEU 84 -8.641 4.672 12.080 645 2HD1 LEU 84 2HD1 LEU 84 -8.704 3.735 10.587 646 3HD1 LEU 84 3HD1 LEU 84 -9.551 5.278 10.696 647 1HD2 LEU 84 1HD2 LEU 84 -7.321 7.354 9.496 648 2HD2 LEU 84 2HD2 LEU 84 -7.210 7.455 11.252 649 3HD2 LEU 84 3HD2 LEU 84 -8.764 7.129 10.484 650 H LYS 85 H LYS 85 -4.252 2.122 12.581 651 HA LYS 85 HA LYS 85 -2.188 2.814 10.578 652 1HB LYS 85 1HB LYS 85 -2.373 1.882 13.309 653 2HB LYS 85 2HB LYS 85 -1.318 0.812 12.384 654 1HG LYS 85 1HG LYS 85 0.269 2.424 12.094 655 2HG LYS 85 2HG LYS 85 -0.929 3.698 11.868 656 1HD LYS 85 1HD LYS 85 -1.376 3.253 14.453 657 2HD LYS 85 2HD LYS 85 0.281 2.658 14.396 658 1HE LYS 85 1HE LYS 85 0.980 4.814 14.524 659 2HE LYS 85 2HE LYS 85 0.263 5.086 12.924 660 1HZ LYS 85 1HZ LYS 85 -0.773 6.549 14.524 661 2HZ LYS 85 2HZ LYS 85 -1.135 5.244 15.548 662 3HZ LYS 85 3HZ LYS 85 -1.902 5.377 14.039 663 H ARG 86 H ARG 86 -4.425 0.208 11.260 664 HA ARG 86 HA ARG 86 -3.194 -1.339 9.005 665 1HB ARG 86 1HB ARG 86 -3.161 -1.966 11.740 666 2HB ARG 86 2HB ARG 86 -4.441 -2.979 11.071 667 1HG ARG 86 1HG ARG 86 -2.621 -3.380 9.161 668 2HG ARG 86 2HG ARG 86 -1.514 -2.978 10.470 669 1HD ARG 86 1HD ARG 86 -3.423 -4.753 11.580 670 2HD ARG 86 2HD ARG 86 -2.918 -5.443 10.027 671 HE ARG 86 HE ARG 86 -0.738 -5.702 10.915 672 1HH1 ARG 86 1HH1 ARG 86 -2.609 -3.480 12.834 673 2HH1 ARG 86 2HH1 ARG 86 -1.392 -3.339 14.055 674 1HH2 ARG 86 1HH2 ARG 86 0.826 -5.502 12.512 675 2HH2 ARG 86 2HH2 ARG 86 0.539 -4.474 13.876 676 H MET 87 H MET 87 -4.726 -2.748 7.897 677 HA MET 87 HA MET 87 -7.607 -2.078 8.390 678 1HB MET 87 1HB MET 87 -5.852 -1.519 6.142 679 2HB MET 87 2HB MET 87 -7.202 -2.531 5.628 680 1HG MET 87 1HG MET 87 -7.518 0.007 7.256 681 2HG MET 87 2HG MET 87 -7.677 -0.060 5.501 682 1HE MET 87 1HE MET 87 -10.542 -0.815 4.467 683 2HE MET 87 2HE MET 87 -10.176 -2.520 4.732 684 3HE MET 87 3HE MET 87 -8.888 -1.401 4.287 685 H ARG 88 H ARG 88 -8.967 -3.864 8.292 686 HA ARG 88 HA ARG 88 -7.703 -6.477 7.531 687 1HB ARG 88 1HB ARG 88 -9.363 -5.483 9.773 688 2HB ARG 88 2HB ARG 88 -9.853 -7.056 9.143 689 1HG ARG 88 1HG ARG 88 -7.600 -7.931 9.458 690 2HG ARG 88 2HG ARG 88 -7.019 -6.342 9.957 691 1HD ARG 88 1HD ARG 88 -9.181 -6.774 11.653 692 2HD ARG 88 2HD ARG 88 -8.424 -8.375 11.534 693 HE ARG 88 HE ARG 88 -6.388 -6.367 11.802 694 1HH1 ARG 88 1HH1 ARG 88 -8.881 -7.991 13.609 695 2HH1 ARG 88 2HH1 ARG 88 -8.064 -7.798 15.121 696 1HH2 ARG 88 1HH2 ARG 88 -5.347 -6.130 13.776 697 2HH2 ARG 88 2HH2 ARG 88 -6.078 -6.753 15.217 698 H ILE 89 H ILE 89 -9.018 -7.968 6.355 699 HA ILE 89 HA ILE 89 -11.525 -6.813 5.178 700 HB ILE 89 HB ILE 89 -9.319 -8.472 3.897 701 1HG1 ILE 89 1HG1 ILE 89 -10.196 -5.676 3.168 702 2HG1 ILE 89 2HG1 ILE 89 -8.954 -5.965 4.386 703 1HG2 ILE 89 1HG2 ILE 89 -11.785 -7.256 2.619 704 2HG2 ILE 89 2HG2 ILE 89 -11.642 -8.958 3.058 705 3HG2 ILE 89 3HG2 ILE 89 -10.576 -8.271 1.832 706 1HD1 ILE 89 1HD1 ILE 89 -7.433 -6.761 2.844 707 2HD1 ILE 89 2HD1 ILE 89 -8.340 -5.669 1.797 708 3HD1 ILE 89 3HD1 ILE 89 -8.687 -7.398 1.780 709 H PHE 90 H PHE 90 -13.248 -8.092 5.730 710 HA PHE 90 HA PHE 90 -12.727 -11.004 6.247 711 1HB PHE 90 1HB PHE 90 -14.405 -8.866 7.526 712 2HB PHE 90 2HB PHE 90 -14.993 -10.526 7.591 713 HD1 PHE 90 HD1 PHE 90 -12.423 -8.180 8.737 714 HD2 PHE 90 HD2 PHE 90 -13.703 -12.281 8.751 715 HE1 PHE 90 HE1 PHE 90 -10.864 -8.661 10.604 716 HE2 PHE 90 HE2 PHE 90 -12.143 -12.761 10.619 717 HZ PHE 90 HZ PHE 90 -10.725 -10.950 11.547 718 H THR 91 H THR 91 -15.244 -11.993 6.229 719 HA THR 91 HA THR 91 -16.449 -11.171 3.612 720 HB THR 91 HB THR 91 -16.836 -13.799 3.525 721 HG1 THR 91 HG1 THR 91 -15.324 -14.924 4.632 722 1HG2 THR 91 1HG2 THR 91 -14.547 -12.085 2.753 723 2HG2 THR 91 2HG2 THR 91 -15.551 -13.140 1.758 724 3HG2 THR 91 3HG2 THR 91 -14.237 -13.821 2.716 725 H ILE 92 H ILE 92 -18.214 -10.131 4.695 726 HA ILE 92 HA ILE 92 -19.664 -11.013 6.920 727 HB ILE 92 HB ILE 92 -21.487 -9.647 5.934 728 1HG1 ILE 92 1HG1 ILE 92 -19.772 -9.615 3.433 729 2HG1 ILE 92 2HG1 ILE 92 -21.229 -10.591 3.618 730 1HG2 ILE 92 1HG2 ILE 92 -18.876 -8.358 5.142 731 2HG2 ILE 92 2HG2 ILE 92 -19.255 -8.673 6.835 732 3HG2 ILE 92 3HG2 ILE 92 -20.292 -7.612 5.883 733 1HD1 ILE 92 1HD1 ILE 92 -20.963 -7.600 3.464 734 2HD1 ILE 92 2HD1 ILE 92 -22.343 -8.316 4.296 735 3HD1 ILE 92 3HD1 ILE 92 -22.066 -8.663 2.590 736 H LYS 93 H LYS 93 -19.809 -12.211 3.600 737 HA LYS 93 HA LYS 93 -21.648 -14.369 4.554 738 1HB LYS 93 1HB LYS 93 -22.888 -14.085 2.405 739 2HB LYS 93 2HB LYS 93 -22.937 -12.621 3.386 740 1HG LYS 93 1HG LYS 93 -20.962 -11.768 2.074 741 2HG LYS 93 2HG LYS 93 -21.128 -13.169 1.016 742 1HD LYS 93 1HD LYS 93 -22.302 -11.284 0.014 743 2HD LYS 93 2HD LYS 93 -23.489 -12.473 0.552 744 1HE LYS 93 1HE LYS 93 -23.015 -10.765 2.771 745 2HE LYS 93 2HE LYS 93 -23.237 -9.716 1.358 746 1HZ LYS 93 1HZ LYS 93 -25.032 -11.844 2.375 747 2HZ LYS 93 2HZ LYS 93 -25.139 -11.284 0.775 748 3HZ LYS 93 3HZ LYS 93 -25.402 -10.215 2.069 749 HA PRO 94 HA PRO 94 -18.695 -17.128 2.784 750 1HB PRO 94 1HB PRO 94 -21.078 -18.590 1.723 751 2HB PRO 94 2HB PRO 94 -19.735 -19.198 2.708 752 1HG PRO 94 1HG PRO 94 -22.175 -18.734 3.729 753 2HG PRO 94 2HG PRO 94 -20.694 -18.515 4.669 754 1HD PRO 94 1HD PRO 94 -22.526 -16.488 3.537 755 2HD PRO 94 2HD PRO 94 -21.444 -16.383 4.944 756 H ILE 95 H ILE 95 -17.800 -17.544 0.692 757 HA ILE 95 HA ILE 95 -19.270 -16.254 -1.585 758 HB ILE 95 HB ILE 95 -16.312 -16.348 -0.889 759 1HG1 ILE 95 1HG1 ILE 95 -18.288 -14.048 -1.001 760 2HG1 ILE 95 2HG1 ILE 95 -17.658 -14.781 0.474 761 1HG2 ILE 95 1HG2 ILE 95 -16.684 -14.471 -2.894 762 2HG2 ILE 95 2HG2 ILE 95 -17.738 -15.795 -3.393 763 3HG2 ILE 95 3HG2 ILE 95 -16.020 -16.089 -3.120 764 1HD1 ILE 95 1HD1 ILE 95 -16.417 -12.716 -0.137 765 2HD1 ILE 95 2HD1 ILE 95 -15.969 -13.461 -1.672 766 3HD1 ILE 95 3HD1 ILE 95 -15.375 -14.139 -0.156 767 H ALA 96 H ALA 96 -19.046 -17.271 -3.633 768 HA ALA 96 HA ALA 96 -18.211 -20.132 -3.515 769 1HB ALA 96 1HB ALA 96 -20.495 -19.585 -4.242 770 2HB ALA 96 2HB ALA 96 -19.587 -20.214 -5.617 771 3HB ALA 96 3HB ALA 96 -19.863 -18.478 -5.462 772 H ILE 97 H ILE 97 -17.007 -20.975 -5.426 773 HA ILE 97 HA ILE 97 -14.705 -19.384 -6.072 774 HB ILE 97 HB ILE 97 -15.904 -21.887 -7.320 775 1HG1 ILE 97 1HG1 ILE 97 -13.526 -21.968 -5.551 776 2HG1 ILE 97 2HG1 ILE 97 -15.048 -21.572 -4.774 777 1HG2 ILE 97 1HG2 ILE 97 -13.601 -20.282 -8.028 778 2HG2 ILE 97 2HG2 ILE 97 -14.253 -21.706 -8.840 779 3HG2 ILE 97 3HG2 ILE 97 -13.103 -21.894 -7.515 780 1HD1 ILE 97 1HD1 ILE 97 -14.528 -23.991 -6.520 781 2HD1 ILE 97 2HD1 ILE 97 -16.077 -23.593 -5.776 782 3HD1 ILE 97 3HD1 ILE 97 -14.693 -24.008 -4.764 783 H GLY 98 H GLY 98 -15.304 -17.440 -7.114 784 1HA GLY 98 1HA GLY 98 -15.274 -16.748 -9.581 785 2HA GLY 98 2HA GLY 98 -16.723 -17.743 -9.729 786 H GLU 99 H GLU 99 -15.845 -15.569 -7.055 787 HA GLU 99 HA GLU 99 -18.338 -14.008 -7.658 788 1HB GLU 99 1HB GLU 99 -16.981 -15.004 -5.162 789 2HB GLU 99 2HB GLU 99 -17.994 -13.565 -5.063 790 1HG GLU 99 1HG GLU 99 -18.847 -16.283 -6.101 791 2HG GLU 99 2HG GLU 99 -19.314 -15.573 -4.559 792 H GLU 100 H GLU 100 -18.198 -11.701 -6.779 793 HA GLU 100 HA GLU 100 -15.479 -10.584 -7.350 794 1HB GLU 100 1HB GLU 100 -17.830 -10.064 -8.555 795 2HB GLU 100 2HB GLU 100 -17.962 -8.918 -7.222 796 1HG GLU 100 1HG GLU 100 -15.318 -8.922 -8.512 797 2HG GLU 100 2HG GLU 100 -16.627 -8.442 -9.591 798 H ILE 101 H ILE 101 -14.391 -10.005 -5.518 799 HA ILE 101 HA ILE 101 -15.864 -9.512 -3.008 800 HB ILE 101 HB ILE 101 -12.940 -9.707 -3.801 801 1HG1 ILE 101 1HG1 ILE 101 -14.603 -11.552 -2.076 802 2HG1 ILE 101 2HG1 ILE 101 -14.438 -11.767 -3.819 803 1HG2 ILE 101 1HG2 ILE 101 -14.241 -8.867 -1.264 804 2HG2 ILE 101 2HG2 ILE 101 -12.639 -8.475 -1.888 805 3HG2 ILE 101 3HG2 ILE 101 -12.925 -10.032 -1.112 806 1HD1 ILE 101 1HD1 ILE 101 -12.761 -12.938 -2.080 807 2HD1 ILE 101 2HD1 ILE 101 -11.929 -11.392 -2.249 808 3HD1 ILE 101 3HD1 ILE 101 -12.225 -12.394 -3.670 809 H THR 102 H THR 102 -16.331 -7.511 -2.287 810 HA THR 102 HA THR 102 -14.632 -5.187 -2.961 811 HB THR 102 HB THR 102 -16.638 -3.985 -3.878 812 HG1 THR 102 HG1 THR 102 -18.389 -4.974 -3.198 813 1HG2 THR 102 1HG2 THR 102 -16.561 -4.995 -6.042 814 2HG2 THR 102 2HG2 THR 102 -16.196 -6.582 -5.365 815 3HG2 THR 102 3HG2 THR 102 -14.983 -5.301 -5.316 816 H ILE 103 H ILE 103 -15.763 -3.158 -1.841 817 HA ILE 103 HA ILE 103 -17.286 -3.985 0.585 818 HB ILE 103 HB ILE 103 -15.647 -2.816 2.006 819 1HG1 ILE 103 1HG1 ILE 103 -13.448 -2.482 0.263 820 2HG1 ILE 103 2HG1 ILE 103 -14.828 -1.737 -0.544 821 1HG2 ILE 103 1HG2 ILE 103 -13.923 -4.442 1.909 822 2HG2 ILE 103 2HG2 ILE 103 -14.080 -4.621 0.162 823 3HG2 ILE 103 3HG2 ILE 103 -15.333 -5.255 1.229 824 1HD1 ILE 103 1HD1 ILE 103 -13.478 -0.979 1.998 825 2HD1 ILE 103 2HD1 ILE 103 -15.233 -0.810 1.956 826 3HD1 ILE 103 3HD1 ILE 103 -14.236 0.045 0.778 827 H SER 104 H SER 104 -18.304 -2.122 1.660 828 HA SER 104 HA SER 104 -19.075 -0.028 -0.271 829 1HB SER 104 1HB SER 104 -20.344 -1.482 1.687 830 2HB SER 104 2HB SER 104 -20.046 0.039 2.527 831 HG SER 104 HG SER 104 -21.668 -0.514 0.348 832 H TYR 105 H TYR 105 -19.601 2.048 1.604 833 HA TYR 105 HA TYR 105 -16.861 2.789 2.568 834 1HB TYR 105 1HB TYR 105 -18.851 4.520 1.050 835 2HB TYR 105 2HB TYR 105 -17.240 5.011 1.571 836 HD1 TYR 105 HD1 TYR 105 -15.416 2.993 0.901 837 HD2 TYR 105 HD2 TYR 105 -18.976 4.102 -1.232 838 HE1 TYR 105 HE1 TYR 105 -14.458 2.054 -1.186 839 HE2 TYR 105 HE2 TYR 105 -18.018 3.163 -3.318 840 HH TYR 105 HH TYR 105 -15.034 1.327 -3.306 841 H GLY 106 H GLY 106 -20.216 4.074 2.548 842 1HA GLY 106 1HA GLY 106 -20.913 3.767 5.196 843 2HA GLY 106 2HA GLY 106 -19.879 5.195 5.221 844 H ASP 107 H ASP 107 -22.014 6.187 5.958 845 HA ASP 107 HA ASP 107 -24.258 6.450 4.202 846 1HB ASP 107 1HB ASP 107 -23.104 8.211 6.396 847 2HB ASP 107 2HB ASP 107 -24.710 8.433 5.703 848 H ASP 108 H ASP 108 -21.236 8.281 4.489 849 HA ASP 108 HA ASP 108 -22.003 10.467 2.769 850 1HB ASP 108 1HB ASP 108 -19.360 9.236 3.621 851 2HB ASP 108 2HB ASP 108 -19.472 10.743 2.712 852 H TYR 109 H TYR 109 -19.375 8.205 1.975 853 HA TYR 109 HA TYR 109 -19.495 8.487 -0.810 854 1HB TYR 109 1HB TYR 109 -18.472 6.560 1.188 855 2HB TYR 109 2HB TYR 109 -18.690 5.880 -0.425 856 HD1 TYR 109 HD1 TYR 109 -16.725 5.896 -1.672 857 HD2 TYR 109 HD2 TYR 109 -17.579 9.207 0.928 858 HE1 TYR 109 HE1 TYR 109 -14.648 7.022 -2.424 859 HE2 TYR 109 HE2 TYR 109 -15.502 10.333 0.176 860 HH TYR 109 HH TYR 109 -13.095 9.188 -0.947 861 H TRP 110 H TRP 110 -21.355 8.236 -2.001 862 HA TRP 110 HA TRP 110 -23.297 7.229 -2.889 863 1HB TRP 110 1HB TRP 110 -21.584 4.888 -1.987 864 2HB TRP 110 2HB TRP 110 -23.014 4.702 -3.003 865 HD1 TRP 110 HD1 TRP 110 -19.817 6.898 -3.040 866 HE1 TRP 110 HE1 TRP 110 -18.989 7.056 -5.477 867 HE3 TRP 110 HE3 TRP 110 -23.430 4.150 -5.378 868 HZ2 TRP 110 HZ2 TRP 110 -19.760 6.138 -8.075 869 HZ3 TRP 110 HZ3 TRP 110 -23.360 3.808 -7.831 870 HH2 TRP 110 HH2 TRP 110 -21.530 4.797 -9.182 871 H LEU 111 H LEU 111 -24.764 5.024 -2.168 872 HA LEU 111 HA LEU 111 -26.298 5.904 0.065 873 1HB LEU 111 1HB LEU 111 -26.975 4.422 -1.867 874 2HB LEU 111 2HB LEU 111 -26.054 3.115 -1.124 875 HG LEU 111 HG LEU 111 -27.483 3.605 0.991 876 1HD1 LEU 111 1HD1 LEU 111 -29.850 4.360 -0.100 877 2HD1 LEU 111 2HD1 LEU 111 -28.739 5.308 -1.089 878 3HD1 LEU 111 3HD1 LEU 111 -28.736 5.493 0.665 879 1HD2 LEU 111 1HD2 LEU 111 -27.644 1.675 -0.771 880 2HD2 LEU 111 2HD2 LEU 111 -29.093 2.524 -1.310 881 3HD2 LEU 111 3HD2 LEU 111 -28.985 1.926 0.346 882 H SER 112 H SER 112 -26.548 4.840 2.166 883 HA SER 112 HA SER 112 -24.085 4.297 3.524 884 1HB SER 112 1HB SER 112 -26.975 3.652 4.225 885 2HB SER 112 2HB SER 112 -25.641 3.715 5.376 886 HG SER 112 HG SER 112 -27.145 5.694 4.642 887 H ARG 113 H ARG 113 -26.817 2.028 2.982 888 HA ARG 113 HA ARG 113 -24.829 -0.141 2.516 889 1HB ARG 113 1HB ARG 113 -26.815 0.221 4.710 890 2HB ARG 113 2HB ARG 113 -26.666 -1.409 4.052 891 1HG ARG 113 1HG ARG 113 -24.101 -1.026 4.315 892 2HG ARG 113 2HG ARG 113 -24.568 0.277 5.406 893 1HD ARG 113 1HD ARG 113 -26.132 -1.603 6.454 894 2HD ARG 113 2HD ARG 113 -24.925 -2.683 5.729 895 HE ARG 113 HE ARG 113 -23.530 -0.568 7.018 896 1HH1 ARG 113 1HH1 ARG 113 -25.584 -3.263 7.815 897 2HH1 ARG 113 2HH1 ARG 113 -24.874 -3.484 9.377 898 1HH2 ARG 113 1HH2 ARG 113 -22.625 -0.874 9.049 899 2HH2 ARG 113 2HH2 ARG 113 -23.211 -2.143 10.072 900 HA PRO 114 HA PRO 114 -27.501 -1.475 -0.692 901 1HB PRO 114 1HB PRO 114 -27.407 -4.251 0.364 902 2HB PRO 114 2HB PRO 114 -26.872 -3.631 -1.208 903 1HG PRO 114 1HG PRO 114 -25.147 -4.371 0.715 904 2HG PRO 114 2HG PRO 114 -24.800 -3.063 -0.423 905 1HD PRO 114 1HD PRO 114 -25.581 -2.922 2.444 906 2HD PRO 114 2HD PRO 114 -24.519 -1.853 1.503 907 H ARG 115 H ARG 115 -28.245 -3.456 2.210 908 HA ARG 115 HA ARG 115 -30.280 -3.803 3.353 909 1HB ARG 115 1HB ARG 115 -30.199 -1.119 2.551 910 2HB ARG 115 2HB ARG 115 -31.788 -1.679 2.027 911 1HG ARG 115 1HG ARG 115 -32.236 -1.047 4.227 912 2HG ARG 115 2HG ARG 115 -31.866 -2.759 4.434 913 1HD ARG 115 1HD ARG 115 -30.138 -2.219 5.797 914 2HD ARG 115 2HD ARG 115 -29.404 -1.259 4.498 915 HE ARG 115 HE ARG 115 -31.488 0.332 5.391 916 1HH1 ARG 115 1HH1 ARG 115 -28.796 -1.262 6.920 917 2HH1 ARG 115 2HH1 ARG 115 -28.664 -0.077 8.172 918 1HH2 ARG 115 1HH2 ARG 115 -31.296 1.857 7.027 919 2HH2 ARG 115 2HH2 ARG 115 -30.068 1.677 8.235 920 H LEU 116 H LEU 116 -31.423 -2.494 0.217 921 HA LEU 116 HA LEU 116 -32.877 -3.455 -1.378 922 1HB LEU 116 1HB LEU 116 -31.366 -5.894 -0.366 923 2HB LEU 116 2HB LEU 116 -32.269 -5.823 -1.878 924 HG LEU 116 HG LEU 116 -30.308 -3.643 -1.486 925 1HD1 LEU 116 1HD1 LEU 116 -29.306 -6.410 -2.180 926 2HD1 LEU 116 2HD1 LEU 116 -29.214 -5.762 -0.543 927 3HD1 LEU 116 3HD1 LEU 116 -28.356 -4.960 -1.858 928 1HD2 LEU 116 1HD2 LEU 116 -31.780 -4.759 -3.568 929 2HD2 LEU 116 2HD2 LEU 116 -30.139 -5.329 -3.869 930 3HD2 LEU 116 3HD2 LEU 116 -30.463 -3.600 -3.743 931 H THR 117 H THR 117 -34.863 -3.077 -0.212 932 HA THR 117 HA THR 117 -35.854 -4.813 1.861 933 HB THR 117 HB THR 117 -37.208 -2.943 -0.119 934 HG1 THR 117 HG1 THR 117 -35.593 -2.112 1.380 935 1HG2 THR 117 1HG2 THR 117 -38.941 -2.873 1.807 936 2HG2 THR 117 2HG2 THR 117 -38.205 -4.386 2.336 937 3HG2 THR 117 3HG2 THR 117 -38.955 -4.281 0.744 938 H GLN 118 H GLN 118 -37.590 -6.389 1.660 939 HA GLN 118 HA GLN 118 -37.538 -7.825 -0.958 940 1HB GLN 118 1HB GLN 118 -37.002 -8.699 1.523 941 2HB GLN 118 2HB GLN 118 -38.751 -8.929 1.549 942 1HG GLN 118 1HG GLN 118 -38.110 -9.957 -0.908 943 2HG GLN 118 2HG GLN 118 -36.681 -10.388 0.031 944 1HE2 GLN 118 1HE2 GLN 118 -36.985 -11.823 1.897 945 2HE2 GLN 118 2HE2 GLN 118 -38.409 -12.728 2.085 946 H ASN 119 H ASN 119 -39.145 -6.290 -1.892 947 HA ASN 119 HA ASN 119 -41.861 -7.261 -1.602 948 1HB ASN 119 1HB ASN 119 -41.011 -5.453 0.322 949 2HB ASN 119 2HB ASN 119 -41.807 -4.411 -0.857 950 1HD2 ASN 119 1HD2 ASN 119 -42.433 -6.239 1.875 951 2HD2 ASN 119 2HD2 ASN 119 -44.084 -6.543 1.626 952 1H GLY 201 1H GLY 201 -36.500 22.859 -4.227 953 2H GLY 201 2H GLY 201 -37.720 21.926 -4.952 954 3H GLY 201 3H GLY 201 -38.132 23.177 -3.880 955 1HA GLY 201 1HA GLY 201 -37.151 23.352 -6.651 956 2HA GLY 201 2HA GLY 201 -38.540 24.150 -5.914 957 H LYS 202 H LYS 202 -35.033 24.195 -6.207 958 HA LYS 202 HA LYS 202 -35.075 27.019 -5.202 959 1HB LYS 202 1HB LYS 202 -33.419 24.635 -4.431 960 2HB LYS 202 2HB LYS 202 -32.667 26.229 -4.373 961 1HG LYS 202 1HG LYS 202 -34.851 26.907 -3.082 962 2HG LYS 202 2HG LYS 202 -34.993 25.174 -2.788 963 1HD LYS 202 1HD LYS 202 -33.241 25.158 -1.337 964 2HD LYS 202 2HD LYS 202 -32.291 26.265 -2.328 965 1HE LYS 202 1HE LYS 202 -32.773 27.868 -0.789 966 2HE LYS 202 2HE LYS 202 -34.446 27.809 -1.373 967 1HZ LYS 202 1HZ LYS 202 -33.209 26.268 0.835 968 2HZ LYS 202 2HZ LYS 202 -34.646 25.752 0.092 969 3HZ LYS 202 3HZ LYS 202 -34.593 27.251 0.887 970 H ALA 203 H ALA 203 -35.128 26.012 -7.963 971 HA ALA 203 HA ALA 203 -32.624 25.901 -9.253 972 1HB ALA 203 1HB ALA 203 -34.167 25.622 -10.889 973 2HB ALA 203 2HB ALA 203 -34.427 27.366 -10.882 974 3HB ALA 203 3HB ALA 203 -35.423 26.322 -9.867 975 HA PRO 204 HA PRO 204 -33.060 30.784 -9.733 976 1HB PRO 204 1HB PRO 204 -34.331 31.263 -7.070 977 2HB PRO 204 2HB PRO 204 -34.593 32.107 -8.607 978 1HG PRO 204 1HG PRO 204 -36.365 30.357 -7.608 979 2HG PRO 204 2HG PRO 204 -36.108 30.559 -9.346 980 1HD PRO 204 1HD PRO 204 -35.288 28.342 -7.562 981 2HD PRO 204 2HD PRO 204 -35.653 28.327 -9.299 982 H ARG 205 H ARG 205 -30.804 30.500 -9.393 983 HA ARG 205 HA ARG 205 -28.758 30.622 -8.218 984 1HB ARG 205 1HB ARG 205 -30.752 32.329 -6.742 985 2HB ARG 205 2HB ARG 205 -29.127 32.145 -6.084 986 1HG ARG 205 1HG ARG 205 -28.891 32.630 -8.891 987 2HG ARG 205 2HG ARG 205 -29.984 33.841 -8.220 988 1HD ARG 205 1HD ARG 205 -28.085 34.936 -7.580 989 2HD ARG 205 2HD ARG 205 -27.950 33.694 -6.320 990 HE ARG 205 HE ARG 205 -26.924 32.548 -8.684 991 1HH1 ARG 205 1HH1 ARG 205 -26.208 35.228 -6.581 992 2HH1 ARG 205 2HH1 ARG 205 -24.513 35.184 -6.921 993 1HH2 ARG 205 1HH2 ARG 205 -24.720 32.511 -9.110 994 2HH2 ARG 205 2HH2 ARG 205 -23.675 33.659 -8.341 995 H LYS 206 H LYS 206 -28.955 28.248 -7.741 996 HA LYS 206 HA LYS 206 -30.099 27.331 -5.238 997 1HB LYS 206 1HB LYS 206 -29.321 26.198 -7.580 998 2HB LYS 206 2HB LYS 206 -27.907 25.828 -6.594 999 1HG LYS 206 1HG LYS 206 -29.216 24.669 -4.980 1000 2HG LYS 206 2HG LYS 206 -30.705 25.234 -5.672 1001 1HD LYS 206 1HD LYS 206 -30.749 23.291 -6.814 1002 2HD LYS 206 2HD LYS 206 -29.517 24.038 -7.837 1003 1HE LYS 206 1HE LYS 206 -28.039 22.479 -7.123 1004 2HE LYS 206 2HE LYS 206 -28.241 23.135 -5.485 1005 1HZ LYS 206 1HZ LYS 206 -30.361 21.813 -5.394 1006 2HZ LYS 206 2HZ LYS 206 -28.947 20.874 -5.399 1007 3HZ LYS 206 3HZ LYS 206 -29.866 21.033 -6.818 1008 H GLN 207 H GLN 207 -29.164 27.443 -3.232 1009 HA GLN 207 HA GLN 207 -26.734 28.812 -2.692 1010 1HB GLN 207 1HB GLN 207 -28.658 28.348 -1.140 1011 2HB GLN 207 2HB GLN 207 -28.138 26.665 -1.059 1012 1HG GLN 207 1HG GLN 207 -25.808 27.757 -0.425 1013 2HG GLN 207 2HG GLN 207 -26.822 29.115 0.062 1014 1HE2 GLN 207 1HE2 GLN 207 -29.082 27.800 1.092 1015 2HE2 GLN 207 2HE2 GLN 207 -28.634 26.860 2.433 1016 H LEU 208 H LEU 208 -24.615 28.123 -2.654 1017 HA LEU 208 HA LEU 208 -23.865 25.602 -3.825 1018 1HB LEU 208 1HB LEU 208 -22.433 27.779 -2.272 1019 2HB LEU 208 2HB LEU 208 -21.577 26.403 -2.968 1020 HG LEU 208 HG LEU 208 -23.404 28.177 -4.603 1021 1HD1 LEU 208 1HD1 LEU 208 -20.409 28.391 -4.166 1022 2HD1 LEU 208 2HD1 LEU 208 -21.622 29.586 -3.706 1023 3HD1 LEU 208 3HD1 LEU 208 -21.305 29.263 -5.410 1024 1HD2 LEU 208 1HD2 LEU 208 -22.306 25.712 -5.131 1025 2HD2 LEU 208 2HD2 LEU 208 -21.096 26.800 -5.811 1026 3HD2 LEU 208 3HD2 LEU 208 -22.769 26.886 -6.363 1027 H ALA 209 H ALA 209 -21.915 24.474 -2.338 1028 HA ALA 209 HA ALA 209 -22.749 24.053 0.446 1029 1HB ALA 209 1HB ALA 209 -23.160 21.564 -0.102 1030 2HB ALA 209 2HB ALA 209 -23.241 22.067 -1.790 1031 3HB ALA 209 3HB ALA 209 -24.407 22.696 -0.625 1032 H THR 210 H THR 210 -21.049 23.159 1.634 1033 HA THR 210 HA THR 210 -18.593 22.427 0.077 1034 HB THR 210 HB THR 210 -17.599 23.060 2.442 1035 HG1 THR 210 HG1 THR 210 -18.904 24.223 3.689 1036 1HG2 THR 210 1HG2 THR 210 -18.187 24.508 0.063 1037 2HG2 THR 210 2HG2 THR 210 -16.917 24.835 1.241 1038 3HG2 THR 210 3HG2 THR 210 -18.502 25.586 1.423 1039 H LYS 211 H LYS 211 -20.564 20.431 0.542 1040 HA LYS 211 HA LYS 211 -20.033 18.921 2.957 1041 1HB LYS 211 1HB LYS 211 -22.089 18.888 1.460 1042 2HB LYS 211 2HB LYS 211 -21.133 17.985 0.284 1043 1HG LYS 211 1HG LYS 211 -20.682 16.268 2.053 1044 2HG LYS 211 2HG LYS 211 -21.775 17.141 3.126 1045 1HD LYS 211 1HD LYS 211 -23.242 16.870 0.777 1046 2HD LYS 211 2HD LYS 211 -22.397 15.328 0.919 1047 1HE LYS 211 1HE LYS 211 -23.598 14.713 2.771 1048 2HE LYS 211 2HE LYS 211 -23.572 16.353 3.445 1049 1HZ LYS 211 1HZ LYS 211 -25.793 15.565 2.577 1050 2HZ LYS 211 2HZ LYS 211 -25.121 15.627 1.018 1051 3HZ LYS 211 3HZ LYS 211 -25.245 17.044 1.945 1052 H ALA 212 H ALA 212 -17.637 18.842 2.882 1053 HA ALA 212 HA ALA 212 -16.494 17.092 0.753 1054 1HB ALA 212 1HB ALA 212 -14.965 18.774 0.936 1055 2HB ALA 212 2HB ALA 212 -14.459 17.984 2.430 1056 3HB ALA 212 3HB ALA 212 -15.626 19.304 2.483 1057 H ALA 213 H ALA 213 -16.922 14.968 1.403 1058 HA ALA 213 HA ALA 213 -15.873 14.182 4.101 1059 1HB ALA 213 1HB ALA 213 -18.326 14.233 4.071 1060 2HB ALA 213 2HB ALA 213 -17.787 12.555 4.123 1061 3HB ALA 213 3HB ALA 213 -18.353 13.252 2.606 1062 H ARG 214 H ARG 214 -15.143 11.906 4.181 1063 HA ARG 214 HA ARG 214 -14.206 10.940 1.501 1064 1HB ARG 214 1HB ARG 214 -13.100 10.670 4.321 1065 2HB ARG 214 2HB ARG 214 -12.379 9.906 2.905 1066 1HG ARG 214 1HG ARG 214 -11.338 11.820 2.343 1067 2HG ARG 214 2HG ARG 214 -12.867 12.699 2.365 1068 1HD ARG 214 1HD ARG 214 -12.397 12.373 5.053 1069 2HD ARG 214 2HD ARG 214 -10.752 12.574 4.420 1070 HE ARG 214 HE ARG 214 -12.830 14.615 4.437 1071 1HH1 ARG 214 1HH1 ARG 214 -10.069 13.378 2.715 1072 2HH1 ARG 214 2HH1 ARG 214 -9.709 14.900 1.977 1073 1HH2 ARG 214 1HH2 ARG 214 -12.342 16.580 3.468 1074 2HH2 ARG 214 2HH2 ARG 214 -10.984 16.700 2.399 1075 1HN MLZ 215 1HN MLZ 215 -13.415 8.362 2.381 1076 HA MLZ 215 HA MLZ 215 -15.911 6.923 2.238 1077 1HB MLZ 215 1HB MLZ 215 -13.112 6.041 3.040 1078 2HB MLZ 215 2HB MLZ 215 -14.405 4.978 2.485 1079 1HG MLZ 215 1HG MLZ 215 -12.771 6.952 0.932 1080 2HG MLZ 215 2HG MLZ 215 -14.428 6.641 0.417 1081 1HD MLZ 215 1HD MLZ 215 -13.008 4.172 1.047 1082 2HD MLZ 215 2HD MLZ 215 -13.877 4.617 -0.422 1083 1HE MLZ 215 1HE MLZ 215 -11.394 4.223 -0.774 1084 2HE MLZ 215 2HE MLZ 215 -11.095 5.649 0.234 1085 HZ MLZ 215 HZ MLZ 215 -11.311 6.696 -1.755 1086 1HCM MLZ 215 1HCM MLZ 215 -13.312 4.773 -2.780 1087 2HCM MLZ 215 2HCM MLZ 215 -11.586 4.441 -2.861 1088 3HCM MLZ 215 3HCM MLZ 215 -12.252 5.843 -3.690 1089 H SER 216 H SER 216 -17.182 6.134 3.894 1090 HA SER 216 HA SER 216 -17.945 5.732 6.089 1091 1HB SER 216 1HB SER 216 -16.130 7.728 7.268 1092 2HB SER 216 2HB SER 216 -16.962 8.315 5.828 1093 HG SER 216 HG SER 216 -18.258 8.696 7.600 1094 H ALA 217 H ALA 217 -16.992 5.387 8.460 1095 HA ALA 217 HA ALA 217 -14.716 3.513 8.149 1096 1HB ALA 217 1HB ALA 217 -14.245 5.067 10.500 1097 2HB ALA 217 2HB ALA 217 -14.544 6.193 9.175 1098 3HB ALA 217 3HB ALA 217 -13.256 4.995 9.041 1099 HA PRO 218 HA PRO 218 -17.625 1.365 10.802 1100 1HB PRO 218 1HB PRO 218 -15.274 -0.385 11.339 1101 2HB PRO 218 2HB PRO 218 -16.885 -0.821 10.742 1102 1HG PRO 218 1HG PRO 218 -14.721 -0.791 9.153 1103 2HG PRO 218 2HG PRO 218 -16.338 -0.382 8.564 1104 1HD PRO 218 1HD PRO 218 -14.033 1.396 9.153 1105 2HD PRO 218 2HD PRO 218 -15.321 1.570 7.942 1106 H ALA 219 H ALA 219 -17.803 0.989 13.131 1107 HA ALA 219 HA ALA 219 -15.870 2.640 14.701 1108 1HB ALA 219 1HB ALA 219 -18.746 2.224 14.597 1109 2HB ALA 219 2HB ALA 219 -17.845 3.492 15.428 1110 3HB ALA 219 3HB ALA 219 -18.141 1.950 16.231 1111 H THR 220 H THR 220 -17.065 -0.605 14.281 1112 HA THR 220 HA THR 220 -16.544 -1.759 16.813 1113 HB THR 220 HB THR 220 -17.678 -2.863 14.922 1114 HG1 THR 220 HG1 THR 220 -17.003 -4.539 15.970 1115 1HG2 THR 220 1HG2 THR 220 -16.106 -3.778 13.088 1116 2HG2 THR 220 2HG2 THR 220 -14.953 -2.569 13.655 1117 3HG2 THR 220 3HG2 THR 220 -16.518 -2.064 13.017 1118 H GLY 221 H GLY 221 -14.590 -3.663 16.590 1119 1HA GLY 221 1HA GLY 221 -12.303 -3.942 16.994 1120 2HA GLY 221 2HA GLY 221 -12.112 -2.995 15.525 1121 1H MET 1 1H MET 1 -1.385 -11.314 9.358 1122 2H MET 1 2H MET 1 -1.645 -11.976 7.816 1123 3H MET 1 3H MET 1 -1.973 -10.334 8.101 1124 HA MET 1 HA MET 1 0.070 -10.296 6.987 1125 1HB MET 1 1HB MET 1 -0.325 -9.415 9.564 1126 2HB MET 1 2HB MET 1 1.166 -10.342 9.736 1127 1HG MET 1 1HG MET 1 1.756 -8.058 9.170 1128 2HG MET 1 2HG MET 1 2.095 -9.075 7.770 1129 1HE MET 1 1HE MET 1 1.743 -6.152 8.430 1130 2HE MET 1 2HE MET 1 0.358 -5.297 7.750 1131 3HE MET 1 3HE MET 1 1.640 -5.882 6.690 1132 H PHE 2 H PHE 2 2.553 -10.990 8.394 1133 HA PHE 2 HA PHE 2 4.166 -12.688 8.065 1134 1HB PHE 2 1HB PHE 2 3.563 -14.651 9.600 1135 2HB PHE 2 2HB PHE 2 3.542 -13.052 10.334 1136 HD1 PHE 2 HD1 PHE 2 1.498 -15.893 9.209 1137 HD2 PHE 2 HD2 PHE 2 1.435 -11.962 10.939 1138 HE1 PHE 2 HE1 PHE 2 -0.859 -16.234 9.898 1139 HE2 PHE 2 HE2 PHE 2 -0.922 -12.303 11.628 1140 HZ PHE 2 HZ PHE 2 -2.069 -14.439 11.107 1141 H ASN 3 H ASN 3 4.086 -13.216 5.842 1142 HA ASN 3 HA ASN 3 2.142 -15.240 4.905 1143 1HB ASN 3 1HB ASN 3 4.138 -13.325 3.775 1144 2HB ASN 3 2HB ASN 3 3.784 -14.760 2.812 1145 1HD2 ASN 3 1HD2 ASN 3 1.780 -14.819 1.700 1146 2HD2 ASN 3 2HD2 ASN 3 0.595 -13.611 1.830 1147 H ASP 4 H ASP 4 2.737 -17.351 4.298 1148 HA ASP 4 HA ASP 4 4.704 -18.756 5.685 1149 1HB ASP 4 1HB ASP 4 2.738 -19.527 4.208 1150 2HB ASP 4 2HB ASP 4 3.847 -19.376 2.845 1151 H ARG 5 H ARG 5 5.011 -17.339 2.410 1152 HA ARG 5 HA ARG 5 7.709 -18.232 1.969 1153 1HB ARG 5 1HB ARG 5 6.176 -15.849 0.863 1154 2HB ARG 5 2HB ARG 5 7.585 -16.604 0.118 1155 1HG ARG 5 1HG ARG 5 5.773 -18.705 0.624 1156 2HG ARG 5 2HG ARG 5 4.805 -17.391 -0.044 1157 1HD ARG 5 1HD ARG 5 5.691 -17.701 -2.113 1158 2HD ARG 5 2HD ARG 5 7.343 -17.708 -1.468 1159 HE ARG 5 HE ARG 5 5.876 -20.124 -0.770 1160 1HH1 ARG 5 1HH1 ARG 5 7.724 -18.540 -3.260 1161 2HH1 ARG 5 2HH1 ARG 5 8.223 -20.027 -3.988 1162 1HH2 ARG 5 1HH2 ARG 5 6.537 -22.039 -1.733 1163 2HH2 ARG 5 2HH2 ARG 5 7.558 -21.995 -3.132 1164 H VAL 6 H VAL 6 6.348 -15.248 3.353 1165 HA VAL 6 HA VAL 6 8.998 -14.643 4.548 1166 HB VAL 6 HB VAL 6 7.434 -12.755 2.746 1167 1HG1 VAL 6 1HG1 VAL 6 10.021 -11.791 3.123 1168 2HG1 VAL 6 2HG1 VAL 6 9.548 -12.365 4.722 1169 3HG1 VAL 6 3HG1 VAL 6 8.561 -11.165 3.889 1170 1HG2 VAL 6 1HG2 VAL 6 9.963 -14.364 2.340 1171 2HG2 VAL 6 2HG2 VAL 6 9.560 -12.968 1.341 1172 3HG2 VAL 6 3HG2 VAL 6 8.501 -14.378 1.354 1173 H ILE 7 H ILE 7 8.766 -13.565 6.524 1174 HA ILE 7 HA ILE 7 5.956 -12.894 7.328 1175 HB ILE 7 HB ILE 7 7.100 -14.808 8.459 1176 1HG1 ILE 7 1HG1 ILE 7 6.924 -12.540 10.436 1177 2HG1 ILE 7 2HG1 ILE 7 5.480 -13.128 9.611 1178 1HG2 ILE 7 1HG2 ILE 7 9.059 -12.644 9.280 1179 2HG2 ILE 7 2HG2 ILE 7 9.409 -14.061 8.291 1180 3HG2 ILE 7 3HG2 ILE 7 9.002 -14.254 9.996 1181 1HD1 ILE 7 1HD1 ILE 7 5.793 -14.280 11.774 1182 2HD1 ILE 7 2HD1 ILE 7 7.387 -14.825 11.252 1183 3HD1 ILE 7 3HD1 ILE 7 5.942 -15.411 10.429 1184 H VAL 8 H VAL 8 5.652 -10.976 8.621 1185 HA VAL 8 HA VAL 8 7.624 -8.843 8.058 1186 HB VAL 8 HB VAL 8 4.853 -8.927 9.310 1187 1HG1 VAL 8 1HG1 VAL 8 6.393 -6.483 8.398 1188 2HG1 VAL 8 2HG1 VAL 8 6.338 -7.010 10.080 1189 3HG1 VAL 8 3HG1 VAL 8 4.855 -6.523 9.259 1190 1HG2 VAL 8 1HG2 VAL 8 4.207 -7.852 7.151 1191 2HG2 VAL 8 2HG2 VAL 8 4.867 -9.473 6.930 1192 3HG2 VAL 8 3HG2 VAL 8 5.864 -8.060 6.585 1193 H LYS 9 H LYS 9 9.024 -8.071 9.599 1194 HA LYS 9 HA LYS 9 8.418 -8.525 12.461 1195 1HB LYS 9 1HB LYS 9 10.580 -9.731 10.818 1196 2HB LYS 9 2HB LYS 9 10.962 -9.306 12.485 1197 1HG LYS 9 1HG LYS 9 9.133 -10.678 13.304 1198 2HG LYS 9 2HG LYS 9 8.575 -10.984 11.660 1199 1HD LYS 9 1HD LYS 9 10.536 -12.261 11.139 1200 2HD LYS 9 2HD LYS 9 11.333 -11.761 12.631 1201 1HE LYS 9 1HE LYS 9 9.295 -12.876 13.821 1202 2HE LYS 9 2HE LYS 9 9.050 -13.699 12.269 1203 1HZ LYS 9 1HZ LYS 9 11.686 -13.553 13.631 1204 2HZ LYS 9 2HZ LYS 9 11.248 -14.541 12.320 1205 3HZ LYS 9 3HZ LYS 9 10.609 -14.845 13.864 1206 H LYS 10 H LYS 10 10.075 -5.369 12.924 1207 HA LYS 10 HA LYS 10 8.451 -5.690 14.564 1208 1HB LYS 10 1HB LYS 10 7.419 -6.533 12.036 1209 2HB LYS 10 2HB LYS 10 6.794 -7.630 13.267 1210 1HG LYS 10 1HG LYS 10 5.296 -5.705 13.035 1211 2HG LYS 10 2HG LYS 10 6.078 -5.665 14.615 1212 1HD LYS 10 1HD LYS 10 7.855 -4.168 13.493 1213 2HD LYS 10 2HD LYS 10 6.693 -3.990 12.178 1214 1HE LYS 10 1HE LYS 10 5.322 -2.639 13.422 1215 2HE LYS 10 2HE LYS 10 5.581 -3.583 14.901 1216 1HZ LYS 10 1HZ LYS 10 7.526 -1.716 13.637 1217 2HZ LYS 10 2HZ LYS 10 7.842 -2.673 15.005 1218 3HZ LYS 10 3HZ LYS 10 6.676 -1.441 15.082 1219 H SER 11 H SER 11 10.476 -6.968 15.448 1220 HA SER 11 HA SER 11 9.418 -9.501 16.516 1221 1HB SER 11 1HB SER 11 10.439 -10.554 14.733 1222 2HB SER 11 2HB SER 11 11.616 -9.260 14.509 1223 HG SER 11 HG SER 11 12.597 -11.126 15.347 1224 HA PRO 12 HA PRO 12 13.429 -8.484 18.957 1225 1HB PRO 12 1HB PRO 12 14.749 -6.159 18.144 1226 2HB PRO 12 2HB PRO 12 15.252 -7.806 17.727 1227 1HG PRO 12 1HG PRO 12 13.725 -5.821 16.126 1228 2HG PRO 12 2HG PRO 12 14.934 -7.002 15.604 1229 1HD PRO 12 1HD PRO 12 12.295 -7.364 15.201 1230 2HD PRO 12 2HD PRO 12 13.399 -8.718 15.504 1231 H LEU 13 H LEU 13 14.191 -5.985 20.002 1232 HA LEU 13 HA LEU 13 11.914 -5.178 21.482 1233 1HB LEU 13 1HB LEU 13 14.678 -4.622 21.296 1234 2HB LEU 13 2HB LEU 13 13.875 -3.061 21.131 1235 HG LEU 13 HG LEU 13 13.006 -4.978 23.281 1236 1HD1 LEU 13 1HD1 LEU 13 15.624 -4.273 23.133 1237 2HD1 LEU 13 2HD1 LEU 13 14.771 -4.505 24.659 1238 3HD1 LEU 13 3HD1 LEU 13 14.978 -2.881 24.003 1239 1HD2 LEU 13 1HD2 LEU 13 12.824 -2.503 24.316 1240 2HD2 LEU 13 2HD2 LEU 13 11.552 -3.194 23.309 1241 3HD2 LEU 13 3HD2 LEU 13 12.731 -2.088 22.604 1242 H GLY 14 H GLY 14 13.154 -4.038 18.376 1243 1HA GLY 14 1HA GLY 14 10.644 -2.823 17.672 1244 2HA GLY 14 2HA GLY 14 11.805 -1.581 18.140 1245 H GLY 15 H GLY 15 10.663 -2.100 15.466 1246 1HA GLY 15 1HA GLY 15 12.481 -1.437 13.656 1247 2HA GLY 15 2HA GLY 15 13.019 -3.090 13.951 1248 H TYR 16 H TYR 16 11.849 -1.888 11.478 1249 HA TYR 16 HA TYR 16 9.600 -3.838 11.160 1250 1HB TYR 16 1HB TYR 16 9.233 -1.167 11.448 1251 2HB TYR 16 2HB TYR 16 9.501 -1.238 9.707 1252 HD1 TYR 16 HD1 TYR 16 6.936 -1.000 11.863 1253 HD2 TYR 16 HD2 TYR 16 8.338 -3.721 8.849 1254 HE1 TYR 16 HE1 TYR 16 4.622 -1.829 11.534 1255 HE2 TYR 16 HE2 TYR 16 6.024 -4.549 8.521 1256 HH TYR 16 HH TYR 16 3.865 -4.631 10.070 1257 H GLY 17 H GLY 17 11.126 -5.221 10.032 1258 1HA GLY 17 1HA GLY 17 11.726 -4.260 7.268 1259 2HA GLY 17 2HA GLY 17 12.949 -5.140 8.188 1260 H VAL 18 H VAL 18 12.606 -6.593 6.134 1261 HA VAL 18 HA VAL 18 10.230 -8.369 6.494 1262 HB VAL 18 HB VAL 18 12.254 -8.013 4.253 1263 1HG1 VAL 18 1HG1 VAL 18 10.709 -9.453 2.950 1264 2HG1 VAL 18 2HG1 VAL 18 9.735 -9.700 4.400 1265 3HG1 VAL 18 3HG1 VAL 18 11.385 -10.317 4.331 1266 1HG2 VAL 18 1HG2 VAL 18 9.773 -7.367 3.280 1267 2HG2 VAL 18 2HG2 VAL 18 10.944 -6.193 3.879 1268 3HG2 VAL 18 3HG2 VAL 18 9.665 -6.783 4.940 1269 H PHE 19 H PHE 19 10.511 -10.528 7.048 1270 HA PHE 19 HA PHE 19 13.318 -11.397 7.638 1271 1HB PHE 19 1HB PHE 19 10.675 -11.622 8.943 1272 2HB PHE 19 2HB PHE 19 11.612 -13.116 8.952 1273 HD1 PHE 19 HD1 PHE 19 12.460 -9.467 9.250 1274 HD2 PHE 19 HD2 PHE 19 12.781 -13.401 10.946 1275 HE1 PHE 19 HE1 PHE 19 13.871 -8.564 11.078 1276 HE2 PHE 19 HE2 PHE 19 14.192 -12.497 12.774 1277 HZ PHE 19 HZ PHE 19 14.737 -10.079 12.840 1278 H ALA 20 H ALA 20 14.100 -12.960 6.294 1279 HA ALA 20 HA ALA 20 12.270 -14.302 4.411 1280 1HB ALA 20 1HB ALA 20 14.133 -14.030 3.155 1281 2HB ALA 20 2HB ALA 20 14.985 -15.168 4.199 1282 3HB ALA 20 3HB ALA 20 15.010 -13.444 4.569 1283 H ARG 21 H ARG 21 11.171 -15.923 5.596 1284 HA ARG 21 HA ARG 21 12.468 -17.742 7.439 1285 1HB ARG 21 1HB ARG 21 9.862 -17.245 6.204 1286 2HB ARG 21 2HB ARG 21 10.193 -18.971 6.351 1287 1HG ARG 21 1HG ARG 21 9.987 -18.922 8.605 1288 2HG ARG 21 2HG ARG 21 10.960 -17.457 8.741 1289 1HD ARG 21 1HD ARG 21 9.116 -16.079 8.691 1290 2HD ARG 21 2HD ARG 21 8.239 -17.130 7.564 1291 HE ARG 21 HE ARG 21 8.215 -17.345 10.481 1292 1HH1 ARG 21 1HH1 ARG 21 7.900 -19.053 7.463 1293 2HH1 ARG 21 2HH1 ARG 21 6.950 -20.322 8.155 1294 1HH2 ARG 21 1HH2 ARG 21 6.981 -19.004 11.354 1295 2HH2 ARG 21 2HH2 ARG 21 6.432 -20.296 10.340 1296 H LYS 22 H LYS 22 12.254 -17.534 3.980 1297 HA LYS 22 HA LYS 22 13.008 -20.374 3.569 1298 1HB LYS 22 1HB LYS 22 12.600 -18.086 1.599 1299 2HB LYS 22 2HB LYS 22 12.580 -19.806 1.229 1300 1HG LYS 22 1HG LYS 22 10.689 -19.385 3.308 1301 2HG LYS 22 2HG LYS 22 10.399 -18.157 2.076 1302 1HD LYS 22 1HD LYS 22 10.030 -19.765 0.390 1303 2HD LYS 22 2HD LYS 22 10.822 -21.043 1.311 1304 1HE LYS 22 1HE LYS 22 8.702 -20.131 2.946 1305 2HE LYS 22 2HE LYS 22 8.029 -20.296 1.314 1306 1HZ LYS 22 1HZ LYS 22 9.254 -22.470 1.203 1307 2HZ LYS 22 2HZ LYS 22 7.954 -22.441 2.296 1308 3HZ LYS 22 3HZ LYS 22 9.548 -22.320 2.869 1309 H SER 23 H SER 23 16.302 -19.546 2.085 1310 HA SER 23 HA SER 23 13.815 -21.183 1.831 1311 1HB SER 23 1HB SER 23 15.802 -22.413 2.425 1312 2HB SER 23 2HB SER 23 15.503 -22.748 0.720 1313 HG SER 23 HG SER 23 17.379 -21.937 0.335 1314 H PHE 24 H PHE 24 15.780 -18.862 0.159 1315 HA PHE 24 HA PHE 24 14.153 -19.326 -2.315 1316 1HB PHE 24 1HB PHE 24 15.324 -16.906 -0.928 1317 2HB PHE 24 2HB PHE 24 14.816 -16.824 -2.615 1318 HD1 PHE 24 HD1 PHE 24 13.714 -15.805 0.368 1319 HD2 PHE 24 HD2 PHE 24 12.447 -18.485 -2.741 1320 HE1 PHE 24 HE1 PHE 24 11.359 -15.529 1.091 1321 HE2 PHE 24 HE2 PHE 24 10.091 -18.209 -2.017 1322 HZ PHE 24 HZ PHE 24 9.547 -16.731 -0.102 1323 H GLU 25 H GLU 25 15.296 -18.671 -4.364 1324 HA GLU 25 HA GLU 25 18.164 -19.514 -4.253 1325 1HB GLU 25 1HB GLU 25 15.943 -20.331 -5.752 1326 2HB GLU 25 2HB GLU 25 16.878 -19.343 -6.875 1327 1HG GLU 25 1HG GLU 25 18.924 -20.696 -6.005 1328 2HG GLU 25 2HG GLU 25 17.720 -21.839 -5.409 1329 H LYS 26 H LYS 26 18.772 -18.493 -6.873 1330 HA LYS 26 HA LYS 26 19.038 -15.602 -6.198 1331 1HB LYS 26 1HB LYS 26 20.947 -17.280 -6.759 1332 2HB LYS 26 2HB LYS 26 20.396 -17.132 -8.427 1333 1HG LYS 26 1HG LYS 26 20.654 -14.651 -8.245 1334 2HG LYS 26 2HG LYS 26 21.326 -14.872 -6.630 1335 1HD LYS 26 1HD LYS 26 23.234 -16.015 -7.463 1336 2HD LYS 26 2HD LYS 26 22.483 -16.287 -9.036 1337 1HE LYS 26 1HE LYS 26 23.581 -14.411 -9.719 1338 2HE LYS 26 2HE LYS 26 22.430 -13.501 -8.722 1339 1HZ LYS 26 1HZ LYS 26 25.077 -14.589 -7.928 1340 2HZ LYS 26 2HZ LYS 26 23.922 -14.081 -6.791 1341 3HZ LYS 26 3HZ LYS 26 24.569 -12.968 -7.900 1342 H GLY 27 H GLY 27 17.257 -14.513 -7.026 1343 1HA GLY 27 1HA GLY 27 16.434 -13.362 -9.032 1344 2HA GLY 27 2HA GLY 27 16.763 -14.830 -9.952 1345 H GLU 28 H GLU 28 15.102 -14.540 -6.813 1346 HA GLU 28 HA GLU 28 12.687 -15.746 -8.124 1347 1HB GLU 28 1HB GLU 28 14.133 -16.142 -5.524 1348 2HB GLU 28 2HB GLU 28 12.393 -16.425 -5.558 1349 1HG GLU 28 1HG GLU 28 12.923 -17.826 -7.704 1350 2HG GLU 28 2HG GLU 28 14.569 -17.848 -7.072 1351 H LEU 29 H LEU 29 10.862 -14.502 -8.051 1352 HA LEU 29 HA LEU 29 10.820 -11.865 -6.935 1353 1HB LEU 29 1HB LEU 29 9.448 -13.033 -8.825 1354 2HB LEU 29 2HB LEU 29 8.398 -13.583 -7.521 1355 HG LEU 29 HG LEU 29 7.583 -11.468 -8.541 1356 1HD1 LEU 29 1HD1 LEU 29 7.601 -12.103 -5.934 1357 2HD1 LEU 29 2HD1 LEU 29 6.914 -10.590 -6.525 1358 3HD1 LEU 29 3HD1 LEU 29 8.544 -10.616 -5.853 1359 1HD2 LEU 29 1HD2 LEU 29 9.519 -9.688 -7.360 1360 2HD2 LEU 29 2HD2 LEU 29 9.002 -9.798 -9.042 1361 3HD2 LEU 29 3HD2 LEU 29 10.331 -10.800 -8.461 1362 H VAL 30 H VAL 30 10.550 -11.288 -4.830 1363 HA VAL 30 HA VAL 30 9.414 -13.283 -2.921 1364 HB VAL 30 HB VAL 30 10.964 -10.699 -2.496 1365 1HG1 VAL 30 1HG1 VAL 30 9.452 -12.257 -0.704 1366 2HG1 VAL 30 2HG1 VAL 30 10.632 -11.013 -0.288 1367 3HG1 VAL 30 3HG1 VAL 30 11.133 -12.700 -0.404 1368 1HG2 VAL 30 1HG2 VAL 30 12.632 -12.728 -1.765 1369 2HG2 VAL 30 2HG2 VAL 30 12.651 -11.974 -3.359 1370 3HG2 VAL 30 3HG2 VAL 30 11.772 -13.482 -3.107 1371 H GLU 31 H GLU 31 7.203 -12.730 -3.757 1372 HA GLU 31 HA GLU 31 5.121 -11.666 -3.452 1373 1HB GLU 31 1HB GLU 31 6.069 -11.765 -1.070 1374 2HB GLU 31 2HB GLU 31 6.558 -10.086 -1.298 1375 1HG GLU 31 1HG GLU 31 4.389 -9.307 -1.291 1376 2HG GLU 31 2HG GLU 31 3.741 -10.796 -1.978 1377 H GLU 32 H GLU 32 4.193 -10.006 -4.579 1378 HA GLU 32 HA GLU 32 5.859 -7.574 -5.130 1379 1HB GLU 32 1HB GLU 32 5.821 -8.937 -7.099 1380 2HB GLU 32 2HB GLU 32 4.123 -9.348 -6.874 1381 1HG GLU 32 1HG GLU 32 3.528 -6.964 -7.294 1382 2HG GLU 32 2HG GLU 32 5.227 -6.624 -7.624 1383 H CYS 33 H CYS 33 4.534 -5.616 -5.549 1384 HA CYS 33 HA CYS 33 1.677 -5.757 -4.758 1385 1HB CYS 33 1HB CYS 33 3.795 -5.188 -2.966 1386 2HB CYS 33 2HB CYS 33 3.025 -3.638 -3.305 1387 HG CYS 33 HG CYS 33 1.209 -4.357 -1.791 1388 H LEU 34 H LEU 34 1.108 -3.107 -4.515 1389 HA LEU 34 HA LEU 34 1.961 -1.983 -7.158 1390 1HB LEU 34 1HB LEU 34 -0.532 -2.599 -6.043 1391 2HB LEU 34 2HB LEU 34 -0.419 -0.846 -5.899 1392 HG LEU 34 HG LEU 34 0.564 -1.288 -8.433 1393 1HD1 LEU 34 1HD1 LEU 34 -1.493 -3.359 -7.715 1394 2HD1 LEU 34 2HD1 LEU 34 0.013 -3.564 -8.609 1395 3HD1 LEU 34 3HD1 LEU 34 -1.363 -2.762 -9.369 1396 1HD2 LEU 34 1HD2 LEU 34 -2.115 -0.849 -8.875 1397 2HD2 LEU 34 2HD2 LEU 34 -0.950 0.410 -8.465 1398 3HD2 LEU 34 3HD2 LEU 34 -1.935 -0.326 -7.201 1399 H CYS 35 H CYS 35 1.722 0.535 -7.136 1400 HA CYS 35 HA CYS 35 2.588 1.684 -4.513 1401 1HB CYS 35 1HB CYS 35 3.978 1.634 -7.188 1402 2HB CYS 35 2HB CYS 35 4.256 2.988 -6.092 1403 HG CYS 35 HG CYS 35 5.846 1.507 -4.916 1404 H ILE 36 H ILE 36 2.910 4.267 -5.119 1405 HA ILE 36 HA ILE 36 0.384 5.063 -6.542 1406 HB ILE 36 HB ILE 36 1.808 6.460 -4.249 1407 1HG1 ILE 36 1HG1 ILE 36 -0.690 4.752 -4.102 1408 2HG1 ILE 36 2HG1 ILE 36 0.913 4.182 -3.638 1409 1HG2 ILE 36 1HG2 ILE 36 -0.015 7.468 -6.014 1410 2HG2 ILE 36 2HG2 ILE 36 0.170 8.038 -4.355 1411 3HG2 ILE 36 3HG2 ILE 36 -1.077 6.853 -4.747 1412 1HD1 ILE 36 1HD1 ILE 36 0.251 6.776 -2.450 1413 2HD1 ILE 36 2HD1 ILE 36 0.852 5.311 -1.675 1414 3HD1 ILE 36 3HD1 ILE 36 -0.873 5.505 -1.975 1415 H VAL 37 H VAL 37 0.590 6.750 -8.046 1416 HA VAL 37 HA VAL 37 3.373 7.776 -8.483 1417 HB VAL 37 HB VAL 37 0.999 7.416 -10.348 1418 1HG1 VAL 37 1HG1 VAL 37 2.884 7.853 -12.078 1419 2HG1 VAL 37 2HG1 VAL 37 3.758 8.575 -10.728 1420 3HG1 VAL 37 3HG1 VAL 37 2.207 9.245 -11.233 1421 1HG2 VAL 37 1HG2 VAL 37 3.286 5.750 -9.539 1422 2HG2 VAL 37 2HG2 VAL 37 3.093 5.898 -11.285 1423 3HG2 VAL 37 3HG2 VAL 37 1.767 5.277 -10.301 1424 H ARG 38 H ARG 38 3.631 9.895 -7.948 1425 HA ARG 38 HA ARG 38 1.420 11.816 -8.439 1426 1HB ARG 38 1HB ARG 38 1.060 10.887 -6.192 1427 2HB ARG 38 2HB ARG 38 2.733 11.227 -5.761 1428 1HG ARG 38 1HG ARG 38 1.088 12.922 -4.891 1429 2HG ARG 38 2HG ARG 38 2.354 13.608 -5.899 1430 1HD ARG 38 1HD ARG 38 0.845 13.749 -7.802 1431 2HD ARG 38 2HD ARG 38 -0.407 12.850 -6.925 1432 HE ARG 38 HE ARG 38 0.340 15.059 -5.310 1433 1HH1 ARG 38 1HH1 ARG 38 -1.161 14.430 -8.387 1434 2HH1 ARG 38 2HH1 ARG 38 -2.114 15.872 -8.341 1435 1HH2 ARG 38 1HH2 ARG 38 -0.907 16.925 -5.273 1436 2HH2 ARG 38 2HH2 ARG 38 -1.973 17.276 -6.593 1437 H HIS 39 H HIS 39 2.269 13.721 -9.183 1438 HA HIS 39 HA HIS 39 4.966 14.105 -9.842 1439 1HB HIS 39 1HB HIS 39 2.671 16.000 -9.270 1440 2HB HIS 39 2HB HIS 39 4.206 16.559 -9.935 1441 HD1 HIS 39 HD1 HIS 39 1.729 16.839 -11.688 1442 HD2 HIS 39 HD2 HIS 39 4.149 13.445 -11.729 1443 HE1 HIS 39 HE1 HIS 39 1.334 15.705 -13.917 1444 H ASN 40 H ASN 40 6.067 16.335 -8.940 1445 HA ASN 40 HA ASN 40 6.634 15.755 -6.079 1446 1HB ASN 40 1HB ASN 40 8.650 17.122 -6.571 1447 2HB ASN 40 2HB ASN 40 8.451 15.837 -7.763 1448 1HD2 ASN 40 1HD2 ASN 40 9.195 19.066 -7.557 1449 2HD2 ASN 40 2HD2 ASN 40 8.642 19.584 -9.076 1450 H ASP 41 H ASP 41 5.559 16.965 -4.607 1451 HA ASP 41 HA ASP 41 5.572 19.845 -4.601 1452 1HB ASP 41 1HB ASP 41 3.166 20.180 -5.081 1453 2HB ASP 41 2HB ASP 41 3.948 19.388 -6.447 1454 H ASP 42 H ASP 42 2.797 19.760 -3.219 1455 HA ASP 42 HA ASP 42 3.569 19.385 -0.532 1456 1HB ASP 42 1HB ASP 42 0.874 18.883 -1.855 1457 2HB ASP 42 2HB ASP 42 1.127 19.246 -0.148 1458 H TRP 43 H TRP 43 2.735 17.051 -2.987 1459 HA TRP 43 HA TRP 43 2.099 14.763 -1.446 1460 1HB TRP 43 1HB TRP 43 1.866 14.801 -3.842 1461 2HB TRP 43 2HB TRP 43 3.552 15.259 -4.067 1462 HD1 TRP 43 HD1 TRP 43 5.184 13.367 -4.536 1463 HE1 TRP 43 HE1 TRP 43 5.125 10.797 -4.342 1464 HE3 TRP 43 HE3 TRP 43 0.664 12.765 -2.246 1465 HZ2 TRP 43 HZ2 TRP 43 3.386 8.757 -3.346 1466 HZ3 TRP 43 HZ3 TRP 43 -0.168 10.500 -1.686 1467 HH2 TRP 43 HH2 TRP 43 1.185 8.503 -2.237 1468 H GLY 44 H GLY 44 5.316 15.732 -2.719 1469 1HA GLY 44 1HA GLY 44 6.777 13.742 -1.286 1470 2HA GLY 44 2HA GLY 44 7.470 15.225 -1.942 1471 H THR 45 H THR 45 5.565 16.897 -0.351 1472 HA THR 45 HA THR 45 7.204 17.189 2.021 1473 HB THR 45 HB THR 45 4.474 18.343 1.350 1474 HG1 THR 45 HG1 THR 45 5.493 19.244 -0.228 1475 1HG2 THR 45 1HG2 THR 45 4.766 19.343 3.355 1476 2HG2 THR 45 2HG2 THR 45 6.081 20.248 2.606 1477 3HG2 THR 45 3HG2 THR 45 6.424 18.756 3.480 1478 H ALA 46 H ALA 46 3.861 16.026 1.470 1479 HA ALA 46 HA ALA 46 3.456 15.404 4.299 1480 1HB ALA 46 1HB ALA 46 1.419 15.805 3.327 1481 2HB ALA 46 2HB ALA 46 1.498 14.102 2.874 1482 3HB ALA 46 3HB ALA 46 1.995 15.344 1.724 1483 H LEU 47 H LEU 47 4.146 13.543 1.336 1484 HA LEU 47 HA LEU 47 4.228 11.010 2.867 1485 1HB LEU 47 1HB LEU 47 4.421 11.887 -0.018 1486 2HB LEU 47 2HB LEU 47 4.864 10.243 0.435 1487 HG LEU 47 HG LEU 47 2.516 10.302 -0.244 1488 1HD1 LEU 47 1HD1 LEU 47 3.476 9.177 2.061 1489 2HD1 LEU 47 2HD1 LEU 47 1.854 8.904 1.423 1490 3HD1 LEU 47 3HD1 LEU 47 2.117 10.119 2.674 1491 1HD2 LEU 47 1HD2 LEU 47 1.757 12.018 2.072 1492 2HD2 LEU 47 2HD2 LEU 47 0.985 11.851 0.495 1493 3HD2 LEU 47 3HD2 LEU 47 2.446 12.825 0.663 1494 H GLU 48 H GLU 48 6.302 13.293 3.148 1495 HA GLU 48 HA GLU 48 8.779 12.435 1.990 1496 1HB GLU 48 1HB GLU 48 9.713 13.955 3.729 1497 2HB GLU 48 2HB GLU 48 8.310 14.674 2.939 1498 1HG GLU 48 1HG GLU 48 7.360 14.913 4.966 1499 2HG GLU 48 2HG GLU 48 7.293 13.155 5.092 1500 H ASP 49 H ASP 49 8.528 10.031 2.431 1501 HA ASP 49 HA ASP 49 10.087 9.272 4.773 1502 1HB ASP 49 1HB ASP 49 7.225 9.498 4.933 1503 2HB ASP 49 2HB ASP 49 7.656 7.794 5.072 1504 H TYR 50 H TYR 50 7.523 7.723 2.789 1505 HA TYR 50 HA TYR 50 9.576 5.701 1.938 1506 1HB TYR 50 1HB TYR 50 6.581 5.299 2.281 1507 2HB TYR 50 2HB TYR 50 7.809 4.049 2.086 1508 HD1 TYR 50 HD1 TYR 50 5.772 5.600 4.436 1509 HD2 TYR 50 HD2 TYR 50 9.845 4.345 3.899 1510 HE1 TYR 50 HE1 TYR 50 6.075 5.535 6.896 1511 HE2 TYR 50 HE2 TYR 50 10.148 4.280 6.361 1512 HH TYR 50 HH TYR 50 8.714 4.033 8.383 1513 H LEU 51 H LEU 51 9.464 7.844 0.315 1514 HA LEU 51 HA LEU 51 7.508 7.201 -1.854 1515 1HB LEU 51 1HB LEU 51 9.019 9.639 -0.914 1516 2HB LEU 51 2HB LEU 51 8.410 9.580 -2.566 1517 HG LEU 51 HG LEU 51 6.763 9.278 -0.035 1518 1HD1 LEU 51 1HD1 LEU 51 7.359 11.496 -1.931 1519 2HD1 LEU 51 2HD1 LEU 51 6.978 11.560 -0.210 1520 3HD1 LEU 51 3HD1 LEU 51 5.687 11.347 -1.391 1521 1HD2 LEU 51 1HD2 LEU 51 4.920 9.530 -1.936 1522 2HD2 LEU 51 2HD2 LEU 51 5.575 7.950 -1.513 1523 3HD2 LEU 51 3HD2 LEU 51 6.180 8.803 -2.932 1524 H PHE 52 H PHE 52 8.429 5.888 -3.381 1525 HA PHE 52 HA PHE 52 11.324 6.097 -4.011 1526 1HB PHE 52 1HB PHE 52 9.130 4.171 -4.251 1527 2HB PHE 52 2HB PHE 52 10.035 4.315 -5.757 1528 HD1 PHE 52 HD1 PHE 52 9.856 2.318 -3.036 1529 HD2 PHE 52 HD2 PHE 52 12.752 4.778 -5.038 1530 HE1 PHE 52 HE1 PHE 52 11.685 0.951 -2.069 1531 HE2 PHE 52 HE2 PHE 52 14.582 3.411 -4.071 1532 HZ PHE 52 HZ PHE 52 14.048 1.497 -2.587 1533 H SER 53 H SER 53 11.599 8.014 -5.207 1534 HA SER 53 HA SER 53 9.639 8.612 -7.364 1535 1HB SER 53 1HB SER 53 10.457 10.840 -7.149 1536 2HB SER 53 2HB SER 53 10.470 10.215 -5.500 1537 HG SER 53 HG SER 53 12.693 9.659 -5.869 1538 H ARG 54 H ARG 54 10.227 8.704 -9.518 1539 HA ARG 54 HA ARG 54 12.923 7.634 -10.219 1540 1HB ARG 54 1HB ARG 54 10.255 7.160 -11.046 1541 2HB ARG 54 2HB ARG 54 11.039 7.971 -12.401 1542 1HG ARG 54 1HG ARG 54 12.887 6.327 -12.305 1543 2HG ARG 54 2HG ARG 54 12.080 5.508 -10.968 1544 1HD ARG 54 1HD ARG 54 10.044 5.322 -12.567 1545 2HD ARG 54 2HD ARG 54 11.206 5.698 -13.855 1546 HE ARG 54 HE ARG 54 12.177 3.644 -12.026 1547 1HH1 ARG 54 1HH1 ARG 54 10.217 4.275 -14.833 1548 2HH1 ARG 54 2HH1 ARG 54 10.392 2.670 -15.452 1549 1HH2 ARG 54 1HH2 ARG 54 12.389 1.566 -12.850 1550 2HH2 ARG 54 2HH2 ARG 54 11.612 1.146 -14.340 1551 H LYS 55 H LYS 55 13.411 8.602 -12.656 1552 HA LYS 55 HA LYS 55 13.973 11.426 -12.196 1553 1HB LYS 55 1HB LYS 55 14.415 9.442 -14.446 1554 2HB LYS 55 2HB LYS 55 14.966 11.115 -14.545 1555 1HG LYS 55 1HG LYS 55 15.958 10.490 -12.122 1556 2HG LYS 55 2HG LYS 55 15.971 8.882 -12.847 1557 1HD LYS 55 1HD LYS 55 16.971 10.438 -14.886 1558 2HD LYS 55 2HD LYS 55 17.640 11.229 -13.458 1559 1HE LYS 55 1HE LYS 55 19.231 9.600 -13.472 1560 2HE LYS 55 2HE LYS 55 17.955 8.486 -12.947 1561 1HZ LYS 55 1HZ LYS 55 17.314 8.322 -15.347 1562 2HZ LYS 55 2HZ LYS 55 18.828 7.643 -14.982 1563 3HZ LYS 55 3HZ LYS 55 18.738 9.163 -15.734 1564 H ASN 56 H ASN 56 11.685 12.140 -12.074 1565 HA ASN 56 HA ASN 56 10.102 12.049 -14.563 1566 1HB ASN 56 1HB ASN 56 11.277 14.596 -13.387 1567 2HB ASN 56 2HB ASN 56 11.758 13.851 -14.912 1568 1HD2 ASN 56 1HD2 ASN 56 10.445 16.550 -14.381 1569 2HD2 ASN 56 2HD2 ASN 56 9.046 16.545 -15.341 1570 H MET 57 H MET 57 9.963 11.480 -11.491 1571 HA MET 57 HA MET 57 7.999 13.343 -10.441 1572 1HB MET 57 1HB MET 57 6.056 11.786 -10.748 1573 2HB MET 57 2HB MET 57 6.713 12.354 -12.282 1574 1HG MET 57 1HG MET 57 8.141 9.993 -11.462 1575 2HG MET 57 2HG MET 57 6.410 9.665 -11.408 1576 1HE MET 57 1HE MET 57 5.333 11.671 -14.105 1577 2HE MET 57 2HE MET 57 4.857 10.420 -12.956 1578 3HE MET 57 3HE MET 57 4.987 10.037 -14.673 1579 H SER 58 H SER 58 6.651 12.028 -8.629 1580 HA SER 58 HA SER 58 8.595 10.218 -7.235 1581 1HB SER 58 1HB SER 58 7.282 11.372 -5.198 1582 2HB SER 58 2HB SER 58 8.676 12.149 -5.946 1583 HG SER 58 HG SER 58 7.395 13.693 -6.497 1584 H ALA 59 H ALA 59 7.698 8.392 -6.233 1585 HA ALA 59 HA ALA 59 4.719 8.102 -6.316 1586 1HB ALA 59 1HB ALA 59 6.908 6.479 -7.570 1587 2HB ALA 59 2HB ALA 59 5.302 6.854 -8.197 1588 3HB ALA 59 3HB ALA 59 5.498 5.614 -6.958 1589 H MET 60 H MET 60 3.972 6.343 -4.803 1590 HA MET 60 HA MET 60 5.735 6.230 -2.403 1591 1HB MET 60 1HB MET 60 3.042 6.729 -2.802 1592 2HB MET 60 2HB MET 60 3.039 5.040 -2.295 1593 1HG MET 60 1HG MET 60 4.843 6.163 -0.546 1594 2HG MET 60 2HG MET 60 3.674 7.466 -0.751 1595 1HE MET 60 1HE MET 60 3.748 7.261 1.526 1596 2HE MET 60 2HE MET 60 3.312 5.885 2.539 1597 3HE MET 60 3HE MET 60 2.073 7.032 2.028 1598 H ALA 61 H ALA 61 5.737 4.070 -1.218 1599 HA ALA 61 HA ALA 61 6.481 1.958 -3.091 1600 1HB ALA 61 1HB ALA 61 6.887 2.742 -0.346 1601 2HB ALA 61 2HB ALA 61 7.815 1.588 -1.303 1602 3HB ALA 61 3HB ALA 61 6.403 1.047 -0.396 1603 H LEU 62 H LEU 62 3.579 2.788 -1.410 1604 HA LEU 62 HA LEU 62 2.038 0.757 -2.662 1605 1HB LEU 62 1HB LEU 62 0.922 1.705 -0.148 1606 2HB LEU 62 2HB LEU 62 1.686 3.026 -1.033 1607 HG LEU 62 HG LEU 62 0.406 2.373 -3.063 1608 1HD1 LEU 62 1HD1 LEU 62 -1.661 0.812 -2.174 1609 2HD1 LEU 62 2HD1 LEU 62 -0.301 0.127 -1.282 1610 3HD1 LEU 62 3HD1 LEU 62 -0.256 0.195 -3.044 1611 1HD2 LEU 62 1HD2 LEU 62 -1.735 2.600 -1.027 1612 2HD2 LEU 62 2HD2 LEU 62 -1.390 3.628 -2.418 1613 3HD2 LEU 62 3HD2 LEU 62 -0.464 3.819 -0.929 1614 H GLY 63 H GLY 63 2.917 -1.330 -2.265 1615 1HA GLY 63 1HA GLY 63 1.892 -2.702 0.014 1616 2HA GLY 63 2HA GLY 63 3.063 -3.368 -1.121 1617 H PHE 64 H PHE 64 4.674 -4.185 0.134 1618 HA PHE 64 HA PHE 64 5.524 -2.807 2.600 1619 1HB PHE 64 1HB PHE 64 6.325 -5.357 1.156 1620 2HB PHE 64 2HB PHE 64 7.004 -4.866 2.708 1621 HD1 PHE 64 HD1 PHE 64 4.989 -3.963 4.384 1622 HD2 PHE 64 HD2 PHE 64 4.640 -6.948 1.314 1623 HE1 PHE 64 HE1 PHE 64 3.023 -4.930 5.547 1624 HE2 PHE 64 HE2 PHE 64 2.674 -7.914 2.477 1625 HZ PHE 64 HZ PHE 64 1.866 -6.905 4.593 1626 H GLY 65 H GLY 65 6.055 -1.275 0.228 1627 1HA GLY 65 1HA GLY 65 8.868 -1.671 -0.486 1628 2HA GLY 65 2HA GLY 65 7.839 -0.348 -1.030 1629 H ALA 66 H ALA 66 7.080 0.007 1.955 1630 HA ALA 66 HA ALA 66 9.224 1.943 2.535 1631 1HB ALA 66 1HB ALA 66 6.619 1.180 3.910 1632 2HB ALA 66 2HB ALA 66 6.835 2.506 2.768 1633 3HB ALA 66 3HB ALA 66 7.614 2.568 4.350 1634 H ILE 67 H ILE 67 7.681 -0.796 4.266 1635 HA ILE 67 HA ILE 67 9.193 -0.894 6.582 1636 HB ILE 67 HB ILE 67 8.799 -3.395 6.417 1637 1HG1 ILE 67 1HG1 ILE 67 7.187 -3.841 4.349 1638 2HG1 ILE 67 2HG1 ILE 67 8.156 -2.572 3.608 1639 1HG2 ILE 67 1HG2 ILE 67 7.101 -1.698 7.214 1640 2HG2 ILE 67 2HG2 ILE 67 6.411 -3.191 6.578 1641 3HG2 ILE 67 3HG2 ILE 67 6.411 -1.729 5.591 1642 1HD1 ILE 67 1HD1 ILE 67 9.690 -4.639 5.066 1643 2HD1 ILE 67 2HD1 ILE 67 10.024 -3.875 3.512 1644 3HD1 ILE 67 3HD1 ILE 67 8.862 -5.197 3.613 1645 H PHE 68 H PHE 68 10.332 -1.657 3.345 1646 HA PHE 68 HA PHE 68 12.552 -3.295 3.872 1647 1HB PHE 68 1HB PHE 68 11.946 -1.071 1.925 1648 2HB PHE 68 2HB PHE 68 13.513 -1.878 1.881 1649 HD1 PHE 68 HD1 PHE 68 12.899 -4.649 2.532 1650 HD2 PHE 68 HD2 PHE 68 10.701 -1.866 0.109 1651 HE1 PHE 68 HE1 PHE 68 11.892 -6.536 1.280 1652 HE2 PHE 68 HE2 PHE 68 9.693 -3.754 -1.145 1653 HZ PHE 68 HZ PHE 68 10.289 -6.090 -0.559 1654 H ASN 69 H ASN 69 14.638 -2.916 4.661 1655 HA ASN 69 HA ASN 69 15.138 -0.183 5.796 1656 1HB ASN 69 1HB ASN 69 15.819 -2.999 6.693 1657 2HB ASN 69 2HB ASN 69 16.562 -1.577 7.424 1658 1HD2 ASN 69 1HD2 ASN 69 14.253 -3.696 8.171 1659 2HD2 ASN 69 2HD2 ASN 69 13.096 -2.689 8.898 1660 H HIS 70 H HIS 70 17.635 0.097 6.170 1661 HA HIS 70 HA HIS 70 18.981 -0.499 3.583 1662 1HB HIS 70 1HB HIS 70 18.737 1.818 4.691 1663 2HB HIS 70 2HB HIS 70 19.918 1.253 5.874 1664 HD1 HIS 70 HD1 HIS 70 19.598 1.536 2.079 1665 HD2 HIS 70 HD2 HIS 70 22.530 1.611 5.042 1666 HE1 HIS 70 HE1 HIS 70 21.784 2.063 0.912 1667 H SER 71 H SER 71 19.713 -2.656 3.882 1668 HA SER 71 HA SER 71 21.541 -3.114 6.215 1669 1HB SER 71 1HB SER 71 19.993 -5.060 4.462 1670 2HB SER 71 2HB SER 71 20.914 -5.480 5.907 1671 HG SER 71 HG SER 71 18.590 -3.876 5.721 1672 H LYS 72 H LYS 72 23.623 -3.895 5.785 1673 HA LYS 72 HA LYS 72 24.873 -3.340 3.298 1674 1HB LYS 72 1HB LYS 72 25.491 -5.037 5.719 1675 2HB LYS 72 2HB LYS 72 26.609 -5.000 4.354 1676 1HG LYS 72 1HG LYS 72 25.615 -2.376 5.358 1677 2HG LYS 72 2HG LYS 72 26.764 -3.238 6.380 1678 1HD LYS 72 1HD LYS 72 28.476 -3.058 4.842 1679 2HD LYS 72 2HD LYS 72 27.377 -3.060 3.462 1680 1HE LYS 72 1HE LYS 72 27.075 -0.779 3.543 1681 2HE LYS 72 2HE LYS 72 27.161 -0.732 5.314 1682 1HZ LYS 72 1HZ LYS 72 29.431 -1.169 3.437 1683 2HZ LYS 72 2HZ LYS 72 29.546 -1.264 5.129 1684 3HZ LYS 72 3HZ LYS 72 29.166 0.215 4.385 1685 H ASP 73 H ASP 73 25.110 -4.559 1.437 1686 HA ASP 73 HA ASP 73 24.722 -6.308 -0.103 1687 1HB ASP 73 1HB ASP 73 26.331 -7.239 1.711 1688 2HB ASP 73 2HB ASP 73 24.919 -8.090 2.338 1689 HA PRO 74 HA PRO 74 20.319 -6.524 1.546 1690 1HB PRO 74 1HB PRO 74 19.260 -5.552 -0.854 1691 2HB PRO 74 2HB PRO 74 19.578 -4.570 0.586 1692 1HG PRO 74 1HG PRO 74 21.183 -4.883 -1.893 1693 2HG PRO 74 2HG PRO 74 20.947 -3.458 -0.873 1694 1HD PRO 74 1HD PRO 74 23.219 -4.926 -0.835 1695 2HD PRO 74 2HD PRO 74 22.601 -4.080 0.600 1696 H ASN 75 H ASN 75 20.087 -8.755 1.411 1697 HA ASN 75 HA ASN 75 20.672 -10.410 -0.812 1698 1HB ASN 75 1HB ASN 75 18.629 -10.672 1.426 1699 2HB ASN 75 2HB ASN 75 19.182 -12.009 0.418 1700 1HD2 ASN 75 1HD2 ASN 75 20.087 -9.857 3.057 1701 2HD2 ASN 75 2HD2 ASN 75 21.552 -10.629 3.432 1702 H ALA 76 H ALA 76 17.980 -8.275 -0.277 1703 HA ALA 76 HA ALA 76 16.605 -9.459 -2.668 1704 1HB ALA 76 1HB ALA 76 15.239 -7.883 -0.487 1705 2HB ALA 76 2HB ALA 76 15.607 -9.590 -0.244 1706 3HB ALA 76 3HB ALA 76 14.550 -9.096 -1.566 1707 H ARG 77 H ARG 77 15.711 -7.946 -4.160 1708 HA ARG 77 HA ARG 77 16.515 -5.087 -3.739 1709 1HB ARG 77 1HB ARG 77 17.207 -7.078 -5.785 1710 2HB ARG 77 2HB ARG 77 16.584 -5.581 -6.480 1711 1HG ARG 77 1HG ARG 77 18.300 -4.728 -4.448 1712 2HG ARG 77 2HG ARG 77 19.147 -6.088 -5.184 1713 1HD ARG 77 1HD ARG 77 17.925 -3.840 -6.817 1714 2HD ARG 77 2HD ARG 77 19.617 -3.846 -6.285 1715 HE ARG 77 HE ARG 77 19.183 -6.374 -7.414 1716 1HH1 ARG 77 1HH1 ARG 77 18.965 -3.057 -8.450 1717 2HH1 ARG 77 2HH1 ARG 77 19.340 -3.432 -10.096 1718 1HH2 ARG 77 1HH2 ARG 77 19.668 -6.834 -9.558 1719 2HH2 ARG 77 2HH2 ARG 77 19.735 -5.553 -10.721 1720 H HIS 78 H HIS 78 15.341 -3.885 -5.845 1721 HA HIS 78 HA HIS 78 12.494 -4.816 -5.880 1722 1HB HIS 78 1HB HIS 78 11.880 -2.418 -5.494 1723 2HB HIS 78 2HB HIS 78 12.807 -3.093 -4.154 1724 HD1 HIS 78 HD1 HIS 78 15.367 -2.414 -4.024 1725 HD2 HIS 78 HD2 HIS 78 13.145 -0.311 -6.855 1726 HE1 HIS 78 HE1 HIS 78 16.768 -0.413 -4.691 1727 H GLU 79 H GLU 79 11.283 -4.023 -7.731 1728 HA GLU 79 HA GLU 79 12.901 -2.770 -9.910 1729 1HB GLU 79 1HB GLU 79 12.979 -5.215 -10.171 1730 2HB GLU 79 2HB GLU 79 11.222 -5.304 -10.040 1731 1HG GLU 79 1HG GLU 79 11.057 -3.839 -12.070 1732 2HG GLU 79 2HG GLU 79 12.810 -3.942 -12.235 1733 H LEU 80 H LEU 80 11.742 -1.057 -10.705 1734 HA LEU 80 HA LEU 80 8.854 -0.847 -10.091 1735 1HB LEU 80 1HB LEU 80 11.026 0.956 -11.184 1736 2HB LEU 80 2HB LEU 80 9.336 1.460 -11.181 1737 HG LEU 80 HG LEU 80 10.511 0.361 -8.653 1738 1HD1 LEU 80 1HD1 LEU 80 10.691 3.296 -9.040 1739 2HD1 LEU 80 2HD1 LEU 80 11.882 2.338 -9.921 1740 3HD1 LEU 80 3HD1 LEU 80 11.769 2.208 -8.166 1741 1HD2 LEU 80 1HD2 LEU 80 8.047 1.281 -9.346 1742 2HD2 LEU 80 2HD2 LEU 80 8.784 2.766 -8.745 1743 3HD2 LEU 80 3HD2 LEU 80 8.683 1.348 -7.702 1744 H THR 81 H THR 81 7.253 -0.596 -11.729 1745 HA THR 81 HA THR 81 7.963 -1.823 -14.338 1746 HB THR 81 HB THR 81 5.404 -1.809 -14.499 1747 HG1 THR 81 HG1 THR 81 4.288 -1.056 -12.832 1748 1HG2 THR 81 1HG2 THR 81 7.065 -3.572 -13.328 1749 2HG2 THR 81 2HG2 THR 81 5.316 -3.794 -13.341 1750 3HG2 THR 81 3HG2 THR 81 6.108 -3.119 -11.918 1751 H ALA 82 H ALA 82 7.391 -0.769 -16.342 1752 HA ALA 82 HA ALA 82 7.970 1.973 -16.594 1753 1HB ALA 82 1HB ALA 82 7.236 -0.226 -18.202 1754 2HB ALA 82 2HB ALA 82 7.775 1.354 -18.771 1755 3HB ALA 82 3HB ALA 82 6.053 1.029 -18.574 1756 H GLY 83 H GLY 83 6.801 3.309 -15.143 1757 1HA GLY 83 1HA GLY 83 4.688 4.767 -15.620 1758 2HA GLY 83 2HA GLY 83 3.829 3.250 -15.367 1759 H LEU 84 H LEU 84 6.340 2.953 -13.297 1760 HA LEU 84 HA LEU 84 6.527 3.186 -10.956 1761 1HB LEU 84 1HB LEU 84 6.109 5.692 -12.184 1762 2HB LEU 84 2HB LEU 84 5.029 5.684 -10.791 1763 HG LEU 84 HG LEU 84 6.887 5.134 -9.305 1764 1HD1 LEU 84 1HD1 LEU 84 8.295 4.738 -11.915 1765 2HD1 LEU 84 2HD1 LEU 84 8.406 3.796 -10.428 1766 3HD1 LEU 84 3HD1 LEU 84 9.238 5.346 -10.554 1767 1HD2 LEU 84 1HD2 LEU 84 7.024 7.398 -9.284 1768 2HD2 LEU 84 2HD2 LEU 84 6.865 7.505 -11.037 1769 3HD2 LEU 84 3HD2 LEU 84 8.442 7.190 -10.312 1770 H LYS 85 H LYS 85 3.914 2.155 -12.306 1771 HA LYS 85 HA LYS 85 1.903 2.822 -10.243 1772 1HB LYS 85 1HB LYS 85 2.019 1.903 -12.985 1773 2HB LYS 85 2HB LYS 85 0.998 0.821 -12.036 1774 1HG LYS 85 1HG LYS 85 -0.594 2.418 -11.697 1775 2HG LYS 85 2HG LYS 85 0.599 3.701 -11.498 1776 1HD LYS 85 1HD LYS 85 0.980 3.271 -14.096 1777 2HD LYS 85 2HD LYS 85 -0.673 2.662 -13.999 1778 1HE LYS 85 1HE LYS 85 -1.390 4.813 -14.096 1779 2HE LYS 85 2HE LYS 85 -0.632 5.083 -12.515 1780 1HZ LYS 85 1HZ LYS 85 0.348 6.561 -14.136 1781 2HZ LYS 85 2HZ LYS 85 0.693 5.263 -15.175 1782 3HZ LYS 85 3HZ LYS 85 1.499 5.396 -13.687 1783 H ARG 86 H ARG 86 4.140 0.237 -10.999 1784 HA ARG 86 HA ARG 86 2.983 -1.326 -8.718 1785 1HB ARG 86 1HB ARG 86 2.879 -1.945 -11.453 1786 2HB ARG 86 2HB ARG 86 4.185 -2.951 -10.823 1787 1HG ARG 86 1HG ARG 86 2.421 -3.374 -8.867 1788 2HG ARG 86 2HG ARG 86 1.273 -2.972 -10.143 1789 1HD ARG 86 1HD ARG 86 3.168 -4.730 -11.313 1790 2HD ARG 86 2HD ARG 86 2.713 -5.436 -9.751 1791 HE ARG 86 HE ARG 86 0.510 -5.704 -10.579 1792 1HH1 ARG 86 1HH1 ARG 86 2.310 -3.459 -12.539 1793 2HH1 ARG 86 2HH1 ARG 86 1.059 -3.323 -13.726 1794 1HH2 ARG 86 1HH2 ARG 86 -1.099 -5.510 -12.132 1795 2HH2 ARG 86 2HH2 ARG 86 -0.857 -4.474 -13.499 1796 H MET 87 H MET 87 4.554 -2.729 -7.658 1797 HA MET 87 HA MET 87 7.415 -2.035 -8.227 1798 1HB MET 87 1HB MET 87 5.718 -1.499 -5.929 1799 2HB MET 87 2HB MET 87 7.090 -2.502 -5.457 1800 1HG MET 87 1HG MET 87 7.341 0.046 -7.081 1801 2HG MET 87 2HG MET 87 7.548 -0.028 -5.331 1802 1HE MET 87 1HE MET 87 10.446 -0.764 -4.379 1803 2HE MET 87 2HE MET 87 10.086 -2.470 -4.641 1804 3HE MET 87 3HE MET 87 8.802 -1.363 -4.157 1805 H ARG 88 H ARG 88 8.793 -3.809 -8.174 1806 HA ARG 88 HA ARG 88 7.570 -6.434 -7.388 1807 1HB ARG 88 1HB ARG 88 9.160 -5.419 -9.671 1808 2HB ARG 88 2HB ARG 88 9.680 -6.990 -9.061 1809 1HG ARG 88 1HG ARG 88 7.427 -7.883 -9.318 1810 2HG ARG 88 2HG ARG 88 6.820 -6.297 -9.795 1811 1HD ARG 88 1HD ARG 88 8.936 -6.705 -11.551 1812 2HD ARG 88 2HD ARG 88 8.197 -8.312 -11.418 1813 HE ARG 88 HE ARG 88 6.139 -6.320 -11.622 1814 1HH1 ARG 88 1HH1 ARG 88 8.595 -7.916 -13.503 1815 2HH1 ARG 88 2HH1 ARG 88 7.735 -7.724 -14.991 1816 1HH2 ARG 88 1HH2 ARG 88 5.042 -6.083 -13.566 1817 2HH2 ARG 88 2HH2 ARG 88 5.739 -6.694 -15.029 1818 H ILE 89 H ILE 89 8.929 -7.921 -6.255 1819 HA ILE 89 HA ILE 89 11.458 -6.750 -5.142 1820 HB ILE 89 HB ILE 89 9.301 -8.432 -3.809 1821 1HG1 ILE 89 1HG1 ILE 89 10.174 -5.632 -3.092 1822 2HG1 ILE 89 2HG1 ILE 89 8.903 -5.926 -4.277 1823 1HG2 ILE 89 1HG2 ILE 89 11.791 -7.201 -2.593 1824 2HG2 ILE 89 2HG2 ILE 89 11.649 -8.903 -3.036 1825 3HG2 ILE 89 3HG2 ILE 89 10.612 -8.229 -1.779 1826 1HD1 ILE 89 1HD1 ILE 89 7.430 -6.740 -2.698 1827 2HD1 ILE 89 2HD1 ILE 89 8.356 -5.645 -1.671 1828 3HD1 ILE 89 3HD1 ILE 89 8.718 -7.372 -1.671 1829 H PHE 90 H PHE 90 13.175 -8.013 -5.746 1830 HA PHE 90 HA PHE 90 12.663 -10.927 -6.261 1831 1HB PHE 90 1HB PHE 90 14.288 -8.770 -7.576 1832 2HB PHE 90 2HB PHE 90 14.888 -10.426 -7.664 1833 HD1 PHE 90 HD1 PHE 90 12.270 -8.096 -8.730 1834 HD2 PHE 90 HD2 PHE 90 13.581 -12.186 -8.796 1835 HE1 PHE 90 HE1 PHE 90 10.665 -8.581 -10.558 1836 HE2 PHE 90 HE2 PHE 90 11.976 -12.671 -10.624 1837 HZ PHE 90 HZ PHE 90 10.518 -10.869 -11.505 1838 H THR 91 H THR 91 15.187 -11.895 -6.316 1839 HA THR 91 HA THR 91 16.457 -11.074 -3.729 1840 HB THR 91 HB THR 91 16.867 -13.700 -3.664 1841 HG1 THR 91 HG1 THR 91 15.335 -14.833 -4.734 1842 1HG2 THR 91 1HG2 THR 91 14.586 -12.007 -2.823 1843 2HG2 THR 91 2HG2 THR 91 15.625 -13.057 -1.859 1844 3HG2 THR 91 3HG2 THR 91 14.291 -13.746 -2.784 1845 H ILE 92 H ILE 92 18.183 -10.016 -4.856 1846 HA ILE 92 HA ILE 92 19.580 -10.877 -7.122 1847 HB ILE 92 HB ILE 92 21.417 -9.501 -6.180 1848 1HG1 ILE 92 1HG1 ILE 92 19.771 -9.493 -3.634 1849 2HG1 ILE 92 2HG1 ILE 92 21.230 -10.456 -3.863 1850 1HG2 ILE 92 1HG2 ILE 92 18.820 -8.236 -5.312 1851 2HG2 ILE 92 2HG2 ILE 92 19.155 -8.542 -7.016 1852 3HG2 ILE 92 3HG2 ILE 92 20.209 -7.475 -6.088 1853 1HD1 ILE 92 1HD1 ILE 92 20.945 -7.468 -3.688 1854 2HD1 ILE 92 2HD1 ILE 92 22.307 -8.169 -4.561 1855 3HD1 ILE 92 3HD1 ILE 92 22.080 -8.525 -2.849 1856 H LYS 93 H LYS 93 19.824 -12.087 -3.812 1857 HA LYS 93 HA LYS 93 21.654 -14.226 -4.825 1858 1HB LYS 93 1HB LYS 93 22.949 -13.941 -2.709 1859 2HB LYS 93 2HB LYS 93 22.960 -12.473 -3.685 1860 1HG LYS 93 1HG LYS 93 21.014 -11.641 -2.317 1861 2HG LYS 93 2HG LYS 93 21.221 -13.045 -1.269 1862 1HD LYS 93 1HD LYS 93 22.407 -11.154 -0.292 1863 2HD LYS 93 2HD LYS 93 23.588 -12.331 -0.867 1864 1HE LYS 93 1HE LYS 93 23.040 -10.619 -3.065 1865 2HE LYS 93 2HE LYS 93 23.291 -9.574 -1.654 1866 1HZ LYS 93 1HZ LYS 93 25.075 -11.683 -2.728 1867 2HZ LYS 93 2HZ LYS 93 25.221 -11.128 -1.130 1868 3HZ LYS 93 3HZ LYS 93 25.441 -10.053 -2.426 1869 HA PRO 94 HA PRO 94 18.772 -17.017 -2.987 1870 1HB PRO 94 1HB PRO 94 21.195 -18.464 -1.998 1871 2HB PRO 94 2HB PRO 94 19.830 -19.078 -2.948 1872 1HG PRO 94 1HG PRO 94 22.238 -18.591 -4.033 1873 2HG PRO 94 2HG PRO 94 20.730 -18.379 -4.931 1874 1HD PRO 94 1HD PRO 94 22.576 -16.342 -3.839 1875 2HD PRO 94 2HD PRO 94 21.457 -16.238 -5.213 1876 H ILE 95 H ILE 95 17.938 -17.448 -0.873 1877 HA ILE 95 HA ILE 95 19.459 -16.155 1.368 1878 HB ILE 95 HB ILE 95 16.483 -16.270 0.752 1879 1HG1 ILE 95 1HG1 ILE 95 18.443 -13.955 0.821 1880 2HG1 ILE 95 2HG1 ILE 95 17.779 -14.687 -0.640 1881 1HG2 ILE 95 1HG2 ILE 95 16.895 -14.398 2.754 1882 2HG2 ILE 95 2HG2 ILE 95 17.972 -15.715 3.217 1883 3HG2 ILE 95 3HG2 ILE 95 16.250 -16.022 2.991 1884 1HD1 ILE 95 1HD1 ILE 95 16.539 -12.634 0.013 1885 2HD1 ILE 95 2HD1 ILE 95 16.138 -13.388 1.557 1886 3HD1 ILE 95 3HD1 ILE 95 15.510 -14.065 0.054 1887 H ALA 96 H ALA 96 19.298 -17.181 3.418 1888 HA ALA 96 HA ALA 96 18.484 -20.049 3.310 1889 1HB ALA 96 1HB ALA 96 20.783 -19.489 3.977 1890 2HB ALA 96 2HB ALA 96 19.917 -20.130 5.373 1891 3HB ALA 96 3HB ALA 96 20.178 -18.393 5.219 1892 H ILE 97 H ILE 97 17.339 -20.909 5.249 1893 HA ILE 97 HA ILE 97 15.043 -19.340 5.964 1894 HB ILE 97 HB ILE 97 16.295 -21.837 7.168 1895 1HG1 ILE 97 1HG1 ILE 97 13.871 -21.931 5.460 1896 2HG1 ILE 97 2HG1 ILE 97 15.375 -21.523 4.638 1897 1HG2 ILE 97 1HG2 ILE 97 13.998 -20.253 7.951 1898 2HG2 ILE 97 2HG2 ILE 97 14.685 -21.675 8.737 1899 3HG2 ILE 97 3HG2 ILE 97 13.496 -21.867 7.449 1900 1HD1 ILE 97 1HD1 ILE 97 14.915 -23.951 6.397 1901 2HD1 ILE 97 2HD1 ILE 97 16.440 -23.538 5.613 1902 3HD1 ILE 97 3HD1 ILE 97 15.033 -23.960 4.637 1903 H GLY 98 H GLY 98 15.655 -17.395 6.998 1904 1HA GLY 98 1HA GLY 98 15.686 -16.713 9.468 1905 2HA GLY 98 2HA GLY 98 17.146 -17.698 9.572 1906 H GLU 99 H GLU 99 16.180 -15.518 6.933 1907 HA GLU 99 HA GLU 99 18.675 -13.940 7.474 1908 1HB GLU 99 1HB GLU 99 17.256 -14.935 5.011 1909 2HB GLU 99 2HB GLU 99 18.258 -13.490 4.892 1910 1HG GLU 99 1HG GLU 99 19.160 -16.206 5.899 1911 2HG GLU 99 2HG GLU 99 19.577 -15.488 4.344 1912 H GLU 100 H GLU 100 18.493 -11.632 6.609 1913 HA GLU 100 HA GLU 100 15.781 -10.539 7.259 1914 1HB GLU 100 1HB GLU 100 18.160 -10.005 8.400 1915 2HB GLU 100 2HB GLU 100 18.246 -8.852 7.069 1916 1HG GLU 100 1HG GLU 100 15.639 -8.884 8.431 1917 2HG GLU 100 2HG GLU 100 16.973 -8.397 9.476 1918 H ILE 101 H ILE 101 14.638 -9.962 5.459 1919 HA ILE 101 HA ILE 101 16.039 -9.449 2.912 1920 HB ILE 101 HB ILE 101 13.139 -9.668 3.782 1921 1HG1 ILE 101 1HG1 ILE 101 14.769 -11.493 2.006 1922 2HG1 ILE 101 2HG1 ILE 101 14.654 -11.716 3.751 1923 1HG2 ILE 101 1HG2 ILE 101 14.363 -8.808 1.215 1924 2HG2 ILE 101 2HG2 ILE 101 12.776 -8.431 1.884 1925 3HG2 ILE 101 3HG2 ILE 101 13.054 -9.983 1.094 1926 1HD1 ILE 101 1HD1 ILE 101 12.940 -12.894 2.054 1927 2HD1 ILE 101 2HD1 ILE 101 12.100 -11.355 2.252 1928 3HD1 ILE 101 3HD1 ILE 101 12.443 -12.360 3.660 1929 H THR 102 H THR 102 16.473 -7.439 2.185 1930 HA THR 102 HA THR 102 14.772 -5.133 2.916 1931 HB THR 102 HB THR 102 16.793 -3.917 3.784 1932 HG1 THR 102 HG1 THR 102 18.532 -4.890 3.052 1933 1HG2 THR 102 1HG2 THR 102 16.781 -4.936 5.944 1934 2HG2 THR 102 2HG2 THR 102 16.411 -6.523 5.271 1935 3HG2 THR 102 3HG2 THR 102 15.187 -5.253 5.259 1936 H ILE 103 H ILE 103 15.856 -3.090 1.775 1937 HA ILE 103 HA ILE 103 17.318 -3.894 -0.695 1938 HB ILE 103 HB ILE 103 15.632 -2.732 -2.067 1939 1HG1 ILE 103 1HG1 ILE 103 13.479 -2.424 -0.263 1940 2HG1 ILE 103 2HG1 ILE 103 14.874 -1.670 0.509 1941 1HG2 ILE 103 1HG2 ILE 103 13.925 -4.373 -1.930 1942 2HG2 ILE 103 2HG2 ILE 103 14.130 -4.558 -0.188 1943 3HG2 ILE 103 3HG2 ILE 103 15.359 -5.177 -1.291 1944 1HD1 ILE 103 1HD1 ILE 103 13.450 -0.914 -1.992 1945 2HD1 ILE 103 2HD1 ILE 103 15.204 -0.730 -1.997 1946 3HD1 ILE 103 3HD1 ILE 103 14.232 0.111 -0.789 1947 H SER 104 H SER 104 18.292 -2.019 -1.790 1948 HA SER 104 HA SER 104 19.098 0.073 0.128 1949 1HB SER 104 1HB SER 104 20.325 -1.363 -1.869 1950 2HB SER 104 2HB SER 104 19.993 0.160 -2.695 1951 HG SER 104 HG SER 104 21.677 -0.389 -0.564 1952 H TYR 105 H TYR 105 19.557 2.161 -1.752 1953 HA TYR 105 HA TYR 105 16.786 2.884 -2.637 1954 1HB TYR 105 1HB TYR 105 18.802 4.625 -1.167 1955 2HB TYR 105 2HB TYR 105 17.174 5.106 -1.642 1956 HD1 TYR 105 HD1 TYR 105 15.385 3.070 -0.931 1957 HD2 TYR 105 HD2 TYR 105 18.993 4.198 1.109 1958 HE1 TYR 105 HE1 TYR 105 14.492 2.115 1.177 1959 HE2 TYR 105 HE2 TYR 105 18.100 3.244 3.216 1960 HH TYR 105 HH TYR 105 15.130 1.384 3.278 1961 H GLY 106 H GLY 106 20.129 4.196 -2.703 1962 1HA GLY 106 1HA GLY 106 20.757 3.905 -5.371 1963 2HA GLY 106 2HA GLY 106 19.710 5.324 -5.362 1964 H ASP 107 H ASP 107 21.817 6.338 -6.152 1965 HA ASP 107 HA ASP 107 24.106 6.611 -4.457 1966 1HB ASP 107 1HB ASP 107 22.879 8.371 -6.611 1967 2HB ASP 107 2HB ASP 107 24.502 8.604 -5.961 1968 H ASP 108 H ASP 108 21.063 8.419 -4.654 1969 HA ASP 108 HA ASP 108 21.859 10.604 -2.946 1970 1HB ASP 108 1HB ASP 108 19.203 9.355 -3.731 1971 2HB ASP 108 2HB ASP 108 19.328 10.860 -2.819 1972 H TYR 109 H TYR 109 19.275 8.315 -2.090 1973 HA TYR 109 HA TYR 109 19.465 8.590 0.691 1974 1HB TYR 109 1HB TYR 109 18.403 6.663 -1.286 1975 2HB TYR 109 2HB TYR 109 18.671 5.979 0.318 1976 HD1 TYR 109 HD1 TYR 109 16.741 5.973 1.617 1977 HD2 TYR 109 HD2 TYR 109 17.497 9.301 -0.991 1978 HE1 TYR 109 HE1 TYR 109 14.675 7.079 2.430 1979 HE2 TYR 109 HE2 TYR 109 15.432 10.408 -0.179 1980 HH TYR 109 HH TYR 109 13.066 9.239 1.006 1981 H TRP 110 H TRP 110 21.358 8.349 1.831 1982 HA TRP 110 HA TRP 110 23.332 7.354 2.661 1983 1HB TRP 110 1HB TRP 110 21.614 5.004 1.796 1984 2HB TRP 110 2HB TRP 110 23.072 4.825 2.773 1985 HD1 TRP 110 HD1 TRP 110 19.860 6.994 2.906 1986 HE1 TRP 110 HE1 TRP 110 19.098 7.136 5.365 1987 HE3 TRP 110 HE3 TRP 110 23.557 4.267 5.132 1988 HZ2 TRP 110 HZ2 TRP 110 19.946 6.214 7.937 1989 HZ3 TRP 110 HZ3 TRP 110 23.556 3.914 7.585 1990 HH2 TRP 110 HH2 TRP 110 21.757 4.883 8.989 1991 H LEU 111 H LEU 111 24.797 5.164 1.891 1992 HA LEU 111 HA LEU 111 26.262 6.065 -0.380 1993 1HB LEU 111 1HB LEU 111 27.004 4.581 1.528 1994 2HB LEU 111 2HB LEU 111 26.073 3.270 0.804 1995 HG LEU 111 HG LEU 111 27.439 3.780 -1.347 1996 1HD1 LEU 111 1HD1 LEU 111 29.829 4.550 -0.317 1997 2HD1 LEU 111 2HD1 LEU 111 28.738 5.485 0.706 1998 3HD1 LEU 111 3HD1 LEU 111 28.686 5.676 -1.047 1999 1HD2 LEU 111 1HD2 LEU 111 27.664 1.844 0.402 2000 2HD2 LEU 111 2HD2 LEU 111 29.120 2.703 0.905 2001 3HD2 LEU 111 3HD2 LEU 111 28.972 2.111 -0.750 2002 H SER 112 H SER 112 26.463 5.012 -2.490 2003 HA SER 112 HA SER 112 23.969 4.455 -3.783 2004 1HB SER 112 1HB SER 112 26.844 3.836 -4.565 2005 2HB SER 112 2HB SER 112 25.478 3.893 -5.680 2006 HG SER 112 HG SER 112 26.986 5.881 -4.978 2007 H ARG 113 H ARG 113 26.734 2.208 -3.326 2008 HA ARG 113 HA ARG 113 24.773 0.015 -2.814 2009 1HB ARG 113 1HB ARG 113 26.698 0.405 -5.060 2010 2HB ARG 113 2HB ARG 113 26.580 -1.228 -4.405 2011 1HG ARG 113 1HG ARG 113 24.005 -0.866 -4.597 2012 2HG ARG 113 2HG ARG 113 24.433 0.446 -5.695 2013 1HD ARG 113 1HD ARG 113 25.982 -1.418 -6.793 2014 2HD ARG 113 2HD ARG 113 24.804 -2.510 -6.040 2015 HE ARG 113 HE ARG 113 23.358 -0.401 -7.281 2016 1HH1 ARG 113 1HH1 ARG 113 25.411 -3.076 -8.146 2017 2HH1 ARG 113 2HH1 ARG 113 24.661 -3.296 -9.688 2018 1HH2 ARG 113 1HH2 ARG 113 22.400 -0.707 -9.288 2019 2HH2 ARG 113 2HH2 ARG 113 22.969 -1.966 -10.332 2020 HA PRO 114 HA PRO 114 27.544 -1.306 0.313 2021 1HB PRO 114 1HB PRO 114 27.444 -4.080 -0.751 2022 2HB PRO 114 2HB PRO 114 26.947 -3.469 0.837 2023 1HG PRO 114 1HG PRO 114 25.176 -4.216 -1.041 2024 2HG PRO 114 2HG PRO 114 24.850 -2.915 0.112 2025 1HD PRO 114 1HD PRO 114 25.551 -2.756 -2.775 2026 2HD PRO 114 2HD PRO 114 24.507 -1.700 -1.800 2027 H ARG 115 H ARG 115 28.225 -3.269 -2.616 2028 HA ARG 115 HA ARG 115 30.230 -3.596 -3.815 2029 1HB ARG 115 1HB ARG 115 30.151 -0.915 -2.999 2030 2HB ARG 115 2HB ARG 115 31.757 -1.465 -2.522 2031 1HG ARG 115 1HG ARG 115 32.140 -0.821 -4.730 2032 2HG ARG 115 2HG ARG 115 31.778 -2.535 -4.934 2033 1HD ARG 115 1HD ARG 115 30.010 -2.004 -6.247 2034 2HD ARG 115 2HD ARG 115 29.304 -1.055 -4.925 2035 HE ARG 115 HE ARG 115 31.349 0.557 -5.868 2036 1HH1 ARG 115 1HH1 ARG 115 28.630 -1.052 -7.329 2037 2HH1 ARG 115 2HH1 ARG 115 28.455 0.137 -8.573 2038 1HH2 ARG 115 1HH2 ARG 115 31.101 2.087 -7.491 2039 2HH2 ARG 115 2HH2 ARG 115 29.842 1.901 -8.666 2040 H LEU 116 H LEU 116 31.448 -2.291 -0.706 2041 HA LEU 116 HA LEU 116 32.952 -3.246 0.846 2042 1HB LEU 116 1HB LEU 116 31.434 -5.693 -0.136 2043 2HB LEU 116 2HB LEU 116 32.377 -5.621 1.352 2044 HG LEU 116 HG LEU 116 30.389 -3.455 1.023 2045 1HD1 LEU 116 1HD1 LEU 116 29.429 -6.233 1.732 2046 2HD1 LEU 116 2HD1 LEU 116 29.286 -5.579 0.100 2047 3HD1 LEU 116 3HD1 LEU 116 28.458 -4.789 1.442 2048 1HD2 LEU 116 1HD2 LEU 116 31.927 -4.567 3.058 2049 2HD2 LEU 116 2HD2 LEU 116 30.299 -5.152 3.402 2050 3HD2 LEU 116 3HD2 LEU 116 30.605 -3.419 3.274 2051 H THR 117 H THR 117 34.903 -2.847 -0.372 2052 HA THR 117 HA THR 117 35.851 -4.566 -2.479 2053 HB THR 117 HB THR 117 37.243 -2.694 -0.528 2054 HG1 THR 117 HG1 THR 117 35.582 -1.870 -1.980 2055 1HG2 THR 117 1HG2 THR 117 38.922 -2.602 -2.500 2056 2HG2 THR 117 2HG2 THR 117 38.184 -4.119 -3.016 2057 3HG2 THR 117 3HG2 THR 117 38.977 -4.014 -1.444 2058 H GLN 118 H GLN 118 37.604 -6.130 -2.332 2059 HA GLN 118 HA GLN 118 37.634 -7.576 0.280 2060 1HB GLN 118 1HB GLN 118 37.039 -8.445 -2.189 2061 2HB GLN 118 2HB GLN 118 38.788 -8.660 -2.264 2062 1HG GLN 118 1HG GLN 118 38.222 -9.703 0.206 2063 2HG GLN 118 2HG GLN 118 36.772 -10.142 -0.696 2064 1HE2 GLN 118 1HE2 GLN 118 37.036 -11.567 -2.575 2065 2HE2 GLN 118 2HE2 GLN 118 38.461 -12.459 -2.805 2066 H ASN 119 H ASN 119 39.254 -6.032 1.177 2067 HA ASN 119 HA ASN 119 41.969 -6.980 0.810 2068 1HB ASN 119 1HB ASN 119 41.053 -5.171 -1.083 2069 2HB ASN 119 2HB ASN 119 41.873 -4.127 0.078 2070 1HD2 ASN 119 1HD2 ASN 119 42.438 -5.939 -2.678 2071 2HD2 ASN 119 2HD2 ASN 119 44.098 -6.231 -2.475 2072 1H GLY 201 1H GLY 201 36.442 23.085 3.706 2073 2H GLY 201 2H GLY 201 37.688 22.159 4.393 2074 3H GLY 201 3H GLY 201 38.061 23.418 3.316 2075 1HA GLY 201 1HA GLY 201 37.154 23.574 6.113 2076 2HA GLY 201 2HA GLY 201 38.516 24.385 5.342 2077 H LYS 202 H LYS 202 35.019 24.402 5.730 2078 HA LYS 202 HA LYS 202 35.010 27.229 4.737 2079 1HB LYS 202 1HB LYS 202 33.353 24.835 4.000 2080 2HB LYS 202 2HB LYS 202 32.587 26.423 3.970 2081 1HG LYS 202 1HG LYS 202 34.730 27.125 2.622 2082 2HG LYS 202 2HG LYS 202 34.877 25.394 2.317 2083 1HD LYS 202 1HD LYS 202 33.087 25.369 0.915 2084 2HD LYS 202 2HD LYS 202 32.155 26.464 1.936 2085 1HE LYS 202 1HE LYS 202 32.582 28.077 0.391 2086 2HE LYS 202 2HE LYS 202 34.271 28.030 0.929 2087 1HZ LYS 202 1HZ LYS 202 32.987 26.488 -1.251 2088 2HZ LYS 202 2HZ LYS 202 34.447 25.980 -0.549 2089 3HZ LYS 202 3HZ LYS 202 34.361 27.482 -1.336 2090 H ALA 203 H ALA 203 35.146 26.213 7.491 2091 HA ALA 203 HA ALA 203 32.680 26.076 8.848 2092 1HB ALA 203 1HB ALA 203 34.269 25.802 10.440 2093 2HB ALA 203 2HB ALA 203 34.514 27.549 10.433 2094 3HB ALA 203 3HB ALA 203 35.490 26.517 9.387 2095 HA PRO 204 HA PRO 204 33.089 30.960 9.336 2096 1HB PRO 204 1HB PRO 204 34.283 31.460 6.642 2097 2HB PRO 204 2HB PRO 204 34.580 32.300 8.174 2098 1HG PRO 204 1HG PRO 204 36.339 30.568 7.120 2099 2HG PRO 204 2HG PRO 204 36.128 30.762 8.865 2100 1HD PRO 204 1HD PRO 204 35.277 28.545 7.095 2101 2HD PRO 204 2HD PRO 204 35.689 28.526 8.821 2102 H ARG 205 H ARG 205 30.827 30.659 9.056 2103 HA ARG 205 HA ARG 205 28.749 30.769 7.938 2104 1HB ARG 205 1HB ARG 205 30.689 32.499 6.416 2105 2HB ARG 205 2HB ARG 205 29.047 32.303 5.802 2106 1HG ARG 205 1HG ARG 205 28.884 32.776 8.616 2107 2HG ARG 205 2HG ARG 205 29.949 33.998 7.920 2108 1HD ARG 205 1HD ARG 205 28.024 35.080 7.336 2109 2HD ARG 205 2HD ARG 205 27.866 33.842 6.076 2110 HE ARG 205 HE ARG 205 26.913 32.679 8.462 2111 1HH1 ARG 205 1HH1 ARG 205 26.119 35.361 6.390 2112 2HH1 ARG 205 2HH1 ARG 205 24.434 35.302 6.776 2113 1HH2 ARG 205 1HH2 ARG 205 24.722 32.622 8.947 2114 2HH2 ARG 205 2HH2 ARG 205 23.647 33.764 8.212 2115 H LYS 206 H LYS 206 28.951 28.399 7.446 2116 HA LYS 206 HA LYS 206 30.035 27.502 4.909 2117 1HB LYS 206 1HB LYS 206 29.332 26.359 7.268 2118 2HB LYS 206 2HB LYS 206 27.893 25.983 6.321 2119 1HG LYS 206 1HG LYS 206 29.174 24.837 4.661 2120 2HG LYS 206 2HG LYS 206 30.692 25.431 5.322 2121 1HD LYS 206 1HD LYS 206 30.758 23.461 6.447 2122 2HD LYS 206 2HD LYS 206 29.549 24.194 7.505 2123 1HE LYS 206 1HE LYS 206 28.069 22.616 6.834 2124 2HE LYS 206 2HE LYS 206 28.189 23.255 5.184 2125 1HZ LYS 206 1HZ LYS 206 30.344 21.986 5.036 2126 2HZ LYS 206 2HZ LYS 206 28.941 21.029 5.074 2127 3HZ LYS 206 3HZ LYS 206 29.895 21.194 6.469 2128 H GLN 207 H GLN 207 29.045 27.613 2.930 2129 HA GLN 207 HA GLN 207 26.590 28.965 2.462 2130 1HB GLN 207 1HB GLN 207 28.475 28.523 0.855 2131 2HB GLN 207 2HB GLN 207 27.966 26.836 0.781 2132 1HG GLN 207 1HG GLN 207 25.611 27.912 0.216 2133 2HG GLN 207 2HG GLN 207 26.601 29.280 -0.292 2134 1HE2 GLN 207 1HE2 GLN 207 28.842 27.987 -1.390 2135 2HE2 GLN 207 2HE2 GLN 207 28.365 27.048 -2.721 2136 H LEU 208 H LEU 208 24.476 28.259 2.479 2137 HA LEU 208 HA LEU 208 23.778 25.728 3.658 2138 1HB LEU 208 1HB LEU 208 22.287 27.899 2.154 2139 2HB LEU 208 2HB LEU 208 21.462 26.513 2.868 2140 HG LEU 208 HG LEU 208 23.318 28.295 4.460 2141 1HD1 LEU 208 1HD1 LEU 208 20.311 28.487 4.106 2142 2HD1 LEU 208 2HD1 LEU 208 21.501 29.694 3.617 2143 3HD1 LEU 208 3HD1 LEU 208 21.234 29.361 5.328 2144 1HD2 LEU 208 1HD2 LEU 208 22.255 25.820 5.007 2145 2HD2 LEU 208 2HD2 LEU 208 21.055 26.895 5.724 2146 3HD2 LEU 208 3HD2 LEU 208 22.742 26.993 6.231 2147 H ALA 209 H ALA 209 21.798 24.590 2.220 2148 HA ALA 209 HA ALA 209 22.559 24.186 -0.587 2149 1HB ALA 209 1HB ALA 209 23.005 21.698 -0.061 2150 2HB ALA 209 2HB ALA 209 23.128 22.195 1.626 2151 3HB ALA 209 3HB ALA 209 24.256 22.838 0.433 2152 H THR 210 H THR 210 20.834 23.283 -1.732 2153 HA THR 210 HA THR 210 18.428 22.526 -0.112 2154 HB THR 210 HB THR 210 17.365 23.159 -2.446 2155 HG1 THR 210 HG1 THR 210 18.626 24.339 -3.724 2156 1HG2 THR 210 1HG2 THR 210 18.006 24.603 -0.078 2157 2HG2 THR 210 2HG2 THR 210 16.701 24.925 -1.220 2158 3HG2 THR 210 3HG2 THR 210 18.275 25.689 -1.442 2159 H LYS 211 H LYS 211 20.402 20.547 -0.639 2160 HA LYS 211 HA LYS 211 19.817 19.043 -3.045 2161 1HB LYS 211 1HB LYS 211 21.913 19.021 -1.604 2162 2HB LYS 211 2HB LYS 211 20.997 18.105 -0.407 2163 1HG LYS 211 1HG LYS 211 20.511 16.392 -2.170 2164 2HG LYS 211 2HG LYS 211 21.568 17.278 -3.269 2165 1HD LYS 211 1HD LYS 211 23.100 17.009 -0.961 2166 2HD LYS 211 2HD LYS 211 22.264 15.461 -1.087 2167 1HE LYS 211 1HE LYS 211 23.419 14.863 -2.973 2168 2HE LYS 211 2HE LYS 211 23.362 16.506 -3.640 2169 1HZ LYS 211 1HZ LYS 211 25.611 15.732 -2.835 2170 2HZ LYS 211 2HZ LYS 211 24.981 15.782 -1.259 2171 3HZ LYS 211 3HZ LYS 211 25.069 17.204 -2.183 2172 H ALA 212 H ALA 212 17.424 18.944 -2.905 2173 HA ALA 212 HA ALA 212 16.354 17.177 -0.753 2174 1HB ALA 212 1HB ALA 212 14.807 18.847 -0.888 2175 2HB ALA 212 2HB ALA 212 14.267 18.058 -2.370 2176 3HB ALA 212 3HB ALA 212 15.422 19.389 -2.450 2177 H ALA 213 H ALA 213 16.780 15.058 -1.423 2178 HA ALA 213 HA ALA 213 15.665 14.275 -4.096 2179 1HB ALA 213 1HB ALA 213 18.118 14.346 -4.132 2180 2HB ALA 213 2HB ALA 213 17.591 12.663 -4.177 2181 3HB ALA 213 3HB ALA 213 18.192 13.359 -2.672 2182 H ARG 214 H ARG 214 14.952 11.993 -4.165 2183 HA ARG 214 HA ARG 214 14.096 11.009 -1.464 2184 1HB ARG 214 1HB ARG 214 12.915 10.741 -4.255 2185 2HB ARG 214 2HB ARG 214 12.240 9.965 -2.823 2186 1HG ARG 214 1HG ARG 214 11.199 11.869 -2.225 2187 2HG ARG 214 2HG ARG 214 12.720 12.760 -2.284 2188 1HD ARG 214 1HD ARG 214 12.179 12.441 -4.960 2189 2HD ARG 214 2HD ARG 214 10.550 12.627 -4.282 2190 HE ARG 214 HE ARG 214 12.611 14.685 -4.347 2191 1HH1 ARG 214 1HH1 ARG 214 9.908 13.418 -2.555 2192 2HH1 ARG 214 2HH1 ARG 214 9.556 14.934 -1.802 2193 1HH2 ARG 214 1HH2 ARG 214 12.134 16.642 -3.356 2194 2HH2 ARG 214 2HH2 ARG 214 10.805 16.746 -2.250 2195 1HN MLZ 215 1HN MLZ 215 13.305 8.429 -2.332 2196 HA MLZ 215 HA MLZ 215 15.812 7.009 -2.264 2197 1HB MLZ 215 1HB MLZ 215 12.999 6.108 -2.994 2198 2HB MLZ 215 2HB MLZ 215 14.315 5.052 -2.479 2199 1HG MLZ 215 1HG MLZ 215 12.709 7.007 -0.874 2200 2HG MLZ 215 2HG MLZ 215 14.382 6.708 -0.405 2201 1HD MLZ 215 1HD MLZ 215 12.964 4.230 -1.006 2202 2HD MLZ 215 2HD MLZ 215 13.869 4.676 0.440 2203 1HE MLZ 215 1HE MLZ 215 11.400 4.260 0.858 2204 2HE MLZ 215 2HE MLZ 215 11.063 5.688 -0.135 2205 HZ MLZ 215 HZ MLZ 215 11.324 6.729 1.852 2206 1HCM MLZ 215 1HCM MLZ 215 13.369 4.820 2.805 2207 2HCM MLZ 215 2HCM MLZ 215 11.645 4.472 2.935 2208 3HCM MLZ 215 3HCM MLZ 215 12.325 5.876 3.755 2209 H SER 216 H SER 216 17.044 6.241 -3.957 2210 HA SER 216 HA SER 216 17.750 5.849 -6.175 2211 1HB SER 216 1HB SER 216 15.888 7.835 -7.295 2212 2HB SER 216 2HB SER 216 16.754 8.424 -5.876 2213 HG SER 216 HG SER 216 17.998 8.822 -7.681 2214 H ALA 217 H ALA 217 16.736 5.507 -8.520 2215 HA ALA 217 HA ALA 217 14.484 3.613 -8.156 2216 1HB ALA 217 1HB ALA 217 13.936 5.172 -10.486 2217 2HB ALA 217 2HB ALA 217 14.262 6.295 -9.165 2218 3HB ALA 217 3HB ALA 217 12.988 5.087 -9.001 2219 HA PRO 218 HA PRO 218 17.337 1.499 -10.895 2220 1HB PRO 218 1HB PRO 218 14.986 -0.267 -11.376 2221 2HB PRO 218 2HB PRO 218 16.616 -0.693 -10.824 2222 1HG PRO 218 1HG PRO 218 14.496 -0.686 -9.177 2223 2HG PRO 218 2HG PRO 218 16.125 -0.267 -8.630 2224 1HD PRO 218 1HD PRO 218 13.790 1.495 -9.149 2225 2HD PRO 218 2HD PRO 218 15.109 1.675 -7.973 2226 H ALA 219 H ALA 219 17.454 1.134 -13.230 2227 HA ALA 219 HA ALA 219 15.466 2.776 -14.740 2228 1HB ALA 219 1HB ALA 219 18.347 2.382 -14.716 2229 2HB ALA 219 2HB ALA 219 17.414 3.646 -15.516 2230 3HB ALA 219 3HB ALA 219 17.700 2.110 -16.333 2231 H THR 220 H THR 220 16.698 -0.461 -14.366 2232 HA THR 220 HA THR 220 16.118 -1.609 -16.888 2233 HB THR 220 HB THR 220 17.312 -2.712 -15.033 2234 HG1 THR 220 HG1 THR 220 16.621 -4.389 -16.069 2235 1HG2 THR 220 1HG2 THR 220 15.798 -3.646 -13.161 2236 2HG2 THR 220 2HG2 THR 220 14.620 -2.445 -13.691 2237 3HG2 THR 220 3HG2 THR 220 16.197 -1.930 -13.093 2238 H GLY 221 H GLY 221 14.194 -3.531 -16.625 2239 1HA GLY 221 1HA GLY 221 11.889 -3.826 -16.962 2240 2HA GLY 221 2HA GLY 221 11.722 -2.884 -15.482 2241 1HN SAH 301 1HN SAH 301 -11.153 -0.283 -8.838 2242 2HN SAH 301 2HN SAH 301 -10.094 0.467 -9.940 2243 HA SAH 301 HA SAH 301 -10.445 2.589 -8.594 2244 1HB SAH 301 1HB SAH 301 -11.928 0.448 -7.153 2245 2HB SAH 301 2HB SAH 301 -10.997 1.550 -6.142 2246 1HG SAH 301 1HG SAH 301 -13.506 2.015 -7.510 2247 2HG SAH 301 2HG SAH 301 -12.291 3.174 -8.053 2248 1H5* SAH 301 1H5* SAH 301 -15.000 2.673 -6.106 2249 2H5* SAH 301 2H5* SAH 301 -14.926 3.838 -4.786 2250 H4* SAH 301 H4* SAH 301 -14.093 5.381 -6.765 2251 H3* SAH 301 H3* SAH 301 -16.527 4.904 -5.290 2252 *HO3 SAH 301 *HO3 SAH 301 -16.745 7.224 -6.010 2253 H2* SAH 301 H2* SAH 301 -18.062 4.676 -6.900 2254 *HO2 SAH 301 *HO2 SAH 301 -18.033 6.955 -7.078 2255 H1* SAH 301 H1* SAH 301 -16.539 4.947 -9.317 2256 H8 SAH 301 H8 SAH 301 -16.540 1.844 -7.053 2257 1HN6 SAH 301 1HN6 SAH 301 -21.133 -0.297 -10.207 2258 2HN6 SAH 301 2HN6 SAH 301 -20.991 0.012 -8.491 2259 H2 SAH 301 H2 SAH 301 -20.328 3.989 -11.736 2260 1HN SAH 302 1HN SAH 302 11.413 -0.274 8.907 2261 2HN SAH 302 2HN SAH 302 10.382 0.459 10.040 2262 HA SAH 302 HA SAH 302 10.673 2.589 8.692 2263 1HB SAH 302 1HB SAH 302 12.139 0.464 7.206 2264 2HB SAH 302 2HB SAH 302 11.173 1.563 6.224 2265 1HG SAH 302 1HG SAH 302 13.712 2.046 7.526 2266 2HG SAH 302 2HG SAH 302 12.503 3.190 8.107 2267 1H5* SAH 302 1H5* SAH 302 15.162 2.718 6.083 2268 2H5* SAH 302 2H5* SAH 302 15.042 3.889 4.770 2269 H4* SAH 302 H4* SAH 302 14.252 5.416 6.778 2270 H3* SAH 302 H3* SAH 302 16.648 4.965 5.235 2271 *HO3 SAH 302 *HO3 SAH 302 16.868 7.283 5.959 2272 H2* SAH 302 H2* SAH 302 18.229 4.743 6.803 2273 *HO2 SAH 302 *HO2 SAH 302 18.186 7.021 6.990 2274 H1* SAH 302 H1* SAH 302 16.770 4.992 9.260 2275 H8 SAH 302 H8 SAH 302 16.733 1.897 6.982 2276 1HN6 SAH 302 1HN6 SAH 302 21.428 -0.218 10.004 2277 2HN6 SAH 302 2HN6 SAH 302 21.237 0.097 8.294 2278 H2 SAH 302 H2 SAH 302 20.631 4.055 11.571 Start of MODEL 6 1 1H MET 1 1H MET 1 0.347 -12.620 -6.053 2 2H MET 1 2H MET 1 0.090 -12.289 -4.407 3 3H MET 1 3H MET 1 0.661 -11.068 -5.440 4 HA MET 1 HA MET 1 -1.657 -10.668 -5.043 5 1HB MET 1 1HB MET 1 -0.540 -11.589 -7.651 6 2HB MET 1 2HB MET 1 -2.277 -11.295 -7.604 7 1HG MET 1 1HG MET 1 -0.213 -9.305 -6.623 8 2HG MET 1 2HG MET 1 -0.893 -9.279 -8.250 9 1HE MET 1 1HE MET 1 -1.584 -7.314 -4.858 10 2HE MET 1 2HE MET 1 -2.160 -6.328 -6.202 11 3HE MET 1 3HE MET 1 -0.637 -7.206 -6.342 12 H PHE 2 H PHE 2 -2.090 -13.314 -7.339 13 HA PHE 2 HA PHE 2 -4.459 -14.326 -6.188 14 1HB PHE 2 1HB PHE 2 -3.782 -16.412 -7.527 15 2HB PHE 2 2HB PHE 2 -3.821 -14.902 -8.434 16 HD1 PHE 2 HD1 PHE 2 -1.913 -14.153 -9.584 17 HD2 PHE 2 HD2 PHE 2 -1.497 -17.126 -6.511 18 HE1 PHE 2 HE1 PHE 2 0.478 -14.430 -10.177 19 HE2 PHE 2 HE2 PHE 2 0.896 -17.403 -7.105 20 HZ PHE 2 HZ PHE 2 1.882 -16.052 -8.938 21 H ASN 3 H ASN 3 -4.871 -15.944 -4.658 22 HA ASN 3 HA ASN 3 -2.561 -17.331 -3.387 23 1HB ASN 3 1HB ASN 3 -3.175 -15.063 -2.305 24 2HB ASN 3 2HB ASN 3 -4.664 -15.851 -1.784 25 1HD2 ASN 3 1HD2 ASN 3 -3.617 -15.368 0.454 26 2HD2 ASN 3 2HD2 ASN 3 -2.558 -16.541 1.076 27 H ASP 4 H ASP 4 -3.324 -19.124 -1.964 28 HA ASP 4 HA ASP 4 -5.463 -20.642 -3.157 29 1HB ASP 4 1HB ASP 4 -3.727 -20.845 -0.688 30 2HB ASP 4 2HB ASP 4 -4.964 -22.056 -1.028 31 H ARG 5 H ARG 5 -6.921 -18.530 -2.707 32 HA ARG 5 HA ARG 5 -9.003 -19.279 -0.904 33 1HB ARG 5 1HB ARG 5 -6.706 -17.878 0.216 34 2HB ARG 5 2HB ARG 5 -8.177 -16.927 0.425 35 1HG ARG 5 1HG ARG 5 -9.103 -19.390 1.094 36 2HG ARG 5 2HG ARG 5 -7.424 -19.539 1.616 37 1HD ARG 5 1HD ARG 5 -7.761 -17.272 2.797 38 2HD ARG 5 2HD ARG 5 -9.496 -17.531 2.535 39 HE ARG 5 HE ARG 5 -8.376 -19.939 3.576 40 1HH1 ARG 5 1HH1 ARG 5 -9.055 -16.662 4.537 41 2HH1 ARG 5 2HH1 ARG 5 -9.259 -17.077 6.204 42 1HH2 ARG 5 1HH2 ARG 5 -8.645 -20.451 5.746 43 2HH2 ARG 5 2HH2 ARG 5 -9.029 -19.204 6.885 44 H VAL 6 H VAL 6 -7.271 -16.639 -2.503 45 HA VAL 6 HA VAL 6 -9.790 -15.708 -3.737 46 HB VAL 6 HB VAL 6 -9.347 -13.368 -2.874 47 1HG1 VAL 6 1HG1 VAL 6 -10.921 -15.158 -1.824 48 2HG1 VAL 6 2HG1 VAL 6 -10.530 -13.723 -0.877 49 3HG1 VAL 6 3HG1 VAL 6 -9.705 -15.247 -0.549 50 1HG2 VAL 6 1HG2 VAL 6 -7.676 -12.914 -1.360 51 2HG2 VAL 6 2HG2 VAL 6 -6.901 -14.245 -2.219 52 3HG2 VAL 6 3HG2 VAL 6 -7.708 -14.539 -0.678 53 H ILE 7 H ILE 7 -9.118 -13.601 -5.099 54 HA ILE 7 HA ILE 7 -6.313 -13.633 -5.998 55 HB ILE 7 HB ILE 7 -7.217 -15.569 -7.157 56 1HG1 ILE 7 1HG1 ILE 7 -7.268 -13.235 -9.090 57 2HG1 ILE 7 2HG1 ILE 7 -5.790 -13.966 -8.465 58 1HG2 ILE 7 1HG2 ILE 7 -9.528 -15.441 -7.131 59 2HG2 ILE 7 2HG2 ILE 7 -9.213 -14.966 -8.803 60 3HG2 ILE 7 3HG2 ILE 7 -9.541 -13.733 -7.586 61 1HD1 ILE 7 1HD1 ILE 7 -7.226 -14.799 -10.718 62 2HD1 ILE 7 2HD1 ILE 7 -7.630 -15.984 -9.476 63 3HD1 ILE 7 3HD1 ILE 7 -5.944 -15.697 -9.906 64 H VAL 8 H VAL 8 -6.020 -11.974 -7.796 65 HA VAL 8 HA VAL 8 -7.960 -9.737 -7.375 66 HB VAL 8 HB VAL 8 -5.659 -9.360 -6.625 67 1HG1 VAL 8 1HG1 VAL 8 -5.077 -10.748 -9.130 68 2HG1 VAL 8 2HG1 VAL 8 -4.059 -10.532 -7.707 69 3HG1 VAL 8 3HG1 VAL 8 -4.122 -9.278 -8.944 70 1HG2 VAL 8 1HG2 VAL 8 -5.377 -7.273 -7.606 71 2HG2 VAL 8 2HG2 VAL 8 -7.046 -7.614 -8.063 72 3HG2 VAL 8 3HG2 VAL 8 -5.744 -7.870 -9.225 73 H LYS 9 H LYS 9 -8.806 -8.654 -9.152 74 HA LYS 9 HA LYS 9 -8.037 -9.569 -11.880 75 1HB LYS 9 1HB LYS 9 -10.819 -9.466 -10.669 76 2HB LYS 9 2HB LYS 9 -10.477 -9.827 -12.360 77 1HG LYS 9 1HG LYS 9 -8.819 -11.605 -11.171 78 2HG LYS 9 2HG LYS 9 -10.087 -11.519 -9.949 79 1HD LYS 9 1HD LYS 9 -11.487 -12.731 -11.235 80 2HD LYS 9 2HD LYS 9 -11.242 -11.649 -12.605 81 1HE LYS 9 1HE LYS 9 -8.986 -12.878 -12.935 82 2HE LYS 9 2HE LYS 9 -9.655 -14.112 -11.851 83 1HZ LYS 9 1HZ LYS 9 -10.715 -13.163 -14.450 84 2HZ LYS 9 2HZ LYS 9 -11.721 -13.937 -13.321 85 3HZ LYS 9 3HZ LYS 9 -10.380 -14.757 -13.966 86 H LYS 10 H LYS 10 -8.762 -6.185 -12.922 87 HA LYS 10 HA LYS 10 -7.951 -7.385 -14.740 88 1HB LYS 10 1HB LYS 10 -6.572 -8.229 -12.312 89 2HB LYS 10 2HB LYS 10 -6.552 -9.490 -13.544 90 1HG LYS 10 1HG LYS 10 -5.878 -6.627 -14.218 91 2HG LYS 10 2HG LYS 10 -4.652 -7.737 -13.606 92 1HD LYS 10 1HD LYS 10 -4.753 -9.100 -15.494 93 2HD LYS 10 2HD LYS 10 -6.398 -8.602 -15.890 94 1HE LYS 10 1HE LYS 10 -4.368 -6.432 -15.931 95 2HE LYS 10 2HE LYS 10 -4.223 -7.652 -17.211 96 1HZ LYS 10 1HZ LYS 10 -5.795 -5.868 -17.800 97 2HZ LYS 10 2HZ LYS 10 -6.741 -6.260 -16.446 98 3HZ LYS 10 3HZ LYS 10 -6.560 -7.381 -17.708 99 H SER 11 H SER 11 -10.505 -7.974 -14.497 100 HA SER 11 HA SER 11 -10.801 -10.943 -14.358 101 1HB SER 11 1HB SER 11 -13.147 -9.158 -14.748 102 2HB SER 11 2HB SER 11 -12.933 -10.485 -13.610 103 HG SER 11 HG SER 11 -12.836 -7.954 -13.069 104 HA PRO 12 HA PRO 12 -11.828 -11.592 -18.596 105 1HB PRO 12 1HB PRO 12 -14.780 -11.429 -18.192 106 2HB PRO 12 2HB PRO 12 -13.813 -12.742 -18.888 107 1HG PRO 12 1HG PRO 12 -14.890 -12.888 -16.431 108 2HG PRO 12 2HG PRO 12 -13.354 -13.659 -16.844 109 1HD PRO 12 1HD PRO 12 -13.874 -11.231 -15.227 110 2HD PRO 12 2HD PRO 12 -12.543 -12.402 -15.122 111 H LEU 13 H LEU 13 -14.203 -9.279 -17.228 112 HA LEU 13 HA LEU 13 -13.317 -7.220 -19.153 113 1HB LEU 13 1HB LEU 13 -15.307 -8.978 -19.873 114 2HB LEU 13 2HB LEU 13 -16.242 -7.662 -19.171 115 HG LEU 13 HG LEU 13 -14.695 -6.132 -20.632 116 1HD1 LEU 13 1HD1 LEU 13 -13.230 -7.207 -21.959 117 2HD1 LEU 13 2HD1 LEU 13 -14.576 -8.000 -22.775 118 3HD1 LEU 13 3HD1 LEU 13 -13.820 -8.763 -21.376 119 1HD2 LEU 13 1HD2 LEU 13 -16.918 -7.888 -21.705 120 2HD2 LEU 13 2HD2 LEU 13 -16.260 -6.516 -22.598 121 3HD2 LEU 13 3HD2 LEU 13 -17.059 -6.258 -21.047 122 H GLY 14 H GLY 14 -13.479 -7.583 -16.180 123 1HA GLY 14 1HA GLY 14 -15.512 -5.520 -15.498 124 2HA GLY 14 2HA GLY 14 -14.741 -6.599 -14.335 125 H GLY 15 H GLY 15 -14.114 -4.717 -13.070 126 1HA GLY 15 1HA GLY 15 -12.038 -2.990 -14.335 127 2HA GLY 15 2HA GLY 15 -12.906 -2.602 -12.849 128 H TYR 16 H TYR 16 -11.010 -2.376 -11.569 129 HA TYR 16 HA TYR 16 -9.288 -4.809 -11.323 130 1HB TYR 16 1HB TYR 16 -8.961 -1.874 -11.101 131 2HB TYR 16 2HB TYR 16 -8.087 -2.801 -9.885 132 HD1 TYR 16 HD1 TYR 16 -5.887 -3.265 -10.461 133 HD2 TYR 16 HD2 TYR 16 -8.885 -3.217 -13.536 134 HE1 TYR 16 HE1 TYR 16 -4.168 -3.865 -12.145 135 HE2 TYR 16 HE2 TYR 16 -7.167 -3.818 -15.220 136 HH TYR 16 HH TYR 16 -4.120 -4.979 -14.403 137 H GLY 17 H GLY 17 -11.084 -5.813 -9.993 138 1HA GLY 17 1HA GLY 17 -11.083 -4.754 -7.194 139 2HA GLY 17 2HA GLY 17 -12.441 -5.640 -7.888 140 H VAL 18 H VAL 18 -12.043 -7.102 -5.930 141 HA VAL 18 HA VAL 18 -9.805 -9.012 -6.567 142 HB VAL 18 HB VAL 18 -9.302 -7.977 -4.481 143 1HG1 VAL 18 1HG1 VAL 18 -12.220 -8.332 -3.761 144 2HG1 VAL 18 2HG1 VAL 18 -11.407 -6.812 -4.119 145 3HG1 VAL 18 3HG1 VAL 18 -10.983 -7.718 -2.667 146 1HG2 VAL 18 1HG2 VAL 18 -9.621 -9.752 -2.799 147 2HG2 VAL 18 2HG2 VAL 18 -9.171 -10.437 -4.361 148 3HG2 VAL 18 3HG2 VAL 18 -10.848 -10.502 -3.820 149 H PHE 19 H PHE 19 -10.481 -11.065 -7.061 150 HA PHE 19 HA PHE 19 -13.382 -11.609 -7.029 151 1HB PHE 19 1HB PHE 19 -10.974 -12.410 -8.469 152 2HB PHE 19 2HB PHE 19 -11.954 -13.808 -8.033 153 HD1 PHE 19 HD1 PHE 19 -12.687 -10.279 -9.108 154 HD2 PHE 19 HD2 PHE 19 -13.377 -14.471 -9.745 155 HE1 PHE 19 HE1 PHE 19 -14.270 -9.741 -10.940 156 HE2 PHE 19 HE2 PHE 19 -14.960 -13.932 -11.576 157 HZ PHE 19 HZ PHE 19 -15.406 -11.567 -12.175 158 H ALA 20 H ALA 20 -14.236 -13.619 -6.145 159 HA ALA 20 HA ALA 20 -12.725 -14.546 -3.737 160 1HB ALA 20 1HB ALA 20 -15.365 -13.644 -4.234 161 2HB ALA 20 2HB ALA 20 -14.739 -14.309 -2.725 162 3HB ALA 20 3HB ALA 20 -15.498 -15.372 -3.910 163 H ARG 21 H ARG 21 -11.488 -16.236 -4.655 164 HA ARG 21 HA ARG 21 -12.565 -18.215 -6.476 165 1HB ARG 21 1HB ARG 21 -10.138 -17.436 -5.960 166 2HB ARG 21 2HB ARG 21 -10.221 -18.546 -4.598 167 1HG ARG 21 1HG ARG 21 -10.516 -20.429 -6.010 168 2HG ARG 21 2HG ARG 21 -10.936 -19.424 -7.395 169 1HD ARG 21 1HD ARG 21 -8.480 -18.434 -6.930 170 2HD ARG 21 2HD ARG 21 -8.242 -20.067 -6.277 171 HE ARG 21 HE ARG 21 -8.727 -19.393 -9.083 172 1HH1 ARG 21 1HH1 ARG 21 -9.057 -21.809 -6.599 173 2HH1 ARG 21 2HH1 ARG 21 -9.113 -23.119 -7.727 174 1HH2 ARG 21 1HH2 ARG 21 -8.802 -21.111 -10.527 175 2HH2 ARG 21 2HH2 ARG 21 -8.970 -22.729 -9.934 176 H LYS 22 H LYS 22 -12.738 -17.749 -3.045 177 HA LYS 22 HA LYS 22 -13.488 -20.586 -2.538 178 1HB LYS 22 1HB LYS 22 -13.101 -18.153 -0.745 179 2HB LYS 22 2HB LYS 22 -13.355 -19.799 -0.172 180 1HG LYS 22 1HG LYS 22 -11.148 -19.364 -2.127 181 2HG LYS 22 2HG LYS 22 -10.899 -18.781 -0.481 182 1HD LYS 22 1HD LYS 22 -11.929 -21.569 -0.995 183 2HD LYS 22 2HD LYS 22 -10.201 -21.222 -1.024 184 1HE LYS 22 1HE LYS 22 -10.197 -21.403 1.235 185 2HE LYS 22 2HE LYS 22 -11.224 -19.959 1.302 186 1HZ LYS 22 1HZ LYS 22 -12.049 -22.801 1.125 187 2HZ LYS 22 2HZ LYS 22 -13.106 -21.541 0.703 188 3HZ LYS 22 3HZ LYS 22 -12.502 -21.648 2.286 189 H SER 23 H SER 23 -16.889 -19.703 -1.385 190 HA SER 23 HA SER 23 -14.423 -21.317 -0.856 191 1HB SER 23 1HB SER 23 -16.418 -22.475 -1.739 192 2HB SER 23 2HB SER 23 -16.106 -22.986 -0.080 193 HG SER 23 HG SER 23 -17.892 -22.077 0.542 194 H PHE 24 H PHE 24 -16.733 -19.127 0.572 195 HA PHE 24 HA PHE 24 -15.387 -19.507 3.231 196 1HB PHE 24 1HB PHE 24 -16.568 -17.119 1.779 197 2HB PHE 24 2HB PHE 24 -16.098 -17.058 3.477 198 HD1 PHE 24 HD1 PHE 24 -13.673 -18.654 3.597 199 HD2 PHE 24 HD2 PHE 24 -14.972 -15.907 0.561 200 HE1 PHE 24 HE1 PHE 24 -11.314 -18.274 2.931 201 HE2 PHE 24 HE2 PHE 24 -12.614 -15.527 -0.105 202 HZ PHE 24 HZ PHE 24 -10.785 -16.711 1.080 203 H GLU 25 H GLU 25 -16.749 -19.308 5.126 204 HA GLU 25 HA GLU 25 -19.508 -20.250 4.688 205 1HB GLU 25 1HB GLU 25 -17.453 -20.195 6.798 206 2HB GLU 25 2HB GLU 25 -19.079 -19.914 7.408 207 1HG GLU 25 1HG GLU 25 -19.563 -21.966 5.707 208 2HG GLU 25 2HG GLU 25 -17.920 -22.342 6.209 209 H LYS 26 H LYS 26 -18.512 -17.979 7.234 210 HA LYS 26 HA LYS 26 -19.722 -15.643 6.085 211 1HB LYS 26 1HB LYS 26 -21.726 -17.144 6.362 212 2HB LYS 26 2HB LYS 26 -21.433 -17.153 8.091 213 1HG LYS 26 1HG LYS 26 -21.495 -14.568 7.920 214 2HG LYS 26 2HG LYS 26 -22.225 -14.834 6.336 215 1HD LYS 26 1HD LYS 26 -23.854 -16.422 7.595 216 2HD LYS 26 2HD LYS 26 -23.297 -15.592 9.049 217 1HE LYS 26 1HE LYS 26 -23.801 -13.435 7.506 218 2HE LYS 26 2HE LYS 26 -24.980 -14.565 6.813 219 1HZ LYS 26 1HZ LYS 26 -25.692 -15.105 9.086 220 2HZ LYS 26 2HZ LYS 26 -25.930 -13.461 8.734 221 3HZ LYS 26 3HZ LYS 26 -24.620 -13.941 9.702 222 H GLY 27 H GLY 27 -17.863 -14.693 7.065 223 1HA GLY 27 1HA GLY 27 -17.515 -13.165 9.024 224 2HA GLY 27 2HA GLY 27 -17.990 -14.518 10.049 225 H GLU 28 H GLU 28 -16.036 -15.286 7.295 226 HA GLU 28 HA GLU 28 -13.778 -15.933 9.121 227 1HB GLU 28 1HB GLU 28 -14.417 -16.660 6.234 228 2HB GLU 28 2HB GLU 28 -13.072 -17.314 7.167 229 1HG GLU 28 1HG GLU 28 -14.629 -18.288 8.786 230 2HG GLU 28 2HG GLU 28 -15.996 -17.572 7.932 231 H LEU 29 H LEU 29 -11.620 -15.235 8.602 232 HA LEU 29 HA LEU 29 -11.467 -12.579 7.404 233 1HB LEU 29 1HB LEU 29 -10.196 -13.700 9.409 234 2HB LEU 29 2HB LEU 29 -9.142 -14.354 8.156 235 HG LEU 29 HG LEU 29 -8.269 -12.219 9.055 236 1HD1 LEU 29 1HD1 LEU 29 -7.662 -11.342 6.976 237 2HD1 LEU 29 2HD1 LEU 29 -9.263 -11.609 6.286 238 3HD1 LEU 29 3HD1 LEU 29 -8.174 -12.973 6.541 239 1HD2 LEU 29 1HD2 LEU 29 -10.144 -10.436 7.790 240 2HD2 LEU 29 2HD2 LEU 29 -9.645 -10.490 9.480 241 3HD2 LEU 29 3HD2 LEU 29 -11.000 -11.474 8.929 242 H VAL 30 H VAL 30 -11.211 -12.245 5.244 243 HA VAL 30 HA VAL 30 -10.421 -14.447 3.460 244 HB VAL 30 HB VAL 30 -11.157 -11.522 3.066 245 1HG1 VAL 30 1HG1 VAL 30 -11.625 -12.579 0.665 246 2HG1 VAL 30 2HG1 VAL 30 -10.342 -13.682 1.163 247 3HG1 VAL 30 3HG1 VAL 30 -10.033 -11.947 1.087 248 1HG2 VAL 30 1HG2 VAL 30 -12.685 -14.123 2.779 249 2HG2 VAL 30 2HG2 VAL 30 -13.274 -12.576 2.171 250 3HG2 VAL 30 3HG2 VAL 30 -13.022 -12.805 3.902 251 H GLU 31 H GLU 31 -9.156 -11.214 4.331 252 HA GLU 31 HA GLU 31 -6.401 -12.060 4.168 253 1HB GLU 31 1HB GLU 31 -7.756 -11.534 1.729 254 2HB GLU 31 2HB GLU 31 -6.690 -10.157 2.004 255 1HG GLU 31 1HG GLU 31 -5.739 -13.015 2.278 256 2HG GLU 31 2HG GLU 31 -5.666 -12.140 0.748 257 H GLU 32 H GLU 32 -5.040 -10.422 4.996 258 HA GLU 32 HA GLU 32 -6.345 -7.777 5.549 259 1HB GLU 32 1HB GLU 32 -5.209 -7.908 7.767 260 2HB GLU 32 2HB GLU 32 -6.322 -9.256 7.525 261 1HG GLU 32 1HG GLU 32 -4.519 -10.749 6.975 262 2HG GLU 32 2HG GLU 32 -3.365 -9.418 6.892 263 H CYS 33 H CYS 33 -4.913 -5.973 5.518 264 HA CYS 33 HA CYS 33 -2.074 -6.503 4.761 265 1HB CYS 33 1HB CYS 33 -4.036 -4.687 3.307 266 2HB CYS 33 2HB CYS 33 -2.343 -4.922 2.875 267 HG CYS 33 HG CYS 33 -3.455 -6.654 1.404 268 H LEU 34 H LEU 34 -1.605 -3.692 4.171 269 HA LEU 34 HA LEU 34 -1.828 -2.594 6.949 270 1HB LEU 34 1HB LEU 34 0.289 -2.956 5.055 271 2HB LEU 34 2HB LEU 34 0.060 -1.223 5.274 272 HG LEU 34 HG LEU 34 0.166 -1.549 7.739 273 1HD1 LEU 34 1HD1 LEU 34 0.520 -4.406 6.851 274 2HD1 LEU 34 2HD1 LEU 34 -0.518 -3.765 8.125 275 3HD1 LEU 34 3HD1 LEU 34 1.226 -3.858 8.371 276 1HD2 LEU 34 1HD2 LEU 34 2.485 -2.554 6.071 277 2HD2 LEU 34 2HD2 LEU 34 2.622 -2.195 7.792 278 3HD2 LEU 34 3HD2 LEU 34 2.213 -0.912 6.654 279 H CYS 35 H CYS 35 -1.687 -0.066 6.862 280 HA CYS 35 HA CYS 35 -3.145 1.099 4.550 281 1HB CYS 35 1HB CYS 35 -4.112 0.783 7.387 282 2HB CYS 35 2HB CYS 35 -4.652 2.167 6.438 283 HG CYS 35 HG CYS 35 -6.362 0.389 5.811 284 H ILE 36 H ILE 36 -3.159 3.543 4.746 285 HA ILE 36 HA ILE 36 -0.700 4.434 6.224 286 HB ILE 36 HB ILE 36 -2.153 5.728 3.892 287 1HG1 ILE 36 1HG1 ILE 36 0.214 3.822 3.918 288 2HG1 ILE 36 2HG1 ILE 36 -1.371 3.519 3.209 289 1HG2 ILE 36 1HG2 ILE 36 -0.053 6.967 3.621 290 2HG2 ILE 36 2HG2 ILE 36 0.658 6.089 4.976 291 3HG2 ILE 36 3HG2 ILE 36 -0.683 7.202 5.252 292 1HD1 ILE 36 1HD1 ILE 36 -0.283 5.999 2.183 293 2HD1 ILE 36 2HD1 ILE 36 -0.784 4.559 1.299 294 3HD1 ILE 36 3HD1 ILE 36 0.858 4.678 1.930 295 H VAL 37 H VAL 37 -0.865 6.184 7.653 296 HA VAL 37 HA VAL 37 -3.642 7.224 8.116 297 HB VAL 37 HB VAL 37 -1.298 6.803 10.005 298 1HG1 VAL 37 1HG1 VAL 37 -3.252 7.088 11.700 299 2HG1 VAL 37 2HG1 VAL 37 -4.086 7.882 10.364 300 3HG1 VAL 37 3HG1 VAL 37 -2.563 8.537 10.967 301 1HG2 VAL 37 1HG2 VAL 37 -3.152 5.118 10.906 302 2HG2 VAL 37 2HG2 VAL 37 -2.037 4.644 9.624 303 3HG2 VAL 37 3HG2 VAL 37 -3.673 5.167 9.221 304 H ARG 38 H ARG 38 -3.834 9.359 7.593 305 HA ARG 38 HA ARG 38 -1.617 11.222 8.253 306 1HB ARG 38 1HB ARG 38 -1.263 10.361 5.941 307 2HB ARG 38 2HB ARG 38 -2.878 10.920 5.507 308 1HG ARG 38 1HG ARG 38 -1.147 12.553 4.824 309 2HG ARG 38 2HG ARG 38 -2.232 13.236 6.036 310 1HD ARG 38 1HD ARG 38 -0.608 13.005 7.770 311 2HD ARG 38 2HD ARG 38 0.391 11.916 6.790 312 HE ARG 38 HE ARG 38 -0.010 14.425 5.423 313 1HH1 ARG 38 1HH1 ARG 38 1.756 12.938 8.028 314 2HH1 ARG 38 2HH1 ARG 38 3.074 14.052 7.916 315 1HH2 ARG 38 1HH2 ARG 38 1.712 15.859 5.297 316 2HH2 ARG 38 2HH2 ARG 38 3.051 15.694 6.383 317 H HIS 39 H HIS 39 -2.392 13.303 8.736 318 HA HIS 39 HA HIS 39 -5.095 13.681 9.489 319 1HB HIS 39 1HB HIS 39 -2.930 15.658 8.681 320 2HB HIS 39 2HB HIS 39 -4.385 16.081 9.584 321 HD1 HIS 39 HD1 HIS 39 -1.216 16.021 10.535 322 HD2 HIS 39 HD2 HIS 39 -4.302 13.460 11.676 323 HE1 HIS 39 HE1 HIS 39 -0.529 15.015 12.757 324 H ASN 40 H ASN 40 -6.093 15.971 8.397 325 HA ASN 40 HA ASN 40 -6.652 15.148 5.577 326 1HB ASN 40 1HB ASN 40 -8.144 16.414 7.834 327 2HB ASN 40 2HB ASN 40 -8.596 16.904 6.201 328 1HD2 ASN 40 1HD2 ASN 40 -9.832 15.434 4.959 329 2HD2 ASN 40 2HD2 ASN 40 -10.238 13.869 5.477 330 H ASP 41 H ASP 41 -5.136 16.274 4.351 331 HA ASP 41 HA ASP 41 -5.476 19.171 4.102 332 1HB ASP 41 1HB ASP 41 -3.090 19.579 4.674 333 2HB ASP 41 2HB ASP 41 -3.958 18.895 6.040 334 H ASP 42 H ASP 42 -2.549 19.016 2.913 335 HA ASP 42 HA ASP 42 -3.160 18.626 0.193 336 1HB ASP 42 1HB ASP 42 -0.653 18.277 1.862 337 2HB ASP 42 2HB ASP 42 -0.623 18.136 0.104 338 H TRP 43 H TRP 43 -2.576 16.294 2.722 339 HA TRP 43 HA TRP 43 -1.944 13.964 1.218 340 1HB TRP 43 1HB TRP 43 -1.749 13.956 3.596 341 2HB TRP 43 2HB TRP 43 -3.374 14.595 3.814 342 HD1 TRP 43 HD1 TRP 43 -5.189 12.905 4.353 343 HE1 TRP 43 HE1 TRP 43 -5.404 10.336 4.235 344 HE3 TRP 43 HE3 TRP 43 -0.784 11.750 2.037 345 HZ2 TRP 43 HZ2 TRP 43 -3.906 8.094 3.287 346 HZ3 TRP 43 HZ3 TRP 43 -0.209 9.393 1.538 347 HH2 TRP 43 HH2 TRP 43 -1.761 7.564 2.160 348 H GLY 44 H GLY 44 -5.159 15.049 2.402 349 1HA GLY 44 1HA GLY 44 -6.692 13.115 1.014 350 2HA GLY 44 2HA GLY 44 -7.301 14.694 1.513 351 H THR 45 H THR 45 -5.360 16.208 -0.061 352 HA THR 45 HA THR 45 -6.797 16.304 -2.570 353 HB THR 45 HB THR 45 -4.121 17.496 -1.752 354 HG1 THR 45 HG1 THR 45 -5.311 18.527 -0.385 355 1HG2 THR 45 1HG2 THR 45 -6.003 17.887 -4.031 356 2HG2 THR 45 2HG2 THR 45 -4.246 18.036 -3.987 357 3HG2 THR 45 3HG2 THR 45 -5.258 19.333 -3.349 358 H ALA 46 H ALA 46 -3.278 15.781 -2.105 359 HA ALA 46 HA ALA 46 -2.719 14.725 -4.646 360 1HB ALA 46 1HB ALA 46 -0.873 15.232 -3.304 361 2HB ALA 46 2HB ALA 46 -0.895 13.474 -3.164 362 3HB ALA 46 3HB ALA 46 -1.576 14.469 -1.878 363 H LEU 47 H LEU 47 -3.463 12.868 -1.667 364 HA LEU 47 HA LEU 47 -3.746 10.389 -3.255 365 1HB LEU 47 1HB LEU 47 -3.699 11.201 -0.350 366 2HB LEU 47 2HB LEU 47 -4.286 9.599 -0.796 367 HG LEU 47 HG LEU 47 -1.880 9.528 -0.285 368 1HD1 LEU 47 1HD1 LEU 47 -1.850 9.279 -3.243 369 2HD1 LEU 47 2HD1 LEU 47 -3.102 8.367 -2.399 370 3HD1 LEU 47 3HD1 LEU 47 -1.403 8.101 -2.009 371 1HD2 LEU 47 1HD2 LEU 47 -0.292 10.883 -1.337 372 2HD2 LEU 47 2HD2 LEU 47 -1.644 11.996 -1.131 373 3HD2 LEU 47 3HD2 LEU 47 -1.355 11.239 -2.698 374 H GLU 48 H GLU 48 -5.731 12.447 -3.809 375 HA GLU 48 HA GLU 48 -8.165 11.992 -2.335 376 1HB GLU 48 1HB GLU 48 -9.137 13.184 -4.321 377 2HB GLU 48 2HB GLU 48 -7.710 13.995 -3.674 378 1HG GLU 48 1HG GLU 48 -6.790 13.866 -5.726 379 2HG GLU 48 2HG GLU 48 -6.733 12.115 -5.530 380 H ASP 49 H ASP 49 -7.546 9.441 -2.587 381 HA ASP 49 HA ASP 49 -9.659 8.239 -4.101 382 1HB ASP 49 1HB ASP 49 -7.465 9.039 -5.636 383 2HB ASP 49 2HB ASP 49 -7.177 7.320 -5.369 384 H TYR 50 H TYR 50 -9.934 6.127 -3.377 385 HA TYR 50 HA TYR 50 -9.533 4.151 -2.148 386 1HB TYR 50 1HB TYR 50 -6.584 4.742 -2.483 387 2HB TYR 50 2HB TYR 50 -7.392 3.179 -2.481 388 HD1 TYR 50 HD1 TYR 50 -5.811 5.484 -4.532 389 HD2 TYR 50 HD2 TYR 50 -9.347 3.042 -4.414 390 HE1 TYR 50 HE1 TYR 50 -5.962 5.580 -7.004 391 HE2 TYR 50 HE2 TYR 50 -9.495 3.141 -6.884 392 HH TYR 50 HH TYR 50 -7.762 3.526 -8.817 393 H LEU 51 H LEU 51 -9.646 6.786 -0.748 394 HA LEU 51 HA LEU 51 -7.795 6.283 1.548 395 1HB LEU 51 1HB LEU 51 -9.355 8.660 0.504 396 2HB LEU 51 2HB LEU 51 -8.681 8.662 2.130 397 HG LEU 51 HG LEU 51 -7.167 8.442 -0.488 398 1HD1 LEU 51 1HD1 LEU 51 -5.981 10.432 0.749 399 2HD1 LEU 51 2HD1 LEU 51 -7.463 10.481 1.704 400 3HD1 LEU 51 3HD1 LEU 51 -7.532 10.712 -0.043 401 1HD2 LEU 51 1HD2 LEU 51 -5.131 8.431 1.054 402 2HD2 LEU 51 2HD2 LEU 51 -6.044 6.923 0.982 403 3HD2 LEU 51 3HD2 LEU 51 -6.239 8.007 2.360 404 H PHE 52 H PHE 52 -8.624 5.674 3.496 405 HA PHE 52 HA PHE 52 -11.601 5.607 3.826 406 1HB PHE 52 1HB PHE 52 -9.269 3.950 4.787 407 2HB PHE 52 2HB PHE 52 -10.777 3.943 5.699 408 HD1 PHE 52 HD1 PHE 52 -12.472 2.454 5.080 409 HD2 PHE 52 HD2 PHE 52 -9.516 3.603 2.182 410 HE1 PHE 52 HE1 PHE 52 -13.448 0.858 3.452 411 HE2 PHE 52 HE2 PHE 52 -10.492 2.007 0.554 412 HZ PHE 52 HZ PHE 52 -12.458 0.634 1.189 413 H SER 53 H SER 53 -12.026 7.600 4.830 414 HA SER 53 HA SER 53 -10.151 8.659 6.837 415 1HB SER 53 1HB SER 53 -11.349 9.969 5.019 416 2HB SER 53 2HB SER 53 -12.846 9.704 5.913 417 HG SER 53 HG SER 53 -11.826 10.715 7.713 418 H ARG 54 H ARG 54 -10.368 8.351 8.987 419 HA ARG 54 HA ARG 54 -12.922 7.221 10.037 420 1HB ARG 54 1HB ARG 54 -10.173 6.678 10.381 421 2HB ARG 54 2HB ARG 54 -10.687 7.426 11.892 422 1HG ARG 54 1HG ARG 54 -12.040 5.673 12.447 423 2HG ARG 54 2HG ARG 54 -12.549 5.409 10.779 424 1HD ARG 54 1HD ARG 54 -10.742 4.020 10.310 425 2HD ARG 54 2HD ARG 54 -9.708 4.782 11.532 426 HE ARG 54 HE ARG 54 -10.642 3.319 13.138 427 1HH1 ARG 54 1HH1 ARG 54 -12.679 3.516 10.322 428 2HH1 ARG 54 2HH1 ARG 54 -13.767 2.298 10.890 429 1HH2 ARG 54 1HH2 ARG 54 -12.069 1.740 13.852 430 2HH2 ARG 54 2HH2 ARG 54 -13.427 1.299 12.872 431 H LYS 55 H LYS 55 -13.119 8.029 12.528 432 HA LYS 55 HA LYS 55 -13.619 10.886 12.369 433 1HB LYS 55 1HB LYS 55 -14.241 8.568 14.035 434 2HB LYS 55 2HB LYS 55 -13.892 9.985 15.025 435 1HG LYS 55 1HG LYS 55 -15.466 11.140 13.168 436 2HG LYS 55 2HG LYS 55 -16.128 9.506 13.118 437 1HD LYS 55 1HD LYS 55 -16.977 9.642 15.242 438 2HD LYS 55 2HD LYS 55 -15.638 10.632 15.823 439 1HE LYS 55 1HE LYS 55 -17.051 12.409 15.689 440 2HE LYS 55 2HE LYS 55 -16.961 12.241 13.925 441 1HZ LYS 55 1HZ LYS 55 -18.792 10.782 13.917 442 2HZ LYS 55 2HZ LYS 55 -19.256 12.046 14.953 443 3HZ LYS 55 3HZ LYS 55 -18.743 10.562 15.600 444 H ASN 56 H ASN 56 -11.245 11.345 11.961 445 HA ASN 56 HA ASN 56 -9.322 11.040 14.110 446 1HB ASN 56 1HB ASN 56 -10.408 13.826 13.652 447 2HB ASN 56 2HB ASN 56 -11.104 12.759 14.871 448 1HD2 ASN 56 1HD2 ASN 56 -10.128 12.891 16.897 449 2HD2 ASN 56 2HD2 ASN 56 -8.554 13.457 17.187 450 H MET 57 H MET 57 -9.590 10.817 11.106 451 HA MET 57 HA MET 57 -8.120 12.973 9.874 452 1HB MET 57 1HB MET 57 -5.897 11.889 9.814 453 2HB MET 57 2HB MET 57 -6.405 12.173 11.475 454 1HG MET 57 1HG MET 57 -7.110 9.552 10.226 455 2HG MET 57 2HG MET 57 -5.445 9.813 10.715 456 1HE MET 57 1HE MET 57 -5.240 11.062 13.715 457 2HE MET 57 2HE MET 57 -4.552 9.984 12.501 458 3HE MET 57 3HE MET 57 -5.087 9.337 14.053 459 H SER 58 H SER 58 -6.681 11.707 7.935 460 HA SER 58 HA SER 58 -8.684 9.890 6.637 461 1HB SER 58 1HB SER 58 -7.344 10.912 4.561 462 2HB SER 58 2HB SER 58 -8.656 11.811 5.321 463 HG SER 58 HG SER 58 -7.081 13.247 5.404 464 H ALA 59 H ALA 59 -7.903 7.936 5.832 465 HA ALA 59 HA ALA 59 -4.933 7.510 5.917 466 1HB ALA 59 1HB ALA 59 -5.539 6.311 7.786 467 2HB ALA 59 2HB ALA 59 -5.978 5.083 6.596 468 3HB ALA 59 3HB ALA 59 -7.216 6.152 7.258 469 H MET 60 H MET 60 -4.332 5.490 4.596 470 HA MET 60 HA MET 60 -6.046 5.381 2.144 471 1HB MET 60 1HB MET 60 -3.398 5.980 2.447 472 2HB MET 60 2HB MET 60 -3.301 4.243 2.166 473 1HG MET 60 1HG MET 60 -5.059 4.875 0.234 474 2HG MET 60 2HG MET 60 -4.212 6.418 0.341 475 1HE MET 60 1HE MET 60 -3.465 6.657 -1.538 476 2HE MET 60 2HE MET 60 -3.232 5.320 -2.665 477 3HE MET 60 3HE MET 60 -1.836 6.182 -2.018 478 H ALA 61 H ALA 61 -5.935 3.153 1.029 479 HA ALA 61 HA ALA 61 -6.731 1.126 2.977 480 1HB ALA 61 1HB ALA 61 -6.588 0.017 0.397 481 2HB ALA 61 2HB ALA 61 -6.924 1.727 0.127 482 3HB ALA 61 3HB ALA 61 -8.007 0.764 1.131 483 H LEU 62 H LEU 62 -3.953 1.589 0.791 484 HA LEU 62 HA LEU 62 -2.363 -0.239 2.425 485 1HB LEU 62 1HB LEU 62 -1.211 0.620 -0.116 486 2HB LEU 62 2HB LEU 62 -1.966 1.964 0.742 487 HG LEU 62 HG LEU 62 -0.714 1.169 2.819 488 1HD1 LEU 62 1HD1 LEU 62 0.311 -0.711 0.741 489 2HD1 LEU 62 2HD1 LEU 62 0.047 -0.977 2.464 490 3HD1 LEU 62 3HD1 LEU 62 1.473 -0.095 1.917 491 1HD2 LEU 62 1HD2 LEU 62 1.433 1.812 0.919 492 2HD2 LEU 62 2HD2 LEU 62 0.866 2.716 2.321 493 3HD2 LEU 62 3HD2 LEU 62 0.028 2.869 0.778 494 H GLY 63 H GLY 63 -3.218 -2.347 2.102 495 1HA GLY 63 1HA GLY 63 -2.168 -3.748 -0.186 496 2HA GLY 63 2HA GLY 63 -3.198 -4.451 1.059 497 H PHE 64 H PHE 64 -5.103 -5.178 0.291 498 HA PHE 64 HA PHE 64 -6.067 -4.267 -2.350 499 1HB PHE 64 1HB PHE 64 -7.097 -6.357 -0.395 500 2HB PHE 64 2HB PHE 64 -7.560 -6.209 -2.089 501 HD1 PHE 64 HD1 PHE 64 -5.312 -7.756 0.187 502 HD2 PHE 64 HD2 PHE 64 -5.590 -6.252 -3.826 503 HE1 PHE 64 HE1 PHE 64 -3.369 -9.149 -0.470 504 HE2 PHE 64 HE2 PHE 64 -3.648 -7.644 -4.482 505 HZ PHE 64 HZ PHE 64 -2.537 -9.094 -2.805 506 H GLY 65 H GLY 65 -6.295 -2.508 0.133 507 1HA GLY 65 1HA GLY 65 -9.136 -2.474 0.779 508 2HA GLY 65 2HA GLY 65 -7.952 -1.265 1.268 509 H ALA 66 H ALA 66 -7.114 -1.077 -1.677 510 HA ALA 66 HA ALA 66 -9.105 0.991 -2.390 511 1HB ALA 66 1HB ALA 66 -7.365 1.599 -4.033 512 2HB ALA 66 2HB ALA 66 -6.481 0.121 -3.652 513 3HB ALA 66 3HB ALA 66 -6.649 1.386 -2.435 514 H ILE 67 H ILE 67 -7.638 -1.912 -3.907 515 HA ILE 67 HA ILE 67 -8.939 -1.947 -6.371 516 HB ILE 67 HB ILE 67 -8.782 -4.462 -6.103 517 1HG1 ILE 67 1HG1 ILE 67 -7.382 -4.889 -3.828 518 2HG1 ILE 67 2HG1 ILE 67 -8.464 -3.616 -3.271 519 1HG2 ILE 67 1HG2 ILE 67 -6.462 -2.697 -5.316 520 2HG2 ILE 67 2HG2 ILE 67 -6.844 -3.340 -6.914 521 3HG2 ILE 67 3HG2 ILE 67 -6.282 -4.422 -5.638 522 1HD1 ILE 67 1HD1 ILE 67 -9.148 -6.234 -3.292 523 2HD1 ILE 67 2HD1 ILE 67 -9.715 -5.759 -4.893 524 3HD1 ILE 67 3HD1 ILE 67 -10.323 -4.930 -3.461 525 H PHE 68 H PHE 68 -10.327 -2.531 -3.211 526 HA PHE 68 HA PHE 68 -12.626 -3.992 -3.680 527 1HB PHE 68 1HB PHE 68 -11.909 -1.608 -1.996 528 2HB PHE 68 2HB PHE 68 -13.566 -2.200 -1.963 529 HD1 PHE 68 HD1 PHE 68 -10.890 -2.298 -0.011 530 HD2 PHE 68 HD2 PHE 68 -13.272 -5.096 -2.233 531 HE1 PHE 68 HE1 PHE 68 -10.194 -4.114 1.528 532 HE2 PHE 68 HE2 PHE 68 -12.576 -6.911 -0.696 533 HZ PHE 68 HZ PHE 68 -11.038 -6.421 1.186 534 H ASN 69 H ASN 69 -14.025 -3.776 -5.383 535 HA ASN 69 HA ASN 69 -14.580 -1.109 -6.541 536 1HB ASN 69 1HB ASN 69 -15.317 -3.975 -7.229 537 2HB ASN 69 2HB ASN 69 -15.817 -2.589 -8.198 538 1HD2 ASN 69 1HD2 ASN 69 -14.204 -4.439 -9.479 539 2HD2 ASN 69 2HD2 ASN 69 -12.630 -3.822 -9.666 540 H HIS 70 H HIS 70 -17.050 -0.946 -7.266 541 HA HIS 70 HA HIS 70 -18.678 -1.255 -4.781 542 1HB HIS 70 1HB HIS 70 -18.428 1.001 -5.704 543 2HB HIS 70 2HB HIS 70 -18.950 0.441 -7.293 544 HD1 HIS 70 HD1 HIS 70 -20.340 0.477 -3.730 545 HD2 HIS 70 HD2 HIS 70 -21.661 0.782 -7.672 546 HE1 HIS 70 HE1 HIS 70 -22.833 0.907 -3.619 547 H SER 71 H SER 71 -19.988 -3.039 -4.799 548 HA SER 71 HA SER 71 -21.206 -3.859 -7.416 549 1HB SER 71 1HB SER 71 -19.402 -5.365 -6.634 550 2HB SER 71 2HB SER 71 -20.222 -5.548 -5.084 551 HG SER 71 HG SER 71 -20.579 -7.185 -6.845 552 H LYS 72 H LYS 72 -23.421 -3.952 -7.363 553 HA LYS 72 HA LYS 72 -25.012 -3.028 -5.238 554 1HB LYS 72 1HB LYS 72 -25.587 -5.006 -7.475 555 2HB LYS 72 2HB LYS 72 -26.838 -4.215 -6.516 556 1HG LYS 72 1HG LYS 72 -24.722 -2.662 -8.020 557 2HG LYS 72 2HG LYS 72 -26.269 -3.097 -8.744 558 1HD LYS 72 1HD LYS 72 -27.484 -1.829 -7.122 559 2HD LYS 72 2HD LYS 72 -26.058 -1.634 -6.104 560 1HE LYS 72 1HE LYS 72 -26.321 -0.499 -8.913 561 2HE LYS 72 2HE LYS 72 -26.554 0.431 -7.423 562 1HZ LYS 72 1HZ LYS 72 -24.101 -0.870 -8.433 563 2HZ LYS 72 2HZ LYS 72 -24.291 -0.581 -6.770 564 3HZ LYS 72 3HZ LYS 72 -24.305 0.717 -7.865 565 H ASP 73 H ASP 73 -23.589 -6.184 -5.713 566 HA ASP 73 HA ASP 73 -25.162 -7.255 -3.398 567 1HB ASP 73 1HB ASP 73 -24.504 -9.457 -4.373 568 2HB ASP 73 2HB ASP 73 -25.365 -8.459 -5.546 569 HA PRO 74 HA PRO 74 -20.755 -6.536 -2.021 570 1HB PRO 74 1HB PRO 74 -21.518 -5.553 0.468 571 2HB PRO 74 2HB PRO 74 -21.169 -4.533 -0.938 572 1HG PRO 74 1HG PRO 74 -23.782 -5.403 0.178 573 2HG PRO 74 2HG PRO 74 -23.332 -3.869 -0.578 574 1HD PRO 74 1HD PRO 74 -24.772 -5.795 -1.848 575 2HD PRO 74 2HD PRO 74 -23.697 -4.665 -2.700 576 H ASN 75 H ASN 75 -20.087 -8.564 -1.547 577 HA ASN 75 HA ASN 75 -21.562 -10.097 0.557 578 1HB ASN 75 1HB ASN 75 -19.621 -11.057 -1.572 579 2HB ASN 75 2HB ASN 75 -20.700 -12.044 -0.604 580 1HD2 ASN 75 1HD2 ASN 75 -20.790 -12.071 -3.481 581 2HD2 ASN 75 2HD2 ASN 75 -22.279 -11.414 -3.965 582 H ALA 76 H ALA 76 -19.183 -8.040 0.722 583 HA ALA 76 HA ALA 76 -17.640 -9.657 2.675 584 1HB ALA 76 1HB ALA 76 -16.734 -8.650 0.022 585 2HB ALA 76 2HB ALA 76 -16.173 -10.048 0.939 586 3HB ALA 76 3HB ALA 76 -15.602 -8.432 1.357 587 H ARG 77 H ARG 77 -16.229 -8.241 4.021 588 HA ARG 77 HA ARG 77 -16.832 -5.329 3.876 589 1HB ARG 77 1HB ARG 77 -18.585 -6.319 5.260 590 2HB ARG 77 2HB ARG 77 -17.388 -7.197 6.210 591 1HG ARG 77 1HG ARG 77 -16.584 -5.222 7.230 592 2HG ARG 77 2HG ARG 77 -17.310 -4.188 5.999 593 1HD ARG 77 1HD ARG 77 -19.412 -4.292 6.967 594 2HD ARG 77 2HD ARG 77 -19.146 -5.922 7.612 595 HE ARG 77 HE ARG 77 -18.387 -3.415 8.916 596 1HH1 ARG 77 1HH1 ARG 77 -17.695 -6.809 8.561 597 2HH1 ARG 77 2HH1 ARG 77 -16.924 -6.925 10.105 598 1HH2 ARG 77 1HH2 ARG 77 -17.382 -3.591 10.915 599 2HH2 ARG 77 2HH2 ARG 77 -16.747 -5.119 11.429 600 H HIS 78 H HIS 78 -15.330 -4.068 5.222 601 HA HIS 78 HA HIS 78 -12.771 -5.541 5.724 602 1HB HIS 78 1HB HIS 78 -11.783 -3.265 5.367 603 2HB HIS 78 2HB HIS 78 -12.734 -3.805 3.983 604 HD1 HIS 78 HD1 HIS 78 -14.809 -2.462 3.380 605 HD2 HIS 78 HD2 HIS 78 -13.126 -1.265 7.001 606 HE1 HIS 78 HE1 HIS 78 -16.013 -0.340 4.062 607 H GLU 79 H GLU 79 -11.514 -4.839 7.616 608 HA GLU 79 HA GLU 79 -13.064 -3.381 9.710 609 1HB GLU 79 1HB GLU 79 -13.342 -5.921 9.790 610 2HB GLU 79 2HB GLU 79 -11.619 -6.014 10.154 611 1HG GLU 79 1HG GLU 79 -11.926 -4.672 12.164 612 2HG GLU 79 2HG GLU 79 -13.627 -4.418 11.773 613 H LEU 80 H LEU 80 -11.734 -2.173 11.084 614 HA LEU 80 HA LEU 80 -8.819 -2.170 10.410 615 1HB LEU 80 1HB LEU 80 -10.838 -0.163 11.408 616 2HB LEU 80 2HB LEU 80 -9.115 0.135 11.630 617 HG LEU 80 HG LEU 80 -10.020 -0.728 8.921 618 1HD1 LEU 80 1HD1 LEU 80 -11.553 0.941 8.812 619 2HD1 LEU 80 2HD1 LEU 80 -10.164 2.027 8.776 620 3HD1 LEU 80 3HD1 LEU 80 -10.973 1.682 10.305 621 1HD2 LEU 80 1HD2 LEU 80 -7.646 -0.347 9.406 622 2HD2 LEU 80 2HD2 LEU 80 -8.010 1.280 9.979 623 3HD2 LEU 80 3HD2 LEU 80 -8.232 0.876 8.277 624 H THR 81 H THR 81 -7.297 -1.924 12.214 625 HA THR 81 HA THR 81 -8.166 -3.430 14.605 626 HB THR 81 HB THR 81 -5.695 -3.398 15.031 627 HG1 THR 81 HG1 THR 81 -5.077 -1.480 14.188 628 1HG2 THR 81 1HG2 THR 81 -6.081 -4.033 12.118 629 2HG2 THR 81 2HG2 THR 81 -6.964 -4.954 13.335 630 3HG2 THR 81 3HG2 THR 81 -5.200 -4.942 13.346 631 H ALA 82 H ALA 82 -9.562 -1.342 15.105 632 HA ALA 82 HA ALA 82 -9.880 0.572 16.459 633 1HB ALA 82 1HB ALA 82 -8.211 0.520 18.435 634 2HB ALA 82 2HB ALA 82 -7.511 -0.896 17.650 635 3HB ALA 82 3HB ALA 82 -9.190 -0.927 18.190 636 H GLY 83 H GLY 83 -8.223 0.908 14.038 637 1HA GLY 83 1HA GLY 83 -7.285 3.546 14.394 638 2HA GLY 83 2HA GLY 83 -5.895 2.482 14.603 639 H LEU 84 H LEU 84 -5.772 4.170 12.487 640 HA LEU 84 HA LEU 84 -6.768 2.753 10.077 641 1HB LEU 84 1HB LEU 84 -5.257 5.345 10.563 642 2HB LEU 84 2HB LEU 84 -5.806 4.802 8.978 643 HG LEU 84 HG LEU 84 -7.664 5.161 11.341 644 1HD1 LEU 84 1HD1 LEU 84 -7.819 7.089 9.123 645 2HD1 LEU 84 2HD1 LEU 84 -6.336 7.212 10.070 646 3HD1 LEU 84 3HD1 LEU 84 -7.904 7.368 10.862 647 1HD2 LEU 84 1HD2 LEU 84 -9.263 5.366 9.268 648 2HD2 LEU 84 2HD2 LEU 84 -8.737 3.768 9.798 649 3HD2 LEU 84 3HD2 LEU 84 -7.960 4.539 8.415 650 H LYS 85 H LYS 85 -4.657 1.548 11.806 651 HA LYS 85 HA LYS 85 -2.193 1.834 10.237 652 1HB LYS 85 1HB LYS 85 -3.031 0.476 12.740 653 2HB LYS 85 2HB LYS 85 -1.441 0.187 12.053 654 1HG LYS 85 1HG LYS 85 -1.541 2.891 11.921 655 2HG LYS 85 2HG LYS 85 -2.552 2.622 13.329 656 1HD LYS 85 1HD LYS 85 -0.812 1.529 14.515 657 2HD LYS 85 2HD LYS 85 0.132 1.274 13.046 658 1HE LYS 85 1HE LYS 85 -0.452 4.115 13.573 659 2HE LYS 85 2HE LYS 85 0.546 3.346 14.823 660 1HZ LYS 85 1HZ LYS 85 1.014 3.115 11.892 661 2HZ LYS 85 2HZ LYS 85 1.998 2.481 13.123 662 3HZ LYS 85 3HZ LYS 85 1.869 4.162 12.919 663 H ARG 86 H ARG 86 -3.762 -1.091 11.537 664 HA ARG 86 HA ARG 86 -2.987 -2.554 9.064 665 1HB ARG 86 1HB ARG 86 -3.040 -3.062 11.852 666 2HB ARG 86 2HB ARG 86 -4.262 -4.118 11.144 667 1HG ARG 86 1HG ARG 86 -2.183 -4.360 9.353 668 2HG ARG 86 2HG ARG 86 -1.331 -4.207 10.890 669 1HD ARG 86 1HD ARG 86 -3.302 -5.954 11.601 670 2HD ARG 86 2HD ARG 86 -3.053 -6.411 9.905 671 HE ARG 86 HE ARG 86 -0.925 -7.221 10.528 672 1HH1 ARG 86 1HH1 ARG 86 -2.064 -4.887 12.846 673 2HH1 ARG 86 2HH1 ARG 86 -0.703 -5.097 13.891 674 1HH2 ARG 86 1HH2 ARG 86 0.832 -7.476 11.903 675 2HH2 ARG 86 2HH2 ARG 86 0.925 -6.551 13.364 676 H MET 87 H MET 87 -4.596 -3.992 8.047 677 HA MET 87 HA MET 87 -7.449 -3.310 8.611 678 1HB MET 87 1HB MET 87 -5.823 -2.309 6.493 679 2HB MET 87 2HB MET 87 -6.961 -3.448 5.773 680 1HG MET 87 1HG MET 87 -7.811 -1.278 7.705 681 2HG MET 87 2HG MET 87 -7.791 -1.046 5.958 682 1HE MET 87 1HE MET 87 -10.254 -2.470 4.352 683 2HE MET 87 2HE MET 87 -9.480 -4.018 4.692 684 3HE MET 87 3HE MET 87 -8.496 -2.577 4.442 685 H ARG 88 H ARG 88 -8.810 -5.070 8.313 686 HA ARG 88 HA ARG 88 -7.604 -7.534 7.092 687 1HB ARG 88 1HB ARG 88 -9.576 -7.199 9.385 688 2HB ARG 88 2HB ARG 88 -8.998 -8.746 8.769 689 1HG ARG 88 1HG ARG 88 -6.920 -8.500 9.718 690 2HG ARG 88 2HG ARG 88 -6.921 -6.748 9.517 691 1HD ARG 88 1HD ARG 88 -7.519 -6.543 11.694 692 2HD ARG 88 2HD ARG 88 -9.031 -7.397 11.333 693 HE ARG 88 HE ARG 88 -8.055 -9.371 12.206 694 1HH1 ARG 88 1HH1 ARG 88 -5.619 -6.985 11.504 695 2HH1 ARG 88 2HH1 ARG 88 -4.346 -7.916 12.214 696 1HH2 ARG 88 1HH2 ARG 88 -6.384 -10.560 13.122 697 2HH2 ARG 88 2HH2 ARG 88 -4.773 -9.924 13.123 698 H ILE 89 H ILE 89 -9.421 -9.079 6.331 699 HA ILE 89 HA ILE 89 -11.768 -7.536 5.285 700 HB ILE 89 HB ILE 89 -9.955 -9.495 3.826 701 1HG1 ILE 89 1HG1 ILE 89 -10.417 -6.553 3.278 702 2HG1 ILE 89 2HG1 ILE 89 -9.091 -7.139 4.282 703 1HG2 ILE 89 1HG2 ILE 89 -12.497 -9.408 3.269 704 2HG2 ILE 89 2HG2 ILE 89 -11.347 -9.260 1.940 705 3HG2 ILE 89 3HG2 ILE 89 -12.136 -7.822 2.589 706 1HD1 ILE 89 1HD1 ILE 89 -8.132 -8.361 2.458 707 2HD1 ILE 89 2HD1 ILE 89 -8.524 -6.762 1.825 708 3HD1 ILE 89 3HD1 ILE 89 -9.571 -8.135 1.464 709 H PHE 90 H PHE 90 -13.636 -8.549 5.865 710 HA PHE 90 HA PHE 90 -13.533 -11.481 6.486 711 1HB PHE 90 1HB PHE 90 -14.963 -9.077 7.580 712 2HB PHE 90 2HB PHE 90 -15.743 -10.651 7.730 713 HD1 PHE 90 HD1 PHE 90 -13.277 -8.435 9.090 714 HD2 PHE 90 HD2 PHE 90 -14.347 -12.580 8.740 715 HE1 PHE 90 HE1 PHE 90 -11.817 -8.974 11.021 716 HE2 PHE 90 HE2 PHE 90 -12.887 -13.119 10.671 717 HZ PHE 90 HZ PHE 90 -11.622 -11.316 11.811 718 H THR 91 H THR 91 -16.036 -12.292 6.325 719 HA THR 91 HA THR 91 -17.063 -11.408 3.646 720 HB THR 91 HB THR 91 -17.720 -13.888 3.472 721 HG1 THR 91 HG1 THR 91 -16.645 -15.261 4.873 722 1HG2 THR 91 1HG2 THR 91 -15.414 -12.559 2.782 723 2HG2 THR 91 2HG2 THR 91 -15.798 -14.212 2.303 724 3HG2 THR 91 3HG2 THR 91 -14.784 -13.916 3.715 725 H ILE 92 H ILE 92 -18.748 -10.108 4.518 726 HA ILE 92 HA ILE 92 -20.406 -10.623 6.717 727 HB ILE 92 HB ILE 92 -22.005 -9.157 5.493 728 1HG1 ILE 92 1HG1 ILE 92 -20.146 -9.641 3.146 729 2HG1 ILE 92 2HG1 ILE 92 -21.789 -10.264 3.290 730 1HG2 ILE 92 1HG2 ILE 92 -19.193 -8.634 5.927 731 2HG2 ILE 92 2HG2 ILE 92 -20.566 -7.547 6.135 732 3HG2 ILE 92 3HG2 ILE 92 -19.784 -7.687 4.561 733 1HD1 ILE 92 1HD1 ILE 92 -20.993 -7.755 2.253 734 2HD1 ILE 92 2HD1 ILE 92 -21.771 -7.422 3.800 735 3HD1 ILE 92 3HD1 ILE 92 -22.639 -8.313 2.550 736 H LYS 93 H LYS 93 -20.387 -12.208 3.595 737 HA LYS 93 HA LYS 93 -22.521 -14.028 4.582 738 1HB LYS 93 1HB LYS 93 -23.816 -13.716 2.541 739 2HB LYS 93 2HB LYS 93 -23.511 -12.130 3.243 740 1HG LYS 93 1HG LYS 93 -21.725 -11.700 1.675 741 2HG LYS 93 2HG LYS 93 -21.802 -13.353 1.063 742 1HD LYS 93 1HD LYS 93 -23.041 -12.139 -0.530 743 2HD LYS 93 2HD LYS 93 -24.289 -12.794 0.528 744 1HE LYS 93 1HE LYS 93 -23.257 -10.231 1.504 745 2HE LYS 93 2HE LYS 93 -23.984 -10.103 -0.109 746 1HZ LYS 93 1HZ LYS 93 -25.532 -10.017 1.928 747 2HZ LYS 93 2HZ LYS 93 -25.272 -11.692 2.027 748 3HZ LYS 93 3HZ LYS 93 -25.974 -11.022 0.633 749 HA PRO 94 HA PRO 94 -20.057 -17.200 2.854 750 1HB PRO 94 1HB PRO 94 -22.434 -18.410 1.648 751 2HB PRO 94 2HB PRO 94 -21.350 -19.078 2.867 752 1HG PRO 94 1HG PRO 94 -23.844 -18.235 3.455 753 2HG PRO 94 2HG PRO 94 -22.516 -18.142 4.600 754 1HD PRO 94 1HD PRO 94 -23.809 -15.997 3.010 755 2HD PRO 94 2HD PRO 94 -23.066 -15.932 4.621 756 H ILE 95 H ILE 95 -19.042 -17.762 0.923 757 HA ILE 95 HA ILE 95 -20.194 -16.557 -1.574 758 HB ILE 95 HB ILE 95 -17.340 -16.467 -0.524 759 1HG1 ILE 95 1HG1 ILE 95 -19.166 -14.132 -1.091 760 2HG1 ILE 95 2HG1 ILE 95 -19.171 -14.936 0.478 761 1HG2 ILE 95 1HG2 ILE 95 -18.518 -16.041 -3.188 762 2HG2 ILE 95 2HG2 ILE 95 -16.836 -16.316 -2.734 763 3HG2 ILE 95 3HG2 ILE 95 -17.525 -14.696 -2.627 764 1HD1 ILE 95 1HD1 ILE 95 -16.604 -14.611 0.431 765 2HD1 ILE 95 2HD1 ILE 95 -17.600 -13.188 0.741 766 3HD1 ILE 95 3HD1 ILE 95 -16.912 -13.451 -0.862 767 H ALA 96 H ALA 96 -19.810 -17.776 -3.458 768 HA ALA 96 HA ALA 96 -18.771 -20.533 -3.004 769 1HB ALA 96 1HB ALA 96 -20.005 -20.963 -5.123 770 2HB ALA 96 2HB ALA 96 -20.366 -19.241 -5.250 771 3HB ALA 96 3HB ALA 96 -21.042 -20.189 -3.925 772 H ILE 97 H ILE 97 -17.401 -21.469 -4.756 773 HA ILE 97 HA ILE 97 -15.165 -19.786 -5.423 774 HB ILE 97 HB ILE 97 -16.095 -22.474 -6.504 775 1HG1 ILE 97 1HG1 ILE 97 -13.905 -22.541 -4.619 776 2HG1 ILE 97 2HG1 ILE 97 -15.287 -21.708 -3.909 777 1HG2 ILE 97 1HG2 ILE 97 -13.993 -20.827 -7.373 778 2HG2 ILE 97 2HG2 ILE 97 -14.202 -22.542 -7.728 779 3HG2 ILE 97 3HG2 ILE 97 -13.227 -22.039 -6.346 780 1HD1 ILE 97 1HD1 ILE 97 -15.651 -24.312 -5.385 781 2HD1 ILE 97 2HD1 ILE 97 -16.702 -23.574 -4.176 782 3HD1 ILE 97 3HD1 ILE 97 -15.170 -24.298 -3.688 783 H GLY 98 H GLY 98 -15.341 -18.158 -6.923 784 1HA GLY 98 1HA GLY 98 -15.351 -17.824 -9.416 785 2HA GLY 98 2HA GLY 98 -16.837 -18.771 -9.442 786 H GLU 99 H GLU 99 -16.269 -16.464 -6.868 787 HA GLU 99 HA GLU 99 -18.412 -14.732 -8.060 788 1HB GLU 99 1HB GLU 99 -17.609 -15.443 -5.224 789 2HB GLU 99 2HB GLU 99 -18.752 -14.152 -5.588 790 1HG GLU 99 1HG GLU 99 -19.179 -16.856 -6.812 791 2HG GLU 99 2HG GLU 99 -19.624 -16.604 -5.124 792 H GLU 100 H GLU 100 -18.190 -12.394 -6.918 793 HA GLU 100 HA GLU 100 -15.310 -11.606 -7.199 794 1HB GLU 100 1HB GLU 100 -16.775 -10.793 -9.007 795 2HB GLU 100 2HB GLU 100 -17.881 -10.101 -7.819 796 1HG GLU 100 1HG GLU 100 -16.185 -8.539 -7.063 797 2HG GLU 100 2HG GLU 100 -14.963 -9.311 -8.072 798 H ILE 101 H ILE 101 -14.412 -10.476 -5.539 799 HA ILE 101 HA ILE 101 -16.116 -9.917 -3.166 800 HB ILE 101 HB ILE 101 -13.100 -10.001 -3.529 801 1HG1 ILE 101 1HG1 ILE 101 -15.054 -12.085 -2.532 802 2HG1 ILE 101 2HG1 ILE 101 -14.099 -12.166 -4.002 803 1HG2 ILE 101 1HG2 ILE 101 -14.887 -9.938 -1.088 804 2HG2 ILE 101 2HG2 ILE 101 -13.730 -8.701 -1.581 805 3HG2 ILE 101 3HG2 ILE 101 -13.159 -10.279 -1.037 806 1HD1 ILE 101 1HD1 ILE 101 -12.025 -12.188 -2.716 807 2HD1 ILE 101 2HD1 ILE 101 -13.079 -13.482 -2.146 808 3HD1 ILE 101 3HD1 ILE 101 -12.929 -11.993 -1.214 809 H THR 102 H THR 102 -16.674 -7.885 -2.725 810 HA THR 102 HA THR 102 -14.919 -5.593 -3.357 811 HB THR 102 HB THR 102 -16.942 -4.545 -4.559 812 HG1 THR 102 HG1 THR 102 -18.223 -6.394 -5.498 813 1HG2 THR 102 1HG2 THR 102 -15.772 -7.011 -5.874 814 2HG2 THR 102 2HG2 THR 102 -14.887 -5.498 -5.684 815 3HG2 THR 102 3HG2 THR 102 -16.347 -5.548 -6.672 816 H ILE 103 H ILE 103 -16.070 -3.520 -2.468 817 HA ILE 103 HA ILE 103 -18.067 -4.133 -0.349 818 HB ILE 103 HB ILE 103 -16.617 -3.117 1.360 819 1HG1 ILE 103 1HG1 ILE 103 -14.107 -3.022 0.061 820 2HG1 ILE 103 2HG1 ILE 103 -15.232 -2.154 -0.981 821 1HG2 ILE 103 1HG2 ILE 103 -14.958 -4.866 1.512 822 2HG2 ILE 103 2HG2 ILE 103 -15.020 -5.144 -0.229 823 3HG2 ILE 103 3HG2 ILE 103 -16.403 -5.566 0.782 824 1HD1 ILE 103 1HD1 ILE 103 -14.119 -1.353 1.577 825 2HD1 ILE 103 2HD1 ILE 103 -15.881 -1.340 1.627 826 3HD1 ILE 103 3HD1 ILE 103 -15.027 -0.392 0.410 827 H SER 104 H SER 104 -18.916 -2.076 0.637 828 HA SER 104 HA SER 104 -19.231 -0.012 -1.455 829 1HB SER 104 1HB SER 104 -20.913 -1.199 0.297 830 2HB SER 104 2HB SER 104 -20.450 0.201 1.264 831 HG SER 104 HG SER 104 -22.223 0.726 0.001 832 H TYR 105 H TYR 105 -19.630 2.265 0.083 833 HA TYR 105 HA TYR 105 -16.941 2.725 1.340 834 1HB TYR 105 1HB TYR 105 -18.655 4.651 -0.275 835 2HB TYR 105 2HB TYR 105 -17.017 4.944 0.305 836 HD1 TYR 105 HD1 TYR 105 -15.714 2.339 -0.259 837 HD2 TYR 105 HD2 TYR 105 -18.460 4.649 -2.622 838 HE1 TYR 105 HE1 TYR 105 -14.804 1.311 -2.325 839 HE2 TYR 105 HE2 TYR 105 -17.549 3.621 -4.686 840 HH TYR 105 HH TYR 105 -14.680 1.655 -4.646 841 H GLY 106 H GLY 106 -20.046 4.501 1.070 842 1HA GLY 106 1HA GLY 106 -20.926 4.198 3.723 843 2HA GLY 106 2HA GLY 106 -19.841 5.588 3.726 844 H ASP 107 H ASP 107 -22.736 5.619 4.186 845 HA ASP 107 HA ASP 107 -24.330 6.388 2.012 846 1HB ASP 107 1HB ASP 107 -25.575 7.669 3.739 847 2HB ASP 107 2HB ASP 107 -25.058 6.104 4.366 848 H ASP 108 H ASP 108 -21.673 8.108 3.494 849 HA ASP 108 HA ASP 108 -22.355 10.688 2.246 850 1HB ASP 108 1HB ASP 108 -20.608 9.594 4.290 851 2HB ASP 108 2HB ASP 108 -19.686 10.625 3.195 852 H TYR 109 H TYR 109 -19.611 8.384 1.987 853 HA TYR 109 HA TYR 109 -18.556 9.594 -0.414 854 1HB TYR 109 1HB TYR 109 -17.611 7.968 1.495 855 2HB TYR 109 2HB TYR 109 -18.073 6.730 0.329 856 HD1 TYR 109 HD1 TYR 109 -16.426 6.067 -1.169 857 HD2 TYR 109 HD2 TYR 109 -16.410 10.103 0.301 858 HE1 TYR 109 HE1 TYR 109 -14.376 6.536 -2.481 859 HE2 TYR 109 HE2 TYR 109 -14.358 10.572 -1.012 860 HH TYR 109 HH TYR 109 -12.335 8.627 -2.011 861 H TRP 110 H TRP 110 -21.056 9.422 -1.256 862 HA TRP 110 HA TRP 110 -21.025 7.753 -3.560 863 1HB TRP 110 1HB TRP 110 -21.775 6.475 -1.069 864 2HB TRP 110 2HB TRP 110 -23.140 6.452 -2.187 865 HD1 TRP 110 HD1 TRP 110 -20.835 4.091 -1.293 866 HE1 TRP 110 HE1 TRP 110 -19.900 2.688 -3.244 867 HE3 TRP 110 HE3 TRP 110 -22.076 7.107 -5.224 868 HZ2 TRP 110 HZ2 TRP 110 -19.705 2.828 -6.095 869 HZ3 TRP 110 HZ3 TRP 110 -21.504 6.448 -7.543 870 HH2 TRP 110 HH2 TRP 110 -20.321 4.314 -7.984 871 H LEU 111 H LEU 111 -23.758 7.256 -3.916 872 HA LEU 111 HA LEU 111 -24.787 9.801 -4.653 873 1HB LEU 111 1HB LEU 111 -25.479 7.033 -4.781 874 2HB LEU 111 2HB LEU 111 -26.885 7.891 -4.151 875 HG LEU 111 HG LEU 111 -25.497 9.186 -6.432 876 1HD1 LEU 111 1HD1 LEU 111 -26.011 7.644 -8.060 877 2HD1 LEU 111 2HD1 LEU 111 -27.387 7.001 -7.163 878 3HD1 LEU 111 3HD1 LEU 111 -25.747 6.523 -6.723 879 1HD2 LEU 111 1HD2 LEU 111 -28.031 9.273 -7.095 880 2HD2 LEU 111 2HD2 LEU 111 -27.462 10.267 -5.754 881 3HD2 LEU 111 3HD2 LEU 111 -28.301 8.749 -5.433 882 H SER 112 H SER 112 -27.407 9.895 -3.689 883 HA SER 112 HA SER 112 -27.023 10.387 -0.752 884 1HB SER 112 1HB SER 112 -28.115 12.468 -1.039 885 2HB SER 112 2HB SER 112 -27.123 12.342 -2.493 886 HG SER 112 HG SER 112 -29.395 12.910 -2.807 887 H ARG 113 H ARG 113 -28.643 9.567 0.560 888 HA ARG 113 HA ARG 113 -30.540 8.281 1.148 889 1HB ARG 113 1HB ARG 113 -31.280 10.294 -0.912 890 2HB ARG 113 2HB ARG 113 -32.462 9.012 -0.647 891 1HG ARG 113 1HG ARG 113 -32.681 9.550 1.661 892 2HG ARG 113 2HG ARG 113 -31.227 10.547 1.645 893 1HD ARG 113 1HD ARG 113 -32.613 11.890 -0.212 894 2HD ARG 113 2HD ARG 113 -33.982 11.200 0.681 895 HE ARG 113 HE ARG 113 -32.311 12.102 2.685 896 1HH1 ARG 113 1HH1 ARG 113 -33.671 13.553 -0.171 897 2HH1 ARG 113 2HH1 ARG 113 -33.707 15.139 0.518 898 1HH2 ARG 113 1HH2 ARG 113 -32.368 14.168 3.558 899 2HH2 ARG 113 2HH2 ARG 113 -32.976 15.487 2.613 900 HA PRO 114 HA PRO 114 -29.742 5.517 -2.604 901 1HB PRO 114 1HB PRO 114 -28.171 3.654 -1.304 902 2HB PRO 114 2HB PRO 114 -27.510 5.034 -2.200 903 1HG PRO 114 1HG PRO 114 -27.886 4.672 0.727 904 2HG PRO 114 2HG PRO 114 -26.584 5.486 -0.151 905 1HD PRO 114 1HD PRO 114 -28.622 6.796 1.116 906 2HD PRO 114 2HD PRO 114 -27.740 7.457 -0.277 907 H ARG 115 H ARG 115 -31.267 3.936 -2.880 908 HA ARG 115 HA ARG 115 -32.317 2.576 -0.430 909 1HB ARG 115 1HB ARG 115 -33.902 3.544 -2.814 910 2HB ARG 115 2HB ARG 115 -34.539 2.908 -1.303 911 1HG ARG 115 1HG ARG 115 -33.008 5.494 -1.674 912 2HG ARG 115 2HG ARG 115 -34.697 5.311 -1.242 913 1HD ARG 115 1HD ARG 115 -33.256 3.812 0.675 914 2HD ARG 115 2HD ARG 115 -32.425 5.366 0.515 915 HE ARG 115 HE ARG 115 -35.222 5.875 0.532 916 1HH1 ARG 115 1HH1 ARG 115 -32.730 4.675 2.645 917 2HH1 ARG 115 2HH1 ARG 115 -33.527 5.226 4.077 918 1HH2 ARG 115 1HH2 ARG 115 -36.236 6.581 2.404 919 2HH2 ARG 115 2HH2 ARG 115 -35.497 6.297 3.944 920 H LEU 116 H LEU 116 -30.520 1.062 -1.562 921 HA LEU 116 HA LEU 116 -31.332 -0.355 -3.960 922 1HB LEU 116 1HB LEU 116 -29.075 -0.052 -2.317 923 2HB LEU 116 2HB LEU 116 -29.504 -1.756 -2.168 924 HG LEU 116 HG LEU 116 -27.961 -1.386 -4.066 925 1HD1 LEU 116 1HD1 LEU 116 -29.656 -3.189 -4.193 926 2HD1 LEU 116 2HD1 LEU 116 -29.313 -2.516 -5.786 927 3HD1 LEU 116 3HD1 LEU 116 -30.789 -2.060 -4.936 928 1HD2 LEU 116 1HD2 LEU 116 -29.623 0.894 -4.459 929 2HD2 LEU 116 2HD2 LEU 116 -29.779 -0.124 -5.891 930 3HD2 LEU 116 3HD2 LEU 116 -28.187 0.432 -5.373 931 H THR 117 H THR 117 -31.509 -1.074 -0.463 932 HA THR 117 HA THR 117 -33.545 -3.170 -1.099 933 HB THR 117 HB THR 117 -31.365 -3.527 0.970 934 HG1 THR 117 HG1 THR 117 -30.273 -3.250 -0.932 935 1HG2 THR 117 1HG2 THR 117 -32.082 -5.944 -0.267 936 2HG2 THR 117 2HG2 THR 117 -33.599 -5.066 -0.068 937 3HG2 THR 117 3HG2 THR 117 -32.579 -5.393 1.333 938 H GLN 118 H GLN 118 -34.866 -3.728 0.837 939 HA GLN 118 HA GLN 118 -35.628 -1.362 2.340 940 1HB GLN 118 1HB GLN 118 -36.480 -4.166 1.910 941 2HB GLN 118 2HB GLN 118 -36.902 -3.510 3.492 942 1HG GLN 118 1HG GLN 118 -37.498 -2.119 0.865 943 2HG GLN 118 2HG GLN 118 -38.661 -3.115 1.740 944 1HE2 GLN 118 1HE2 GLN 118 -38.490 -2.397 4.336 945 2HE2 GLN 118 2HE2 GLN 118 -38.703 -0.727 4.555 946 H ASN 119 H ASN 119 -33.131 -1.403 3.139 947 HA ASN 119 HA ASN 119 -32.868 -3.086 5.585 948 1HB ASN 119 1HB ASN 119 -31.085 -2.910 3.788 949 2HB ASN 119 2HB ASN 119 -30.890 -1.215 4.234 950 1HD2 ASN 119 1HD2 ASN 119 -28.749 -1.450 5.135 951 2HD2 ASN 119 2HD2 ASN 119 -28.450 -2.346 6.545 952 1H GLY 201 1H GLY 201 -29.948 41.943 -4.222 953 2H GLY 201 2H GLY 201 -30.232 42.533 -5.788 954 3H GLY 201 3H GLY 201 -28.644 42.426 -5.196 955 1HA GLY 201 1HA GLY 201 -30.299 40.000 -5.373 956 2HA GLY 201 2HA GLY 201 -29.502 40.628 -6.815 957 H LYS 202 H LYS 202 -28.371 40.671 -3.434 958 HA LYS 202 HA LYS 202 -25.907 39.244 -4.359 959 1HB LYS 202 1HB LYS 202 -25.673 41.529 -3.429 960 2HB LYS 202 2HB LYS 202 -26.482 41.012 -1.950 961 1HG LYS 202 1HG LYS 202 -24.257 39.256 -2.659 962 2HG LYS 202 2HG LYS 202 -23.738 40.925 -2.426 963 1HD LYS 202 1HD LYS 202 -25.667 40.013 -0.407 964 2HD LYS 202 2HD LYS 202 -24.161 39.096 -0.399 965 1HE LYS 202 1HE LYS 202 -22.872 41.204 -0.242 966 2HE LYS 202 2HE LYS 202 -24.387 42.127 -0.251 967 1HZ LYS 202 1HZ LYS 202 -23.843 39.928 1.669 968 2HZ LYS 202 2HZ LYS 202 -25.085 41.083 1.737 969 3HZ LYS 202 3HZ LYS 202 -23.476 41.549 2.016 970 H ALA 203 H ALA 203 -26.445 37.060 -4.029 971 HA ALA 203 HA ALA 203 -26.668 36.191 -1.216 972 1HB ALA 203 1HB ALA 203 -28.744 34.815 -1.938 973 2HB ALA 203 2HB ALA 203 -28.821 35.900 -3.326 974 3HB ALA 203 3HB ALA 203 -28.980 36.546 -1.693 975 HA PRO 204 HA PRO 204 -24.504 33.437 -4.397 976 1HB PRO 204 1HB PRO 204 -22.012 33.558 -3.182 977 2HB PRO 204 2HB PRO 204 -22.513 34.595 -4.530 978 1HG PRO 204 1HG PRO 204 -22.387 35.189 -1.620 979 2HG PRO 204 2HG PRO 204 -22.042 36.237 -3.002 980 1HD PRO 204 1HD PRO 204 -24.343 36.372 -1.554 981 2HD PRO 204 2HD PRO 204 -24.243 36.816 -3.271 982 H ARG 205 H ARG 205 -23.812 31.247 -3.895 983 HA ARG 205 HA ARG 205 -23.746 30.453 -1.035 984 1HB ARG 205 1HB ARG 205 -25.575 28.788 -1.500 985 2HB ARG 205 2HB ARG 205 -26.117 30.459 -1.653 986 1HG ARG 205 1HG ARG 205 -25.037 29.531 -4.170 987 2HG ARG 205 2HG ARG 205 -26.292 28.428 -3.605 988 1HD ARG 205 1HD ARG 205 -27.085 31.197 -3.180 989 2HD ARG 205 2HD ARG 205 -26.715 30.887 -4.887 990 HE ARG 205 HE ARG 205 -28.203 28.674 -3.870 991 1HH1 ARG 205 1HH1 ARG 205 -28.593 32.051 -4.622 992 2HH1 ARG 205 2HH1 ARG 205 -30.280 31.891 -4.970 993 1HH2 ARG 205 1HH2 ARG 205 -30.394 28.493 -4.327 994 2HH2 ARG 205 2HH2 ARG 205 -31.293 29.894 -4.805 995 H LYS 206 H LYS 206 -22.010 30.383 -3.597 996 HA LYS 206 HA LYS 206 -21.460 27.431 -3.554 997 1HB LYS 206 1HB LYS 206 -22.281 28.941 -5.661 998 2HB LYS 206 2HB LYS 206 -20.535 29.142 -5.810 999 1HG LYS 206 1HG LYS 206 -20.661 26.471 -5.357 1000 2HG LYS 206 2HG LYS 206 -22.202 26.713 -6.181 1001 1HD LYS 206 1HD LYS 206 -19.602 27.819 -7.261 1002 2HD LYS 206 2HD LYS 206 -20.188 26.210 -7.682 1003 1HE LYS 206 1HE LYS 206 -22.255 28.289 -7.938 1004 2HE LYS 206 2HE LYS 206 -20.874 28.526 -9.026 1005 1HZ LYS 206 1HZ LYS 206 -21.038 26.133 -9.588 1006 2HZ LYS 206 2HZ LYS 206 -22.414 27.013 -10.056 1007 3HZ LYS 206 3HZ LYS 206 -22.463 26.035 -8.669 1008 H GLN 207 H GLN 207 -20.337 29.401 -1.695 1009 HA GLN 207 HA GLN 207 -17.482 29.460 -2.612 1010 1HB GLN 207 1HB GLN 207 -19.310 31.333 -1.286 1011 2HB GLN 207 2HB GLN 207 -17.782 31.162 -0.422 1012 1HG GLN 207 1HG GLN 207 -17.509 32.931 -2.046 1013 2HG GLN 207 2HG GLN 207 -16.595 31.536 -2.619 1014 1HE2 GLN 207 1HE2 GLN 207 -17.034 30.909 -4.742 1015 2HE2 GLN 207 2HE2 GLN 207 -18.431 31.328 -5.609 1016 H LEU 208 H LEU 208 -19.613 28.843 0.187 1017 HA LEU 208 HA LEU 208 -17.511 27.016 1.272 1018 1HB LEU 208 1HB LEU 208 -17.878 29.558 2.192 1019 2HB LEU 208 2HB LEU 208 -19.032 28.689 3.204 1020 HG LEU 208 HG LEU 208 -16.433 27.333 2.935 1021 1HD1 LEU 208 1HD1 LEU 208 -16.641 30.037 4.292 1022 2HD1 LEU 208 2HD1 LEU 208 -15.592 29.620 2.937 1023 3HD1 LEU 208 3HD1 LEU 208 -15.308 28.906 4.524 1024 1HD2 LEU 208 1HD2 LEU 208 -17.252 26.437 4.830 1025 2HD2 LEU 208 2HD2 LEU 208 -18.635 27.527 4.739 1026 3HD2 LEU 208 3HD2 LEU 208 -17.183 28.015 5.613 1027 H ALA 209 H ALA 209 -20.164 26.618 -0.092 1028 HA ALA 209 HA ALA 209 -21.750 25.426 2.147 1029 1HB ALA 209 1HB ALA 209 -22.790 27.087 0.583 1030 2HB ALA 209 2HB ALA 209 -23.584 25.514 0.510 1031 3HB ALA 209 3HB ALA 209 -22.455 25.991 -0.758 1032 H THR 210 H THR 210 -19.307 24.161 1.052 1033 HA THR 210 HA THR 210 -20.556 21.684 -0.094 1034 HB THR 210 HB THR 210 -18.461 21.468 -1.399 1035 HG1 THR 210 HG1 THR 210 -16.846 22.448 -0.488 1036 1HG2 THR 210 1HG2 THR 210 -20.504 23.136 -1.946 1037 2HG2 THR 210 2HG2 THR 210 -19.111 22.969 -3.014 1038 3HG2 THR 210 3HG2 THR 210 -19.194 24.315 -1.876 1039 H LYS 211 H LYS 211 -19.082 19.724 0.319 1040 HA LYS 211 HA LYS 211 -17.534 19.987 2.863 1041 1HB LYS 211 1HB LYS 211 -18.763 17.949 3.661 1042 2HB LYS 211 2HB LYS 211 -19.836 19.325 3.404 1043 1HG LYS 211 1HG LYS 211 -20.465 18.444 1.198 1044 2HG LYS 211 2HG LYS 211 -19.355 17.090 1.409 1045 1HD LYS 211 1HD LYS 211 -21.099 15.982 2.330 1046 2HD LYS 211 2HD LYS 211 -20.894 17.040 3.726 1047 1HE LYS 211 1HE LYS 211 -22.657 18.433 3.095 1048 2HE LYS 211 2HE LYS 211 -22.491 18.029 1.376 1049 1HZ LYS 211 1HZ LYS 211 -23.283 15.823 1.808 1050 2HZ LYS 211 2HZ LYS 211 -24.403 16.912 2.473 1051 3HZ LYS 211 3HZ LYS 211 -23.310 16.096 3.484 1052 H ALA 212 H ALA 212 -16.117 18.080 3.228 1053 HA ALA 212 HA ALA 212 -15.470 16.628 0.681 1054 1HB ALA 212 1HB ALA 212 -13.176 16.891 2.353 1055 2HB ALA 212 2HB ALA 212 -13.965 18.468 2.316 1056 3HB ALA 212 3HB ALA 212 -13.473 17.692 0.811 1057 H ALA 213 H ALA 213 -16.858 14.877 1.617 1058 HA ALA 213 HA ALA 213 -15.754 13.528 4.026 1059 1HB ALA 213 1HB ALA 213 -17.934 12.951 4.298 1060 2HB ALA 213 2HB ALA 213 -18.005 12.257 2.678 1061 3HB ALA 213 3HB ALA 213 -18.300 13.979 2.913 1062 H ARG 214 H ARG 214 -14.951 11.378 3.929 1063 HA ARG 214 HA ARG 214 -14.266 10.420 1.173 1064 1HB ARG 214 1HB ARG 214 -12.961 9.966 3.882 1065 2HB ARG 214 2HB ARG 214 -12.349 9.351 2.348 1066 1HG ARG 214 1HG ARG 214 -12.749 12.069 1.869 1067 2HG ARG 214 2HG ARG 214 -12.094 12.019 3.505 1068 1HD ARG 214 1HD ARG 214 -10.175 10.703 2.739 1069 2HD ARG 214 2HD ARG 214 -10.856 10.622 1.103 1070 HE ARG 214 HE ARG 214 -9.526 12.931 2.282 1071 1HH1 ARG 214 1HH1 ARG 214 -12.003 11.892 0.068 1072 2HH1 ARG 214 2HH1 ARG 214 -11.924 13.341 -0.873 1073 1HH2 ARG 214 1HH2 ARG 214 -9.442 14.803 1.044 1074 2HH2 ARG 214 2HH2 ARG 214 -10.486 14.977 -0.327 1075 1HN MLZ 215 1HN MLZ 215 -13.485 7.813 1.960 1076 HA MLZ 215 HA MLZ 215 -15.956 6.389 1.873 1077 1HB MLZ 215 1HB MLZ 215 -13.089 5.708 2.569 1078 2HB MLZ 215 2HB MLZ 215 -14.346 4.471 2.540 1079 1HG MLZ 215 1HG MLZ 215 -13.576 6.287 0.234 1080 2HG MLZ 215 2HG MLZ 215 -14.884 5.105 0.198 1081 1HD MLZ 215 1HD MLZ 215 -11.990 4.414 0.781 1082 2HD MLZ 215 2HD MLZ 215 -13.320 3.282 0.537 1083 1HE MLZ 215 1HE MLZ 215 -11.802 4.880 -1.478 1084 2HE MLZ 215 2HE MLZ 215 -13.535 4.639 -1.775 1085 HZ MLZ 215 HZ MLZ 215 -13.190 2.255 -1.284 1086 1HCM MLZ 215 1HCM MLZ 215 -11.572 3.451 -3.468 1087 2HCM MLZ 215 2HCM MLZ 215 -13.246 2.913 -3.558 1088 3HCM MLZ 215 3HCM MLZ 215 -11.953 1.736 -3.359 1089 H SER 216 H SER 216 -17.418 6.193 3.518 1090 HA SER 216 HA SER 216 -18.299 5.967 5.695 1091 1HB SER 216 1HB SER 216 -16.278 7.190 7.246 1092 2HB SER 216 2HB SER 216 -16.203 7.980 5.672 1093 HG SER 216 HG SER 216 -18.152 8.769 5.944 1094 H ALA 217 H ALA 217 -17.779 4.973 7.888 1095 HA ALA 217 HA ALA 217 -15.495 3.038 7.681 1096 1HB ALA 217 1HB ALA 217 -14.951 3.835 9.732 1097 2HB ALA 217 2HB ALA 217 -16.526 3.329 10.344 1098 3HB ALA 217 3HB ALA 217 -16.323 4.941 9.658 1099 HA PRO 218 HA PRO 218 -18.233 -0.378 7.931 1100 1HB PRO 218 1HB PRO 218 -17.247 -1.811 10.118 1101 2HB PRO 218 2HB PRO 218 -16.593 -1.896 8.473 1102 1HG PRO 218 1HG PRO 218 -15.613 -0.383 10.832 1103 2HG PRO 218 2HG PRO 218 -14.702 -1.163 9.532 1104 1HD PRO 218 1HD PRO 218 -15.070 1.519 9.675 1105 2HD PRO 218 2HD PRO 218 -14.901 0.650 8.135 1106 H ALA 219 H ALA 219 -17.534 -0.249 11.413 1107 HA ALA 219 HA ALA 219 -19.932 1.189 12.150 1108 1HB ALA 219 1HB ALA 219 -20.033 -1.813 12.545 1109 2HB ALA 219 2HB ALA 219 -20.697 -1.046 11.102 1110 3HB ALA 219 3HB ALA 219 -21.355 -0.655 12.690 1111 H THR 220 H THR 220 -17.205 1.228 13.006 1112 HA THR 220 HA THR 220 -16.982 -0.231 15.542 1113 HB THR 220 HB THR 220 -14.938 1.472 15.595 1114 HG1 THR 220 HG1 THR 220 -14.749 2.634 13.870 1115 1HG2 THR 220 1HG2 THR 220 -13.683 -0.215 14.651 1116 2HG2 THR 220 2HG2 THR 220 -14.795 -0.429 13.299 1117 3HG2 THR 220 3HG2 THR 220 -15.192 -1.097 14.882 1118 H GLY 221 H GLY 221 -19.285 1.088 15.893 1119 1HA GLY 221 1HA GLY 221 -20.374 2.609 17.308 1120 2HA GLY 221 2HA GLY 221 -18.826 2.794 18.135 1121 1H MET 1 1H MET 1 -0.962 -12.487 5.310 1122 2H MET 1 2H MET 1 -0.602 -12.176 3.680 1123 3H MET 1 3H MET 1 -1.208 -10.934 4.668 1124 HA MET 1 HA MET 1 1.138 -10.585 4.403 1125 1HB MET 1 1HB MET 1 -0.149 -11.461 6.949 1126 2HB MET 1 2HB MET 1 1.593 -11.200 7.002 1127 1HG MET 1 1HG MET 1 -0.370 -9.179 5.885 1128 2HG MET 1 2HG MET 1 0.214 -9.152 7.550 1129 1HE MET 1 1HE MET 1 1.141 -7.231 4.190 1130 2HE MET 1 2HE MET 1 1.657 -6.244 5.558 1131 3HE MET 1 3HE MET 1 0.111 -7.091 5.615 1132 H PHE 2 H PHE 2 1.382 -13.218 6.742 1133 HA PHE 2 HA PHE 2 3.792 -14.284 5.739 1134 1HB PHE 2 1HB PHE 2 2.998 -16.345 7.053 1135 2HB PHE 2 2HB PHE 2 3.014 -14.829 7.949 1136 HD1 PHE 2 HD1 PHE 2 1.056 -14.033 8.978 1137 HD2 PHE 2 HD2 PHE 2 0.763 -17.024 5.909 1138 HE1 PHE 2 HE1 PHE 2 -1.370 -14.259 9.432 1139 HE2 PHE 2 HE2 PHE 2 -1.665 -17.250 6.363 1140 HZ PHE 2 HZ PHE 2 -2.730 -15.866 8.124 1141 H ASN 3 H ASN 3 4.263 -15.924 4.249 1142 HA ASN 3 HA ASN 3 2.005 -17.277 2.855 1143 1HB ASN 3 1HB ASN 3 2.727 -15.031 1.794 1144 2HB ASN 3 2HB ASN 3 4.228 -15.852 1.368 1145 1HD2 ASN 3 1HD2 ASN 3 3.324 -15.368 -0.932 1146 2HD2 ASN 3 2HD2 ASN 3 2.281 -16.525 -1.606 1147 H ASP 4 H ASP 4 2.817 -19.095 1.489 1148 HA ASP 4 HA ASP 4 4.850 -20.645 2.821 1149 1HB ASP 4 1HB ASP 4 3.259 -20.837 0.256 1150 2HB ASP 4 2HB ASP 4 4.450 -22.067 0.677 1151 H ARG 5 H ARG 5 6.373 -18.565 2.442 1152 HA ARG 5 HA ARG 5 8.543 -19.370 0.772 1153 1HB ARG 5 1HB ARG 5 6.344 -17.934 -0.493 1154 2HB ARG 5 2HB ARG 5 7.843 -17.014 -0.622 1155 1HG ARG 5 1HG ARG 5 8.758 -19.500 -1.217 1156 2HG ARG 5 2HG ARG 5 7.111 -19.621 -1.835 1157 1HD ARG 5 1HD ARG 5 7.561 -17.371 -3.012 1158 2HD ARG 5 2HD ARG 5 9.272 -17.661 -2.645 1159 HE ARG 5 HE ARG 5 8.169 -20.056 -3.733 1160 1HH1 ARG 5 1HH1 ARG 5 8.968 -16.802 -4.677 1161 2HH1 ARG 5 2HH1 ARG 5 9.260 -17.235 -6.325 1162 1HH2 ARG 5 1HH2 ARG 5 8.555 -20.593 -5.879 1163 2HH2 ARG 5 2HH2 ARG 5 9.029 -19.363 -7.003 1164 H VAL 6 H VAL 6 6.777 -16.677 2.238 1165 HA VAL 6 HA VAL 6 9.232 -15.795 3.618 1166 HB VAL 6 HB VAL 6 8.887 -13.450 2.714 1167 1HG1 VAL 6 1HG1 VAL 6 10.484 -15.279 1.771 1168 2HG1 VAL 6 2HG1 VAL 6 10.178 -13.845 0.793 1169 3HG1 VAL 6 3HG1 VAL 6 9.344 -15.355 0.428 1170 1HG2 VAL 6 1HG2 VAL 6 7.315 -12.976 1.100 1171 2HG2 VAL 6 2HG2 VAL 6 6.465 -14.285 1.921 1172 3HG2 VAL 6 3HG2 VAL 6 7.355 -14.608 0.433 1173 H ILE 7 H ILE 7 8.521 -13.659 4.922 1174 HA ILE 7 HA ILE 7 5.670 -13.629 5.656 1175 HB ILE 7 HB ILE 7 6.466 -15.572 6.880 1176 1HG1 ILE 7 1HG1 ILE 7 6.448 -13.223 8.795 1177 2HG1 ILE 7 2HG1 ILE 7 4.995 -13.931 8.089 1178 1HG2 ILE 7 1HG2 ILE 7 8.777 -15.484 6.993 1179 2HG2 ILE 7 2HG2 ILE 7 8.373 -14.992 8.638 1180 3HG2 ILE 7 3HG2 ILE 7 8.796 -13.776 7.432 1181 1HD1 ILE 7 1HD1 ILE 7 6.279 -14.772 10.429 1182 2HD1 ILE 7 2HD1 ILE 7 6.732 -15.975 9.222 1183 3HD1 ILE 7 3HD1 ILE 7 5.030 -15.652 9.549 1184 H VAL 8 H VAL 8 5.304 -11.950 7.419 1185 HA VAL 8 HA VAL 8 7.310 -9.753 7.097 1186 HB VAL 8 HB VAL 8 5.064 -9.339 6.211 1187 1HG1 VAL 8 1HG1 VAL 8 4.309 -10.694 8.687 1188 2HG1 VAL 8 2HG1 VAL 8 3.381 -10.471 7.204 1189 3HG1 VAL 8 3HG1 VAL 8 3.395 -9.207 8.434 1190 1HG2 VAL 8 1HG2 VAL 8 4.766 -7.239 7.157 1191 2HG2 VAL 8 2HG2 VAL 8 6.399 -7.608 7.714 1192 3HG2 VAL 8 3HG2 VAL 8 5.025 -7.828 8.799 1193 H LYS 9 H LYS 9 8.070 -8.673 8.913 1194 HA LYS 9 HA LYS 9 7.124 -9.546 11.597 1195 1HB LYS 9 1HB LYS 9 9.974 -9.509 10.553 1196 2HB LYS 9 2HB LYS 9 9.525 -9.848 12.223 1197 1HG LYS 9 1HG LYS 9 7.906 -11.605 10.952 1198 2HG LYS 9 2HG LYS 9 9.247 -11.552 9.808 1199 1HD LYS 9 1HD LYS 9 10.543 -12.781 11.182 1200 2HD LYS 9 2HD LYS 9 10.239 -11.684 12.526 1201 1HE LYS 9 1HE LYS 9 7.943 -12.866 12.732 1202 2HE LYS 9 2HE LYS 9 8.651 -14.122 11.699 1203 1HZ LYS 9 1HZ LYS 9 9.574 -13.171 14.348 1204 2HZ LYS 9 2HZ LYS 9 10.629 -13.974 13.287 1205 3HZ LYS 9 3HZ LYS 9 9.237 -14.762 13.857 1206 H LYS 10 H LYS 10 7.854 -6.169 12.657 1207 HA LYS 10 HA LYS 10 6.910 -7.342 14.435 1208 1HB LYS 10 1HB LYS 10 5.663 -8.177 11.932 1209 2HB LYS 10 2HB LYS 10 5.545 -9.427 13.170 1210 1HG LYS 10 1HG LYS 10 4.889 -6.545 13.782 1211 2HG LYS 10 2HG LYS 10 3.680 -7.637 13.108 1212 1HD LYS 10 1HD LYS 10 3.642 -8.985 15.008 1213 2HD LYS 10 2HD LYS 10 5.270 -8.516 15.497 1214 1HE LYS 10 1HE LYS 10 3.285 -6.306 15.401 1215 2HE LYS 10 2HE LYS 10 3.041 -7.512 16.680 1216 1HZ LYS 10 1HZ LYS 10 4.610 -5.753 17.347 1217 2HZ LYS 10 2HZ LYS 10 5.627 -6.175 16.054 1218 3HZ LYS 10 3HZ LYS 10 5.350 -7.282 17.312 1219 H SER 11 H SER 11 9.464 -7.979 14.343 1220 HA SER 11 HA SER 11 9.709 -10.954 14.244 1221 1HB SER 11 1HB SER 11 12.063 -9.211 14.760 1222 2HB SER 11 2HB SER 11 11.891 -10.543 13.621 1223 HG SER 11 HG SER 11 11.876 -8.016 13.056 1224 HA PRO 12 HA PRO 12 10.472 -11.586 18.541 1225 1HB PRO 12 1HB PRO 12 13.445 -11.483 18.311 1226 2HB PRO 12 2HB PRO 12 12.414 -12.771 18.959 1227 1HG PRO 12 1HG PRO 12 13.630 -12.960 16.571 1228 2HG PRO 12 2HG PRO 12 12.057 -13.698 16.899 1229 1HD PRO 12 1HD PRO 12 12.719 -11.293 15.296 1230 2HD PRO 12 2HD PRO 12 11.374 -12.439 15.121 1231 H LEU 13 H LEU 13 12.968 -9.331 17.299 1232 HA LEU 13 HA LEU 13 12.011 -7.239 19.152 1233 1HB LEU 13 1HB LEU 13 13.920 -9.031 20.006 1234 2HB LEU 13 2HB LEU 13 14.922 -7.738 19.348 1235 HG LEU 13 HG LEU 13 13.322 -6.165 20.701 1236 1HD1 LEU 13 1HD1 LEU 13 11.760 -7.199 21.947 1237 2HD1 LEU 13 2HD1 LEU 13 13.040 -8.012 22.848 1238 3HD1 LEU 13 3HD1 LEU 13 12.352 -8.772 21.413 1239 1HD2 LEU 13 1HD2 LEU 13 15.442 -7.953 21.917 1240 2HD2 LEU 13 2HD2 LEU 13 14.760 -6.561 22.759 1241 3HD2 LEU 13 3HD2 LEU 13 15.654 -6.332 21.256 1242 H GLY 14 H GLY 14 12.341 -7.630 16.197 1243 1HA GLY 14 1HA GLY 14 14.452 -5.609 15.615 1244 2HA GLY 14 2HA GLY 14 13.728 -6.687 14.421 1245 H GLY 15 H GLY 15 13.215 -4.804 13.108 1246 1HA GLY 15 1HA GLY 15 11.102 -3.027 14.235 1247 2HA GLY 15 2HA GLY 15 12.064 -2.669 12.800 1248 H TYR 16 H TYR 16 10.252 -2.417 11.409 1249 HA TYR 16 HA TYR 16 8.500 -4.816 11.077 1250 1HB TYR 16 1HB TYR 16 8.245 -1.879 10.820 1251 2HB TYR 16 2HB TYR 16 7.426 -2.798 9.558 1252 HD1 TYR 16 HD1 TYR 16 5.186 -3.216 10.007 1253 HD2 TYR 16 HD2 TYR 16 7.998 -3.200 13.253 1254 HE1 TYR 16 HE1 TYR 16 3.360 -3.769 11.591 1255 HE2 TYR 16 HE2 TYR 16 6.172 -3.753 14.837 1256 HH TYR 16 HH TYR 16 3.157 -4.862 13.850 1257 H GLY 17 H GLY 17 10.348 -5.869 9.868 1258 1HA GLY 17 1HA GLY 17 10.532 -4.835 7.065 1259 2HA GLY 17 2HA GLY 17 11.829 -5.742 7.845 1260 H VAL 18 H VAL 18 11.501 -7.201 5.886 1261 HA VAL 18 HA VAL 18 9.211 -9.075 6.392 1262 HB VAL 18 HB VAL 18 8.854 -8.043 4.275 1263 1HG1 VAL 18 1HG1 VAL 18 11.804 -8.465 3.732 1264 2HG1 VAL 18 2HG1 VAL 18 11.006 -6.926 4.027 1265 3HG1 VAL 18 3HG1 VAL 18 10.649 -7.837 2.561 1266 1HG2 VAL 18 1HG2 VAL 18 9.236 -9.839 2.628 1267 2HG2 VAL 18 2HG2 VAL 18 8.681 -10.500 4.166 1268 3HG2 VAL 18 3HG2 VAL 18 10.386 -10.603 3.726 1269 H PHE 19 H PHE 19 9.819 -11.132 6.943 1270 HA PHE 19 HA PHE 19 12.704 -11.733 7.087 1271 1HB PHE 19 1HB PHE 19 10.200 -12.474 8.387 1272 2HB PHE 19 2HB PHE 19 11.176 -13.896 8.021 1273 HD1 PHE 19 HD1 PHE 19 11.914 -10.372 9.111 1274 HD2 PHE 19 HD2 PHE 19 12.483 -14.570 9.819 1275 HE1 PHE 19 HE1 PHE 19 13.397 -9.848 11.029 1276 HE2 PHE 19 HE2 PHE 19 13.966 -14.046 11.736 1277 HZ PHE 19 HZ PHE 19 14.423 -11.685 12.341 1278 H ALA 20 H ALA 20 13.569 -13.767 6.271 1279 HA ALA 20 HA ALA 20 12.186 -14.684 3.783 1280 1HB ALA 20 1HB ALA 20 14.810 -13.830 4.430 1281 2HB ALA 20 2HB ALA 20 14.263 -14.496 2.891 1282 3HB ALA 20 3HB ALA 20 14.927 -15.564 4.128 1283 H ARG 21 H ARG 21 10.861 -16.342 4.640 1284 HA ARG 21 HA ARG 21 11.793 -18.323 6.536 1285 1HB ARG 21 1HB ARG 21 9.412 -17.508 5.868 1286 2HB ARG 21 2HB ARG 21 9.558 -18.636 4.521 1287 1HG ARG 21 1HG ARG 21 9.727 -20.507 5.966 1288 2HG ARG 21 2HG ARG 21 10.087 -19.498 7.366 1289 1HD ARG 21 1HD ARG 21 7.683 -18.464 6.749 1290 2HD ARG 21 2HD ARG 21 7.451 -20.097 6.095 1291 HE ARG 21 HE ARG 21 7.784 -19.408 8.920 1292 1HH1 ARG 21 1HH1 ARG 21 8.211 -21.851 6.478 1293 2HH1 ARG 21 2HH1 ARG 21 8.175 -23.152 7.617 1294 1HH2 ARG 21 1HH2 ARG 21 7.740 -21.114 10.380 1295 2HH2 ARG 21 2HH2 ARG 21 7.910 -22.740 9.809 1296 H LYS 22 H LYS 22 12.175 -17.894 3.118 1297 HA LYS 22 HA LYS 22 12.898 -20.749 2.676 1298 1HB LYS 22 1HB LYS 22 12.665 -18.324 0.846 1299 2HB LYS 22 2HB LYS 22 12.919 -19.980 0.302 1300 1HG LYS 22 1HG LYS 22 10.610 -19.486 2.119 1301 2HG LYS 22 2HG LYS 22 10.470 -18.912 0.457 1302 1HD LYS 22 1HD LYS 22 11.413 -21.714 1.052 1303 2HD LYS 22 2HD LYS 22 9.692 -21.335 0.978 1304 1HE LYS 22 1HE LYS 22 9.819 -21.535 -1.278 1305 2HE LYS 22 2HE LYS 22 10.877 -20.111 -1.296 1306 1HZ LYS 22 1HZ LYS 22 11.633 -22.967 -1.048 1307 2HZ LYS 22 2HZ LYS 22 12.688 -21.724 -0.573 1308 3HZ LYS 22 3HZ LYS 22 12.177 -21.833 -2.189 1309 H SER 23 H SER 23 16.377 -19.941 1.720 1310 HA SER 23 HA SER 23 13.915 -21.512 1.058 1311 1HB SER 23 1HB SER 23 15.830 -22.702 2.066 1312 2HB SER 23 2HB SER 23 15.608 -23.220 0.395 1313 HG SER 23 HG SER 23 17.444 -22.351 -0.126 1314 H PHE 24 H PHE 24 16.346 -19.379 -0.249 1315 HA PHE 24 HA PHE 24 15.154 -19.759 -2.976 1316 1HB PHE 24 1HB PHE 24 16.294 -17.379 -1.477 1317 2HB PHE 24 2HB PHE 24 15.925 -17.325 -3.200 1318 HD1 PHE 24 HD1 PHE 24 13.481 -18.874 -3.451 1319 HD2 PHE 24 HD2 PHE 24 14.654 -16.126 -0.364 1320 HE1 PHE 24 HE1 PHE 24 11.095 -18.443 -2.928 1321 HE2 PHE 24 HE2 PHE 24 12.269 -15.695 0.159 1322 HZ PHE 24 HZ PHE 24 10.489 -16.854 -1.123 1323 H GLU 25 H GLU 25 16.627 -19.601 -4.790 1324 HA GLU 25 HA GLU 25 19.339 -20.593 -4.187 1325 1HB GLU 25 1HB GLU 25 17.413 -20.514 -6.412 1326 2HB GLU 25 2HB GLU 25 19.080 -20.265 -6.930 1327 1HG GLU 25 1HG GLU 25 19.420 -22.318 -5.185 1328 2HG GLU 25 2HG GLU 25 17.798 -22.673 -5.778 1329 H LYS 26 H LYS 26 18.538 -18.323 -6.800 1330 HA LYS 26 HA LYS 26 19.724 -16.000 -5.601 1331 1HB LYS 26 1HB LYS 26 21.712 -17.547 -5.752 1332 2HB LYS 26 2HB LYS 26 21.514 -17.559 -7.502 1333 1HG LYS 26 1HG LYS 26 21.625 -14.981 -7.337 1334 2HG LYS 26 2HG LYS 26 22.252 -15.244 -5.710 1335 1HD LYS 26 1HD LYS 26 23.923 -16.873 -6.859 1336 2HD LYS 26 2HD LYS 26 23.469 -16.045 -8.348 1337 1HE LYS 26 1HE LYS 26 23.924 -13.885 -6.794 1338 2HE LYS 26 2HE LYS 26 25.036 -15.031 -6.024 1339 1HZ LYS 26 1HZ LYS 26 25.871 -15.605 -8.246 1340 2HZ LYS 26 2HZ LYS 26 26.120 -13.963 -7.893 1341 3HZ LYS 26 3HZ LYS 26 24.860 -14.426 -8.933 1342 H GLY 27 H GLY 27 17.945 -15.024 -6.695 1343 1HA GLY 27 1HA GLY 27 17.744 -13.507 -8.683 1344 2HA GLY 27 2HA GLY 27 18.251 -14.878 -9.668 1345 H GLU 28 H GLU 28 16.124 -15.584 -7.028 1346 HA GLU 28 HA GLU 28 13.966 -16.203 -8.979 1347 1HB GLU 28 1HB GLU 28 14.420 -16.916 -6.056 1348 2HB GLU 28 2HB GLU 28 13.118 -17.554 -7.059 1349 1HG GLU 28 1HG GLU 28 14.749 -18.572 -8.577 1350 2HG GLU 28 2HG GLU 28 16.077 -17.875 -7.648 1351 H LEU 29 H LEU 29 11.796 -15.460 -8.595 1352 HA LEU 29 HA LEU 29 11.624 -12.791 -7.426 1353 1HB LEU 29 1HB LEU 29 10.451 -13.905 -9.495 1354 2HB LEU 29 2HB LEU 29 9.313 -14.527 -8.302 1355 HG LEU 29 HG LEU 29 8.535 -12.382 -9.267 1356 1HD1 LEU 29 1HD1 LEU 29 7.825 -11.477 -7.234 1357 2HD1 LEU 29 2HD1 LEU 29 9.377 -11.768 -6.448 1358 3HD1 LEU 29 3HD1 LEU 29 8.278 -13.113 -6.757 1359 1HD2 LEU 29 1HD2 LEU 29 10.369 -10.626 -7.906 1360 2HD2 LEU 29 2HD2 LEU 29 9.969 -10.686 -9.623 1361 3HD2 LEU 29 3HD2 LEU 29 11.269 -11.691 -8.985 1362 H VAL 30 H VAL 30 11.248 -12.434 -5.288 1363 HA VAL 30 HA VAL 30 10.311 -14.604 -3.538 1364 HB VAL 30 HB VAL 30 11.080 -11.690 -3.123 1365 1HG1 VAL 30 1HG1 VAL 30 11.384 -12.735 -0.690 1366 2HG1 VAL 30 2HG1 VAL 30 10.112 -13.818 -1.255 1367 3HG1 VAL 30 3HG1 VAL 30 9.833 -12.077 -1.210 1368 1HG2 VAL 30 1HG2 VAL 30 12.536 -14.318 -2.727 1369 2HG2 VAL 30 2HG2 VAL 30 13.120 -12.777 -2.097 1370 3HG2 VAL 30 3HG2 VAL 30 12.965 -13.017 -3.837 1371 H GLU 31 H GLU 31 9.163 -11.355 -4.506 1372 HA GLU 31 HA GLU 31 6.387 -12.147 -4.499 1373 1HB GLU 31 1HB GLU 31 7.606 -11.626 -1.989 1374 2HB GLU 31 2HB GLU 31 6.585 -10.230 -2.337 1375 1HG GLU 31 1HG GLU 31 5.596 -13.072 -2.644 1376 2HG GLU 31 2HG GLU 31 5.450 -12.183 -1.128 1377 H GLU 32 H GLU 32 5.110 -10.490 -5.419 1378 HA GLU 32 HA GLU 32 6.498 -7.875 -5.913 1379 1HB GLU 32 1HB GLU 32 5.492 -8.004 -8.194 1380 2HB GLU 32 2HB GLU 32 6.561 -9.370 -7.877 1381 1HG GLU 32 1HG GLU 32 4.700 -10.824 -7.423 1382 2HG GLU 32 2HG GLU 32 3.569 -9.470 -7.418 1383 H CYS 33 H CYS 33 5.103 -6.044 -5.981 1384 HA CYS 33 HA CYS 33 2.213 -6.512 -5.389 1385 1HB CYS 33 1HB CYS 33 4.121 -4.722 -3.835 1386 2HB CYS 33 2HB CYS 33 2.402 -4.921 -3.502 1387 HG CYS 33 HG CYS 33 3.391 -6.662 -1.955 1388 H LEU 34 H LEU 34 1.766 -3.688 -4.849 1389 HA LEU 34 HA LEU 34 2.174 -2.618 -7.617 1390 1HB LEU 34 1HB LEU 34 -0.057 -2.923 -5.849 1391 2HB LEU 34 2HB LEU 34 0.218 -1.197 -6.067 1392 HG LEU 34 HG LEU 34 0.251 -1.545 -8.534 1393 1HD1 LEU 34 1HD1 LEU 34 -0.211 -4.384 -7.644 1394 2HD1 LEU 34 2HD1 LEU 34 0.912 -3.774 -8.860 1395 3HD1 LEU 34 3HD1 LEU 34 -0.816 -3.836 -9.207 1396 1HD2 LEU 34 1HD2 LEU 34 -2.182 -2.488 -6.995 1397 2HD2 LEU 34 2HD2 LEU 34 -2.210 -2.142 -8.724 1398 3HD2 LEU 34 3HD2 LEU 34 -1.843 -0.856 -7.574 1399 H CYS 35 H CYS 35 2.078 -0.087 -7.557 1400 HA CYS 35 HA CYS 35 3.419 1.070 -5.172 1401 1HB CYS 35 1HB CYS 35 4.544 0.708 -7.945 1402 2HB CYS 35 2HB CYS 35 5.056 2.091 -6.977 1403 HG CYS 35 HG CYS 35 6.690 0.286 -6.236 1404 H ILE 36 H ILE 36 3.483 3.512 -5.386 1405 HA ILE 36 HA ILE 36 1.142 4.437 -7.013 1406 HB ILE 36 HB ILE 36 2.482 5.722 -4.608 1407 1HG1 ILE 36 1HG1 ILE 36 0.083 3.865 -4.759 1408 2HG1 ILE 36 2HG1 ILE 36 1.617 3.534 -3.956 1409 1HG2 ILE 36 1HG2 ILE 36 0.394 7.003 -4.472 1410 2HG2 ILE 36 2HG2 ILE 36 -0.252 6.128 -5.860 1411 3HG2 ILE 36 3HG2 ILE 36 1.124 7.212 -6.064 1412 1HD1 ILE 36 1HD1 ILE 36 0.519 6.043 -3.015 1413 2HD1 ILE 36 2HD1 ILE 36 0.939 4.601 -2.092 1414 3HD1 ILE 36 3HD1 ILE 36 -0.661 4.747 -2.821 1415 H VAL 37 H VAL 37 1.428 6.170 -8.443 1416 HA VAL 37 HA VAL 37 4.247 7.152 -8.749 1417 HB VAL 37 HB VAL 37 2.008 6.761 -10.771 1418 1HG1 VAL 37 1HG1 VAL 37 4.067 6.996 -12.349 1419 2HG1 VAL 37 2HG1 VAL 37 4.835 7.784 -10.970 1420 3HG1 VAL 37 3HG1 VAL 37 3.364 8.463 -11.667 1421 1HG2 VAL 37 1HG2 VAL 37 3.879 5.031 -11.548 1422 2HG2 VAL 37 2HG2 VAL 37 2.682 4.591 -10.330 1423 3HG2 VAL 37 3HG2 VAL 37 4.301 5.085 -9.836 1424 H ARG 38 H ARG 38 4.450 9.287 -8.231 1425 HA ARG 38 HA ARG 38 2.313 11.187 -9.035 1426 1HB ARG 38 1HB ARG 38 1.807 10.353 -6.742 1427 2HB ARG 38 2HB ARG 38 3.403 10.885 -6.217 1428 1HG ARG 38 1HG ARG 38 1.668 12.557 -5.650 1429 2HG ARG 38 2HG ARG 38 2.836 13.208 -6.800 1430 1HD ARG 38 1HD ARG 38 1.312 12.994 -8.626 1431 2HD ARG 38 2HD ARG 38 0.236 11.932 -7.698 1432 HE ARG 38 HE ARG 38 0.605 14.445 -6.329 1433 1HH1 ARG 38 1HH1 ARG 38 -1.034 12.970 -9.022 1434 2HH1 ARG 38 2HH1 ARG 38 -2.334 14.110 -8.997 1435 1HH2 ARG 38 1HH2 ARG 38 -1.092 15.912 -6.316 1436 2HH2 ARG 38 2HH2 ARG 38 -2.369 15.764 -7.477 1437 H HIS 39 H HIS 39 3.155 13.249 -9.487 1438 HA HIS 39 HA HIS 39 5.905 13.568 -10.082 1439 1HB HIS 39 1HB HIS 39 3.736 15.593 -9.418 1440 2HB HIS 39 2HB HIS 39 5.250 15.981 -10.236 1441 HD1 HIS 39 HD1 HIS 39 2.142 15.973 -11.373 1442 HD2 HIS 39 HD2 HIS 39 5.238 13.344 -12.310 1443 HE1 HIS 39 HE1 HIS 39 1.567 14.962 -13.623 1444 H ASN 40 H ASN 40 6.882 15.848 -8.950 1445 HA ASN 40 HA ASN 40 7.258 15.040 -6.095 1446 1HB ASN 40 1HB ASN 40 8.905 16.256 -8.271 1447 2HB ASN 40 2HB ASN 40 9.273 16.754 -6.620 1448 1HD2 ASN 40 1HD2 ASN 40 10.401 15.268 -5.293 1449 2HD2 ASN 40 2HD2 ASN 40 10.805 13.692 -5.774 1450 H ASP 41 H ASP 41 5.704 16.195 -4.967 1451 HA ASP 41 HA ASP 41 6.076 19.095 -4.722 1452 1HB ASP 41 1HB ASP 41 3.731 19.555 -5.441 1453 2HB ASP 41 2HB ASP 41 4.669 18.833 -6.746 1454 H ASP 42 H ASP 42 3.081 19.008 -3.708 1455 HA ASP 42 HA ASP 42 3.524 18.630 -0.954 1456 1HB ASP 42 1HB ASP 42 1.113 18.314 -2.765 1457 2HB ASP 42 2HB ASP 42 0.977 18.189 -1.011 1458 H TRP 43 H TRP 43 3.043 16.287 -3.495 1459 HA TRP 43 HA TRP 43 2.278 13.983 -2.014 1460 1HB TRP 43 1HB TRP 43 2.224 13.959 -4.399 1461 2HB TRP 43 2HB TRP 43 3.872 14.564 -4.525 1462 HD1 TRP 43 HD1 TRP 43 5.679 12.832 -4.942 1463 HE1 TRP 43 HE1 TRP 43 5.837 10.263 -4.793 1464 HE3 TRP 43 HE3 TRP 43 1.124 11.784 -2.883 1465 HZ2 TRP 43 HZ2 TRP 43 4.243 8.059 -3.921 1466 HZ3 TRP 43 HZ3 TRP 43 0.472 9.443 -2.403 1467 HH2 TRP 43 HH2 TRP 43 2.024 7.579 -2.917 1468 H GLY 44 H GLY 44 5.578 14.995 -3.014 1469 1HA GLY 44 1HA GLY 44 6.989 13.044 -1.523 1470 2HA GLY 44 2HA GLY 44 7.657 14.607 -1.998 1471 H THR 45 H THR 45 5.656 16.170 -0.549 1472 HA THR 45 HA THR 45 6.945 16.262 2.037 1473 HB THR 45 HB THR 45 4.346 17.498 1.053 1474 HG1 THR 45 HG1 THR 45 5.635 18.495 -0.249 1475 1HG2 THR 45 1HG2 THR 45 6.098 17.873 3.437 1476 2HG2 THR 45 2HG2 THR 45 4.350 18.056 3.288 1477 3HG2 THR 45 3HG2 THR 45 5.422 19.327 2.700 1478 H ALA 46 H ALA 46 3.450 15.803 1.368 1479 HA ALA 46 HA ALA 46 2.722 14.780 3.880 1480 1HB ALA 46 1HB ALA 46 0.967 15.310 2.427 1481 2HB ALA 46 2HB ALA 46 0.964 13.550 2.303 1482 3HB ALA 46 3HB ALA 46 1.739 14.522 1.051 1483 H LEU 47 H LEU 47 3.604 12.884 0.963 1484 HA LEU 47 HA LEU 47 3.743 10.413 2.585 1485 1HB LEU 47 1HB LEU 47 3.884 11.201 -0.324 1486 2HB LEU 47 2HB LEU 47 4.411 9.592 0.168 1487 HG LEU 47 HG LEU 47 2.038 9.563 -0.484 1488 1HD1 LEU 47 1HD1 LEU 47 1.830 9.340 2.470 1489 2HD1 LEU 47 2HD1 LEU 47 3.112 8.397 1.709 1490 3HD1 LEU 47 3HD1 LEU 47 1.433 8.160 1.221 1491 1HD2 LEU 47 1HD2 LEU 47 0.417 10.957 0.464 1492 2HD2 LEU 47 2HD2 LEU 47 1.800 12.043 0.330 1493 3HD2 LEU 47 3HD2 LEU 47 1.405 11.305 1.882 1494 H GLU 48 H GLU 48 5.731 12.437 3.240 1495 HA GLU 48 HA GLU 48 8.240 11.922 1.915 1496 1HB GLU 48 1HB GLU 48 9.115 13.113 3.946 1497 2HB GLU 48 2HB GLU 48 7.746 13.946 3.210 1498 1HG GLU 48 1HG GLU 48 6.704 13.852 5.205 1499 2HG GLU 48 2HG GLU 48 6.624 12.100 5.020 1500 H ASP 49 H ASP 49 7.557 9.387 2.148 1501 HA ASP 49 HA ASP 49 9.552 8.158 3.795 1502 1HB ASP 49 1HB ASP 49 7.288 9.012 5.192 1503 2HB ASP 49 2HB ASP 49 6.982 7.297 4.922 1504 H TYR 50 H TYR 50 9.828 6.035 3.104 1505 HA TYR 50 HA TYR 50 9.461 4.056 1.868 1506 1HB TYR 50 1HB TYR 50 6.510 4.707 2.024 1507 2HB TYR 50 2HB TYR 50 7.285 3.128 2.082 1508 HD1 TYR 50 HD1 TYR 50 5.632 5.481 4.018 1509 HD2 TYR 50 HD2 TYR 50 9.118 2.972 4.123 1510 HE1 TYR 50 HE1 TYR 50 5.638 5.595 6.494 1511 HE2 TYR 50 HE2 TYR 50 9.124 3.087 6.599 1512 HH TYR 50 HH TYR 50 7.288 3.522 8.426 1513 H LEU 51 H LEU 51 9.710 6.678 0.458 1514 HA LEU 51 HA LEU 51 7.986 6.188 -1.939 1515 1HB LEU 51 1HB LEU 51 9.528 8.544 -0.824 1516 2HB LEU 51 2HB LEU 51 8.951 8.544 -2.487 1517 HG LEU 51 HG LEU 51 7.282 8.377 0.039 1518 1HD1 LEU 51 1HD1 LEU 51 6.212 10.378 -1.280 1519 2HD1 LEU 51 2HD1 LEU 51 7.748 10.391 -2.146 1520 3HD1 LEU 51 3HD1 LEU 51 7.718 10.635 -0.400 1521 1HD2 LEU 51 1HD2 LEU 51 5.342 8.389 -1.622 1522 2HD2 LEU 51 2HD2 LEU 51 6.219 6.866 -1.483 1523 3HD2 LEU 51 3HD2 LEU 51 6.516 7.932 -2.856 1524 H PHE 52 H PHE 52 8.912 5.548 -3.833 1525 HA PHE 52 HA PHE 52 11.904 5.420 -3.983 1526 1HB PHE 52 1HB PHE 52 9.602 3.799 -5.068 1527 2HB PHE 52 2HB PHE 52 11.160 3.756 -5.890 1528 HD1 PHE 52 HD1 PHE 52 12.786 2.239 -5.161 1529 HD2 PHE 52 HD2 PHE 52 9.688 3.470 -2.451 1530 HE1 PHE 52 HE1 PHE 52 13.633 0.639 -3.466 1531 HE2 PHE 52 HE2 PHE 52 10.535 1.870 -0.757 1532 HZ PHE 52 HZ PHE 52 12.507 0.454 -1.264 1533 H SER 53 H SER 53 12.426 7.396 -4.975 1534 HA SER 53 HA SER 53 10.696 8.474 -7.098 1535 1HB SER 53 1HB SER 53 11.811 9.775 -5.223 1536 2HB SER 53 2HB SER 53 13.352 9.474 -6.025 1537 HG SER 53 HG SER 53 12.460 10.488 -7.889 1538 H ARG 54 H ARG 54 11.033 8.146 -9.228 1539 HA ARG 54 HA ARG 54 13.622 6.957 -10.122 1540 1HB ARG 54 1HB ARG 54 10.887 6.459 -10.618 1541 2HB ARG 54 2HB ARG 54 11.503 7.184 -12.103 1542 1HG ARG 54 1HG ARG 54 12.853 5.402 -12.564 1543 2HG ARG 54 2HG ARG 54 13.257 5.143 -10.866 1544 1HD ARG 54 1HD ARG 54 11.399 3.789 -10.496 1545 2HD ARG 54 2HD ARG 54 10.454 4.564 -11.782 1546 HE ARG 54 HE ARG 54 11.452 3.069 -13.319 1547 1HH1 ARG 54 1HH1 ARG 54 13.323 3.252 -10.389 1548 2HH1 ARG 54 2HH1 ARG 54 14.419 2.008 -10.882 1549 1HH2 ARG 54 1HH2 ARG 54 12.888 1.458 -13.936 1550 2HH2 ARG 54 2HH2 ARG 54 14.177 0.999 -12.874 1551 H LYS 55 H LYS 55 13.984 7.733 -12.597 1552 HA LYS 55 HA LYS 55 14.534 10.585 -12.442 1553 1HB LYS 55 1HB LYS 55 15.202 8.240 -14.045 1554 2HB LYS 55 2HB LYS 55 14.939 9.656 -15.063 1555 1HG LYS 55 1HG LYS 55 16.422 10.795 -13.123 1556 2HG LYS 55 2HG LYS 55 17.048 9.149 -13.022 1557 1HD LYS 55 1HD LYS 55 18.024 9.252 -15.093 1558 2HD LYS 55 2HD LYS 55 16.741 10.262 -15.759 1559 1HE LYS 55 1HE LYS 55 18.178 12.013 -15.555 1560 2HE LYS 55 2HE LYS 55 17.981 11.862 -13.799 1561 1HZ LYS 55 1HZ LYS 55 19.779 10.368 -13.671 1562 2HZ LYS 55 2HZ LYS 55 20.328 11.613 -14.687 1563 3HZ LYS 55 3HZ LYS 55 19.825 10.134 -15.353 1564 H ASN 56 H ASN 56 12.141 11.093 -12.164 1565 HA ASN 56 HA ASN 56 10.344 10.804 -14.423 1566 1HB ASN 56 1HB ASN 56 11.457 13.576 -13.925 1567 2HB ASN 56 2HB ASN 56 12.201 12.482 -15.092 1568 1HD2 ASN 56 1HD2 ASN 56 11.349 12.617 -17.174 1569 2HD2 ASN 56 2HD2 ASN 56 9.807 13.211 -17.560 1570 H MET 57 H MET 57 10.413 10.606 -11.415 1571 HA MET 57 HA MET 57 8.934 12.802 -10.280 1572 1HB MET 57 1HB MET 57 6.688 11.759 -10.344 1573 2HB MET 57 2HB MET 57 7.298 12.018 -11.975 1574 1HG MET 57 1HG MET 57 7.884 9.394 -10.660 1575 2HG MET 57 2HG MET 57 6.251 9.681 -11.252 1576 1HE MET 57 1HE MET 57 6.245 10.910 -14.278 1577 2HE MET 57 2HE MET 57 5.458 9.857 -13.102 1578 3HE MET 57 3HE MET 57 6.080 9.185 -14.610 1579 H SER 58 H SER 58 7.357 11.578 -8.422 1580 HA SER 58 HA SER 58 9.244 9.733 -6.995 1581 1HB SER 58 1HB SER 58 7.806 10.800 -5.009 1582 2HB SER 58 2HB SER 58 9.177 11.668 -5.698 1583 HG SER 58 HG SER 58 7.638 13.131 -5.884 1584 H ALA 59 H ALA 59 8.379 7.803 -6.222 1585 HA ALA 59 HA ALA 59 5.413 7.432 -6.475 1586 1HB ALA 59 1HB ALA 59 6.105 6.206 -8.298 1587 2HB ALA 59 2HB ALA 59 6.447 4.981 -7.077 1588 3HB ALA 59 3HB ALA 59 7.743 6.019 -7.673 1589 H MET 60 H MET 60 4.694 5.439 -5.181 1590 HA MET 60 HA MET 60 6.258 5.310 -2.632 1591 1HB MET 60 1HB MET 60 3.648 5.967 -3.096 1592 2HB MET 60 2HB MET 60 3.494 4.233 -2.808 1593 1HG MET 60 1HG MET 60 5.150 4.845 -0.780 1594 2HG MET 60 2HG MET 60 4.341 6.403 -0.947 1595 1HE MET 60 1HE MET 60 3.491 6.673 0.882 1596 2HE MET 60 2HE MET 60 3.165 5.351 2.003 1597 3HE MET 60 3HE MET 60 1.827 6.234 1.268 1598 H ALA 61 H ALA 61 6.030 3.096 -1.511 1599 HA ALA 61 HA ALA 61 6.911 1.037 -3.385 1600 1HB ALA 61 1HB ALA 61 6.589 -0.044 -0.814 1601 2HB ALA 61 2HB ALA 61 6.943 1.661 -0.536 1602 3HB ALA 61 3HB ALA 61 8.064 0.668 -1.467 1603 H LEU 62 H LEU 62 4.015 1.575 -1.376 1604 HA LEU 62 HA LEU 62 2.487 -0.235 -3.088 1605 1HB LEU 62 1HB LEU 62 1.205 0.667 -0.626 1606 2HB LEU 62 2HB LEU 62 2.036 1.989 -1.447 1607 HG LEU 62 HG LEU 62 0.892 1.201 -3.588 1608 1HD1 LEU 62 1HD1 LEU 62 -0.290 -0.641 -1.561 1609 2HD1 LEU 62 2HD1 LEU 62 0.069 -0.927 -3.263 1610 3HD1 LEU 62 3HD1 LEU 62 -1.368 -0.013 -2.807 1611 1HD2 LEU 62 1HD2 LEU 62 -1.350 1.899 -1.821 1612 2HD2 LEU 62 2HD2 LEU 62 -0.685 2.781 -3.196 1613 3HD2 LEU 62 3HD2 LEU 62 0.063 2.931 -1.606 1614 H GLY 63 H GLY 63 3.279 -2.357 -2.699 1615 1HA GLY 63 1HA GLY 63 2.070 -3.718 -0.466 1616 2HA GLY 63 2HA GLY 63 3.157 -4.450 -1.643 1617 H PHE 64 H PHE 64 5.000 -5.207 -0.758 1618 HA PHE 64 HA PHE 64 5.823 -4.292 1.929 1619 1HB PHE 64 1HB PHE 64 6.925 -6.419 0.053 1620 2HB PHE 64 2HB PHE 64 7.291 -6.265 1.771 1621 HD1 PHE 64 HD1 PHE 64 5.151 -7.787 -0.623 1622 HD2 PHE 64 HD2 PHE 64 5.221 -6.254 3.389 1623 HE1 PHE 64 HE1 PHE 64 3.145 -9.138 -0.072 1624 HE2 PHE 64 HE2 PHE 64 3.217 -7.604 3.939 1625 HZ PHE 64 HZ PHE 64 2.178 -9.046 2.210 1626 H GLY 65 H GLY 65 6.232 -2.560 -0.550 1627 1HA GLY 65 1HA GLY 65 9.106 -2.585 -1.027 1628 2HA GLY 65 2HA GLY 65 7.976 -1.358 -1.595 1629 H ALA 66 H ALA 66 6.971 -1.130 1.296 1630 HA ALA 66 HA ALA 66 8.959 0.906 2.108 1631 1HB ALA 66 1HB ALA 66 7.137 1.561 3.641 1632 2HB ALA 66 2HB ALA 66 6.248 0.098 3.219 1633 3HB ALA 66 3HB ALA 66 6.513 1.349 2.005 1634 H ILE 67 H ILE 67 7.346 -1.954 3.558 1635 HA ILE 67 HA ILE 67 8.499 -1.993 6.095 1636 HB ILE 67 HB ILE 67 8.307 -4.507 5.837 1637 1HG1 ILE 67 1HG1 ILE 67 7.036 -4.926 3.486 1638 2HG1 ILE 67 2HG1 ILE 67 8.174 -3.679 2.985 1639 1HG2 ILE 67 1HG2 ILE 67 6.072 -2.702 4.900 1640 2HG2 ILE 67 2HG2 ILE 67 6.345 -3.339 6.523 1641 3HG2 ILE 67 3HG2 ILE 67 5.836 -4.420 5.225 1642 1HD1 ILE 67 1HD1 ILE 67 8.805 -6.310 3.066 1643 2HD1 ILE 67 2HD1 ILE 67 9.285 -5.832 4.694 1644 3HD1 ILE 67 3HD1 ILE 67 9.993 -5.027 3.294 1645 H PHE 68 H PHE 68 10.058 -2.631 3.027 1646 HA PHE 68 HA PHE 68 12.297 -4.132 3.642 1647 1HB PHE 68 1HB PHE 68 11.728 -1.750 1.900 1648 2HB PHE 68 2HB PHE 68 13.371 -2.373 1.969 1649 HD1 PHE 68 HD1 PHE 68 10.814 -2.437 -0.136 1650 HD2 PHE 68 HD2 PHE 68 13.006 -5.261 2.243 1651 HE1 PHE 68 HE1 PHE 68 10.174 -4.252 -1.701 1652 HE2 PHE 68 HE2 PHE 68 12.366 -7.075 0.681 1653 HZ PHE 68 HZ PHE 68 10.950 -6.572 -1.292 1654 H ASN 69 H ASN 69 13.596 -3.927 5.423 1655 HA ASN 69 HA ASN 69 14.136 -1.262 6.591 1656 1HB ASN 69 1HB ASN 69 14.774 -4.136 7.342 1657 2HB ASN 69 2HB ASN 69 15.243 -2.751 8.330 1658 1HD2 ASN 69 1HD2 ASN 69 13.521 -4.554 9.528 1659 2HD2 ASN 69 2HD2 ASN 69 11.953 -3.911 9.617 1660 H HIS 70 H HIS 70 16.562 -1.141 7.460 1661 HA HIS 70 HA HIS 70 18.327 -1.503 5.078 1662 1HB HIS 70 1HB HIS 70 18.067 0.766 5.967 1663 2HB HIS 70 2HB HIS 70 18.483 0.210 7.588 1664 HD1 HIS 70 HD1 HIS 70 20.081 0.187 4.114 1665 HD2 HIS 70 HD2 HIS 70 21.173 0.501 8.124 1666 HE1 HIS 70 HE1 HIS 70 22.585 0.569 4.147 1667 H SER 71 H SER 71 19.598 -3.312 5.186 1668 HA SER 71 HA SER 71 20.643 -4.131 7.877 1669 1HB SER 71 1HB SER 71 18.862 -5.610 7.004 1670 2HB SER 71 2HB SER 71 19.767 -5.822 5.504 1671 HG SER 71 HG SER 71 19.986 -7.449 7.294 1672 H LYS 72 H LYS 72 22.855 -4.268 7.955 1673 HA LYS 72 HA LYS 72 24.586 -3.394 5.921 1674 1HB LYS 72 1HB LYS 72 24.990 -5.362 8.203 1675 2HB LYS 72 2HB LYS 72 26.310 -4.603 7.314 1676 1HG LYS 72 1HG LYS 72 24.139 -3.000 8.680 1677 2HG LYS 72 2HG LYS 72 25.633 -3.457 9.496 1678 1HD LYS 72 1HD LYS 72 26.967 -2.226 7.938 1679 2HD LYS 72 2HD LYS 72 25.606 -2.012 6.837 1680 1HE LYS 72 1HE LYS 72 25.727 -0.857 9.648 1681 2HE LYS 72 2HE LYS 72 26.066 0.056 8.167 1682 1HZ LYS 72 1HZ LYS 72 23.532 -1.190 9.040 1683 2HZ LYS 72 2HZ LYS 72 23.825 -0.919 7.389 1684 3HZ LYS 72 3HZ LYS 72 23.800 0.388 8.473 1685 H ASP 73 H ASP 73 23.076 -6.517 6.335 1686 HA ASP 73 HA ASP 73 24.765 -7.637 4.127 1687 1HB ASP 73 1HB ASP 73 24.003 -9.819 5.076 1688 2HB ASP 73 2HB ASP 73 24.813 -8.828 6.290 1689 HA PRO 74 HA PRO 74 20.458 -6.832 2.488 1690 1HB PRO 74 1HB PRO 74 21.387 -5.901 0.037 1691 2HB PRO 74 2HB PRO 74 20.976 -4.860 1.412 1692 1HG PRO 74 1HG PRO 74 23.632 -5.790 0.460 1693 2HG PRO 74 2HG PRO 74 23.168 -4.241 1.177 1694 1HD PRO 74 1HD PRO 74 24.492 -6.184 2.544 1695 2HD PRO 74 2HD PRO 74 23.392 -5.026 3.322 1696 H ASN 75 H ASN 75 19.773 -8.866 1.985 1697 HA ASN 75 HA ASN 75 21.345 -10.444 -0.015 1698 1HB ASN 75 1HB ASN 75 19.263 -11.351 2.003 1699 2HB ASN 75 2HB ASN 75 20.377 -12.375 1.105 1700 1HD2 ASN 75 1HD2 ASN 75 20.298 -12.368 3.986 1701 2HD2 ASN 75 2HD2 ASN 75 21.768 -11.735 4.552 1702 H ALA 76 H ALA 76 19.021 -8.344 -0.336 1703 HA ALA 76 HA ALA 76 17.564 -9.948 -2.363 1704 1HB ALA 76 1HB ALA 76 16.524 -8.900 0.223 1705 2HB ALA 76 2HB ALA 76 15.990 -10.295 -0.715 1706 3HB ALA 76 3HB ALA 76 15.477 -8.672 -1.177 1707 H ARG 77 H ARG 77 16.263 -8.517 -3.801 1708 HA ARG 77 HA ARG 77 16.913 -5.615 -3.642 1709 1HB ARG 77 1HB ARG 77 18.725 -6.651 -4.913 1710 2HB ARG 77 2HB ARG 77 17.569 -7.514 -5.926 1711 1HG ARG 77 1HG ARG 77 16.866 -5.533 -7.006 1712 2HG ARG 77 2HG ARG 77 17.538 -4.502 -5.743 1713 1HD ARG 77 1HD ARG 77 19.692 -4.655 -6.583 1714 2HD ARG 77 2HD ARG 77 19.432 -6.285 -7.230 1715 HE ARG 77 HE ARG 77 18.800 -3.775 -8.596 1716 1HH1 ARG 77 1HH1 ARG 77 18.022 -7.152 -8.257 1717 2HH1 ARG 77 2HH1 ARG 77 17.341 -7.266 -9.843 1718 1HH2 ARG 77 1HH2 ARG 77 17.912 -3.949 -10.649 1719 2HH2 ARG 77 2HH2 ARG 77 17.278 -5.468 -11.189 1720 H HIS 78 H HIS 78 15.519 -4.337 -5.085 1721 HA HIS 78 HA HIS 78 12.965 -5.765 -5.726 1722 1HB HIS 78 1HB HIS 78 12.003 -3.467 -5.444 1723 2HB HIS 78 2HB HIS 78 12.860 -4.014 -4.003 1724 HD1 HIS 78 HD1 HIS 78 14.922 -2.705 -3.288 1725 HD2 HIS 78 HD2 HIS 78 13.480 -1.508 -7.012 1726 HE1 HIS 78 HE1 HIS 78 16.205 -0.614 -3.915 1727 H GLU 79 H GLU 79 11.836 -5.056 -7.693 1728 HA GLU 79 HA GLU 79 13.535 -3.645 -9.704 1729 1HB GLU 79 1HB GLU 79 13.768 -6.190 -9.748 1730 2HB GLU 79 2HB GLU 79 12.067 -6.254 -10.212 1731 1HG GLU 79 1HG GLU 79 12.519 -4.936 -12.211 1732 2HG GLU 79 2HG GLU 79 14.198 -4.711 -11.722 1733 H LEU 80 H LEU 80 12.312 -2.424 -11.163 1734 HA LEU 80 HA LEU 80 9.364 -2.361 -10.662 1735 1HB LEU 80 1HB LEU 80 11.477 -0.400 -11.555 1736 2HB LEU 80 2HB LEU 80 9.775 -0.072 -11.881 1737 HG LEU 80 HG LEU 80 10.503 -0.927 -9.115 1738 1HD1 LEU 80 1HD1 LEU 80 12.060 0.713 -8.929 1739 2HD1 LEU 80 2HD1 LEU 80 10.692 1.825 -8.983 1740 3HD1 LEU 80 3HD1 LEU 80 11.584 1.452 -10.458 1741 1HD2 LEU 80 1HD2 LEU 80 8.170 -0.505 -9.742 1742 2HD2 LEU 80 2HD2 LEU 80 8.598 1.109 -10.306 1743 3HD2 LEU 80 3HD2 LEU 80 8.712 0.716 -8.591 1744 H THR 81 H THR 81 7.956 -2.100 -12.555 1745 HA THR 81 HA THR 81 8.934 -3.643 -14.879 1746 HB THR 81 HB THR 81 6.494 -3.567 -15.450 1747 HG1 THR 81 HG1 THR 81 5.865 -1.630 -14.660 1748 1HG2 THR 81 1HG2 THR 81 6.695 -4.184 -12.515 1749 2HG2 THR 81 2HG2 THR 81 7.629 -5.132 -13.671 1750 3HG2 THR 81 3HG2 THR 81 5.870 -5.086 -13.786 1751 H ALA 82 H ALA 82 10.398 -1.586 -15.312 1752 HA ALA 82 HA ALA 82 10.832 0.309 -16.659 1753 1HB ALA 82 1HB ALA 82 9.283 0.272 -18.729 1754 2HB ALA 82 2HB ALA 82 8.510 -1.123 -17.976 1755 3HB ALA 82 3HB ALA 82 10.217 -1.191 -18.415 1756 H GLY 83 H GLY 83 9.043 0.699 -14.342 1757 1HA GLY 83 1HA GLY 83 8.179 3.351 -14.772 1758 2HA GLY 83 2HA GLY 83 6.784 2.312 -15.056 1759 H LEU 84 H LEU 84 6.570 4.020 -12.963 1760 HA LEU 84 HA LEU 84 7.394 2.605 -10.488 1761 1HB LEU 84 1HB LEU 84 5.965 5.222 -11.081 1762 2HB LEU 84 2HB LEU 84 6.409 4.682 -9.463 1763 HG LEU 84 HG LEU 84 8.410 4.984 -11.715 1764 1HD1 LEU 84 1HD1 LEU 84 8.472 6.929 -9.506 1765 2HD1 LEU 84 2HD1 LEU 84 7.051 7.071 -10.540 1766 3HD1 LEU 84 3HD1 LEU 84 8.665 7.191 -11.239 1767 1HD2 LEU 84 1HD2 LEU 84 9.888 5.177 -9.552 1768 2HD2 LEU 84 2HD2 LEU 84 9.363 3.585 -10.100 1769 3HD2 LEU 84 3HD2 LEU 84 8.521 4.382 -8.771 1770 H LYS 85 H LYS 85 5.364 1.426 -12.327 1771 HA LYS 85 HA LYS 85 2.813 1.773 -10.880 1772 1HB LYS 85 1HB LYS 85 3.779 0.368 -13.365 1773 2HB LYS 85 2HB LYS 85 2.141 0.128 -12.757 1774 1HG LYS 85 1HG LYS 85 2.291 2.830 -12.644 1775 2HG LYS 85 2HG LYS 85 3.376 2.529 -13.997 1776 1HD LYS 85 1HD LYS 85 1.684 1.457 -15.262 1777 2HD LYS 85 2HD LYS 85 0.654 1.234 -13.848 1778 1HE LYS 85 1HE LYS 85 1.321 4.057 -14.362 1779 2HE LYS 85 2HE LYS 85 0.384 3.297 -15.662 1780 1HZ LYS 85 1HZ LYS 85 -0.259 3.101 -12.762 1781 2HZ LYS 85 2HZ LYS 85 -1.182 2.476 -14.044 1782 3HZ LYS 85 3HZ LYS 85 -1.032 4.156 -13.846 1783 H ARG 86 H ARG 86 4.404 -1.193 -12.094 1784 HA ARG 86 HA ARG 86 3.455 -2.619 -9.660 1785 1HB ARG 86 1HB ARG 86 3.663 -3.152 -12.437 1786 2HB ARG 86 2HB ARG 86 4.820 -4.226 -11.650 1787 1HG ARG 86 1HG ARG 86 2.635 -4.411 -9.983 1788 2HG ARG 86 2HG ARG 86 1.878 -4.256 -11.568 1789 1HD ARG 86 1HD ARG 86 3.853 -6.046 -12.148 1790 2HD ARG 86 2HD ARG 86 3.495 -6.483 -10.467 1791 HE ARG 86 HE ARG 86 1.392 -7.259 -11.208 1792 1HH1 ARG 86 1HH1 ARG 86 2.712 -4.966 -13.472 1793 2HH1 ARG 86 2HH1 ARG 86 1.411 -5.159 -14.595 1794 1HH2 ARG 86 1HH2 ARG 86 -0.286 -7.492 -12.683 1795 2HH2 ARG 86 2HH2 ARG 86 -0.275 -6.577 -14.154 1796 H MET 87 H MET 87 4.973 -4.079 -8.539 1797 HA MET 87 HA MET 87 7.867 -3.457 -8.940 1798 1HB MET 87 1HB MET 87 6.139 -2.406 -6.928 1799 2HB MET 87 2HB MET 87 7.210 -3.561 -6.134 1800 1HG MET 87 1HG MET 87 8.216 -1.425 -8.028 1801 2HG MET 87 2HG MET 87 8.097 -1.177 -6.287 1802 1HE MET 87 1HE MET 87 10.433 -2.635 -4.527 1803 2HE MET 87 2HE MET 87 9.650 -4.171 -4.900 1804 3HE MET 87 3HE MET 87 8.681 -2.708 -4.720 1805 H ARG 88 H ARG 88 9.173 -5.240 -8.547 1806 HA ARG 88 HA ARG 88 7.850 -7.670 -7.381 1807 1HB ARG 88 1HB ARG 88 9.959 -7.391 -9.557 1808 2HB ARG 88 2HB ARG 88 9.316 -8.923 -8.965 1809 1HG ARG 88 1HG ARG 88 7.302 -8.646 -10.036 1810 2HG ARG 88 2HG ARG 88 7.326 -6.892 -9.848 1811 1HD ARG 88 1HD ARG 88 8.055 -6.717 -11.988 1812 2HD ARG 88 2HD ARG 88 9.526 -7.597 -11.531 1813 HE ARG 88 HE ARG 88 8.564 -9.559 -12.446 1814 1HH1 ARG 88 1HH1 ARG 88 6.139 -7.121 -11.907 1815 2HH1 ARG 88 2HH1 ARG 88 4.892 -8.033 -12.684 1816 1HH2 ARG 88 1HH2 ARG 88 6.927 -10.724 -13.450 1817 2HH2 ARG 88 2HH2 ARG 88 5.332 -10.057 -13.551 1818 H ILE 89 H ILE 89 9.587 -9.243 -6.503 1819 HA ILE 89 HA ILE 89 11.899 -7.736 -5.332 1820 HB ILE 89 HB ILE 89 9.965 -9.647 -3.967 1821 1HG1 ILE 89 1HG1 ILE 89 10.451 -6.710 -3.415 1822 2HG1 ILE 89 2HG1 ILE 89 9.176 -7.280 -4.491 1823 1HG2 ILE 89 1HG2 ILE 89 12.471 -9.605 -3.263 1824 2HG2 ILE 89 2HG2 ILE 89 11.248 -9.423 -2.005 1825 3HG2 ILE 89 3HG2 ILE 89 12.102 -8.006 -2.617 1826 1HD1 ILE 89 1HD1 ILE 89 8.087 -8.467 -2.718 1827 2HD1 ILE 89 2HD1 ILE 89 8.473 -6.871 -2.075 1828 3HD1 ILE 89 3HD1 ILE 89 9.470 -8.260 -1.643 1829 H PHE 90 H PHE 90 13.778 -8.790 -5.793 1830 HA PHE 90 HA PHE 90 13.653 -11.725 -6.397 1831 1HB PHE 90 1HB PHE 90 15.192 -9.359 -7.422 1832 2HB PHE 90 2HB PHE 90 15.949 -10.949 -7.514 1833 HD1 PHE 90 HD1 PHE 90 13.612 -8.697 -9.033 1834 HD2 PHE 90 HD2 PHE 90 14.577 -12.859 -8.591 1835 HE1 PHE 90 HE1 PHE 90 12.258 -9.225 -11.043 1836 HE2 PHE 90 HE2 PHE 90 13.223 -13.387 -10.600 1837 HZ PHE 90 HZ PHE 90 12.063 -11.569 -11.827 1838 H THR 91 H THR 91 16.126 -12.582 -6.082 1839 HA THR 91 HA THR 91 17.010 -11.695 -3.354 1840 HB THR 91 HB THR 91 17.607 -14.186 -3.122 1841 HG1 THR 91 HG1 THR 91 16.590 -15.550 -4.574 1842 1HG2 THR 91 1HG2 THR 91 15.292 -12.806 -2.580 1843 2HG2 THR 91 2HG2 THR 91 15.614 -14.463 -2.067 1844 3HG2 THR 91 3HG2 THR 91 14.691 -14.160 -3.538 1845 H ILE 92 H ILE 92 18.770 -10.435 -4.135 1846 HA ILE 92 HA ILE 92 20.543 -10.997 -6.227 1847 HB ILE 92 HB ILE 92 22.096 -9.556 -4.922 1848 1HG1 ILE 92 1HG1 ILE 92 20.093 -9.983 -2.686 1849 2HG1 ILE 92 2HG1 ILE 92 21.730 -10.639 -2.728 1850 1HG2 ILE 92 1HG2 ILE 92 19.326 -8.982 -5.526 1851 2HG2 ILE 92 2HG2 ILE 92 20.730 -7.924 -5.661 1852 3HG2 ILE 92 3HG2 ILE 92 19.854 -8.035 -4.134 1853 1HD1 ILE 92 1HD1 ILE 92 20.923 -8.107 -1.759 1854 2HD1 ILE 92 2HD1 ILE 92 21.798 -7.802 -3.260 1855 3HD1 ILE 92 3HD1 ILE 92 22.573 -8.699 -1.954 1856 H LYS 93 H LYS 93 20.310 -12.558 -3.101 1857 HA LYS 93 HA LYS 93 22.463 -14.427 -3.945 1858 1HB LYS 93 1HB LYS 93 23.640 -14.124 -1.834 1859 2HB LYS 93 2HB LYS 93 23.408 -12.538 -2.565 1860 1HG LYS 93 1HG LYS 93 21.542 -12.060 -1.109 1861 2HG LYS 93 2HG LYS 93 21.550 -13.709 -0.481 1862 1HD LYS 93 1HD LYS 93 22.717 -12.505 1.174 1863 2HD LYS 93 2HD LYS 93 24.011 -13.193 0.195 1864 1HE LYS 93 1HE LYS 93 23.089 -10.620 -0.858 1865 2HE LYS 93 2HE LYS 93 23.723 -10.491 0.793 1866 1HZ LYS 93 1HZ LYS 93 25.389 -10.453 -1.149 1867 2HZ LYS 93 2HZ LYS 93 25.103 -12.124 -1.251 1868 3HZ LYS 93 3HZ LYS 93 25.734 -11.455 0.177 1869 HA PRO 94 HA PRO 94 19.826 -17.527 -2.350 1870 1HB PRO 94 1HB PRO 94 22.127 -18.790 -0.982 1871 2HB PRO 94 2HB PRO 94 21.094 -19.441 -2.264 1872 1HG PRO 94 1HG PRO 94 23.638 -18.657 -2.696 1873 2HG PRO 94 2HG PRO 94 22.382 -18.545 -3.930 1874 1HD PRO 94 1HD PRO 94 23.616 -16.406 -2.285 1875 2HD PRO 94 2HD PRO 94 22.969 -16.338 -3.938 1876 H ILE 95 H ILE 95 18.699 -18.055 -0.465 1877 HA ILE 95 HA ILE 95 19.727 -16.856 2.081 1878 HB ILE 95 HB ILE 95 16.942 -16.723 0.864 1879 1HG1 ILE 95 1HG1 ILE 95 18.777 -14.417 1.520 1880 2HG1 ILE 95 2HG1 ILE 95 18.858 -15.235 -0.040 1881 1HG2 ILE 95 1HG2 ILE 95 17.969 -16.296 3.589 1882 2HG2 ILE 95 2HG2 ILE 95 16.312 -16.542 3.038 1883 3HG2 ILE 95 3HG2 ILE 95 17.038 -14.937 2.961 1884 1HD1 ILE 95 1HD1 ILE 95 16.300 -14.861 -0.148 1885 2HD1 ILE 95 2HD1 ILE 95 17.340 -13.460 -0.409 1886 3HD1 ILE 95 3HD1 ILE 95 16.554 -13.696 1.152 1887 H ALA 96 H ALA 96 19.208 -18.053 3.948 1888 HA ALA 96 HA ALA 96 18.144 -20.793 3.453 1889 1HB ALA 96 1HB ALA 96 19.243 -21.230 5.646 1890 2HB ALA 96 2HB ALA 96 19.630 -19.514 5.780 1891 3HB ALA 96 3HB ALA 96 20.364 -20.486 4.505 1892 H ILE 97 H ILE 97 16.654 -21.688 5.129 1893 HA ILE 97 HA ILE 97 14.417 -19.957 5.650 1894 HB ILE 97 HB ILE 97 15.228 -22.652 6.804 1895 1HG1 ILE 97 1HG1 ILE 97 13.152 -22.694 4.794 1896 2HG1 ILE 97 2HG1 ILE 97 14.590 -21.894 4.160 1897 1HG2 ILE 97 1HG2 ILE 97 13.112 -20.957 7.535 1898 2HG2 ILE 97 2HG2 ILE 97 13.265 -22.673 7.914 1899 3HG2 ILE 97 3HG2 ILE 97 12.384 -22.164 6.474 1900 1HD1 ILE 97 1HD1 ILE 97 14.814 -24.491 5.674 1901 2HD1 ILE 97 2HD1 ILE 97 15.950 -23.784 4.525 1902 3HD1 ILE 97 3HD1 ILE 97 14.435 -24.482 3.952 1903 H GLY 98 H GLY 98 14.537 -18.319 7.146 1904 1HA GLY 98 1HA GLY 98 14.406 -17.963 9.632 1905 2HA GLY 98 2HA GLY 98 15.869 -18.938 9.753 1906 H GLU 99 H GLU 99 15.502 -16.643 7.136 1907 HA GLU 99 HA GLU 99 17.603 -14.942 8.437 1908 1HB GLU 99 1HB GLU 99 16.953 -15.664 5.562 1909 2HB GLU 99 2HB GLU 99 18.098 -14.390 5.984 1910 1HG GLU 99 1HG GLU 99 18.399 -17.092 7.252 1911 2HG GLU 99 2HG GLU 99 18.948 -16.863 5.591 1912 H GLU 100 H GLU 100 17.493 -12.610 7.267 1913 HA GLU 100 HA GLU 100 14.617 -11.764 7.379 1914 1HB GLU 100 1HB GLU 100 15.991 -10.965 9.255 1915 2HB GLU 100 2HB GLU 100 17.178 -10.306 8.128 1916 1HG GLU 100 1HG GLU 100 15.560 -8.717 7.264 1917 2HG GLU 100 2HG GLU 100 14.266 -9.457 8.205 1918 H ILE 101 H ILE 101 13.833 -10.629 5.651 1919 HA ILE 101 HA ILE 101 15.694 -10.133 3.381 1920 HB ILE 101 HB ILE 101 12.661 -10.150 3.563 1921 1HG1 ILE 101 1HG1 ILE 101 14.628 -12.281 2.692 1922 2HG1 ILE 101 2HG1 ILE 101 13.590 -12.336 4.115 1923 1HG2 ILE 101 1HG2 ILE 101 14.590 -10.138 1.228 1924 2HG2 ILE 101 2HG2 ILE 101 13.430 -8.877 1.646 1925 3HG2 ILE 101 3HG2 ILE 101 12.860 -10.446 1.077 1926 1HD1 ILE 101 1HD1 ILE 101 11.592 -12.324 2.705 1927 2HD1 ILE 101 2HD1 ILE 101 12.652 -13.642 2.208 1928 3HD1 ILE 101 3HD1 ILE 101 12.586 -12.158 1.258 1929 H THR 102 H THR 102 16.322 -8.111 2.953 1930 HA THR 102 HA THR 102 14.571 -5.783 3.463 1931 HB THR 102 HB THR 102 16.541 -4.760 4.778 1932 HG1 THR 102 HG1 THR 102 17.729 -6.625 5.805 1933 1HG2 THR 102 1HG2 THR 102 15.247 -7.193 6.039 1934 2HG2 THR 102 2HG2 THR 102 14.405 -5.664 5.786 1935 3HG2 THR 102 3HG2 THR 102 15.802 -5.734 6.860 1936 H ILE 103 H ILE 103 15.815 -3.737 2.632 1937 HA ILE 103 HA ILE 103 17.921 -4.406 0.639 1938 HB ILE 103 HB ILE 103 16.594 -3.378 -1.160 1939 1HG1 ILE 103 1HG1 ILE 103 14.014 -3.223 -0.013 1940 2HG1 ILE 103 2HG1 ILE 103 15.093 -2.368 1.088 1941 1HG2 ILE 103 1HG2 ILE 103 14.913 -5.095 -1.397 1942 2HG2 ILE 103 2HG2 ILE 103 14.867 -5.360 0.346 1943 3HG2 ILE 103 3HG2 ILE 103 16.298 -5.817 -0.578 1944 1HD1 ILE 103 1HD1 ILE 103 14.149 -1.568 -1.538 1945 2HD1 ILE 103 2HD1 ILE 103 15.911 -1.589 -1.484 1946 3HD1 ILE 103 3HD1 ILE 103 15.005 -0.615 -0.327 1947 H SER 104 H SER 104 18.867 -2.375 -0.311 1948 HA SER 104 HA SER 104 19.098 -0.299 1.780 1949 1HB SER 104 1HB SER 104 20.858 -1.534 0.140 1950 2HB SER 104 2HB SER 104 20.480 -0.134 -0.864 1951 HG SER 104 HG SER 104 22.185 0.368 0.499 1952 H TYR 105 H TYR 105 19.632 1.956 0.253 1953 HA TYR 105 HA TYR 105 17.032 2.457 -1.164 1954 1HB TYR 105 1HB TYR 105 18.686 4.364 0.533 1955 2HB TYR 105 2HB TYR 105 17.091 4.683 -0.145 1956 HD1 TYR 105 HD1 TYR 105 15.706 2.109 0.362 1957 HD2 TYR 105 HD2 TYR 105 18.352 4.386 2.865 1958 HE1 TYR 105 HE1 TYR 105 14.656 1.115 2.377 1959 HE2 TYR 105 HE2 TYR 105 17.302 3.393 4.879 1960 HH TYR 105 HH TYR 105 14.400 1.482 4.684 1961 H GLY 106 H GLY 106 20.151 4.171 -0.728 1962 1HA GLY 106 1HA GLY 106 21.179 3.832 -3.321 1963 2HA GLY 106 2HA GLY 106 20.124 5.243 -3.398 1964 H ASP 107 H ASP 107 23.041 5.213 -3.686 1965 HA ASP 107 HA ASP 107 24.519 5.971 -1.426 1966 1HB ASP 107 1HB ASP 107 25.889 7.213 -3.087 1967 2HB ASP 107 2HB ASP 107 25.378 5.653 -3.732 1968 H ASP 108 H ASP 108 21.987 7.729 -3.076 1969 HA ASP 108 HA ASP 108 22.646 10.306 -1.810 1970 1HB ASP 108 1HB ASP 108 21.001 9.228 -3.945 1971 2HB ASP 108 2HB ASP 108 20.037 10.286 -2.914 1972 H TYR 109 H TYR 109 19.851 8.056 -1.694 1973 HA TYR 109 HA TYR 109 18.674 9.309 0.629 1974 1HB TYR 109 1HB TYR 109 17.813 7.685 -1.320 1975 2HB TYR 109 2HB TYR 109 18.181 6.448 -0.119 1976 HD1 TYR 109 HD1 TYR 109 16.436 5.830 1.284 1977 HD2 TYR 109 HD2 TYR 109 16.586 9.852 -0.215 1978 HE1 TYR 109 HE1 TYR 109 14.322 6.350 2.469 1979 HE2 TYR 109 HE2 TYR 109 14.471 10.372 0.971 1980 HH TYR 109 HH TYR 109 12.355 8.476 1.865 1981 H TRP 110 H TRP 110 21.120 9.095 1.618 1982 HA TRP 110 HA TRP 110 20.918 7.447 3.930 1983 1HB TRP 110 1HB TRP 110 21.790 6.133 1.497 1984 2HB TRP 110 2HB TRP 110 23.085 6.094 2.694 1985 HD1 TRP 110 HD1 TRP 110 20.791 3.771 1.683 1986 HE1 TRP 110 HE1 TRP 110 19.715 2.403 3.585 1987 HE3 TRP 110 HE3 TRP 110 21.857 6.795 5.657 1988 HZ2 TRP 110 HZ2 TRP 110 19.354 2.571 6.419 1989 HZ3 TRP 110 HZ3 TRP 110 21.137 6.168 7.944 1990 HH2 TRP 110 HH2 TRP 110 19.888 4.062 8.330 1991 H LEU 111 H LEU 111 23.616 6.901 4.450 1992 HA LEU 111 HA LEU 111 24.649 9.432 5.227 1993 1HB LEU 111 1HB LEU 111 25.278 6.652 5.417 1994 2HB LEU 111 2HB LEU 111 26.735 7.478 4.865 1995 HG LEU 111 HG LEU 111 25.241 8.819 7.050 1996 1HD1 LEU 111 1HD1 LEU 111 25.627 7.281 8.717 1997 2HD1 LEU 111 2HD1 LEU 111 27.041 6.604 7.908 1998 3HD1 LEU 111 3HD1 LEU 111 25.421 6.155 7.376 1999 1HD2 LEU 111 1HD2 LEU 111 27.733 8.863 7.861 2000 2HD2 LEU 111 2HD2 LEU 111 27.264 9.856 6.481 2001 3HD2 LEU 111 3HD2 LEU 111 28.090 8.319 6.221 2002 H SER 112 H SER 112 27.323 9.467 4.419 2003 HA SER 112 HA SER 112 27.122 9.941 1.462 2004 1HB SER 112 1HB SER 112 28.236 12.003 1.797 2005 2HB SER 112 2HB SER 112 27.158 11.910 3.190 2006 HG SER 112 HG SER 112 29.419 12.436 3.633 2007 H ARG 113 H ARG 113 28.800 9.080 0.254 2008 HA ARG 113 HA ARG 113 30.702 7.755 -0.213 2009 1HB ARG 113 1HB ARG 113 31.360 9.768 1.873 2010 2HB ARG 113 2HB ARG 113 32.530 8.461 1.688 2011 1HG ARG 113 1HG ARG 113 32.895 8.974 -0.608 2012 2HG ARG 113 2HG ARG 113 31.463 10.000 -0.685 2013 1HD ARG 113 1HD ARG 113 32.763 11.331 1.241 2014 2HD ARG 113 2HD ARG 113 34.169 10.608 0.435 2015 HE ARG 113 HE ARG 113 32.636 11.524 -1.671 2016 1HH1 ARG 113 1HH1 ARG 113 33.854 12.974 1.250 2017 2HH1 ARG 113 2HH1 ARG 113 33.963 14.552 0.552 2018 1HH2 ARG 113 1HH2 ARG 113 32.785 13.582 -2.554 2019 2HH2 ARG 113 2HH2 ARG 113 33.362 14.896 -1.585 2020 HA PRO 114 HA PRO 114 29.624 5.040 3.508 2021 1HB PRO 114 1HB PRO 114 28.102 3.193 2.130 2022 2HB PRO 114 2HB PRO 114 27.416 4.592 2.975 2023 1HG PRO 114 1HG PRO 114 27.958 4.198 0.078 2024 2HG PRO 114 2HG PRO 114 26.623 5.044 0.872 2025 1HD PRO 114 1HD PRO 114 28.755 6.306 -0.283 2026 2HD PRO 114 2HD PRO 114 27.807 6.994 1.052 2027 H ARG 115 H ARG 115 31.106 3.428 3.885 2028 HA ARG 115 HA ARG 115 32.257 2.012 1.507 2029 1HB ARG 115 1HB ARG 115 33.735 2.983 3.975 2030 2HB ARG 115 2HB ARG 115 34.450 2.321 2.508 2031 1HG ARG 115 1HG ARG 115 32.944 4.941 2.771 2032 2HG ARG 115 2HG ARG 115 34.662 4.737 2.447 2033 1HD ARG 115 1HD ARG 115 33.304 3.231 0.458 2034 2HD ARG 115 2HD ARG 115 32.491 4.803 0.554 2035 HE ARG 115 HE ARG 115 35.294 5.262 0.697 2036 1HH1 ARG 115 1HH1 ARG 115 32.906 4.090 -1.549 2037 2HH1 ARG 115 2HH1 ARG 115 33.796 4.614 -2.936 2038 1HH2 ARG 115 1HH2 ARG 115 36.429 5.931 -1.117 2039 2HH2 ARG 115 2HH2 ARG 115 35.776 5.649 -2.696 2040 H LEU 116 H LEU 116 30.381 0.558 2.546 2041 HA LEU 116 HA LEU 116 31.023 -0.854 4.999 2042 1HB LEU 116 1HB LEU 116 28.872 -0.522 3.222 2043 2HB LEU 116 2HB LEU 116 29.275 -2.235 3.113 2044 HG LEU 116 HG LEU 116 27.631 -1.819 4.913 2045 1HD1 LEU 116 1HD1 LEU 116 29.280 -3.652 5.153 2046 2HD1 LEU 116 2HD1 LEU 116 28.857 -2.959 6.719 2047 3HD1 LEU 116 3HD1 LEU 116 30.389 -2.539 5.954 2048 1HD2 LEU 116 1HD2 LEU 116 29.311 0.432 5.387 2049 2HD2 LEU 116 2HD2 LEU 116 29.362 -0.576 6.833 2050 3HD2 LEU 116 3HD2 LEU 116 27.815 0.005 6.217 2051 H THR 117 H THR 117 31.391 -1.606 1.524 2052 HA THR 117 HA THR 117 33.344 -3.736 2.294 2053 HB THR 117 HB THR 117 31.283 -4.068 0.103 2054 HG1 THR 117 HG1 THR 117 30.086 -3.754 1.935 2055 1HG2 THR 117 1HG2 THR 117 31.878 -6.488 1.399 2056 2HG2 THR 117 2HG2 THR 117 33.421 -5.641 1.283 2057 3HG2 THR 117 3HG2 THR 117 32.479 -5.961 -0.173 2058 H GLN 118 H GLN 118 34.765 -4.335 0.445 2059 HA GLN 118 HA GLN 118 35.662 -1.998 -1.029 2060 1HB GLN 118 1HB GLN 118 36.431 -4.813 -0.529 2061 2HB GLN 118 2HB GLN 118 36.958 -4.180 -2.088 2062 1HG GLN 118 1HG GLN 118 37.426 -2.778 0.560 2063 2HG GLN 118 2HG GLN 118 38.619 -3.803 -0.238 2064 1HE2 GLN 118 1HE2 GLN 118 38.615 -3.105 -2.844 2065 2HE2 GLN 118 2HE2 GLN 118 38.873 -1.441 -3.064 2066 H ASN 119 H ASN 119 33.215 -1.998 -1.974 2067 HA ASN 119 HA ASN 119 33.064 -3.696 -4.418 2068 1HB ASN 119 1HB ASN 119 31.182 -3.471 -2.731 2069 2HB ASN 119 2HB ASN 119 31.047 -1.776 -3.201 2070 1HD2 ASN 119 1HD2 ASN 119 28.959 -1.977 -4.224 2071 2HD2 ASN 119 2HD2 ASN 119 28.725 -2.880 -5.643 2072 1H GLY 201 1H GLY 201 30.460 41.464 4.860 2073 2H GLY 201 2H GLY 201 30.663 42.062 6.436 2074 3H GLY 201 3H GLY 201 29.111 41.981 5.752 2075 1HA GLY 201 1HA GLY 201 30.704 39.525 6.045 2076 2HA GLY 201 2HA GLY 201 29.837 40.180 7.433 2077 H LYS 202 H LYS 202 28.908 40.216 3.991 2078 HA LYS 202 HA LYS 202 26.366 38.844 4.779 2079 1HB LYS 202 1HB LYS 202 26.231 41.125 3.820 2080 2HB LYS 202 2HB LYS 202 27.116 40.580 2.395 2081 1HG LYS 202 1HG LYS 202 24.820 38.873 2.985 2082 2HG LYS 202 2HG LYS 202 24.347 40.550 2.709 2083 1HD LYS 202 1HD LYS 202 26.374 39.584 0.814 2084 2HD LYS 202 2HD LYS 202 24.853 38.696 0.724 2085 1HE LYS 202 1HE LYS 202 23.617 40.827 0.476 2086 2HE LYS 202 2HE LYS 202 25.147 41.720 0.566 2087 1HZ LYS 202 1HZ LYS 202 24.674 39.515 -1.365 2088 2HZ LYS 202 2HZ LYS 202 25.941 40.646 -1.369 2089 3HZ LYS 202 3HZ LYS 202 24.360 41.141 -1.746 2090 H ALA 203 H ALA 203 26.878 36.648 4.498 2091 HA ALA 203 HA ALA 203 27.250 35.751 1.710 2092 1HB ALA 203 1HB ALA 203 29.252 34.341 2.563 2093 2HB ALA 203 2HB ALA 203 29.269 35.436 3.945 2094 3HB ALA 203 3HB ALA 203 29.536 36.065 2.319 2095 HA PRO 204 HA PRO 204 24.848 33.066 4.777 2096 1HB PRO 204 1HB PRO 204 22.435 33.225 3.417 2097 2HB PRO 204 2HB PRO 204 22.876 34.264 4.784 2098 1HG PRO 204 1HG PRO 204 22.933 34.834 1.868 2099 2HG PRO 204 2HG PRO 204 22.528 35.901 3.219 2100 1HD PRO 204 1HD PRO 204 24.913 35.979 1.909 2101 2HD PRO 204 2HD PRO 204 24.721 36.440 3.613 2102 H ARG 205 H ARG 205 24.144 30.885 4.253 2103 HA ARG 205 HA ARG 205 24.231 30.069 1.400 2104 1HB ARG 205 1HB ARG 205 25.996 28.372 1.984 2105 2HB ARG 205 2HB ARG 205 26.561 30.034 2.155 2106 1HG ARG 205 1HG ARG 205 25.317 29.148 4.612 2107 2HG ARG 205 2HG ARG 205 26.580 28.016 4.130 2108 1HD ARG 205 1HD ARG 205 27.451 30.767 3.733 2109 2HD ARG 205 2HD ARG 205 26.976 30.479 5.417 2110 HE ARG 205 HE ARG 205 28.477 28.229 4.506 2111 1HH1 ARG 205 1HH1 ARG 205 28.889 31.604 5.255 2112 2HH1 ARG 205 2HH1 ARG 205 30.549 31.414 5.703 2113 1HH2 ARG 205 1HH2 ARG 205 30.633 28.009 5.093 2114 2HH2 ARG 205 2HH2 ARG 205 31.530 29.396 5.613 2115 H LYS 206 H LYS 206 22.346 30.054 3.855 2116 HA LYS 206 HA LYS 206 21.741 27.113 3.802 2117 1HB LYS 206 1HB LYS 206 22.467 28.625 5.942 2118 2HB LYS 206 2HB LYS 206 20.719 28.861 5.987 2119 1HG LYS 206 1HG LYS 206 20.819 26.184 5.561 2120 2HG LYS 206 2HG LYS 206 22.313 26.403 6.473 2121 1HD LYS 206 1HD LYS 206 19.676 27.568 7.389 2122 2HD LYS 206 2HD LYS 206 20.205 25.952 7.857 2123 1HE LYS 206 1HE LYS 206 22.294 27.993 8.218 2124 2HE LYS 206 2HE LYS 206 20.856 28.266 9.220 2125 1HZ LYS 206 1HZ LYS 206 20.939 25.876 9.810 2126 2HZ LYS 206 2HZ LYS 206 22.302 26.732 10.352 2127 3HZ LYS 206 3HZ LYS 206 22.413 25.742 8.977 2128 H GLN 207 H GLN 207 20.769 29.087 1.865 2129 HA GLN 207 HA GLN 207 17.866 29.209 2.611 2130 1HB GLN 207 1HB GLN 207 19.806 31.035 1.381 2131 2HB GLN 207 2HB GLN 207 18.329 30.886 0.430 2132 1HG GLN 207 1HG GLN 207 17.995 32.675 2.021 2133 2HG GLN 207 2HG GLN 207 17.022 31.302 2.550 2134 1HE2 GLN 207 1HE2 GLN 207 17.323 30.686 4.699 2135 2HE2 GLN 207 2HE2 GLN 207 18.674 31.085 5.645 2136 H LEU 208 H LEU 208 20.146 28.527 -0.052 2137 HA LEU 208 HA LEU 208 18.076 26.732 -1.246 2138 1HB LEU 208 1HB LEU 208 18.546 29.258 -2.162 2139 2HB LEU 208 2HB LEU 208 19.741 28.359 -3.098 2140 HG LEU 208 HG LEU 208 17.104 27.055 -2.972 2141 1HD1 LEU 208 1HD1 LEU 208 17.445 29.743 -4.335 2142 2HD1 LEU 208 2HD1 LEU 208 16.310 29.358 -3.041 2143 3HD1 LEU 208 3HD1 LEU 208 16.106 28.636 -4.637 2144 1HD2 LEU 208 1HD2 LEU 208 18.016 26.127 -4.808 2145 2HD2 LEU 208 2HD2 LEU 208 19.412 27.192 -4.645 2146 3HD2 LEU 208 3HD2 LEU 208 18.024 27.700 -5.607 2147 H ALA 209 H ALA 209 20.636 26.295 0.275 2148 HA ALA 209 HA ALA 209 22.327 25.054 -1.857 2149 1HB ALA 209 1HB ALA 209 23.305 26.707 -0.247 2150 2HB ALA 209 2HB ALA 209 24.063 25.120 -0.115 2151 3HB ALA 209 3HB ALA 209 22.871 25.630 1.080 2152 H THR 210 H THR 210 19.799 23.845 -0.900 2153 HA THR 210 HA THR 210 20.929 21.354 0.338 2154 HB THR 210 HB THR 210 18.758 21.190 1.518 2155 HG1 THR 210 HG1 THR 210 17.219 22.193 0.506 2156 1HG2 THR 210 1HG2 THR 210 20.797 22.824 2.172 2157 2HG2 THR 210 2HG2 THR 210 19.340 22.693 3.157 2158 3HG2 THR 210 3HG2 THR 210 19.517 24.026 2.016 2159 H LYS 211 H LYS 211 19.444 19.420 -0.147 2160 HA LYS 211 HA LYS 211 18.054 19.690 -2.780 2161 1HB LYS 211 1HB LYS 211 19.288 17.623 -3.489 2162 2HB LYS 211 2HB LYS 211 20.371 18.980 -3.179 2163 1HG LYS 211 1HG LYS 211 20.851 18.106 -0.934 2164 2HG LYS 211 2HG LYS 211 19.729 16.771 -1.199 2165 1HD LYS 211 1HD LYS 211 21.502 15.622 -2.007 2166 2HD LYS 211 2HD LYS 211 21.400 16.672 -3.422 2167 1HE LYS 211 1HE LYS 211 23.151 18.036 -2.698 2168 2HE LYS 211 2HE LYS 211 22.875 17.650 -0.988 2169 1HZ LYS 211 1HZ LYS 211 23.648 15.426 -1.356 2170 2HZ LYS 211 2HZ LYS 211 24.827 16.488 -1.962 2171 3HZ LYS 211 3HZ LYS 211 23.779 15.684 -3.029 2172 H ALA 212 H ALA 212 16.623 17.807 -3.214 2173 HA ALA 212 HA ALA 212 15.799 16.392 -0.698 2174 1HB ALA 212 1HB ALA 212 13.613 16.684 -2.506 2175 2HB ALA 212 2HB ALA 212 14.430 18.245 -2.433 2176 3HB ALA 212 3HB ALA 212 13.834 17.492 -0.954 2177 H ALA 213 H ALA 213 17.205 14.605 -1.538 2178 HA ALA 213 HA ALA 213 16.219 13.257 -3.998 2179 1HB ALA 213 1HB ALA 213 18.399 12.636 -4.136 2180 2HB ALA 213 2HB ALA 213 18.361 11.954 -2.510 2181 3HB ALA 213 3HB ALA 213 18.704 13.669 -2.740 2182 H ARG 214 H ARG 214 15.369 11.124 -3.932 2183 HA ARG 214 HA ARG 214 14.503 10.204 -1.215 2184 1HB ARG 214 1HB ARG 214 13.353 9.751 -3.992 2185 2HB ARG 214 2HB ARG 214 12.638 9.161 -2.492 2186 1HG ARG 214 1HG ARG 214 13.064 11.875 -2.011 2187 2HG ARG 214 2HG ARG 214 12.505 11.823 -3.683 2188 1HD ARG 214 1HD ARG 214 10.519 10.551 -3.022 2189 2HD ARG 214 2HD ARG 214 11.100 10.472 -1.347 2190 HE ARG 214 HE ARG 214 9.888 12.795 -2.620 2191 1HH1 ARG 214 1HH1 ARG 214 12.209 11.728 -0.256 2192 2HH1 ARG 214 2HH1 ARG 214 12.103 13.186 0.668 2193 1HH2 ARG 214 1HH2 ARG 214 9.768 14.679 -1.404 2194 2HH2 ARG 214 2HH2 ARG 214 10.733 14.845 0.025 2195 1HN MLZ 215 1HN MLZ 215 13.721 7.606 -2.025 2196 HA MLZ 215 HA MLZ 215 16.153 6.135 -1.783 2197 1HB MLZ 215 1HB MLZ 215 13.318 5.502 -2.642 2198 2HB MLZ 215 2HB MLZ 215 14.547 4.242 -2.529 2199 1HG MLZ 215 1HG MLZ 215 13.679 6.093 -0.286 2200 2HG MLZ 215 2HG MLZ 215 14.958 4.886 -0.164 2201 1HD MLZ 215 1HD MLZ 215 12.091 4.246 -0.912 2202 2HD MLZ 215 2HD MLZ 215 13.381 3.090 -0.581 2203 1HE MLZ 215 1HE MLZ 215 11.780 4.735 1.329 2204 2HE MLZ 215 2HE MLZ 215 13.486 4.463 1.729 2205 HZ MLZ 215 HZ MLZ 215 13.124 2.082 1.237 2206 1HCM MLZ 215 1HCM MLZ 215 11.404 3.329 3.309 2207 2HCM MLZ 215 2HCM MLZ 215 13.061 2.760 3.502 2208 3HCM MLZ 215 3HCM MLZ 215 11.757 1.603 3.236 2209 H SER 216 H SER 216 17.704 5.901 -3.337 2210 HA SER 216 HA SER 216 18.708 5.634 -5.457 2211 1HB SER 216 1HB SER 216 16.806 6.882 -7.134 2212 2HB SER 216 2HB SER 216 16.654 7.688 -5.572 2213 HG SER 216 HG SER 216 18.632 8.437 -5.735 2214 H ALA 217 H ALA 217 18.299 4.631 -7.669 2215 HA ALA 217 HA ALA 217 15.968 2.743 -7.583 2216 1HB ALA 217 1HB ALA 217 15.562 3.532 -9.668 2217 2HB ALA 217 2HB ALA 217 17.160 2.991 -10.183 2218 3HB ALA 217 3HB ALA 217 16.949 4.612 -9.521 2219 HA PRO 218 HA PRO 218 18.649 -0.727 -7.644 2220 1HB PRO 218 1HB PRO 218 17.766 -2.160 -9.875 2221 2HB PRO 218 2HB PRO 218 17.014 -2.218 -8.271 2222 1HG PRO 218 1HG PRO 218 16.204 -0.707 -10.696 2223 2HG PRO 218 2HG PRO 218 15.203 -1.458 -9.446 2224 1HD PRO 218 1HD PRO 218 15.632 1.215 -9.586 2225 2HD PRO 218 2HD PRO 218 15.356 0.363 -8.052 2226 H ALA 219 H ALA 219 18.159 -0.615 -11.163 2227 HA ALA 219 HA ALA 219 20.624 0.770 -11.768 2228 1HB ALA 219 1HB ALA 219 20.689 -2.236 -12.133 2229 2HB ALA 219 2HB ALA 219 21.281 -1.470 -10.659 2230 3HB ALA 219 3HB ALA 219 22.040 -1.105 -12.209 2231 H THR 220 H THR 220 17.953 0.853 -12.784 2232 HA THR 220 HA THR 220 17.852 -0.622 -15.317 2233 HB THR 220 HB THR 220 15.848 1.120 -15.504 2234 HG1 THR 220 HG1 THR 220 15.580 2.299 -13.802 2235 1HG2 THR 220 1HG2 THR 220 14.506 -0.535 -14.623 2236 2HG2 THR 220 2HG2 THR 220 15.533 -0.759 -13.206 2237 3HG2 THR 220 3HG2 THR 220 16.009 -1.448 -14.758 2238 H GLY 221 H GLY 221 20.196 0.649 -15.541 2239 1HA GLY 221 1HA GLY 221 21.396 2.136 -16.902 2240 2HA GLY 221 2HA GLY 221 19.904 2.344 -17.819 2241 1HN SAH 301 1HN SAH 301 -10.872 -1.432 -9.219 2242 2HN SAH 301 2HN SAH 301 -9.234 -1.010 -9.379 2243 HA SAH 301 HA SAH 301 -11.374 1.043 -9.287 2244 1HB SAH 301 1HB SAH 301 -10.563 -0.832 -7.293 2245 2HB SAH 301 2HB SAH 301 -9.911 0.741 -6.834 2246 1HG SAH 301 1HG SAH 301 -12.355 0.093 -6.113 2247 2HG SAH 301 2HG SAH 301 -12.758 0.535 -7.771 2248 1H5* SAH 301 1H5* SAH 301 -14.297 1.851 -6.928 2249 2H5* SAH 301 2H5* SAH 301 -14.166 3.295 -5.924 2250 H4* SAH 301 H4* SAH 301 -13.030 4.229 -8.098 2251 H3* SAH 301 H3* SAH 301 -15.639 4.296 -6.861 2252 *HO3 SAH 301 *HO3 SAH 301 -15.558 6.406 -7.666 2253 H2* SAH 301 H2* SAH 301 -17.004 3.782 -8.556 2254 *HO2 SAH 301 *HO2 SAH 301 -15.777 5.255 -10.541 2255 H1* SAH 301 H1* SAH 301 -15.177 3.458 -10.766 2256 H8 SAH 301 H8 SAH 301 -15.473 0.632 -8.278 2257 1HN6 SAH 301 1HN6 SAH 301 -20.049 -1.527 -10.985 2258 2HN6 SAH 301 2HN6 SAH 301 -20.487 -0.725 -9.494 2259 H2 SAH 301 H2 SAH 301 -19.363 2.803 -12.869 2260 1HN SAH 302 1HN SAH 302 10.271 -1.489 9.047 2261 2HN SAH 302 2HN SAH 302 8.635 -1.036 9.107 2262 HA SAH 302 HA SAH 302 10.820 0.970 9.131 2263 1HB SAH 302 1HB SAH 302 10.087 -0.901 7.103 2264 2HB SAH 302 2HB SAH 302 9.494 0.681 6.595 2265 1HG SAH 302 1HG SAH 302 11.963 -0.021 6.023 2266 2HG SAH 302 2HG SAH 302 12.277 0.426 7.699 2267 1H5* SAH 302 1H5* SAH 302 13.888 1.706 6.939 2268 2H5* SAH 302 2H5* SAH 302 13.846 3.143 5.918 2269 H4* SAH 302 H4* SAH 302 12.602 4.118 8.013 2270 H3* SAH 302 H3* SAH 302 15.280 4.124 6.932 2271 *HO3 SAH 302 *HO3 SAH 302 15.194 6.242 7.716 2272 H2* SAH 302 H2* SAH 302 16.533 3.598 8.709 2273 *HO2 SAH 302 *HO2 SAH 302 15.220 5.111 10.607 2274 H1* SAH 302 H1* SAH 302 14.573 3.329 10.810 2275 H8 SAH 302 H8 SAH 302 14.959 0.476 8.364 2276 1HN6 SAH 302 1HN6 SAH 302 19.324 -1.747 11.354 2277 2HN6 SAH 302 2HN6 SAH 302 19.865 -0.967 9.885 2278 H2 SAH 302 H2 SAH 302 18.614 2.612 13.161 Start of MODEL 7 1 1H MET 1 1H MET 1 0.529 -12.493 -5.698 2 2H MET 1 2H MET 1 0.366 -12.122 -4.049 3 3H MET 1 3H MET 1 0.991 -10.964 -5.122 4 HA MET 1 HA MET 1 -1.276 -10.389 -4.628 5 1HB MET 1 1HB MET 1 -0.338 -11.382 -7.278 6 2HB MET 1 2HB MET 1 -2.041 -10.944 -7.158 7 1HG MET 1 1HG MET 1 -0.260 -8.992 -5.882 8 2HG MET 1 2HG MET 1 0.042 -9.175 -7.610 9 1HE MET 1 1HE MET 1 -0.896 -6.299 -7.260 10 2HE MET 1 2HE MET 1 -2.036 -6.404 -8.601 11 3HE MET 1 3HE MET 1 -0.540 -7.336 -8.641 12 H PHE 2 H PHE 2 -1.913 -13.025 -6.883 13 HA PHE 2 HA PHE 2 -4.349 -13.848 -5.778 14 1HB PHE 2 1HB PHE 2 -3.790 -16.020 -6.992 15 2HB PHE 2 2HB PHE 2 -3.604 -14.562 -7.964 16 HD1 PHE 2 HD1 PHE 2 -1.496 -13.944 -8.868 17 HD2 PHE 2 HD2 PHE 2 -1.727 -17.037 -5.898 18 HE1 PHE 2 HE1 PHE 2 0.884 -14.507 -9.272 19 HE2 PHE 2 HE2 PHE 2 0.656 -17.598 -6.298 20 HZ PHE 2 HZ PHE 2 1.960 -16.330 -7.984 21 H ASN 3 H ASN 3 -4.937 -15.242 -4.122 22 HA ASN 3 HA ASN 3 -2.753 -16.641 -2.627 23 1HB ASN 3 1HB ASN 3 -3.488 -14.403 -1.655 24 2HB ASN 3 2HB ASN 3 -5.076 -15.124 -1.400 25 1HD2 ASN 3 1HD2 ASN 3 -1.752 -15.066 -0.250 26 2HD2 ASN 3 2HD2 ASN 3 -1.999 -16.081 1.088 27 H ASP 4 H ASP 4 -3.522 -18.520 -1.431 28 HA ASP 4 HA ASP 4 -5.407 -20.152 -2.760 29 1HB ASP 4 1HB ASP 4 -3.538 -20.682 -1.060 30 2HB ASP 4 2HB ASP 4 -4.721 -20.291 0.188 31 H ARG 5 H ARG 5 -5.953 -17.592 -0.476 32 HA ARG 5 HA ARG 5 -8.680 -18.577 0.177 33 1HB ARG 5 1HB ARG 5 -6.638 -16.779 1.293 34 2HB ARG 5 2HB ARG 5 -8.271 -16.118 1.395 35 1HG ARG 5 1HG ARG 5 -8.738 -18.682 2.155 36 2HG ARG 5 2HG ARG 5 -7.096 -18.470 2.759 37 1HD ARG 5 1HD ARG 5 -8.713 -16.122 3.336 38 2HD ARG 5 2HD ARG 5 -9.447 -17.589 4.008 39 HE ARG 5 HE ARG 5 -6.880 -16.431 4.809 40 1HH1 ARG 5 1HH1 ARG 5 -8.780 -19.337 4.553 41 2HH1 ARG 5 2HH1 ARG 5 -7.900 -20.153 5.799 42 1HH2 ARG 5 1HH2 ARG 5 -5.753 -17.512 6.423 43 2HH2 ARG 5 2HH2 ARG 5 -6.200 -19.130 6.850 44 H VAL 6 H VAL 6 -7.055 -16.069 -1.700 45 HA VAL 6 HA VAL 6 -9.641 -15.392 -2.974 46 HB VAL 6 HB VAL 6 -9.263 -12.963 -2.446 47 1HG1 VAL 6 1HG1 VAL 6 -10.126 -13.080 -0.225 48 2HG1 VAL 6 2HG1 VAL 6 -9.305 -14.609 0.091 49 3HG1 VAL 6 3HG1 VAL 6 -10.673 -14.556 -1.019 50 1HG2 VAL 6 1HG2 VAL 6 -7.223 -13.933 -0.440 51 2HG2 VAL 6 2HG2 VAL 6 -7.557 -12.276 -0.946 52 3HG2 VAL 6 3HG2 VAL 6 -6.750 -13.390 -2.050 53 H ILE 7 H ILE 7 -8.974 -13.307 -4.522 54 HA ILE 7 HA ILE 7 -6.263 -13.655 -5.640 55 HB ILE 7 HB ILE 7 -7.555 -15.491 -6.629 56 1HG1 ILE 7 1HG1 ILE 7 -7.362 -13.277 -8.683 57 2HG1 ILE 7 2HG1 ILE 7 -5.948 -14.107 -8.037 58 1HG2 ILE 7 1HG2 ILE 7 -9.433 -13.966 -8.196 59 2HG2 ILE 7 2HG2 ILE 7 -9.663 -13.601 -6.487 60 3HG2 ILE 7 3HG2 ILE 7 -9.755 -15.269 -7.052 61 1HD1 ILE 7 1HD1 ILE 7 -7.377 -14.950 -10.225 62 2HD1 ILE 7 2HD1 ILE 7 -8.101 -15.910 -8.935 63 3HD1 ILE 7 3HD1 ILE 7 -6.364 -15.997 -9.231 64 H VAL 8 H VAL 8 -5.918 -12.060 -7.468 65 HA VAL 8 HA VAL 8 -7.480 -9.588 -6.905 66 HB VAL 8 HB VAL 8 -5.054 -9.494 -6.632 67 1HG1 VAL 8 1HG1 VAL 8 -5.051 -10.624 -9.434 68 2HG1 VAL 8 2HG1 VAL 8 -4.242 -11.255 -8.001 69 3HG1 VAL 8 3HG1 VAL 8 -3.651 -9.785 -8.772 70 1HG2 VAL 8 1HG2 VAL 8 -6.110 -7.476 -7.512 71 2HG2 VAL 8 2HG2 VAL 8 -5.999 -8.103 -9.157 72 3HG2 VAL 8 3HG2 VAL 8 -4.532 -7.685 -8.272 73 H LYS 9 H LYS 9 -8.679 -8.591 -8.471 74 HA LYS 9 HA LYS 9 -8.501 -9.544 -11.285 75 1HB LYS 9 1HB LYS 9 -10.953 -9.437 -9.504 76 2HB LYS 9 2HB LYS 9 -11.015 -9.712 -11.243 77 1HG LYS 9 1HG LYS 9 -9.137 -11.553 -10.473 78 2HG LYS 9 2HG LYS 9 -10.213 -11.549 -9.076 79 1HD LYS 9 1HD LYS 9 -12.138 -11.983 -10.521 80 2HD LYS 9 2HD LYS 9 -11.115 -11.888 -11.953 81 1HE LYS 9 1HE LYS 9 -9.737 -13.796 -10.863 82 2HE LYS 9 2HE LYS 9 -11.145 -14.018 -9.807 83 1HZ LYS 9 1HZ LYS 9 -11.011 -14.177 -12.762 84 2HZ LYS 9 2HZ LYS 9 -12.483 -13.912 -11.958 85 3HZ LYS 9 3HZ LYS 9 -11.604 -15.336 -11.672 86 H LYS 10 H LYS 10 -9.416 -6.176 -12.205 87 HA LYS 10 HA LYS 10 -8.992 -7.412 -14.134 88 1HB LYS 10 1HB LYS 10 -7.178 -8.308 -11.991 89 2HB LYS 10 2HB LYS 10 -7.328 -9.447 -13.330 90 1HG LYS 10 1HG LYS 10 -6.794 -6.490 -13.720 91 2HG LYS 10 2HG LYS 10 -5.511 -7.696 -13.618 92 1HD LYS 10 1HD LYS 10 -5.831 -8.274 -15.770 93 2HD LYS 10 2HD LYS 10 -7.537 -8.597 -15.462 94 1HE LYS 10 1HE LYS 10 -8.161 -6.352 -15.963 95 2HE LYS 10 2HE LYS 10 -6.486 -5.779 -15.843 96 1HZ LYS 10 1HZ LYS 10 -7.058 -6.098 -18.155 97 2HZ LYS 10 2HZ LYS 10 -7.571 -7.689 -17.852 98 3HZ LYS 10 3HZ LYS 10 -5.929 -7.282 -17.698 99 H SER 11 H SER 11 -11.396 -8.027 -13.697 100 HA SER 11 HA SER 11 -11.592 -11.022 -13.636 101 1HB SER 11 1HB SER 11 -14.049 -10.197 -12.828 102 2HB SER 11 2HB SER 11 -12.735 -10.491 -11.692 103 HG SER 11 HG SER 11 -12.935 -8.480 -11.186 104 HA PRO 12 HA PRO 12 -13.787 -10.982 -17.443 105 1HB PRO 12 1HB PRO 12 -16.355 -11.729 -16.113 106 2HB PRO 12 2HB PRO 12 -15.493 -12.549 -17.428 107 1HG PRO 12 1HG PRO 12 -15.514 -13.502 -14.922 108 2HG PRO 12 2HG PRO 12 -14.117 -13.686 -15.991 109 1HD PRO 12 1HD PRO 12 -14.492 -11.888 -13.660 110 2HD PRO 12 2HD PRO 12 -13.008 -12.629 -14.294 111 H LEU 13 H LEU 13 -13.879 -8.760 -17.915 112 HA LEU 13 HA LEU 13 -14.851 -6.626 -18.184 113 1HB LEU 13 1HB LEU 13 -16.797 -8.680 -18.468 114 2HB LEU 13 2HB LEU 13 -17.569 -7.382 -17.558 115 HG LEU 13 HG LEU 13 -15.949 -6.764 -20.021 116 1HD1 LEU 13 1HD1 LEU 13 -18.558 -8.134 -19.850 117 2HD1 LEU 13 2HD1 LEU 13 -17.422 -8.041 -21.196 118 3HD1 LEU 13 3HD1 LEU 13 -18.544 -6.714 -20.896 119 1HD2 LEU 13 1HD2 LEU 13 -18.441 -5.379 -19.073 120 2HD2 LEU 13 2HD2 LEU 13 -17.068 -4.715 -19.958 121 3HD2 LEU 13 3HD2 LEU 13 -16.915 -5.083 -18.240 122 H GLY 14 H GLY 14 -13.755 -6.942 -15.665 123 1HA GLY 14 1HA GLY 14 -15.736 -5.491 -13.965 124 2HA GLY 14 2HA GLY 14 -14.770 -6.798 -13.280 125 H GLY 15 H GLY 15 -14.598 -4.240 -12.192 126 1HA GLY 15 1HA GLY 15 -12.300 -2.832 -13.341 127 2HA GLY 15 2HA GLY 15 -13.122 -2.419 -11.836 128 H TYR 16 H TYR 16 -11.165 -2.268 -10.619 129 HA TYR 16 HA TYR 16 -9.524 -4.752 -10.436 130 1HB TYR 16 1HB TYR 16 -8.960 -2.009 -10.582 131 2HB TYR 16 2HB TYR 16 -8.622 -2.438 -8.910 132 HD1 TYR 16 HD1 TYR 16 -7.769 -3.115 -12.442 133 HD2 TYR 16 HD2 TYR 16 -6.838 -3.975 -8.338 134 HE1 TYR 16 HE1 TYR 16 -5.649 -4.191 -13.149 135 HE2 TYR 16 HE2 TYR 16 -4.718 -5.050 -9.044 136 HH TYR 16 HH TYR 16 -3.193 -4.607 -11.590 137 H GLY 17 H GLY 17 -11.452 -5.682 -9.169 138 1HA GLY 17 1HA GLY 17 -11.441 -4.746 -6.332 139 2HA GLY 17 2HA GLY 17 -12.733 -5.698 -7.064 140 H VAL 18 H VAL 18 -12.263 -7.153 -5.114 141 HA VAL 18 HA VAL 18 -9.957 -8.966 -5.791 142 HB VAL 18 HB VAL 18 -9.428 -7.856 -3.744 143 1HG1 VAL 18 1HG1 VAL 18 -11.283 -6.729 -2.979 144 2HG1 VAL 18 2HG1 VAL 18 -11.284 -8.080 -1.843 145 3HG1 VAL 18 3HG1 VAL 18 -12.355 -8.102 -3.242 146 1HG2 VAL 18 1HG2 VAL 18 -10.760 -10.176 -2.453 147 2HG2 VAL 18 2HG2 VAL 18 -9.073 -9.663 -2.385 148 3HG2 VAL 18 3HG2 VAL 18 -9.670 -10.546 -3.790 149 H PHE 19 H PHE 19 -10.548 -11.064 -6.200 150 HA PHE 19 HA PHE 19 -13.409 -11.771 -5.985 151 1HB PHE 19 1HB PHE 19 -11.017 -12.534 -7.509 152 2HB PHE 19 2HB PHE 19 -11.985 -13.926 -7.022 153 HD1 PHE 19 HD1 PHE 19 -12.880 -10.413 -7.994 154 HD2 PHE 19 HD2 PHE 19 -13.333 -14.608 -8.801 155 HE1 PHE 19 HE1 PHE 19 -14.526 -9.894 -9.776 156 HE2 PHE 19 HE2 PHE 19 -14.978 -14.088 -10.582 157 HZ PHE 19 HZ PHE 19 -15.575 -11.731 -11.070 158 H ALA 20 H ALA 20 -14.071 -13.809 -4.977 159 HA ALA 20 HA ALA 20 -12.315 -14.553 -2.666 160 1HB ALA 20 1HB ALA 20 -14.191 -14.202 -1.448 161 2HB ALA 20 2HB ALA 20 -15.082 -15.357 -2.438 162 3HB ALA 20 3HB ALA 20 -15.000 -13.663 -2.919 163 H ARG 21 H ARG 21 -11.244 -16.419 -3.326 164 HA ARG 21 HA ARG 21 -12.301 -18.408 -5.108 165 1HB ARG 21 1HB ARG 21 -9.901 -17.786 -3.887 166 2HB ARG 21 2HB ARG 21 -10.369 -19.260 -3.038 167 1HG ARG 21 1HG ARG 21 -9.662 -20.453 -4.812 168 2HG ARG 21 2HG ARG 21 -10.930 -19.702 -5.780 169 1HD ARG 21 1HD ARG 21 -9.483 -18.056 -6.628 170 2HD ARG 21 2HD ARG 21 -8.349 -18.223 -5.274 171 HE ARG 21 HE ARG 21 -8.353 -20.737 -6.434 172 1HH1 ARG 21 1HH1 ARG 21 -7.840 -17.501 -7.611 173 2HH1 ARG 21 2HH1 ARG 21 -6.762 -18.010 -8.864 174 1HH2 ARG 21 1HH2 ARG 21 -6.951 -21.372 -8.069 175 2HH2 ARG 21 2HH2 ARG 21 -6.262 -20.184 -9.124 176 H LYS 22 H LYS 22 -12.567 -17.868 -1.652 177 HA LYS 22 HA LYS 22 -13.793 -20.505 -1.133 178 1HB LYS 22 1HB LYS 22 -13.626 -18.069 0.681 179 2HB LYS 22 2HB LYS 22 -13.708 -19.761 1.158 180 1HG LYS 22 1HG LYS 22 -11.443 -19.605 -0.480 181 2HG LYS 22 2HG LYS 22 -11.372 -18.165 0.535 182 1HD LYS 22 1HD LYS 22 -11.123 -19.377 2.471 183 2HD LYS 22 2HD LYS 22 -12.112 -20.714 1.883 184 1HE LYS 22 1HE LYS 22 -9.788 -20.559 0.220 185 2HE LYS 22 2HE LYS 22 -9.260 -20.534 1.910 186 1HZ LYS 22 1HZ LYS 22 -9.677 -22.810 0.978 187 2HZ LYS 22 2HZ LYS 22 -11.321 -22.400 0.864 188 3HZ LYS 22 3HZ LYS 22 -10.561 -22.449 2.382 189 H SER 23 H SER 23 -17.194 -19.140 -0.495 190 HA SER 23 HA SER 23 -15.068 -20.966 0.499 191 1HB SER 23 1HB SER 23 -18.007 -20.979 1.180 192 2HB SER 23 2HB SER 23 -17.433 -21.617 -0.360 193 HG SER 23 HG SER 23 -16.711 -23.307 0.632 194 H PHE 24 H PHE 24 -16.627 -18.039 1.344 195 HA PHE 24 HA PHE 24 -15.449 -18.199 4.068 196 1HB PHE 24 1HB PHE 24 -16.424 -16.029 2.198 197 2HB PHE 24 2HB PHE 24 -16.039 -15.674 3.881 198 HD1 PHE 24 HD1 PHE 24 -13.732 -17.178 4.551 199 HD2 PHE 24 HD2 PHE 24 -14.698 -15.360 0.782 200 HE1 PHE 24 HE1 PHE 24 -11.322 -17.079 3.981 201 HE2 PHE 24 HE2 PHE 24 -12.286 -15.261 0.211 202 HZ PHE 24 HZ PHE 24 -10.598 -16.121 1.811 203 H GLU 25 H GLU 25 -16.691 -17.418 5.905 204 HA GLU 25 HA GLU 25 -19.556 -18.181 5.735 205 1HB GLU 25 1HB GLU 25 -17.590 -18.811 7.469 206 2HB GLU 25 2HB GLU 25 -18.180 -17.353 8.257 207 1HG GLU 25 1HG GLU 25 -20.479 -18.811 7.505 208 2HG GLU 25 2HG GLU 25 -19.361 -19.979 8.207 209 H LYS 26 H LYS 26 -20.350 -16.582 8.005 210 HA LYS 26 HA LYS 26 -20.671 -13.964 6.640 211 1HB LYS 26 1HB LYS 26 -22.534 -15.466 7.605 212 2HB LYS 26 2HB LYS 26 -21.955 -14.968 9.191 213 1HG LYS 26 1HG LYS 26 -22.353 -12.622 8.638 214 2HG LYS 26 2HG LYS 26 -22.839 -13.071 7.004 215 1HD LYS 26 1HD LYS 26 -24.722 -14.375 7.912 216 2HD LYS 26 2HD LYS 26 -24.233 -13.947 9.551 217 1HE LYS 26 1HE LYS 26 -24.406 -11.472 8.643 218 2HE LYS 26 2HE LYS 26 -25.467 -12.211 7.429 219 1HZ LYS 26 1HZ LYS 26 -25.702 -12.665 10.360 220 2HZ LYS 26 2HZ LYS 26 -26.776 -13.199 9.157 221 3HZ LYS 26 3HZ LYS 26 -26.643 -11.541 9.501 222 H GLY 27 H GLY 27 -18.118 -14.726 8.027 223 1HA GLY 27 1HA GLY 27 -17.443 -12.299 9.248 224 2HA GLY 27 2HA GLY 27 -18.001 -13.340 10.558 225 H GLU 28 H GLU 28 -15.556 -12.978 8.036 226 HA GLU 28 HA GLU 28 -13.709 -14.644 9.660 227 1HB GLU 28 1HB GLU 28 -14.870 -15.268 6.968 228 2HB GLU 28 2HB GLU 28 -13.189 -15.716 7.259 229 1HG GLU 28 1HG GLU 28 -14.139 -16.717 9.498 230 2HG GLU 28 2HG GLU 28 -15.675 -16.695 8.634 231 H LEU 29 H LEU 29 -11.796 -13.525 9.741 232 HA LEU 29 HA LEU 29 -11.231 -11.139 8.349 233 1HB LEU 29 1HB LEU 29 -10.132 -12.042 10.418 234 2HB LEU 29 2HB LEU 29 -9.311 -13.242 9.428 235 HG LEU 29 HG LEU 29 -7.969 -11.143 10.032 236 1HD1 LEU 29 1HD1 LEU 29 -7.795 -12.815 7.943 237 2HD1 LEU 29 2HD1 LEU 29 -6.708 -11.442 8.143 238 3HD1 LEU 29 3HD1 LEU 29 -8.098 -11.316 7.066 239 1HD2 LEU 29 1HD2 LEU 29 -9.181 -9.729 7.732 240 2HD2 LEU 29 2HD2 LEU 29 -8.543 -9.080 9.244 241 3HD2 LEU 29 3HD2 LEU 29 -10.165 -9.768 9.192 242 H VAL 30 H VAL 30 -10.897 -10.856 6.192 243 HA VAL 30 HA VAL 30 -10.260 -13.112 4.435 244 HB VAL 30 HB VAL 30 -10.603 -10.118 4.029 245 1HG1 VAL 30 1HG1 VAL 30 -9.302 -10.972 2.185 246 2HG1 VAL 30 2HG1 VAL 30 -10.963 -10.800 1.618 247 3HG1 VAL 30 3HG1 VAL 30 -10.337 -12.393 2.046 248 1HG2 VAL 30 1HG2 VAL 30 -12.707 -11.449 2.833 249 2HG2 VAL 30 2HG2 VAL 30 -12.763 -10.682 4.420 250 3HG2 VAL 30 3HG2 VAL 30 -12.424 -12.407 4.286 251 H GLU 31 H GLU 31 -8.657 -9.987 5.190 252 HA GLU 31 HA GLU 31 -6.019 -11.196 5.234 253 1HB GLU 31 1HB GLU 31 -5.252 -10.110 3.113 254 2HB GLU 31 2HB GLU 31 -6.510 -11.311 2.827 255 1HG GLU 31 1HG GLU 31 -8.124 -9.237 3.104 256 2HG GLU 31 2HG GLU 31 -6.679 -8.317 2.689 257 H GLU 32 H GLU 32 -5.696 -9.942 7.119 258 HA GLU 32 HA GLU 32 -6.235 -7.076 7.192 259 1HB GLU 32 1HB GLU 32 -5.160 -7.307 9.418 260 2HB GLU 32 2HB GLU 32 -6.332 -8.598 9.152 261 1HG GLU 32 1HG GLU 32 -4.706 -10.113 9.502 262 2HG GLU 32 2HG GLU 32 -3.853 -9.495 8.087 263 H CYS 33 H CYS 33 -4.609 -5.405 7.262 264 HA CYS 33 HA CYS 33 -1.821 -6.160 6.567 265 1HB CYS 33 1HB CYS 33 -3.696 -5.668 4.610 266 2HB CYS 33 2HB CYS 33 -2.989 -4.068 4.835 267 HG CYS 33 HG CYS 33 -0.657 -5.034 4.229 268 H LEU 34 H LEU 34 -1.244 -3.422 5.676 269 HA LEU 34 HA LEU 34 -1.439 -2.038 8.328 270 1HB LEU 34 1HB LEU 34 0.651 -2.502 6.287 271 2HB LEU 34 2HB LEU 34 0.603 -0.853 6.907 272 HG LEU 34 HG LEU 34 0.609 -1.816 9.239 273 1HD1 LEU 34 1HD1 LEU 34 -0.066 -4.017 9.173 274 2HD1 LEU 34 2HD1 LEU 34 1.675 -4.275 9.070 275 3HD1 LEU 34 3HD1 LEU 34 0.690 -4.311 7.608 276 1HD2 LEU 34 1HD2 LEU 34 2.796 -1.869 7.272 277 2HD2 LEU 34 2HD2 LEU 34 3.084 -2.890 8.681 278 3HD2 LEU 34 3HD2 LEU 34 2.757 -1.170 8.890 279 H CYS 35 H CYS 35 -1.267 0.442 8.047 280 HA CYS 35 HA CYS 35 -2.482 1.460 5.537 281 1HB CYS 35 1HB CYS 35 -3.802 1.103 8.179 282 2HB CYS 35 2HB CYS 35 -4.086 2.655 7.394 283 HG CYS 35 HG CYS 35 -5.497 1.544 5.681 284 H ILE 36 H ILE 36 -2.171 3.743 5.298 285 HA ILE 36 HA ILE 36 -0.044 4.858 7.050 286 HB ILE 36 HB ILE 36 -1.369 5.906 4.520 287 1HG1 ILE 36 1HG1 ILE 36 1.212 4.352 4.892 288 2HG1 ILE 36 2HG1 ILE 36 -0.269 3.711 4.183 289 1HG2 ILE 36 1HG2 ILE 36 0.667 7.300 4.359 290 2HG2 ILE 36 2HG2 ILE 36 1.237 6.638 5.891 291 3HG2 ILE 36 3HG2 ILE 36 -0.216 7.636 5.849 292 1HD1 ILE 36 1HD1 ILE 36 1.627 4.660 2.617 293 2HD1 ILE 36 2HD1 ILE 36 0.933 6.221 3.051 294 3HD1 ILE 36 3HD1 ILE 36 -0.063 5.005 2.252 295 H VAL 37 H VAL 37 -0.391 6.693 8.357 296 HA VAL 37 HA VAL 37 -3.246 7.590 8.569 297 HB VAL 37 HB VAL 37 -1.051 7.455 10.667 298 1HG1 VAL 37 1HG1 VAL 37 -2.447 8.672 11.945 299 2HG1 VAL 37 2HG1 VAL 37 -3.707 7.458 11.726 300 3HG1 VAL 37 3HG1 VAL 37 -3.571 8.801 10.591 301 1HG2 VAL 37 1HG2 VAL 37 -2.646 5.585 11.527 302 2HG2 VAL 37 2HG2 VAL 37 -1.564 5.204 10.187 303 3HG2 VAL 37 3HG2 VAL 37 -3.262 5.563 9.874 304 H ARG 38 H ARG 38 -3.588 9.720 8.156 305 HA ARG 38 HA ARG 38 -1.468 11.718 8.732 306 1HB ARG 38 1HB ARG 38 -2.550 10.889 6.049 307 2HB ARG 38 2HB ARG 38 -2.028 12.555 6.285 308 1HG ARG 38 1HG ARG 38 -0.345 10.079 6.772 309 2HG ARG 38 2HG ARG 38 -0.186 11.175 5.401 310 1HD ARG 38 1HD ARG 38 0.131 13.037 7.197 311 2HD ARG 38 2HD ARG 38 0.469 11.692 8.300 312 HE ARG 38 HE ARG 38 1.947 11.182 5.958 313 1HH1 ARG 38 1HH1 ARG 38 1.777 13.630 8.427 314 2HH1 ARG 38 2HH1 ARG 38 3.449 14.048 8.282 315 1HH2 ARG 38 1HH2 ARG 38 4.114 11.742 5.788 316 2HH2 ARG 38 2HH2 ARG 38 4.764 12.988 6.800 317 H HIS 39 H HIS 39 -2.465 13.992 8.036 318 HA HIS 39 HA HIS 39 -5.170 14.112 9.245 319 1HB HIS 39 1HB HIS 39 -2.809 15.847 8.844 320 2HB HIS 39 2HB HIS 39 -4.352 16.684 8.677 321 HD1 HIS 39 HD1 HIS 39 -3.310 17.781 11.033 322 HD2 HIS 39 HD2 HIS 39 -4.825 13.901 11.203 323 HE1 HIS 39 HE1 HIS 39 -3.761 17.294 13.477 324 H ASN 40 H ASN 40 -6.400 16.179 8.088 325 HA ASN 40 HA ASN 40 -7.082 15.185 5.409 326 1HB ASN 40 1HB ASN 40 -8.440 16.281 7.491 327 2HB ASN 40 2HB ASN 40 -8.193 17.724 6.507 328 1HD2 ASN 40 1HD2 ASN 40 -9.395 14.337 6.245 329 2HD2 ASN 40 2HD2 ASN 40 -10.516 14.672 5.016 330 H ASP 41 H ASP 41 -7.797 18.078 4.633 331 HA ASP 41 HA ASP 41 -6.860 19.787 3.338 332 1HB ASP 41 1HB ASP 41 -4.454 19.189 5.096 333 2HB ASP 41 2HB ASP 41 -4.794 20.699 4.260 334 H ASP 42 H ASP 42 -3.716 19.613 2.960 335 HA ASP 42 HA ASP 42 -3.555 18.794 0.342 336 1HB ASP 42 1HB ASP 42 -1.564 18.351 2.596 337 2HB ASP 42 2HB ASP 42 -1.151 18.349 0.882 338 H TRP 43 H TRP 43 -3.028 16.610 3.143 339 HA TRP 43 HA TRP 43 -2.487 14.218 1.772 340 1HB TRP 43 1HB TRP 43 -2.321 14.371 4.161 341 2HB TRP 43 2HB TRP 43 -3.993 14.902 4.315 342 HD1 TRP 43 HD1 TRP 43 -5.848 13.096 4.441 343 HE1 TRP 43 HE1 TRP 43 -5.837 10.520 4.533 344 HE3 TRP 43 HE3 TRP 43 -0.963 12.192 3.258 345 HZ2 TRP 43 HZ2 TRP 43 -4.001 8.363 4.154 346 HZ3 TRP 43 HZ3 TRP 43 -0.112 9.868 3.131 347 HH2 TRP 43 HH2 TRP 43 -1.623 7.955 3.577 348 H GLY 44 H GLY 44 -5.690 15.567 2.659 349 1HA GLY 44 1HA GLY 44 -7.309 13.492 1.662 350 2HA GLY 44 2HA GLY 44 -7.808 15.181 1.726 351 H THR 45 H THR 45 -6.016 16.334 -0.081 352 HA THR 45 HA THR 45 -7.230 15.572 -2.613 353 HB THR 45 HB THR 45 -4.876 17.392 -1.980 354 HG1 THR 45 HG1 THR 45 -6.308 18.606 -1.086 355 1HG2 THR 45 1HG2 THR 45 -5.097 18.249 -4.107 356 2HG2 THR 45 2HG2 THR 45 -6.824 17.900 -4.181 357 3HG2 THR 45 3HG2 THR 45 -5.651 16.604 -4.426 358 H ALA 46 H ALA 46 -3.770 15.663 -1.629 359 HA ALA 46 HA ALA 46 -2.679 14.341 -3.840 360 1HB ALA 46 1HB ALA 46 -1.817 13.849 -0.978 361 2HB ALA 46 2HB ALA 46 -1.606 15.421 -1.749 362 3HB ALA 46 3HB ALA 46 -0.797 14.001 -2.410 363 H LEU 47 H LEU 47 -3.720 12.765 -0.778 364 HA LEU 47 HA LEU 47 -3.577 10.126 -2.121 365 1HB LEU 47 1HB LEU 47 -4.090 11.074 0.718 366 2HB LEU 47 2HB LEU 47 -4.141 9.376 0.254 367 HG LEU 47 HG LEU 47 -1.944 9.774 1.111 368 1HD1 LEU 47 1HD1 LEU 47 -2.112 8.493 -1.064 369 2HD1 LEU 47 2HD1 LEU 47 -0.536 9.224 -0.759 370 3HD1 LEU 47 3HD1 LEU 47 -1.655 9.979 -1.894 371 1HD2 LEU 47 1HD2 LEU 47 -2.324 12.367 0.500 372 2HD2 LEU 47 2HD2 LEU 47 -1.270 11.911 -0.838 373 3HD2 LEU 47 3HD2 LEU 47 -0.730 11.691 0.826 374 H GLU 48 H GLU 48 -5.749 12.257 -2.657 375 HA GLU 48 HA GLU 48 -8.240 11.552 -1.576 376 1HB GLU 48 1HB GLU 48 -9.093 12.365 -3.805 377 2HB GLU 48 2HB GLU 48 -7.889 13.431 -3.087 378 1HG GLU 48 1HG GLU 48 -6.986 13.285 -5.191 379 2HG GLU 48 2HG GLU 48 -6.245 11.840 -4.509 380 H ASP 49 H ASP 49 -9.891 10.059 -2.333 381 HA ASP 49 HA ASP 49 -10.668 7.956 -3.040 382 1HB ASP 49 1HB ASP 49 -9.910 9.013 -5.221 383 2HB ASP 49 2HB ASP 49 -8.382 8.165 -5.015 384 H TYR 50 H TYR 50 -10.210 5.758 -2.583 385 HA TYR 50 HA TYR 50 -9.045 3.940 -1.614 386 1HB TYR 50 1HB TYR 50 -6.474 5.393 -2.261 387 2HB TYR 50 2HB TYR 50 -6.792 3.663 -2.294 388 HD1 TYR 50 HD1 TYR 50 -9.136 3.308 -3.928 389 HD2 TYR 50 HD2 TYR 50 -5.940 6.150 -4.385 390 HE1 TYR 50 HE1 TYR 50 -9.615 3.460 -6.348 391 HE2 TYR 50 HE2 TYR 50 -6.425 6.297 -6.814 392 HH TYR 50 HH TYR 50 -8.425 4.075 -8.425 393 H LEU 51 H LEU 51 -9.355 6.825 -0.273 394 HA LEU 51 HA LEU 51 -7.400 6.355 1.945 395 1HB LEU 51 1HB LEU 51 -7.666 8.515 0.387 396 2HB LEU 51 2HB LEU 51 -8.932 8.904 1.550 397 HG LEU 51 HG LEU 51 -7.267 8.559 3.394 398 1HD1 LEU 51 1HD1 LEU 51 -4.854 8.888 1.983 399 2HD1 LEU 51 2HD1 LEU 51 -5.711 7.590 1.151 400 3HD1 LEU 51 3HD1 LEU 51 -5.372 7.462 2.875 401 1HD2 LEU 51 1HD2 LEU 51 -7.194 10.805 3.168 402 2HD2 LEU 51 2HD2 LEU 51 -7.315 10.695 1.412 403 3HD2 LEU 51 3HD2 LEU 51 -5.740 10.574 2.197 404 H PHE 52 H PHE 52 -8.471 5.190 3.519 405 HA PHE 52 HA PHE 52 -11.327 5.725 4.105 406 1HB PHE 52 1HB PHE 52 -9.208 3.760 5.020 407 2HB PHE 52 2HB PHE 52 -10.789 3.838 5.799 408 HD1 PHE 52 HD1 PHE 52 -12.838 3.258 4.561 409 HD2 PHE 52 HD2 PHE 52 -8.957 2.941 2.746 410 HE1 PHE 52 HE1 PHE 52 -13.804 1.888 2.734 411 HE2 PHE 52 HE2 PHE 52 -9.924 1.571 0.918 412 HZ PHE 52 HZ PHE 52 -12.348 1.044 0.913 413 H SER 53 H SER 53 -11.794 7.360 5.540 414 HA SER 53 HA SER 53 -9.693 8.113 7.533 415 1HB SER 53 1HB SER 53 -10.417 9.799 5.867 416 2HB SER 53 2HB SER 53 -12.086 9.613 6.405 417 HG SER 53 HG SER 53 -11.585 11.106 7.780 418 H ARG 54 H ARG 54 -10.145 7.974 9.696 419 HA ARG 54 HA ARG 54 -12.842 6.968 10.490 420 1HB ARG 54 1HB ARG 54 -10.495 5.884 10.986 421 2HB ARG 54 2HB ARG 54 -10.379 7.129 12.229 422 1HG ARG 54 1HG ARG 54 -12.091 6.222 13.489 423 2HG ARG 54 2HG ARG 54 -12.906 5.539 12.082 424 1HD ARG 54 1HD ARG 54 -11.998 3.551 12.744 425 2HD ARG 54 2HD ARG 54 -10.462 4.194 12.130 426 HE ARG 54 HE ARG 54 -9.796 4.509 14.376 427 1HH1 ARG 54 1HH1 ARG 54 -13.265 4.325 14.147 428 2HH1 ARG 54 2HH1 ARG 54 -13.492 4.407 15.859 429 1HH2 ARG 54 1HH2 ARG 54 -10.117 4.614 16.595 430 2HH2 ARG 54 2HH2 ARG 54 -11.725 4.569 17.237 431 H LYS 55 H LYS 55 -13.162 7.769 13.005 432 HA LYS 55 HA LYS 55 -13.563 10.638 12.808 433 1HB LYS 55 1HB LYS 55 -14.794 8.573 14.059 434 2HB LYS 55 2HB LYS 55 -13.811 9.165 15.398 435 1HG LYS 55 1HG LYS 55 -14.826 11.498 14.313 436 2HG LYS 55 2HG LYS 55 -16.172 10.372 14.140 437 1HD LYS 55 1HD LYS 55 -15.070 9.917 16.711 438 2HD LYS 55 2HD LYS 55 -15.203 11.666 16.526 439 1HE LYS 55 1HE LYS 55 -17.557 11.531 16.070 440 2HE LYS 55 2HE LYS 55 -17.481 9.771 15.865 441 1HZ LYS 55 1HZ LYS 55 -16.723 11.201 18.362 442 2HZ LYS 55 2HZ LYS 55 -16.843 9.520 18.145 443 3HZ LYS 55 3HZ LYS 55 -18.241 10.483 18.111 444 H ASN 56 H ASN 56 -11.156 10.989 12.517 445 HA ASN 56 HA ASN 56 -9.304 10.626 14.690 446 1HB ASN 56 1HB ASN 56 -10.914 12.224 15.715 447 2HB ASN 56 2HB ASN 56 -9.332 12.971 15.497 448 1HD2 ASN 56 1HD2 ASN 56 -9.449 15.018 14.576 449 2HD2 ASN 56 2HD2 ASN 56 -10.666 15.549 13.520 450 H MET 57 H MET 57 -9.468 10.489 11.720 451 HA MET 57 HA MET 57 -8.090 12.713 10.507 452 1HB MET 57 1HB MET 57 -5.806 11.637 10.476 453 2HB MET 57 2HB MET 57 -6.325 12.111 12.092 454 1HG MET 57 1HG MET 57 -7.249 9.433 11.455 455 2HG MET 57 2HG MET 57 -5.500 9.551 11.269 456 1HE MET 57 1HE MET 57 -4.145 10.647 14.603 457 2HE MET 57 2HE MET 57 -4.661 11.801 13.373 458 3HE MET 57 3HE MET 57 -3.889 10.289 12.895 459 H SER 58 H SER 58 -6.649 11.626 8.540 460 HA SER 58 HA SER 58 -8.480 9.607 7.291 461 1HB SER 58 1HB SER 58 -6.645 11.704 6.071 462 2HB SER 58 2HB SER 58 -7.753 10.666 5.174 463 HG SER 58 HG SER 58 -9.415 11.793 5.866 464 H ALA 59 H ALA 59 -7.512 7.805 6.239 465 HA ALA 59 HA ALA 59 -4.538 7.580 6.388 466 1HB ALA 59 1HB ALA 59 -5.155 5.152 7.247 467 2HB ALA 59 2HB ALA 59 -6.671 5.921 7.716 468 3HB ALA 59 3HB ALA 59 -5.145 6.502 8.382 469 H MET 60 H MET 60 -3.668 6.064 4.858 470 HA MET 60 HA MET 60 -5.433 5.543 2.541 471 1HB MET 60 1HB MET 60 -3.222 6.552 2.227 472 2HB MET 60 2HB MET 60 -2.459 5.212 3.080 473 1HG MET 60 1HG MET 60 -2.207 4.853 0.689 474 2HG MET 60 2HG MET 60 -3.341 3.660 1.320 475 1HE MET 60 1HE MET 60 -3.366 6.119 -2.003 476 2HE MET 60 2HE MET 60 -2.388 6.404 -0.563 477 3HE MET 60 3HE MET 60 -3.780 7.433 -0.901 478 H ALA 61 H ALA 61 -5.602 3.398 1.598 479 HA ALA 61 HA ALA 61 -5.676 1.266 3.626 480 1HB ALA 61 1HB ALA 61 -7.489 0.923 2.294 481 2HB ALA 61 2HB ALA 61 -6.366 0.233 1.122 482 3HB ALA 61 3HB ALA 61 -6.822 1.934 1.013 483 H LEU 62 H LEU 62 -3.462 0.752 4.012 484 HA LEU 62 HA LEU 62 -1.472 -0.451 3.645 485 1HB LEU 62 1HB LEU 62 -1.122 0.148 0.861 486 2HB LEU 62 2HB LEU 62 -1.814 1.545 1.639 487 HG LEU 62 HG LEU 62 0.003 0.969 3.495 488 1HD1 LEU 62 1HD1 LEU 62 0.632 -0.654 1.195 489 2HD1 LEU 62 2HD1 LEU 62 1.398 -0.642 2.784 490 3HD1 LEU 62 3HD1 LEU 62 1.945 0.471 1.531 491 1HD2 LEU 62 1HD2 LEU 62 1.338 2.723 2.565 492 2HD2 LEU 62 2HD2 LEU 62 -0.317 3.073 2.062 493 3HD2 LEU 62 3HD2 LEU 62 0.815 2.344 0.923 494 H GLY 63 H GLY 63 -3.264 -2.303 3.695 495 1HA GLY 63 1HA GLY 63 -2.469 -4.304 1.832 496 2HA GLY 63 2HA GLY 63 -3.878 -4.417 2.886 497 H PHE 64 H PHE 64 -4.952 -5.454 1.025 498 HA PHE 64 HA PHE 64 -5.421 -3.962 -1.429 499 1HB PHE 64 1HB PHE 64 -6.374 -6.483 -0.094 500 2HB PHE 64 2HB PHE 64 -7.268 -5.875 -1.486 501 HD1 PHE 64 HD1 PHE 64 -6.695 -7.094 -3.390 502 HD2 PHE 64 HD2 PHE 64 -3.610 -5.949 -0.629 503 HE1 PHE 64 HE1 PHE 64 -4.982 -8.048 -4.908 504 HE2 PHE 64 HE2 PHE 64 -1.898 -6.902 -2.146 505 HZ PHE 64 HZ PHE 64 -2.583 -7.952 -4.286 506 H GLY 65 H GLY 65 -6.091 -2.078 0.332 507 1HA GLY 65 1HA GLY 65 -8.953 -2.278 1.027 508 2HA GLY 65 2HA GLY 65 -7.875 -0.957 1.468 509 H ALA 66 H ALA 66 -6.836 -0.518 -1.198 510 HA ALA 66 HA ALA 66 -8.858 1.275 -2.205 511 1HB ALA 66 1HB ALA 66 -7.145 1.833 -3.781 512 2HB ALA 66 2HB ALA 66 -6.415 0.232 -3.664 513 3HB ALA 66 3HB ALA 66 -6.281 1.364 -2.317 514 H ILE 67 H ILE 67 -7.634 -1.890 -3.327 515 HA ILE 67 HA ILE 67 -8.953 -2.102 -5.788 516 HB ILE 67 HB ILE 67 -8.953 -4.595 -5.211 517 1HG1 ILE 67 1HG1 ILE 67 -7.278 -4.522 -2.951 518 2HG1 ILE 67 2HG1 ILE 67 -8.636 -3.472 -2.557 519 1HG2 ILE 67 1HG2 ILE 67 -6.539 -4.737 -5.269 520 2HG2 ILE 67 2HG2 ILE 67 -6.386 -3.097 -4.639 521 3HG2 ILE 67 3HG2 ILE 67 -7.043 -3.363 -6.256 522 1HD1 ILE 67 1HD1 ILE 67 -8.564 -6.375 -2.840 523 2HD1 ILE 67 2HD1 ILE 67 -9.835 -5.639 -3.816 524 3HD1 ILE 67 3HD1 ILE 67 -9.782 -5.355 -2.076 525 H PHE 68 H PHE 68 -10.332 -2.553 -2.541 526 HA PHE 68 HA PHE 68 -12.739 -3.837 -3.129 527 1HB PHE 68 1HB PHE 68 -11.933 -1.640 -1.220 528 2HB PHE 68 2HB PHE 68 -13.578 -2.273 -1.215 529 HD1 PHE 68 HD1 PHE 68 -10.841 -2.509 0.661 530 HD2 PHE 68 HD2 PHE 68 -13.247 -5.112 -1.764 531 HE1 PHE 68 HE1 PHE 68 -10.082 -4.456 1.998 532 HE2 PHE 68 HE2 PHE 68 -12.490 -7.058 -0.428 533 HZ PHE 68 HZ PHE 68 -10.908 -6.730 1.453 534 H ASN 69 H ASN 69 -14.281 -3.345 -4.617 535 HA ASN 69 HA ASN 69 -14.538 -0.555 -5.605 536 1HB ASN 69 1HB ASN 69 -15.549 -3.286 -6.461 537 2HB ASN 69 2HB ASN 69 -16.041 -1.801 -7.275 538 1HD2 ASN 69 1HD2 ASN 69 -13.997 -4.255 -7.789 539 2HD2 ASN 69 2HD2 ASN 69 -12.682 -3.442 -8.491 540 H HIS 70 H HIS 70 -16.973 0.006 -6.137 541 HA HIS 70 HA HIS 70 -18.485 -0.265 -3.593 542 1HB HIS 70 1HB HIS 70 -17.973 1.935 -4.749 543 2HB HIS 70 2HB HIS 70 -19.022 1.415 -6.068 544 HD1 HIS 70 HD1 HIS 70 -20.561 3.506 -5.369 545 HD2 HIS 70 HD2 HIS 70 -20.344 0.422 -2.573 546 HE1 HIS 70 HE1 HIS 70 -22.481 3.866 -3.757 547 H SER 71 H SER 71 -19.723 -2.130 -3.602 548 HA SER 71 HA SER 71 -21.281 -2.748 -6.090 549 1HB SER 71 1HB SER 71 -19.652 -4.455 -5.485 550 2HB SER 71 2HB SER 71 -20.218 -4.462 -3.816 551 HG SER 71 HG SER 71 -21.341 -5.582 -6.091 552 H LYS 72 H LYS 72 -23.486 -2.604 -5.905 553 HA LYS 72 HA LYS 72 -24.845 -1.551 -3.675 554 1HB LYS 72 1HB LYS 72 -25.484 -3.037 -6.173 555 2HB LYS 72 2HB LYS 72 -26.755 -3.016 -4.950 556 1HG LYS 72 1HG LYS 72 -25.448 -0.409 -5.372 557 2HG LYS 72 2HG LYS 72 -26.323 -1.013 -6.780 558 1HD LYS 72 1HD LYS 72 -28.372 -0.977 -5.692 559 2HD LYS 72 2HD LYS 72 -27.646 -1.180 -4.097 560 1HE LYS 72 1HE LYS 72 -28.180 1.079 -3.975 561 2HE LYS 72 2HE LYS 72 -26.584 1.219 -4.737 562 1HZ LYS 72 1HZ LYS 72 -27.782 0.939 -6.913 563 2HZ LYS 72 2HZ LYS 72 -28.092 2.404 -6.112 564 3HZ LYS 72 3HZ LYS 72 -29.240 1.152 -6.069 565 H ASP 73 H ASP 73 -23.861 -4.853 -4.333 566 HA ASP 73 HA ASP 73 -25.407 -5.814 -1.958 567 1HB ASP 73 1HB ASP 73 -24.028 -7.233 -4.269 568 2HB ASP 73 2HB ASP 73 -24.914 -8.050 -2.981 569 HA PRO 74 HA PRO 74 -20.967 -5.343 -0.609 570 1HB PRO 74 1HB PRO 74 -21.713 -4.692 2.003 571 2HB PRO 74 2HB PRO 74 -21.345 -3.514 0.732 572 1HG PRO 74 1HG PRO 74 -23.973 -4.473 1.731 573 2HG PRO 74 2HG PRO 74 -23.499 -2.867 1.158 574 1HD PRO 74 1HD PRO 74 -24.967 -4.589 -0.332 575 2HD PRO 74 2HD PRO 74 -23.843 -3.414 -1.048 576 H ASN 75 H ASN 75 -20.432 -7.530 -0.541 577 HA ASN 75 HA ASN 75 -21.827 -9.318 1.377 578 1HB ASN 75 1HB ASN 75 -19.755 -9.699 -0.813 579 2HB ASN 75 2HB ASN 75 -20.396 -11.023 0.160 580 1HD2 ASN 75 1HD2 ASN 75 -20.945 -11.334 -2.470 581 2HD2 ASN 75 2HD2 ASN 75 -22.545 -10.909 -2.843 582 H ALA 76 H ALA 76 -18.874 -7.510 1.064 583 HA ALA 76 HA ALA 76 -17.807 -8.885 3.509 584 1HB ALA 76 1HB ALA 76 -15.847 -7.539 1.800 585 2HB ALA 76 2HB ALA 76 -16.753 -8.769 0.918 586 3HB ALA 76 3HB ALA 76 -15.861 -9.207 2.375 587 H ARG 77 H ARG 77 -16.043 -7.299 4.520 588 HA ARG 77 HA ARG 77 -16.831 -4.446 4.267 589 1HB ARG 77 1HB ARG 77 -17.766 -6.292 6.274 590 2HB ARG 77 2HB ARG 77 -16.743 -5.084 7.049 591 1HG ARG 77 1HG ARG 77 -18.381 -3.712 5.170 592 2HG ARG 77 2HG ARG 77 -19.432 -4.789 6.087 593 1HD ARG 77 1HD ARG 77 -17.491 -2.764 7.263 594 2HD ARG 77 2HD ARG 77 -19.261 -2.657 7.276 595 HE ARG 77 HE ARG 77 -17.632 -4.406 8.970 596 1HH1 ARG 77 1HH1 ARG 77 -20.726 -3.914 7.448 597 2HH1 ARG 77 2HH1 ARG 77 -21.564 -4.915 8.581 598 1HH2 ARG 77 1HH2 ARG 77 -18.745 -5.701 10.426 599 2HH2 ARG 77 2HH2 ARG 77 -20.455 -5.920 10.254 600 H HIS 78 H HIS 78 -15.352 -3.069 5.683 601 HA HIS 78 HA HIS 78 -12.665 -4.377 5.962 602 1HB HIS 78 1HB HIS 78 -11.795 -2.126 5.301 603 2HB HIS 78 2HB HIS 78 -12.831 -2.826 4.057 604 HD1 HIS 78 HD1 HIS 78 -15.133 -1.721 3.652 605 HD2 HIS 78 HD2 HIS 78 -12.931 0.107 6.683 606 HE1 HIS 78 HE1 HIS 78 -16.314 0.456 4.183 607 H GLU 79 H GLU 79 -11.870 -4.298 8.018 608 HA GLU 79 HA GLU 79 -13.108 -2.369 9.943 609 1HB GLU 79 1HB GLU 79 -13.113 -4.998 10.130 610 2HB GLU 79 2HB GLU 79 -11.444 -4.782 10.649 611 1HG GLU 79 1HG GLU 79 -12.074 -3.508 12.538 612 2HG GLU 79 2HG GLU 79 -13.691 -3.207 11.903 613 H LEU 80 H LEU 80 -11.475 -1.745 11.751 614 HA LEU 80 HA LEU 80 -8.793 -1.204 10.515 615 1HB LEU 80 1HB LEU 80 -10.793 0.459 12.014 616 2HB LEU 80 2HB LEU 80 -9.083 0.841 12.215 617 HG LEU 80 HG LEU 80 -10.157 0.426 9.445 618 1HD1 LEU 80 1HD1 LEU 80 -11.084 2.456 11.300 619 2HD1 LEU 80 2HD1 LEU 80 -11.613 2.136 9.649 620 3HD1 LEU 80 3HD1 LEU 80 -10.232 3.193 9.943 621 1HD2 LEU 80 1HD2 LEU 80 -7.688 0.836 10.213 622 2HD2 LEU 80 2HD2 LEU 80 -8.206 2.511 10.394 623 3HD2 LEU 80 3HD2 LEU 80 -8.307 1.722 8.820 624 H THR 81 H THR 81 -6.998 -1.421 11.861 625 HA THR 81 HA THR 81 -7.526 -2.700 14.519 626 HB THR 81 HB THR 81 -5.357 -3.037 12.417 627 HG1 THR 81 HG1 THR 81 -6.471 -4.726 11.877 628 1HG2 THR 81 1HG2 THR 81 -5.148 -5.062 14.350 629 2HG2 THR 81 2HG2 THR 81 -5.303 -3.561 15.262 630 3HG2 THR 81 3HG2 THR 81 -4.013 -3.741 14.073 631 H ALA 82 H ALA 82 -6.302 -1.952 16.289 632 HA ALA 82 HA ALA 82 -5.082 -0.367 17.548 633 1HB ALA 82 1HB ALA 82 -3.577 -0.984 15.042 634 2HB ALA 82 2HB ALA 82 -3.095 -1.219 16.722 635 3HB ALA 82 3HB ALA 82 -3.001 0.384 15.994 636 H GLY 83 H GLY 83 -7.315 0.626 15.878 637 1HA GLY 83 1HA GLY 83 -8.189 2.827 15.635 638 2HA GLY 83 2HA GLY 83 -6.568 3.470 15.898 639 H LEU 84 H LEU 84 -5.213 3.785 14.107 640 HA LEU 84 HA LEU 84 -6.443 3.218 11.427 641 1HB LEU 84 1HB LEU 84 -5.695 5.657 12.764 642 2HB LEU 84 2HB LEU 84 -4.658 5.451 11.355 643 HG LEU 84 HG LEU 84 -6.608 5.196 9.908 644 1HD1 LEU 84 1HD1 LEU 84 -7.898 4.528 12.349 645 2HD1 LEU 84 2HD1 LEU 84 -8.594 4.523 10.728 646 3HD1 LEU 84 3HD1 LEU 84 -8.694 5.973 11.728 647 1HD2 LEU 84 1HD2 LEU 84 -6.368 7.557 11.713 648 2HD2 LEU 84 2HD2 LEU 84 -7.779 7.480 10.658 649 3HD2 LEU 84 3HD2 LEU 84 -6.157 7.454 9.965 650 H LYS 85 H LYS 85 -4.372 1.725 13.092 651 HA LYS 85 HA LYS 85 -1.871 2.118 11.567 652 1HB LYS 85 1HB LYS 85 -2.845 0.536 13.933 653 2HB LYS 85 2HB LYS 85 -1.345 0.048 13.143 654 1HG LYS 85 1HG LYS 85 -1.921 2.851 14.149 655 2HG LYS 85 2HG LYS 85 -0.972 1.651 15.027 656 1HD LYS 85 1HD LYS 85 0.855 2.170 13.819 657 2HD LYS 85 2HD LYS 85 -0.009 1.822 12.320 658 1HE LYS 85 1HE LYS 85 0.472 4.093 12.022 659 2HE LYS 85 2HE LYS 85 -1.107 4.209 12.823 660 1HZ LYS 85 1HZ LYS 85 1.567 4.288 14.128 661 2HZ LYS 85 2HZ LYS 85 0.094 4.225 14.970 662 3HZ LYS 85 3HZ LYS 85 0.464 5.573 14.007 663 H ARG 86 H ARG 86 -3.562 -0.911 12.425 664 HA ARG 86 HA ARG 86 -2.910 -1.950 9.705 665 1HB ARG 86 1HB ARG 86 -3.201 -2.995 12.462 666 2HB ARG 86 2HB ARG 86 -3.837 -4.053 11.202 667 1HG ARG 86 1HG ARG 86 -1.766 -4.540 10.409 668 2HG ARG 86 2HG ARG 86 -1.223 -2.868 10.550 669 1HD ARG 86 1HD ARG 86 -0.208 -3.294 12.538 670 2HD ARG 86 2HD ARG 86 -1.654 -4.104 13.170 671 HE ARG 86 HE ARG 86 -0.452 -5.765 11.172 672 1HH1 ARG 86 1HH1 ARG 86 0.090 -4.588 14.403 673 2HH1 ARG 86 2HH1 ARG 86 1.016 -5.972 14.870 674 1HH2 ARG 86 1HH2 ARG 86 0.753 -7.551 11.802 675 2HH2 ARG 86 2HH2 ARG 86 1.390 -7.638 13.410 676 H MET 87 H MET 87 -4.690 -3.676 9.011 677 HA MET 87 HA MET 87 -7.420 -2.592 9.572 678 1HB MET 87 1HB MET 87 -5.916 -2.884 6.981 679 2HB MET 87 2HB MET 87 -7.674 -3.023 6.976 680 1HG MET 87 1HG MET 87 -7.784 -0.816 8.181 681 2HG MET 87 2HG MET 87 -6.038 -0.672 7.974 682 1HE MET 87 1HE MET 87 -8.714 -2.105 5.073 683 2HE MET 87 2HE MET 87 -9.425 -0.493 5.011 684 3HE MET 87 3HE MET 87 -9.312 -1.348 6.549 685 H ARG 88 H ARG 88 -9.091 -4.150 9.338 686 HA ARG 88 HA ARG 88 -8.220 -6.980 8.861 687 1HB ARG 88 1HB ARG 88 -8.277 -6.559 11.233 688 2HB ARG 88 2HB ARG 88 -9.836 -5.750 11.109 689 1HG ARG 88 1HG ARG 88 -10.564 -8.100 10.080 690 2HG ARG 88 2HG ARG 88 -9.186 -8.663 11.021 691 1HD ARG 88 1HD ARG 88 -11.474 -6.991 12.112 692 2HD ARG 88 2HD ARG 88 -11.285 -8.737 12.362 693 HE ARG 88 HE ARG 88 -8.855 -7.355 13.066 694 1HH1 ARG 88 1HH1 ARG 88 -12.094 -7.996 14.170 695 2HH1 ARG 88 2HH1 ARG 88 -11.675 -7.830 15.840 696 1HH2 ARG 88 1HH2 ARG 88 -8.337 -7.145 15.241 697 2HH2 ARG 88 2HH2 ARG 88 -9.566 -7.353 16.444 698 H ILE 89 H ILE 89 -9.314 -7.316 6.908 699 HA ILE 89 HA ILE 89 -12.064 -6.304 6.553 700 HB ILE 89 HB ILE 89 -10.240 -8.017 4.821 701 1HG1 ILE 89 1HG1 ILE 89 -10.731 -5.197 4.115 702 2HG1 ILE 89 2HG1 ILE 89 -9.820 -5.419 5.609 703 1HG2 ILE 89 1HG2 ILE 89 -11.731 -7.623 3.039 704 2HG2 ILE 89 2HG2 ILE 89 -12.525 -6.291 3.879 705 3HG2 ILE 89 3HG2 ILE 89 -12.805 -7.953 4.398 706 1HD1 ILE 89 1HD1 ILE 89 -8.530 -5.334 3.326 707 2HD1 ILE 89 2HD1 ILE 89 -9.085 -7.000 3.157 708 3HD1 ILE 89 3HD1 ILE 89 -8.072 -6.542 4.527 709 H PHE 90 H PHE 90 -13.904 -7.599 6.601 710 HA PHE 90 HA PHE 90 -13.504 -10.525 7.132 711 1HB PHE 90 1HB PHE 90 -14.784 -8.362 8.673 712 2HB PHE 90 2HB PHE 90 -15.808 -9.785 8.481 713 HD1 PHE 90 HD1 PHE 90 -15.571 -11.506 10.036 714 HD2 PHE 90 HD2 PHE 90 -12.227 -8.936 9.224 715 HE1 PHE 90 HE1 PHE 90 -14.241 -12.691 11.762 716 HE2 PHE 90 HE2 PHE 90 -10.900 -10.120 10.950 717 HZ PHE 90 HZ PHE 90 -11.902 -11.995 12.215 718 H THR 91 H THR 91 -16.113 -11.331 7.166 719 HA THR 91 HA THR 91 -17.199 -10.439 4.515 720 HB THR 91 HB THR 91 -17.869 -12.893 4.328 721 HG1 THR 91 HG1 THR 91 -17.715 -13.791 6.239 722 1HG2 THR 91 1HG2 THR 91 -15.992 -12.312 3.041 723 2HG2 THR 91 2HG2 THR 91 -15.379 -13.627 4.043 724 3HG2 THR 91 3HG2 THR 91 -15.011 -11.954 4.463 725 H ILE 92 H ILE 92 -18.864 -9.126 5.385 726 HA ILE 92 HA ILE 92 -20.508 -9.743 7.623 727 HB ILE 92 HB ILE 92 -21.978 -8.028 6.603 728 1HG1 ILE 92 1HG1 ILE 92 -20.180 -8.279 4.174 729 2HG1 ILE 92 2HG1 ILE 92 -21.801 -8.966 4.275 730 1HG2 ILE 92 1HG2 ILE 92 -20.427 -6.566 7.328 731 2HG2 ILE 92 2HG2 ILE 92 -19.602 -6.694 5.775 732 3HG2 ILE 92 3HG2 ILE 92 -19.163 -7.774 7.099 733 1HD1 ILE 92 1HD1 ILE 92 -22.783 -6.951 3.941 734 2HD1 ILE 92 2HD1 ILE 92 -21.193 -6.403 3.410 735 3HD1 ILE 92 3HD1 ILE 92 -21.702 -6.148 5.079 736 H LYS 93 H LYS 93 -20.453 -11.117 4.448 737 HA LYS 93 HA LYS 93 -22.882 -12.709 5.103 738 1HB LYS 93 1HB LYS 93 -22.328 -11.058 2.617 739 2HB LYS 93 2HB LYS 93 -23.580 -12.298 2.678 740 1HG LYS 93 1HG LYS 93 -24.056 -10.821 4.973 741 2HG LYS 93 2HG LYS 93 -23.579 -9.592 3.802 742 1HD LYS 93 1HD LYS 93 -25.570 -11.727 3.055 743 2HD LYS 93 2HD LYS 93 -26.091 -10.284 3.925 744 1HE LYS 93 1HE LYS 93 -24.835 -8.954 2.085 745 2HE LYS 93 2HE LYS 93 -24.862 -10.472 1.168 746 1HZ LYS 93 1HZ LYS 93 -27.191 -9.027 2.327 747 2HZ LYS 93 2HZ LYS 93 -27.282 -10.591 1.670 748 3HZ LYS 93 3HZ LYS 93 -26.864 -9.276 0.679 749 HA PRO 94 HA PRO 94 -20.223 -16.063 3.952 750 1HB PRO 94 1HB PRO 94 -22.800 -17.101 2.873 751 2HB PRO 94 2HB PRO 94 -21.564 -17.939 3.828 752 1HG PRO 94 1HG PRO 94 -23.729 -17.049 4.972 753 2HG PRO 94 2HG PRO 94 -22.191 -16.868 5.774 754 1HD PRO 94 1HD PRO 94 -23.881 -14.833 4.407 755 2HD PRO 94 2HD PRO 94 -22.832 -14.664 5.829 756 H ILE 95 H ILE 95 -19.003 -16.383 2.069 757 HA ILE 95 HA ILE 95 -20.201 -15.394 -0.498 758 HB ILE 95 HB ILE 95 -17.374 -15.413 0.616 759 1HG1 ILE 95 1HG1 ILE 95 -19.033 -13.081 -0.357 760 2HG1 ILE 95 2HG1 ILE 95 -19.111 -13.651 1.310 761 1HG2 ILE 95 1HG2 ILE 95 -17.034 -15.845 -1.685 762 2HG2 ILE 95 2HG2 ILE 95 -16.923 -14.089 -1.567 763 3HG2 ILE 95 3HG2 ILE 95 -18.403 -14.841 -2.164 764 1HD1 ILE 95 1HD1 ILE 95 -17.465 -11.950 1.356 765 2HD1 ILE 95 2HD1 ILE 95 -16.749 -12.485 -0.165 766 3HD1 ILE 95 3HD1 ILE 95 -16.535 -13.447 1.297 767 H ALA 96 H ALA 96 -20.044 -16.750 -2.298 768 HA ALA 96 HA ALA 96 -19.368 -19.572 -1.758 769 1HB ALA 96 1HB ALA 96 -21.439 -18.967 -2.914 770 2HB ALA 96 2HB ALA 96 -20.389 -19.819 -4.047 771 3HB ALA 96 3HB ALA 96 -20.532 -18.063 -4.126 772 H ILE 97 H ILE 97 -18.020 -20.773 -3.356 773 HA ILE 97 HA ILE 97 -15.462 -19.557 -3.771 774 HB ILE 97 HB ILE 97 -16.789 -22.011 -4.984 775 1HG1 ILE 97 1HG1 ILE 97 -14.811 -22.058 -2.731 776 2HG1 ILE 97 2HG1 ILE 97 -16.485 -21.632 -2.379 777 1HG2 ILE 97 1HG2 ILE 97 -14.332 -20.808 -5.641 778 2HG2 ILE 97 2HG2 ILE 97 -14.853 -22.441 -6.056 779 3HG2 ILE 97 3HG2 ILE 97 -13.920 -22.160 -4.586 780 1HD1 ILE 97 1HD1 ILE 97 -16.961 -23.781 -3.890 781 2HD1 ILE 97 2HD1 ILE 97 -16.629 -23.929 -2.164 782 3HD1 ILE 97 3HD1 ILE 97 -15.346 -24.224 -3.337 783 H GLY 98 H GLY 98 -15.088 -17.964 -5.264 784 1HA GLY 98 1HA GLY 98 -14.780 -17.336 -7.591 785 2HA GLY 98 2HA GLY 98 -16.155 -18.357 -8.014 786 H GLU 99 H GLU 99 -15.959 -15.929 -5.418 787 HA GLU 99 HA GLU 99 -18.250 -14.509 -6.735 788 1HB GLU 99 1HB GLU 99 -17.546 -15.371 -4.011 789 2HB GLU 99 2HB GLU 99 -18.091 -13.695 -4.083 790 1HG GLU 99 1HG GLU 99 -19.732 -15.448 -5.743 791 2HG GLU 99 2HG GLU 99 -19.729 -15.954 -4.053 792 H GLU 100 H GLU 100 -18.267 -12.077 -5.891 793 HA GLU 100 HA GLU 100 -15.514 -10.985 -6.356 794 1HB GLU 100 1HB GLU 100 -17.767 -10.651 -7.822 795 2HB GLU 100 2HB GLU 100 -17.974 -9.327 -6.676 796 1HG GLU 100 1HG GLU 100 -15.235 -9.491 -7.680 797 2HG GLU 100 2HG GLU 100 -16.405 -9.267 -8.980 798 H ILE 101 H ILE 101 -14.628 -10.217 -4.492 799 HA ILE 101 HA ILE 101 -16.350 -9.369 -2.245 800 HB ILE 101 HB ILE 101 -13.345 -9.627 -2.598 801 1HG1 ILE 101 1HG1 ILE 101 -15.381 -11.438 -1.267 802 2HG1 ILE 101 2HG1 ILE 101 -14.565 -11.763 -2.797 803 1HG2 ILE 101 1HG2 ILE 101 -13.099 -9.189 -0.319 804 2HG2 ILE 101 2HG2 ILE 101 -14.780 -9.583 0.039 805 3HG2 ILE 101 3HG2 ILE 101 -14.381 -8.060 -0.755 806 1HD1 ILE 101 1HD1 ILE 101 -12.672 -11.083 -0.686 807 2HD1 ILE 101 2HD1 ILE 101 -12.706 -12.494 -1.743 808 3HD1 ILE 101 3HD1 ILE 101 -13.654 -12.484 -0.256 809 H THR 102 H THR 102 -16.880 -7.277 -1.955 810 HA THR 102 HA THR 102 -15.007 -5.094 -2.597 811 HB THR 102 HB THR 102 -16.859 -4.032 -4.038 812 HG1 THR 102 HG1 THR 102 -17.734 -6.708 -4.247 813 1HG2 THR 102 1HG2 THR 102 -15.780 -6.619 -5.172 814 2HG2 THR 102 2HG2 THR 102 -14.749 -5.218 -4.879 815 3HG2 THR 102 3HG2 THR 102 -16.088 -5.105 -6.021 816 H ILE 103 H ILE 103 -15.379 -3.404 -1.143 817 HA ILE 103 HA ILE 103 -17.760 -3.672 0.635 818 HB ILE 103 HB ILE 103 -16.413 -2.287 2.158 819 1HG1 ILE 103 1HG1 ILE 103 -13.922 -2.157 0.812 820 2HG1 ILE 103 2HG1 ILE 103 -15.132 -1.529 -0.307 821 1HG2 ILE 103 1HG2 ILE 103 -15.183 -4.082 2.764 822 2HG2 ILE 103 2HG2 ILE 103 -14.233 -4.021 1.279 823 3HG2 ILE 103 3HG2 ILE 103 -15.785 -4.859 1.299 824 1HD1 ILE 103 1HD1 ILE 103 -15.900 -0.380 2.074 825 2HD1 ILE 103 2HD1 ILE 103 -14.907 0.412 0.851 826 3HD1 ILE 103 3HD1 ILE 103 -14.142 -0.391 2.222 827 H SER 104 H SER 104 -18.665 -1.476 1.398 828 HA SER 104 HA SER 104 -19.043 0.268 -1.002 829 1HB SER 104 1HB SER 104 -21.148 0.869 0.155 830 2HB SER 104 2HB SER 104 -21.002 -0.883 0.016 831 HG SER 104 HG SER 104 -21.533 0.222 2.165 832 H TYR 105 H TYR 105 -19.967 2.565 0.200 833 HA TYR 105 HA TYR 105 -17.655 3.458 1.897 834 1HB TYR 105 1HB TYR 105 -19.211 5.060 -0.168 835 2HB TYR 105 2HB TYR 105 -17.725 5.546 0.645 836 HD1 TYR 105 HD1 TYR 105 -16.227 2.922 0.509 837 HD2 TYR 105 HD2 TYR 105 -18.522 5.041 -2.443 838 HE1 TYR 105 HE1 TYR 105 -14.898 1.855 -1.293 839 HE2 TYR 105 HE2 TYR 105 -17.190 3.973 -4.243 840 HH TYR 105 HH TYR 105 -15.348 1.302 -3.825 841 H GLY 106 H GLY 106 -20.921 4.551 0.889 842 1HA GLY 106 1HA GLY 106 -22.699 5.391 2.165 843 2HA GLY 106 2HA GLY 106 -22.000 4.539 3.541 844 H ASP 107 H ASP 107 -23.174 7.117 3.744 845 HA ASP 107 HA ASP 107 -22.724 9.223 4.700 846 1HB ASP 107 1HB ASP 107 -20.996 7.271 5.754 847 2HB ASP 107 2HB ASP 107 -19.951 8.647 5.397 848 H ASP 108 H ASP 108 -22.558 10.801 3.170 849 HA ASP 108 HA ASP 108 -21.620 12.303 1.634 850 1HB ASP 108 1HB ASP 108 -20.145 12.667 3.536 851 2HB ASP 108 2HB ASP 108 -19.176 11.266 3.098 852 H TYR 109 H TYR 109 -18.898 10.010 1.637 853 HA TYR 109 HA TYR 109 -18.274 10.015 -1.045 854 1HB TYR 109 1HB TYR 109 -17.790 8.443 1.263 855 2HB TYR 109 2HB TYR 109 -18.193 7.308 -0.025 856 HD1 TYR 109 HD1 TYR 109 -16.577 6.724 -1.622 857 HD2 TYR 109 HD2 TYR 109 -16.069 10.311 0.685 858 HE1 TYR 109 HE1 TYR 109 -14.322 7.036 -2.605 859 HE2 TYR 109 HE2 TYR 109 -13.814 10.624 -0.297 860 HH TYR 109 HH TYR 109 -12.027 8.616 -1.472 861 H TRP 110 H TRP 110 -19.700 9.854 -2.733 862 HA TRP 110 HA TRP 110 -21.422 9.011 -4.112 863 1HB TRP 110 1HB TRP 110 -19.658 6.954 -3.139 864 2HB TRP 110 2HB TRP 110 -21.276 6.273 -3.317 865 HD1 TRP 110 HD1 TRP 110 -22.394 6.364 -5.751 866 HE1 TRP 110 HE1 TRP 110 -21.341 6.526 -8.099 867 HE3 TRP 110 HE3 TRP 110 -17.693 7.921 -4.503 868 HZ2 TRP 110 HZ2 TRP 110 -18.835 7.224 -9.290 869 HZ3 TRP 110 HZ3 TRP 110 -15.995 8.326 -6.262 870 HH2 TRP 110 HH2 TRP 110 -16.559 7.980 -8.651 871 H LEU 111 H LEU 111 -23.145 6.818 -3.714 872 HA LEU 111 HA LEU 111 -25.316 7.882 -2.309 873 1HB LEU 111 1HB LEU 111 -24.804 5.705 -3.845 874 2HB LEU 111 2HB LEU 111 -24.924 4.925 -2.268 875 HG LEU 111 HG LEU 111 -27.019 6.926 -3.026 876 1HD1 LEU 111 1HD1 LEU 111 -27.333 5.734 -4.967 877 2HD1 LEU 111 2HD1 LEU 111 -28.201 4.658 -3.871 878 3HD1 LEU 111 3HD1 LEU 111 -26.538 4.293 -4.333 879 1HD2 LEU 111 1HD2 LEU 111 -28.408 5.295 -1.716 880 2HD2 LEU 111 2HD2 LEU 111 -27.062 5.963 -0.793 881 3HD2 LEU 111 3HD2 LEU 111 -26.954 4.332 -1.456 882 H SER 112 H SER 112 -25.990 7.835 -0.165 883 HA SER 112 HA SER 112 -24.019 7.287 1.901 884 1HB SER 112 1HB SER 112 -26.248 8.864 1.579 885 2HB SER 112 2HB SER 112 -26.878 7.584 2.616 886 HG SER 112 HG SER 112 -24.870 9.463 3.101 887 H ARG 113 H ARG 113 -26.031 6.201 3.807 888 HA ARG 113 HA ARG 113 -25.452 3.479 3.818 889 1HB ARG 113 1HB ARG 113 -27.982 4.927 4.668 890 2HB ARG 113 2HB ARG 113 -27.505 3.329 5.238 891 1HG ARG 113 1HG ARG 113 -25.260 4.542 5.878 892 2HG ARG 113 2HG ARG 113 -26.252 5.999 5.814 893 1HD ARG 113 1HD ARG 113 -27.777 5.104 7.487 894 2HD ARG 113 2HD ARG 113 -26.947 3.536 7.458 895 HE ARG 113 HE ARG 113 -26.002 5.941 8.809 896 1HH1 ARG 113 1HH1 ARG 113 -25.041 3.032 7.156 897 2HH1 ARG 113 2HH1 ARG 113 -23.508 2.955 7.952 898 1HH2 ARG 113 1HH2 ARG 113 -24.006 5.819 9.830 899 2HH2 ARG 113 2HH2 ARG 113 -22.924 4.519 9.455 900 HA PRO 114 HA PRO 114 -27.858 2.460 0.110 901 1HB PRO 114 1HB PRO 114 -26.652 0.019 -0.301 902 2HB PRO 114 2HB PRO 114 -25.960 1.552 -0.861 903 1HG PRO 114 1HG PRO 114 -25.248 -0.106 1.498 904 2HG PRO 114 2HG PRO 114 -24.210 0.861 0.443 905 1HD PRO 114 1HD PRO 114 -25.036 1.634 2.949 906 2HD PRO 114 2HD PRO 114 -24.535 2.757 1.670 907 H ARG 115 H ARG 115 -29.841 2.120 1.240 908 HA ARG 115 HA ARG 115 -30.222 -0.233 2.945 909 1HB ARG 115 1HB ARG 115 -31.564 2.254 2.194 910 2HB ARG 115 2HB ARG 115 -32.695 0.903 2.270 911 1HG ARG 115 1HG ARG 115 -32.705 1.154 4.512 912 2HG ARG 115 2HG ARG 115 -31.035 0.587 4.513 913 1HD ARG 115 1HD ARG 115 -30.162 2.757 4.616 914 2HD ARG 115 2HD ARG 115 -31.614 3.479 3.896 915 HE ARG 115 HE ARG 115 -32.232 2.144 6.392 916 1HH1 ARG 115 1HH1 ARG 115 -30.858 5.037 5.026 917 2HH1 ARG 115 2HH1 ARG 115 -31.249 6.005 6.405 918 1HH2 ARG 115 1HH2 ARG 115 -32.728 3.422 8.169 919 2HH2 ARG 115 2HH2 ARG 115 -32.300 5.100 8.172 920 H LEU 116 H LEU 116 -30.033 -2.125 1.689 921 HA LEU 116 HA LEU 116 -32.111 -2.458 -0.442 922 1HB LEU 116 1HB LEU 116 -29.300 -2.271 -0.745 923 2HB LEU 116 2HB LEU 116 -29.693 -3.978 -0.951 924 HG LEU 116 HG LEU 116 -31.680 -2.908 -2.420 925 1HD1 LEU 116 1HD1 LEU 116 -29.517 -1.089 -3.307 926 2HD1 LEU 116 2HD1 LEU 116 -30.310 -0.639 -1.797 927 3HD1 LEU 116 3HD1 LEU 116 -31.262 -0.830 -3.269 928 1HD2 LEU 116 1HD2 LEU 116 -30.396 -3.494 -4.358 929 2HD2 LEU 116 2HD2 LEU 116 -29.854 -4.564 -3.064 930 3HD2 LEU 116 3HD2 LEU 116 -28.875 -3.172 -3.525 931 H THR 117 H THR 117 -32.909 -4.630 -0.623 932 HA THR 117 HA THR 117 -32.127 -6.437 1.644 933 HB THR 117 HB THR 117 -34.845 -6.313 0.324 934 HG1 THR 117 HG1 THR 117 -34.019 -4.804 2.572 935 1HG2 THR 117 1HG2 THR 117 -33.666 -7.356 2.880 936 2HG2 THR 117 2HG2 THR 117 -34.770 -8.150 1.757 937 3HG2 THR 117 3HG2 THR 117 -35.368 -6.896 2.843 938 H GLN 118 H GLN 118 -32.529 -8.775 1.154 939 HA GLN 118 HA GLN 118 -31.314 -9.675 -1.223 940 1HB GLN 118 1HB GLN 118 -32.314 -10.727 1.135 941 2HB GLN 118 2HB GLN 118 -33.375 -11.447 -0.077 942 1HG GLN 118 1HG GLN 118 -31.715 -12.747 -0.925 943 2HG GLN 118 2HG GLN 118 -30.526 -11.448 -0.827 944 1HE2 GLN 118 1HE2 GLN 118 -29.204 -11.324 1.080 945 2HE2 GLN 118 2HE2 GLN 118 -29.254 -12.495 2.308 946 H ASN 119 H ASN 119 -32.169 -8.870 -3.166 947 HA ASN 119 HA ASN 119 -33.700 -8.646 -4.952 948 1HB ASN 119 1HB ASN 119 -33.800 -11.261 -3.778 949 2HB ASN 119 2HB ASN 119 -35.437 -10.824 -4.266 950 1HD2 ASN 119 1HD2 ASN 119 -32.107 -10.442 -5.638 951 2HD2 ASN 119 2HD2 ASN 119 -32.549 -10.907 -7.210 952 1H GLY 201 1H GLY 201 -28.688 38.238 -18.073 953 2H GLY 201 2H GLY 201 -28.073 38.437 -16.503 954 3H GLY 201 3H GLY 201 -29.417 37.434 -16.767 955 1HA GLY 201 1HA GLY 201 -28.105 35.861 -17.977 956 2HA GLY 201 2HA GLY 201 -26.709 36.934 -17.873 957 H LYS 202 H LYS 202 -26.253 37.626 -15.464 958 HA LYS 202 HA LYS 202 -25.484 36.879 -13.359 959 1HB LYS 202 1HB LYS 202 -28.266 36.438 -13.700 960 2HB LYS 202 2HB LYS 202 -27.641 35.005 -12.884 961 1HG LYS 202 1HG LYS 202 -26.958 36.200 -11.017 962 2HG LYS 202 2HG LYS 202 -26.736 37.695 -11.927 963 1HD LYS 202 1HD LYS 202 -28.755 38.351 -11.165 964 2HD LYS 202 2HD LYS 202 -29.467 37.097 -12.179 965 1HE LYS 202 1HE LYS 202 -29.270 35.471 -10.331 966 2HE LYS 202 2HE LYS 202 -28.526 36.716 -9.311 967 1HZ LYS 202 1HZ LYS 202 -30.493 38.095 -9.636 968 2HZ LYS 202 2HZ LYS 202 -30.926 36.605 -8.946 969 3HZ LYS 202 3HZ LYS 202 -31.206 36.891 -10.597 970 H ALA 203 H ALA 203 -25.604 34.452 -12.069 971 HA ALA 203 HA ALA 203 -24.554 32.462 -14.049 972 1HB ALA 203 1HB ALA 203 -22.965 33.997 -12.501 973 2HB ALA 203 2HB ALA 203 -22.553 32.326 -12.888 974 3HB ALA 203 3HB ALA 203 -23.308 32.713 -11.342 975 HA PRO 204 HA PRO 204 -27.057 29.492 -12.009 976 1HB PRO 204 1HB PRO 204 -24.742 27.636 -11.872 977 2HB PRO 204 2HB PRO 204 -26.292 27.435 -12.708 978 1HG PRO 204 1HG PRO 204 -23.989 27.908 -14.016 979 2HG PRO 204 2HG PRO 204 -25.556 28.487 -14.598 980 1HD PRO 204 1HD PRO 204 -23.350 29.990 -13.288 981 2HD PRO 204 2HD PRO 204 -24.509 30.523 -14.525 982 H ARG 205 H ARG 205 -27.577 29.510 -9.859 983 HA ARG 205 HA ARG 205 -25.512 30.061 -7.838 984 1HB ARG 205 1HB ARG 205 -28.219 30.601 -8.227 985 2HB ARG 205 2HB ARG 205 -28.226 29.395 -6.940 986 1HG ARG 205 1HG ARG 205 -26.179 31.014 -6.128 987 2HG ARG 205 2HG ARG 205 -27.244 32.183 -6.908 988 1HD ARG 205 1HD ARG 205 -28.727 30.284 -5.239 989 2HD ARG 205 2HD ARG 205 -27.544 31.229 -4.313 990 HE ARG 205 HE ARG 205 -28.693 33.117 -5.961 991 1HH1 ARG 205 1HH1 ARG 205 -29.970 30.718 -3.785 992 2HH1 ARG 205 2HH1 ARG 205 -31.380 31.647 -3.413 993 1HH2 ARG 205 1HH2 ARG 205 -30.532 34.304 -5.462 994 2HH2 ARG 205 2HH2 ARG 205 -31.698 33.662 -4.354 995 H LYS 206 H LYS 206 -24.274 28.250 -7.353 996 HA LYS 206 HA LYS 206 -25.756 25.839 -6.390 997 1HB LYS 206 1HB LYS 206 -24.059 26.168 -8.733 998 2HB LYS 206 2HB LYS 206 -23.393 24.949 -7.645 999 1HG LYS 206 1HG LYS 206 -26.291 24.992 -8.531 1000 2HG LYS 206 2HG LYS 206 -25.041 24.050 -9.343 1001 1HD LYS 206 1HD LYS 206 -25.457 23.806 -6.368 1002 2HD LYS 206 2HD LYS 206 -26.456 22.886 -7.492 1003 1HE LYS 206 1HE LYS 206 -24.697 21.540 -8.155 1004 2HE LYS 206 2HE LYS 206 -23.499 22.830 -7.940 1005 1HZ LYS 206 1HZ LYS 206 -24.075 22.673 -5.489 1006 2HZ LYS 206 2HZ LYS 206 -23.177 21.381 -6.129 1007 3HZ LYS 206 3HZ LYS 206 -24.844 21.204 -5.855 1008 H GLN 207 H GLN 207 -24.698 24.758 -4.671 1009 HA GLN 207 HA GLN 207 -22.977 26.276 -2.977 1010 1HB GLN 207 1HB GLN 207 -24.080 23.526 -3.193 1011 2HB GLN 207 2HB GLN 207 -22.635 23.679 -2.194 1012 1HG GLN 207 1HG GLN 207 -23.676 25.236 -0.737 1013 2HG GLN 207 2HG GLN 207 -24.982 25.555 -1.878 1014 1HE2 GLN 207 1HE2 GLN 207 -26.780 24.814 -0.655 1015 2HE2 GLN 207 2HE2 GLN 207 -26.936 23.222 -0.086 1016 H LEU 208 H LEU 208 -20.724 25.690 -2.366 1017 HA LEU 208 HA LEU 208 -19.173 24.668 -4.723 1018 1HB LEU 208 1HB LEU 208 -18.712 26.827 -2.653 1019 2HB LEU 208 2HB LEU 208 -17.378 26.183 -3.609 1020 HG LEU 208 HG LEU 208 -19.892 27.098 -4.981 1021 1HD1 LEU 208 1HD1 LEU 208 -18.516 28.796 -3.301 1022 2HD1 LEU 208 2HD1 LEU 208 -19.458 29.308 -4.701 1023 3HD1 LEU 208 3HD1 LEU 208 -17.716 29.072 -4.848 1024 1HD2 LEU 208 1HD2 LEU 208 -17.102 26.394 -5.663 1025 2HD2 LEU 208 2HD2 LEU 208 -17.738 27.808 -6.504 1026 3HD2 LEU 208 3HD2 LEU 208 -18.567 26.257 -6.636 1027 H ALA 209 H ALA 209 -19.727 24.418 -1.277 1028 HA ALA 209 HA ALA 209 -17.933 22.047 -1.196 1029 1HB ALA 209 1HB ALA 209 -16.425 23.048 0.197 1030 2HB ALA 209 2HB ALA 209 -17.694 23.832 1.137 1031 3HB ALA 209 3HB ALA 209 -17.127 24.565 -0.364 1032 H THR 210 H THR 210 -18.851 20.436 0.040 1033 HA THR 210 HA THR 210 -20.957 21.196 2.026 1034 HB THR 210 HB THR 210 -21.117 19.005 -0.077 1035 HG1 THR 210 HG1 THR 210 -22.553 20.363 -1.092 1036 1HG2 THR 210 1HG2 THR 210 -22.443 19.263 2.366 1037 2HG2 THR 210 2HG2 THR 210 -22.955 18.263 1.008 1038 3HG2 THR 210 3HG2 THR 210 -23.590 19.898 1.187 1039 H LYS 211 H LYS 211 -18.826 20.687 3.309 1040 HA LYS 211 HA LYS 211 -17.648 19.210 4.728 1041 1HB LYS 211 1HB LYS 211 -20.252 17.701 4.283 1042 2HB LYS 211 2HB LYS 211 -19.123 17.403 5.605 1043 1HG LYS 211 1HG LYS 211 -19.599 19.447 6.643 1044 2HG LYS 211 2HG LYS 211 -20.200 20.174 5.154 1045 1HD LYS 211 1HD LYS 211 -22.271 19.130 5.321 1046 2HD LYS 211 2HD LYS 211 -21.634 17.794 6.281 1047 1HE LYS 211 1HE LYS 211 -22.080 18.886 8.223 1048 2HE LYS 211 2HE LYS 211 -21.310 20.372 7.634 1049 1HZ LYS 211 1HZ LYS 211 -23.243 20.991 6.484 1050 2HZ LYS 211 2HZ LYS 211 -23.817 20.443 7.986 1051 3HZ LYS 211 3HZ LYS 211 -23.935 19.446 6.616 1052 H ALA 212 H ALA 212 -16.119 18.747 2.904 1053 HA ALA 212 HA ALA 212 -16.535 16.412 1.214 1054 1HB ALA 212 1HB ALA 212 -14.070 18.039 1.945 1055 2HB ALA 212 2HB ALA 212 -15.157 18.375 0.598 1056 3HB ALA 212 3HB ALA 212 -14.176 16.910 0.593 1057 H ALA 213 H ALA 213 -16.831 14.565 2.539 1058 HA ALA 213 HA ALA 213 -14.661 13.938 4.500 1059 1HB ALA 213 1HB ALA 213 -17.010 13.992 5.285 1060 2HB ALA 213 2HB ALA 213 -16.365 12.353 5.381 1061 3HB ALA 213 3HB ALA 213 -17.448 12.799 4.062 1062 H ARG 214 H ARG 214 -13.876 11.676 4.513 1063 HA ARG 214 HA ARG 214 -13.508 10.648 1.767 1064 1HB ARG 214 1HB ARG 214 -12.416 9.746 4.460 1065 2HB ARG 214 2HB ARG 214 -11.788 9.280 2.880 1066 1HG ARG 214 1HG ARG 214 -11.957 12.167 3.769 1067 2HG ARG 214 2HG ARG 214 -10.535 11.166 4.062 1068 1HD ARG 214 1HD ARG 214 -9.949 12.075 2.000 1069 2HD ARG 214 2HD ARG 214 -10.848 10.653 1.438 1070 HE ARG 214 HE ARG 214 -12.607 12.902 1.977 1071 1HH1 ARG 214 1HH1 ARG 214 -10.411 11.524 -0.346 1072 2HH1 ARG 214 2HH1 ARG 214 -11.169 12.304 -1.690 1073 1HH2 ARG 214 1HH2 ARG 214 -13.574 13.904 0.215 1074 2HH2 ARG 214 2HH2 ARG 214 -12.946 13.642 -1.378 1075 1HN MLZ 215 1HN MLZ 215 -13.105 7.877 2.748 1076 HA MLZ 215 HA MLZ 215 -15.803 6.888 2.359 1077 1HB MLZ 215 1HB MLZ 215 -13.039 5.856 2.781 1078 2HB MLZ 215 2HB MLZ 215 -14.350 4.748 3.185 1079 1HG MLZ 215 1HG MLZ 215 -14.666 6.210 0.627 1080 2HG MLZ 215 2HG MLZ 215 -15.000 4.520 1.006 1081 1HD MLZ 215 1HD MLZ 215 -12.201 5.648 0.735 1082 2HD MLZ 215 2HD MLZ 215 -12.660 3.950 0.857 1083 1HE MLZ 215 1HE MLZ 215 -12.563 5.651 -1.508 1084 2HE MLZ 215 2HE MLZ 215 -14.160 4.906 -1.308 1085 HZ MLZ 215 HZ MLZ 215 -13.170 2.772 -1.076 1086 1HCM MLZ 215 1HCM MLZ 215 -11.501 3.865 -3.229 1087 2HCM MLZ 215 2HCM MLZ 215 -13.250 4.005 -3.359 1088 3HCM MLZ 215 3HCM MLZ 215 -12.502 2.418 -3.221 1089 H SER 216 H SER 216 -17.249 6.122 3.909 1090 HA SER 216 HA SER 216 -18.174 5.742 6.050 1091 1HB SER 216 1HB SER 216 -16.270 7.607 7.327 1092 2HB SER 216 2HB SER 216 -17.038 8.253 5.876 1093 HG SER 216 HG SER 216 -18.592 8.660 7.237 1094 H ALA 217 H ALA 217 -17.340 5.378 8.500 1095 HA ALA 217 HA ALA 217 -15.149 3.371 8.279 1096 1HB ALA 217 1HB ALA 217 -15.084 5.988 9.563 1097 2HB ALA 217 2HB ALA 217 -13.758 4.861 9.281 1098 3HB ALA 217 3HB ALA 217 -14.757 4.703 10.725 1099 HA PRO 218 HA PRO 218 -18.072 1.181 10.790 1100 1HB PRO 218 1HB PRO 218 -16.410 -0.840 11.656 1101 2HB PRO 218 2HB PRO 218 -17.127 -0.796 10.035 1102 1HG PRO 218 1HG PRO 218 -14.381 -0.067 10.920 1103 2HG PRO 218 2HG PRO 218 -14.911 -0.871 9.436 1104 1HD PRO 218 1HD PRO 218 -14.210 1.765 9.567 1105 2HD PRO 218 2HD PRO 218 -15.354 1.109 8.377 1106 H ALA 219 H ALA 219 -17.626 -0.108 13.158 1107 HA ALA 219 HA ALA 219 -16.650 2.093 14.932 1108 1HB ALA 219 1HB ALA 219 -18.088 0.005 16.287 1109 2HB ALA 219 2HB ALA 219 -18.961 0.408 14.809 1110 3HB ALA 219 3HB ALA 219 -18.606 1.665 15.994 1111 H THR 220 H THR 220 -15.188 1.582 16.634 1112 HA THR 220 HA THR 220 -14.107 -1.202 16.704 1113 HB THR 220 HB THR 220 -12.437 1.331 16.539 1114 HG1 THR 220 HG1 THR 220 -12.610 1.193 14.464 1115 1HG2 THR 220 1HG2 THR 220 -11.580 -1.498 15.941 1116 2HG2 THR 220 2HG2 THR 220 -11.564 -0.877 17.592 1117 3HG2 THR 220 3HG2 THR 220 -10.576 -0.107 16.350 1118 H GLY 221 H GLY 221 -14.706 -1.651 18.828 1119 1HA GLY 221 1HA GLY 221 -13.515 0.099 20.922 1120 2HA GLY 221 2HA GLY 221 -15.214 -0.355 21.049 1121 1H MET 1 1H MET 1 -0.362 -12.502 6.028 1122 2H MET 1 2H MET 1 -0.243 -12.127 4.376 1123 3H MET 1 3H MET 1 -0.838 -10.971 5.468 1124 HA MET 1 HA MET 1 1.416 -10.393 4.913 1125 1HB MET 1 1HB MET 1 0.546 -11.397 7.586 1126 2HB MET 1 2HB MET 1 2.246 -10.960 7.424 1127 1HG MET 1 1HG MET 1 0.435 -9.003 6.201 1128 2HG MET 1 2HG MET 1 0.177 -9.191 7.935 1129 1HE MET 1 1HE MET 1 1.108 -6.315 7.570 1130 2HE MET 1 2HE MET 1 2.283 -6.424 8.880 1131 3HE MET 1 3HE MET 1 0.788 -7.356 8.956 1132 H PHE 2 H PHE 2 2.109 -13.041 7.146 1133 HA PHE 2 HA PHE 2 4.513 -13.862 5.976 1134 1HB PHE 2 1HB PHE 2 3.984 -16.037 7.198 1135 2HB PHE 2 2HB PHE 2 3.825 -14.582 8.179 1136 HD1 PHE 2 HD1 PHE 2 1.744 -13.969 9.143 1137 HD2 PHE 2 HD2 PHE 2 1.893 -17.050 6.155 1138 HE1 PHE 2 HE1 PHE 2 -0.626 -14.528 9.604 1139 HE2 PHE 2 HE2 PHE 2 -0.479 -17.609 6.615 1140 HZ PHE 2 HZ PHE 2 -1.738 -16.345 8.339 1141 H ASN 3 H ASN 3 5.059 -15.252 4.302 1142 HA ASN 3 HA ASN 3 2.834 -16.645 2.861 1143 1HB ASN 3 1HB ASN 3 3.546 -14.405 1.876 1144 2HB ASN 3 2HB ASN 3 5.127 -15.125 1.577 1145 1HD2 ASN 3 1HD2 ASN 3 1.774 -15.061 0.514 1146 2HD2 ASN 3 2HD2 ASN 3 1.984 -16.073 -0.833 1147 H ASP 4 H ASP 4 3.570 -18.520 1.638 1148 HA ASP 4 HA ASP 4 5.487 -20.159 2.913 1149 1HB ASP 4 1HB ASP 4 3.574 -20.682 1.261 1150 2HB ASP 4 2HB ASP 4 4.725 -20.289 -0.016 1151 H ARG 5 H ARG 5 5.976 -17.592 0.623 1152 HA ARG 5 HA ARG 5 8.684 -18.578 -0.102 1153 1HB ARG 5 1HB ARG 5 6.617 -16.776 -1.160 1154 2HB ARG 5 2HB ARG 5 8.246 -16.114 -1.301 1155 1HG ARG 5 1HG ARG 5 8.692 -18.677 -2.083 1156 2HG ARG 5 2HG ARG 5 7.035 -18.462 -2.643 1157 1HD ARG 5 1HD ARG 5 8.638 -16.113 -3.256 1158 2HD ARG 5 2HD ARG 5 9.353 -17.578 -3.955 1159 HE ARG 5 HE ARG 5 6.767 -16.416 -4.680 1160 1HH1 ARG 5 1HH1 ARG 5 8.670 -19.325 -4.483 1161 2HH1 ARG 5 2HH1 ARG 5 7.757 -20.136 -5.707 1162 1HH2 ARG 5 1HH2 ARG 5 5.597 -17.492 -6.267 1163 2HH2 ARG 5 2HH2 ARG 5 6.031 -19.109 -6.711 1164 H VAL 6 H VAL 6 7.112 -16.071 1.820 1165 HA VAL 6 HA VAL 6 9.730 -15.402 3.031 1166 HB VAL 6 HB VAL 6 9.341 -12.972 2.520 1167 1HG1 VAL 6 1HG1 VAL 6 10.146 -13.084 0.277 1168 2HG1 VAL 6 2HG1 VAL 6 9.315 -14.610 -0.022 1169 3HG1 VAL 6 3HG1 VAL 6 10.712 -14.562 1.053 1170 1HG2 VAL 6 1HG2 VAL 6 7.249 -13.934 0.565 1171 2HG2 VAL 6 2HG2 VAL 6 7.598 -12.279 1.067 1172 3HG2 VAL 6 3HG2 VAL 6 6.818 -13.396 2.188 1173 H ILE 7 H ILE 7 9.104 -13.323 4.602 1174 HA ILE 7 HA ILE 7 6.424 -13.671 5.789 1175 HB ILE 7 HB ILE 7 7.741 -15.511 6.739 1176 1HG1 ILE 7 1HG1 ILE 7 7.604 -13.303 8.805 1177 2HG1 ILE 7 2HG1 ILE 7 6.172 -14.129 8.193 1178 1HG2 ILE 7 1HG2 ILE 7 9.659 -13.992 8.262 1179 2HG2 ILE 7 2HG2 ILE 7 9.845 -13.622 6.547 1180 3HG2 ILE 7 3HG2 ILE 7 9.951 -15.291 7.106 1181 1HD1 ILE 7 1HD1 ILE 7 7.656 -14.980 10.340 1182 2HD1 ILE 7 2HD1 ILE 7 8.346 -15.937 9.029 1183 3HD1 ILE 7 3HD1 ILE 7 6.617 -16.024 9.369 1184 H VAL 8 H VAL 8 6.128 -12.081 7.630 1185 HA VAL 8 HA VAL 8 7.678 -9.609 7.034 1186 HB VAL 8 HB VAL 8 5.246 -9.512 6.825 1187 1HG1 VAL 8 1HG1 VAL 8 5.314 -10.650 9.623 1188 2HG1 VAL 8 2HG1 VAL 8 4.468 -11.276 8.209 1189 3HG1 VAL 8 3HG1 VAL 8 3.899 -9.807 8.999 1190 1HG2 VAL 8 1HG2 VAL 8 6.326 -7.497 7.683 1191 2HG2 VAL 8 2HG2 VAL 8 6.257 -8.129 9.328 1192 3HG2 VAL 8 3HG2 VAL 8 4.768 -7.707 8.483 1193 H LYS 9 H LYS 9 8.919 -8.618 8.570 1194 HA LYS 9 HA LYS 9 8.813 -9.578 11.386 1195 1HB LYS 9 1HB LYS 9 11.218 -9.469 9.542 1196 2HB LYS 9 2HB LYS 9 11.324 -9.749 11.278 1197 1HG LYS 9 1HG LYS 9 9.425 -11.586 10.552 1198 2HG LYS 9 2HG LYS 9 10.464 -11.578 9.128 1199 1HD LYS 9 1HD LYS 9 12.426 -12.019 10.520 1200 2HD LYS 9 2HD LYS 9 11.440 -11.926 11.979 1201 1HE LYS 9 1HE LYS 9 10.033 -13.830 10.920 1202 2HE LYS 9 2HE LYS 9 11.412 -14.050 9.826 1203 1HZ LYS 9 1HZ LYS 9 11.355 -14.218 12.784 1204 2HZ LYS 9 2HZ LYS 9 12.806 -13.952 11.943 1205 3HZ LYS 9 3HZ LYS 9 11.919 -15.375 11.675 1206 H LYS 10 H LYS 10 9.755 -6.214 12.292 1207 HA LYS 10 HA LYS 10 9.380 -7.456 14.227 1208 1HB LYS 10 1HB LYS 10 7.509 -8.343 12.130 1209 2HB LYS 10 2HB LYS 10 7.693 -9.486 13.461 1210 1HG LYS 10 1HG LYS 10 7.172 -6.530 13.874 1211 2HG LYS 10 2HG LYS 10 5.887 -7.735 13.801 1212 1HD LYS 10 1HD LYS 10 6.261 -8.319 15.943 1213 2HD LYS 10 2HD LYS 10 7.958 -8.642 15.590 1214 1HE LYS 10 1HE LYS 10 8.597 -6.399 16.081 1215 2HE LYS 10 2HE LYS 10 6.921 -5.825 16.006 1216 1HZ LYS 10 1HZ LYS 10 7.552 -6.152 18.301 1217 2HZ LYS 10 2HZ LYS 10 8.055 -7.742 17.981 1218 3HZ LYS 10 3HZ LYS 10 6.411 -7.333 17.870 1219 H SER 11 H SER 11 11.771 -8.071 13.726 1220 HA SER 11 HA SER 11 11.962 -11.066 13.652 1221 1HB SER 11 1HB SER 11 14.398 -10.241 12.782 1222 2HB SER 11 2HB SER 11 13.055 -10.531 11.680 1223 HG SER 11 HG SER 11 13.243 -8.518 11.175 1224 HA PRO 12 HA PRO 12 14.256 -11.040 17.400 1225 1HB PRO 12 1HB PRO 12 16.787 -11.785 16.002 1226 2HB PRO 12 2HB PRO 12 15.958 -12.607 17.337 1227 1HG PRO 12 1HG PRO 12 15.914 -13.553 14.828 1228 2HG PRO 12 2HG PRO 12 14.545 -13.739 15.932 1229 1HD PRO 12 1HD PRO 12 14.861 -11.935 13.598 1230 2HD PRO 12 2HD PRO 12 13.393 -12.676 14.267 1231 H LEU 13 H LEU 13 14.362 -8.819 17.876 1232 HA LEU 13 HA LEU 13 15.343 -6.687 18.126 1233 1HB LEU 13 1HB LEU 13 17.293 -8.743 18.354 1234 2HB LEU 13 2HB LEU 13 18.043 -7.443 17.427 1235 HG LEU 13 HG LEU 13 16.488 -6.831 19.933 1236 1HD1 LEU 13 1HD1 LEU 13 19.091 -8.203 19.691 1237 2HD1 LEU 13 2HD1 LEU 13 17.990 -8.113 21.066 1238 3HD1 LEU 13 3HD1 LEU 13 19.105 -6.786 20.741 1239 1HD2 LEU 13 1HD2 LEU 13 18.956 -5.445 18.925 1240 2HD2 LEU 13 2HD2 LEU 13 17.606 -4.782 19.848 1241 3HD2 LEU 13 3HD2 LEU 13 17.409 -5.146 18.133 1242 H GLY 14 H GLY 14 14.181 -6.994 15.636 1243 1HA GLY 14 1HA GLY 14 16.119 -5.540 13.889 1244 2HA GLY 14 2HA GLY 14 15.134 -6.844 13.225 1245 H GLY 15 H GLY 15 14.936 -4.283 12.149 1246 1HA GLY 15 1HA GLY 15 12.670 -2.876 13.362 1247 2HA GLY 15 2HA GLY 15 13.453 -2.459 11.838 1248 H TYR 16 H TYR 16 11.465 -2.303 10.673 1249 HA TYR 16 HA TYR 16 9.817 -4.784 10.526 1250 1HB TYR 16 1HB TYR 16 9.262 -2.041 10.698 1251 2HB TYR 16 2HB TYR 16 8.879 -2.464 9.031 1252 HD1 TYR 16 HD1 TYR 16 8.117 -3.153 12.581 1253 HD2 TYR 16 HD2 TYR 16 7.079 -3.998 8.500 1254 HE1 TYR 16 HE1 TYR 16 6.015 -4.229 13.339 1255 HE2 TYR 16 HE2 TYR 16 4.977 -5.074 9.257 1256 HH TYR 16 HH TYR 16 3.519 -4.638 11.844 1257 H GLY 17 H GLY 17 11.711 -5.712 9.207 1258 1HA GLY 17 1HA GLY 17 11.625 -4.769 6.374 1259 2HA GLY 17 2HA GLY 17 12.935 -5.726 7.069 1260 H VAL 18 H VAL 18 12.402 -7.170 5.136 1261 HA VAL 18 HA VAL 18 10.125 -8.989 5.857 1262 HB VAL 18 HB VAL 18 9.545 -7.868 3.828 1263 1HG1 VAL 18 1HG1 VAL 18 11.385 -6.743 3.016 1264 2HG1 VAL 18 2HG1 VAL 18 11.353 -8.092 1.879 1265 3HG1 VAL 18 3HG1 VAL 18 12.460 -8.119 3.251 1266 1HG2 VAL 18 1HG2 VAL 18 10.837 -10.187 2.497 1267 2HG2 VAL 18 2HG2 VAL 18 9.150 -9.671 2.475 1268 3HG2 VAL 18 3HG2 VAL 18 9.783 -10.559 3.861 1269 H PHE 19 H PHE 19 10.726 -11.085 6.244 1270 HA PHE 19 HA PHE 19 13.580 -11.795 5.954 1271 1HB PHE 19 1HB PHE 19 11.227 -12.560 7.537 1272 2HB PHE 19 2HB PHE 19 12.180 -13.951 7.021 1273 HD1 PHE 19 HD1 PHE 19 13.104 -10.442 7.980 1274 HD2 PHE 19 HD2 PHE 19 13.573 -14.639 8.762 1275 HE1 PHE 19 HE1 PHE 19 14.796 -9.929 9.720 1276 HE2 PHE 19 HE2 PHE 19 15.264 -14.127 10.502 1277 HZ PHE 19 HZ PHE 19 15.876 -11.772 10.981 1278 H ALA 20 H ALA 20 14.212 -13.831 4.923 1279 HA ALA 20 HA ALA 20 12.394 -14.565 2.657 1280 1HB ALA 20 1HB ALA 20 14.241 -14.212 1.390 1281 2HB ALA 20 2HB ALA 20 15.155 -15.371 2.354 1282 3HB ALA 20 3HB ALA 20 15.087 -13.678 2.842 1283 H ARG 21 H ARG 21 11.340 -16.432 3.339 1284 HA ARG 21 HA ARG 21 12.442 -18.427 5.086 1285 1HB ARG 21 1HB ARG 21 10.012 -17.800 3.929 1286 2HB ARG 21 2HB ARG 21 10.457 -19.272 3.065 1287 1HG ARG 21 1HG ARG 21 9.794 -20.469 4.853 1288 2HG ARG 21 2HG ARG 21 11.087 -19.722 5.790 1289 1HD ARG 21 1HD ARG 21 9.665 -18.078 6.680 1290 2HD ARG 21 2HD ARG 21 8.496 -18.239 5.356 1291 HE ARG 21 HE ARG 21 8.528 -20.757 6.508 1292 1HH1 ARG 21 1HH1 ARG 21 8.048 -17.524 7.707 1293 2HH1 ARG 21 2HH1 ARG 21 7.003 -18.036 8.986 1294 1HH2 ARG 21 1HH2 ARG 21 7.168 -21.396 8.177 1295 2HH2 ARG 21 2HH2 ARG 21 6.507 -20.209 9.253 1296 H LYS 22 H LYS 22 12.621 -17.875 1.629 1297 HA LYS 22 HA LYS 22 13.829 -20.514 1.068 1298 1HB LYS 22 1HB LYS 22 13.616 -18.073 -0.734 1299 2HB LYS 22 2HB LYS 22 13.684 -19.763 -1.218 1300 1HG LYS 22 1HG LYS 22 11.463 -19.611 0.479 1301 2HG LYS 22 2HG LYS 22 11.367 -18.167 -0.529 1302 1HD LYS 22 1HD LYS 22 11.066 -19.373 -2.462 1303 2HD LYS 22 2HD LYS 22 12.069 -20.713 -1.904 1304 1HE LYS 22 1HE LYS 22 9.789 -20.562 -0.180 1305 2HE LYS 22 2HE LYS 22 9.215 -20.532 -1.858 1306 1HZ LYS 22 1HZ LYS 22 9.657 -22.810 -0.942 1307 2HZ LYS 22 2HZ LYS 22 11.304 -22.401 -0.870 1308 3HZ LYS 22 3HZ LYS 22 10.504 -22.445 -2.368 1309 H SER 23 H SER 23 17.213 -19.150 0.346 1310 HA SER 23 HA SER 23 15.059 -20.972 -0.600 1311 1HB SER 23 1HB SER 23 17.980 -20.985 -1.355 1312 2HB SER 23 2HB SER 23 17.445 -21.627 0.197 1313 HG SER 23 HG SER 23 16.697 -23.314 -0.780 1314 H PHE 24 H PHE 24 16.597 -18.043 -1.475 1315 HA PHE 24 HA PHE 24 15.348 -18.195 -4.163 1316 1HB PHE 24 1HB PHE 24 16.375 -16.031 -2.317 1317 2HB PHE 24 2HB PHE 24 15.948 -15.671 -3.989 1318 HD1 PHE 24 HD1 PHE 24 13.623 -17.171 -4.603 1319 HD2 PHE 24 HD2 PHE 24 14.688 -15.364 -0.854 1320 HE1 PHE 24 HE1 PHE 24 11.228 -17.071 -3.970 1321 HE2 PHE 24 HE2 PHE 24 12.292 -15.265 -0.221 1322 HZ PHE 24 HZ PHE 24 10.562 -16.119 -1.779 1323 H GLU 25 H GLU 25 16.544 -17.409 -6.034 1324 HA GLU 25 HA GLU 25 19.413 -18.174 -5.942 1325 1HB GLU 25 1HB GLU 25 17.402 -18.797 -7.627 1326 2HB GLU 25 2HB GLU 25 17.974 -17.334 -8.427 1327 1HG GLU 25 1HG GLU 25 20.289 -18.800 -7.736 1328 2HG GLU 25 2HG GLU 25 19.155 -19.969 -8.411 1329 H LYS 26 H LYS 26 20.150 -16.570 -8.226 1330 HA LYS 26 HA LYS 26 20.508 -13.956 -6.862 1331 1HB LYS 26 1HB LYS 26 22.343 -15.460 -7.881 1332 2HB LYS 26 2HB LYS 26 21.722 -14.953 -9.450 1333 1HG LYS 26 1HG LYS 26 22.139 -12.610 -8.899 1334 2HG LYS 26 2HG LYS 26 22.667 -13.064 -7.279 1335 1HD LYS 26 1HD LYS 26 24.524 -14.367 -8.240 1336 2HD LYS 26 2HD LYS 26 23.993 -13.933 -9.865 1337 1HE LYS 26 1HE LYS 26 24.194 -11.460 -8.955 1338 2HE LYS 26 2HE LYS 26 25.284 -12.205 -7.771 1339 1HZ LYS 26 1HZ LYS 26 25.442 -12.651 -10.708 1340 2HZ LYS 26 2HZ LYS 26 26.546 -13.189 -9.535 1341 3HZ LYS 26 3HZ LYS 26 26.406 -11.531 -9.871 1342 H GLY 27 H GLY 27 17.919 -14.712 -8.184 1343 1HA GLY 27 1HA GLY 27 17.215 -12.281 -9.381 1344 2HA GLY 27 2HA GLY 27 17.738 -13.318 -10.707 1345 H GLU 28 H GLU 28 15.359 -12.962 -8.122 1346 HA GLU 28 HA GLU 28 13.469 -14.620 -9.702 1347 1HB GLU 28 1HB GLU 28 14.699 -15.255 -7.043 1348 2HB GLU 28 2HB GLU 28 13.011 -15.700 -7.292 1349 1HG GLU 28 1HG GLU 28 13.901 -16.695 -9.558 1350 2HG GLU 28 2HG GLU 28 15.460 -16.678 -8.733 1351 H LEU 29 H LEU 29 11.557 -13.501 -9.730 1352 HA LEU 29 HA LEU 29 11.030 -11.118 -8.317 1353 1HB LEU 29 1HB LEU 29 9.877 -12.014 -10.359 1354 2HB LEU 29 2HB LEU 29 9.080 -13.216 -9.352 1355 HG LEU 29 HG LEU 29 7.724 -11.113 -9.914 1356 1HD1 LEU 29 1HD1 LEU 29 7.603 -12.793 -7.825 1357 2HD1 LEU 29 2HD1 LEU 29 6.512 -11.417 -7.994 1358 3HD1 LEU 29 3HD1 LEU 29 7.930 -11.296 -6.953 1359 1HD2 LEU 29 1HD2 LEU 29 8.998 -9.709 -7.641 1360 2HD2 LEU 29 2HD2 LEU 29 8.321 -9.057 -9.133 1361 3HD2 LEU 29 3HD2 LEU 29 9.944 -9.745 -9.128 1362 H VAL 30 H VAL 30 10.752 -10.841 -6.151 1363 HA VAL 30 HA VAL 30 10.158 -13.102 -4.385 1364 HB VAL 30 HB VAL 30 10.515 -10.109 -3.980 1365 1HG1 VAL 30 1HG1 VAL 30 9.261 -10.968 -2.104 1366 2HG1 VAL 30 2HG1 VAL 30 10.937 -10.799 -1.581 1367 3HG1 VAL 30 3HG1 VAL 30 10.299 -12.390 -1.996 1368 1HG2 VAL 30 1HG2 VAL 30 12.649 -11.445 -2.842 1369 2HG2 VAL 30 2HG2 VAL 30 12.664 -10.674 -4.428 1370 3HG2 VAL 30 3HG2 VAL 30 12.326 -12.399 -4.290 1371 H GLU 31 H GLU 31 8.540 -9.973 -5.089 1372 HA GLU 31 HA GLU 31 5.900 -11.179 -5.067 1373 1HB GLU 31 1HB GLU 31 5.189 -10.099 -2.924 1374 2HB GLU 31 2HB GLU 31 6.454 -11.301 -2.675 1375 1HG GLU 31 1HG GLU 31 8.062 -9.229 -2.987 1376 2HG GLU 31 2HG GLU 31 6.629 -8.309 -2.532 1377 H GLU 32 H GLU 32 5.529 -9.920 -6.940 1378 HA GLU 32 HA GLU 32 6.069 -7.054 -7.018 1379 1HB GLU 32 1HB GLU 32 4.937 -7.278 -9.216 1380 2HB GLU 32 2HB GLU 32 6.114 -8.570 -8.985 1381 1HG GLU 32 1HG GLU 32 4.478 -10.082 -9.296 1382 2HG GLU 32 2HG GLU 32 3.663 -9.468 -7.858 1383 H CYS 33 H CYS 33 4.442 -5.381 -7.040 1384 HA CYS 33 HA CYS 33 1.674 -6.135 -6.277 1385 1HB CYS 33 1HB CYS 33 3.600 -5.651 -4.367 1386 2HB CYS 33 2HB CYS 33 2.889 -4.050 -4.569 1387 HG CYS 33 HG CYS 33 0.572 -5.016 -3.906 1388 H LEU 34 H LEU 34 1.124 -3.400 -5.362 1389 HA LEU 34 HA LEU 34 1.251 -2.009 -8.014 1390 1HB LEU 34 1HB LEU 34 -0.787 -2.476 -5.921 1391 2HB LEU 34 2HB LEU 34 -0.753 -0.825 -6.539 1392 HG LEU 34 HG LEU 34 -0.820 -1.782 -8.871 1393 1HD1 LEU 34 1HD1 LEU 34 -0.146 -3.984 -8.830 1394 2HD1 LEU 34 2HD1 LEU 34 -1.884 -4.240 -8.682 1395 3HD1 LEU 34 3HD1 LEU 34 -0.862 -4.282 -7.246 1396 1HD2 LEU 34 1HD2 LEU 34 -2.955 -1.839 -6.848 1397 2HD2 LEU 34 2HD2 LEU 34 -3.281 -2.855 -8.252 1398 3HD2 LEU 34 3HD2 LEU 34 -2.958 -1.134 -8.465 1399 H CYS 35 H CYS 35 1.088 0.471 -7.721 1400 HA CYS 35 HA CYS 35 2.368 1.481 -5.241 1401 1HB CYS 35 1HB CYS 35 3.620 1.126 -7.916 1402 2HB CYS 35 2HB CYS 35 3.925 2.679 -7.137 1403 HG CYS 35 HG CYS 35 5.380 1.562 -5.464 1404 H ILE 36 H ILE 36 2.059 3.764 -4.988 1405 HA ILE 36 HA ILE 36 -0.106 4.886 -6.681 1406 HB ILE 36 HB ILE 36 1.287 5.925 -4.184 1407 1HG1 ILE 36 1HG1 ILE 36 -1.304 4.374 -4.492 1408 2HG1 ILE 36 2HG1 ILE 36 0.195 3.730 -3.823 1409 1HG2 ILE 36 1HG2 ILE 36 -0.742 7.320 -3.965 1410 2HG2 ILE 36 2HG2 ILE 36 -1.353 6.663 -5.483 1411 3HG2 ILE 36 3HG2 ILE 36 0.102 7.659 -5.476 1412 1HD1 ILE 36 1HD1 ILE 36 -1.659 4.675 -2.206 1413 2HD1 ILE 36 2HD1 ILE 36 -0.975 6.238 -2.654 1414 3HD1 ILE 36 3HD1 ILE 36 0.041 5.018 -1.885 1415 H VAL 37 H VAL 37 0.210 6.723 -7.991 1416 HA VAL 37 HA VAL 37 3.060 7.618 -8.275 1417 HB VAL 37 HB VAL 37 0.810 7.492 -10.316 1418 1HG1 VAL 37 1HG1 VAL 37 2.174 8.712 -11.625 1419 2HG1 VAL 37 2HG1 VAL 37 3.438 7.496 -11.443 1420 3HG1 VAL 37 3HG1 VAL 37 3.333 8.836 -10.301 1421 1HG2 VAL 37 1HG2 VAL 37 2.381 5.624 -11.222 1422 2HG2 VAL 37 2HG2 VAL 37 1.333 5.240 -9.856 1423 3HG2 VAL 37 3HG2 VAL 37 3.039 5.598 -9.586 1424 H ARG 38 H ARG 38 3.415 9.747 -7.865 1425 HA ARG 38 HA ARG 38 1.282 11.749 -8.380 1426 1HB ARG 38 1HB ARG 38 2.433 10.910 -5.728 1427 2HB ARG 38 2HB ARG 38 1.906 12.578 -5.945 1428 1HG ARG 38 1HG ARG 38 0.209 10.105 -6.395 1429 2HG ARG 38 2HG ARG 38 0.086 11.198 -5.018 1430 1HD ARG 38 1HD ARG 38 -0.275 13.064 -6.801 1431 2HD ARG 38 2HD ARG 38 -0.643 11.722 -7.900 1432 HE ARG 38 HE ARG 38 -2.060 11.207 -5.519 1433 1HH1 ARG 38 1HH1 ARG 38 -1.952 13.663 -7.984 1434 2HH1 ARG 38 2HH1 ARG 38 -3.619 14.082 -7.795 1435 1HH2 ARG 38 1HH2 ARG 38 -4.221 11.769 -5.291 1436 2HH2 ARG 38 2HH2 ARG 38 -4.896 13.019 -6.282 1437 H HIS 39 H HIS 39 2.300 14.020 -7.703 1438 HA HIS 39 HA HIS 39 4.972 14.142 -8.981 1439 1HB HIS 39 1HB HIS 39 2.624 15.877 -8.513 1440 2HB HIS 39 2HB HIS 39 4.171 16.712 -8.384 1441 HD1 HIS 39 HD1 HIS 39 3.070 17.817 -10.709 1442 HD2 HIS 39 HD2 HIS 39 4.576 13.936 -10.929 1443 HE1 HIS 39 HE1 HIS 39 3.456 17.337 -13.165 1444 H ASN 40 H ASN 40 6.231 16.208 -7.848 1445 HA ASN 40 HA ASN 40 6.984 15.201 -5.193 1446 1HB ASN 40 1HB ASN 40 8.289 16.302 -7.307 1447 2HB ASN 40 2HB ASN 40 8.068 17.742 -6.312 1448 1HD2 ASN 40 1HD2 ASN 40 9.274 14.353 -6.092 1449 2HD2 ASN 40 2HD2 ASN 40 10.427 14.684 -4.891 1450 H ASP 41 H ASP 41 7.726 18.086 -4.426 1451 HA ASP 41 HA ASP 41 6.821 19.798 -3.103 1452 1HB ASP 41 1HB ASP 41 4.369 19.207 -4.800 1453 2HB ASP 41 2HB ASP 41 4.727 20.717 -3.969 1454 H ASP 42 H ASP 42 3.687 19.625 -2.644 1455 HA ASP 42 HA ASP 42 3.594 18.798 -0.026 1456 1HB ASP 42 1HB ASP 42 1.545 18.363 -2.229 1457 2HB ASP 42 2HB ASP 42 1.176 18.357 -0.504 1458 H TRP 43 H TRP 43 2.992 16.623 -2.818 1459 HA TRP 43 HA TRP 43 2.489 14.227 -1.439 1460 1HB TRP 43 1HB TRP 43 2.257 14.387 -3.823 1461 2HB TRP 43 2HB TRP 43 3.924 14.917 -4.021 1462 HD1 TRP 43 HD1 TRP 43 5.774 13.110 -4.199 1463 HE1 TRP 43 HE1 TRP 43 5.757 10.535 -4.298 1464 HE3 TRP 43 HE3 TRP 43 0.920 12.208 -2.893 1465 HZ2 TRP 43 HZ2 TRP 43 3.931 8.378 -3.878 1466 HZ3 TRP 43 HZ3 TRP 43 0.072 9.884 -2.751 1467 HH2 TRP 43 HH2 TRP 43 1.568 7.970 -3.241 1468 H GLY 44 H GLY 44 5.665 15.577 -2.407 1469 1HA GLY 44 1HA GLY 44 7.307 13.497 -1.458 1470 2HA GLY 44 2HA GLY 44 7.806 15.186 -1.530 1471 H THR 45 H THR 45 6.062 16.333 0.328 1472 HA THR 45 HA THR 45 7.341 15.567 2.821 1473 HB THR 45 HB THR 45 4.973 17.389 2.257 1474 HG1 THR 45 HG1 THR 45 6.383 18.604 1.330 1475 1HG2 THR 45 1HG2 THR 45 5.250 18.240 4.381 1476 2HG2 THR 45 2HG2 THR 45 6.978 17.889 4.408 1477 3HG2 THR 45 3HG2 THR 45 5.811 16.595 4.680 1478 H ALA 46 H ALA 46 3.856 15.661 1.930 1479 HA ALA 46 HA ALA 46 2.821 14.334 4.165 1480 1HB ALA 46 1HB ALA 46 1.882 13.851 1.326 1481 2HB ALA 46 2HB ALA 46 1.694 15.421 2.106 1482 3HB ALA 46 3HB ALA 46 0.899 13.999 2.785 1483 H LEU 47 H LEU 47 3.785 12.766 1.072 1484 HA LEU 47 HA LEU 47 3.671 10.124 2.413 1485 1HB LEU 47 1HB LEU 47 4.111 11.079 -0.437 1486 2HB LEU 47 2HB LEU 47 4.172 9.380 0.020 1487 HG LEU 47 HG LEU 47 1.954 9.782 -0.778 1488 1HD1 LEU 47 1HD1 LEU 47 2.177 8.494 1.389 1489 2HD1 LEU 47 2HD1 LEU 47 0.594 9.227 1.126 1490 3HD1 LEU 47 3HD1 LEU 47 1.741 9.979 2.234 1491 1HD2 LEU 47 1HD2 LEU 47 2.353 12.373 -0.169 1492 2HD2 LEU 47 2HD2 LEU 47 1.331 11.915 1.194 1493 3HD2 LEU 47 3HD2 LEU 47 0.753 11.699 -0.458 1494 H GLU 48 H GLU 48 5.856 12.249 2.895 1495 HA GLU 48 HA GLU 48 8.320 11.547 1.749 1496 1HB GLU 48 1HB GLU 48 9.233 12.353 3.958 1497 2HB GLU 48 2HB GLU 48 8.009 13.421 3.276 1498 1HG GLU 48 1HG GLU 48 7.161 13.266 5.404 1499 2HG GLU 48 2HG GLU 48 6.402 11.823 4.734 1500 H ASP 49 H ASP 49 9.990 10.053 2.452 1501 HA ASP 49 HA ASP 49 10.782 7.944 3.138 1502 1HB ASP 49 1HB ASP 49 10.079 8.995 5.343 1503 2HB ASP 49 2HB ASP 49 8.544 8.145 5.180 1504 H TYR 50 H TYR 50 10.310 5.747 2.689 1505 HA TYR 50 HA TYR 50 9.118 3.934 1.744 1506 1HB TYR 50 1HB TYR 50 6.566 5.388 2.461 1507 2HB TYR 50 2HB TYR 50 6.883 3.657 2.481 1508 HD1 TYR 50 HD1 TYR 50 9.265 3.298 4.046 1509 HD2 TYR 50 HD2 TYR 50 6.086 6.138 4.601 1510 HE1 TYR 50 HE1 TYR 50 9.811 3.439 6.456 1511 HE2 TYR 50 HE2 TYR 50 6.636 6.277 7.017 1512 HH TYR 50 HH TYR 50 8.675 4.049 8.568 1513 H LEU 51 H LEU 51 9.397 6.824 0.403 1514 HA LEU 51 HA LEU 51 7.383 6.360 -1.763 1515 1HB LEU 51 1HB LEU 51 7.691 8.516 -0.207 1516 2HB LEU 51 2HB LEU 51 8.928 8.907 -1.402 1517 HG LEU 51 HG LEU 51 7.215 8.569 -3.202 1518 1HD1 LEU 51 1HD1 LEU 51 4.840 8.896 -1.728 1519 2HD1 LEU 51 2HD1 LEU 51 5.716 7.595 -0.923 1520 3HD1 LEU 51 3HD1 LEU 51 5.333 7.472 -2.638 1521 1HD2 LEU 51 1HD2 LEU 51 7.150 10.815 -2.969 1522 2HD2 LEU 51 2HD2 LEU 51 7.316 10.699 -1.217 1523 3HD2 LEU 51 3HD2 LEU 51 5.721 10.581 -1.961 1524 H PHE 52 H PHE 52 8.412 5.199 -3.369 1525 HA PHE 52 HA PHE 52 11.252 5.734 -4.027 1526 1HB PHE 52 1HB PHE 52 9.109 3.773 -4.893 1527 2HB PHE 52 2HB PHE 52 10.668 3.852 -5.712 1528 HD1 PHE 52 HD1 PHE 52 12.748 3.266 -4.530 1529 HD2 PHE 52 HD2 PHE 52 8.916 2.948 -2.615 1530 HE1 PHE 52 HE1 PHE 52 13.761 1.890 -2.733 1531 HE2 PHE 52 HE2 PHE 52 9.929 1.571 -0.818 1532 HZ PHE 52 HZ PHE 52 12.351 1.042 -0.876 1533 H SER 53 H SER 53 11.682 7.372 -5.469 1534 HA SER 53 HA SER 53 9.532 8.133 -7.404 1535 1HB SER 53 1HB SER 53 10.301 9.813 -5.753 1536 2HB SER 53 2HB SER 53 11.955 9.627 -6.335 1537 HG SER 53 HG SER 53 11.420 11.125 -7.692 1538 H ARG 54 H ARG 54 9.927 8.001 -9.578 1539 HA ARG 54 HA ARG 54 12.602 6.998 -10.449 1540 1HB ARG 54 1HB ARG 54 10.242 5.912 -10.883 1541 2HB ARG 54 2HB ARG 54 10.094 7.160 -12.120 1542 1HG ARG 54 1HG ARG 54 11.772 6.257 -13.426 1543 2HG ARG 54 2HG ARG 54 12.623 5.569 -12.043 1544 1HD ARG 54 1HD ARG 54 11.697 3.584 -12.687 1545 2HD ARG 54 2HD ARG 54 10.178 4.226 -12.033 1546 HE ARG 54 HE ARG 54 9.454 4.549 -14.258 1547 1HH1 ARG 54 1HH1 ARG 54 12.927 4.361 -14.120 1548 2HH1 ARG 54 2HH1 ARG 54 13.110 4.448 -15.838 1549 1HH2 ARG 54 1HH2 ARG 54 9.717 4.660 -16.485 1550 2HH2 ARG 54 2HH2 ARG 54 11.308 4.616 -17.168 1551 H LYS 55 H LYS 55 12.861 7.799 -12.964 1552 HA LYS 55 HA LYS 55 13.274 10.671 -12.782 1553 1HB LYS 55 1HB LYS 55 14.464 8.607 -14.064 1554 2HB LYS 55 2HB LYS 55 13.446 9.204 -15.374 1555 1HG LYS 55 1HG LYS 55 14.490 11.532 -14.306 1556 2HG LYS 55 2HG LYS 55 15.840 10.405 -14.171 1557 1HD LYS 55 1HD LYS 55 14.671 9.959 -16.714 1558 2HD LYS 55 2HD LYS 55 14.810 11.707 -16.528 1559 1HE LYS 55 1HE LYS 55 17.175 11.569 -16.134 1560 2HE LYS 55 2HE LYS 55 17.102 9.808 -15.932 1561 1HZ LYS 55 1HZ LYS 55 16.281 11.246 -18.403 1562 2HZ LYS 55 2HZ LYS 55 16.405 9.565 -18.196 1563 3HZ LYS 55 3HZ LYS 55 17.805 10.527 -18.194 1564 H ASN 56 H ASN 56 10.866 11.023 -12.411 1565 HA ASN 56 HA ASN 56 8.959 10.667 -14.540 1566 1HB ASN 56 1HB ASN 56 10.544 12.266 -15.602 1567 2HB ASN 56 2HB ASN 56 8.969 13.014 -15.342 1568 1HD2 ASN 56 1HD2 ASN 56 9.111 15.059 -14.419 1569 2HD2 ASN 56 2HD2 ASN 56 10.357 15.586 -13.393 1570 H MET 57 H MET 57 9.184 10.522 -11.583 1571 HA MET 57 HA MET 57 7.856 12.742 -10.325 1572 1HB MET 57 1HB MET 57 5.573 11.669 -10.236 1573 2HB MET 57 2HB MET 57 6.050 12.147 -11.863 1574 1HG MET 57 1HG MET 57 6.988 9.467 -11.258 1575 2HG MET 57 2HG MET 57 5.244 9.585 -11.026 1576 1HE MET 57 1HE MET 57 3.805 10.693 -14.321 1577 2HE MET 57 2HE MET 57 4.354 11.842 -13.101 1578 3HE MET 57 3HE MET 57 3.593 10.330 -12.608 1579 H SER 58 H SER 58 6.466 11.651 -8.322 1580 HA SER 58 HA SER 58 8.327 9.627 -7.127 1581 1HB SER 58 1HB SER 58 6.527 11.723 -5.853 1582 2HB SER 58 2HB SER 58 7.657 10.681 -4.989 1583 HG SER 58 HG SER 58 9.301 11.808 -5.721 1584 H ALA 59 H ALA 59 7.385 7.823 -6.055 1585 HA ALA 59 HA ALA 59 4.409 7.601 -6.126 1586 1HB ALA 59 1HB ALA 59 5.000 5.175 -7.010 1587 2HB ALA 59 2HB ALA 59 6.504 5.945 -7.516 1588 3HB ALA 59 3HB ALA 59 4.962 6.529 -8.139 1589 H MET 60 H MET 60 3.576 6.081 -4.581 1590 HA MET 60 HA MET 60 5.400 5.550 -2.311 1591 1HB MET 60 1HB MET 60 3.201 6.563 -1.937 1592 2HB MET 60 2HB MET 60 2.413 5.225 -2.773 1593 1HG MET 60 1HG MET 60 2.223 4.860 -0.377 1594 2HG MET 60 2HG MET 60 3.339 3.668 -1.042 1595 1HE MET 60 1HE MET 60 3.454 6.116 2.286 1596 2HE MET 60 2HE MET 60 2.439 6.406 0.873 1597 3HE MET 60 3HE MET 60 3.840 7.433 1.178 1598 H ALA 61 H ALA 61 5.586 3.401 -1.381 1599 HA ALA 61 HA ALA 61 5.613 1.275 -3.414 1600 1HB ALA 61 1HB ALA 61 7.459 0.928 -2.130 1601 2HB ALA 61 2HB ALA 61 6.365 0.237 -0.932 1602 3HB ALA 61 3HB ALA 61 6.825 1.937 -0.830 1603 H LEU 62 H LEU 62 3.387 0.767 -3.746 1604 HA LEU 62 HA LEU 62 1.405 -0.433 -3.327 1605 1HB LEU 62 1HB LEU 62 1.138 0.162 -0.531 1606 2HB LEU 62 2HB LEU 62 1.828 1.570 -1.332 1607 HG LEU 62 HG LEU 62 -0.061 0.986 -3.134 1608 1HD1 LEU 62 1HD1 LEU 62 -0.652 -0.661 -0.828 1609 2HD1 LEU 62 2HD1 LEU 62 -1.450 -0.627 -2.399 1610 3HD1 LEU 62 3HD1 LEU 62 -1.963 0.480 -1.126 1611 1HD2 LEU 62 1HD2 LEU 62 -1.370 2.737 -2.168 1612 2HD2 LEU 62 2HD2 LEU 62 0.297 3.085 -1.707 1613 3HD2 LEU 62 3HD2 LEU 62 -0.807 2.355 -0.541 1614 H GLY 63 H GLY 63 3.195 -2.289 -3.431 1615 1HA GLY 63 1HA GLY 63 2.447 -4.294 -1.554 1616 2HA GLY 63 2HA GLY 63 3.827 -4.406 -2.645 1617 H PHE 64 H PHE 64 4.948 -5.449 -0.816 1618 HA PHE 64 HA PHE 64 5.482 -3.965 1.629 1619 1HB PHE 64 1HB PHE 64 6.398 -6.482 0.263 1620 2HB PHE 64 2HB PHE 64 7.329 -5.879 1.633 1621 HD1 PHE 64 HD1 PHE 64 6.805 -7.103 3.548 1622 HD2 PHE 64 HD2 PHE 64 3.650 -5.948 0.871 1623 HE1 PHE 64 HE1 PHE 64 5.130 -8.060 5.107 1624 HE2 PHE 64 HE2 PHE 64 1.977 -6.904 2.430 1625 HZ PHE 64 HZ PHE 64 2.716 -7.961 4.547 1626 H GLY 65 H GLY 65 6.109 -2.075 -0.142 1627 1HA GLY 65 1HA GLY 65 8.952 -2.278 -0.911 1628 2HA GLY 65 2HA GLY 65 7.864 -0.954 -1.322 1629 H ALA 66 H ALA 66 6.894 -0.522 1.372 1630 HA ALA 66 HA ALA 66 8.944 1.267 2.332 1631 1HB ALA 66 1HB ALA 66 7.273 1.822 3.953 1632 2HB ALA 66 2HB ALA 66 6.538 0.222 3.850 1633 3HB ALA 66 3HB ALA 66 6.370 1.358 2.511 1634 H ILE 67 H ILE 67 7.746 -1.900 3.476 1635 HA ILE 67 HA ILE 67 9.128 -2.118 5.902 1636 HB ILE 67 HB ILE 67 9.110 -4.611 5.318 1637 1HG1 ILE 67 1HG1 ILE 67 7.379 -4.531 3.102 1638 2HG1 ILE 67 2HG1 ILE 67 8.727 -3.481 2.675 1639 1HG2 ILE 67 1HG2 ILE 67 6.695 -4.750 5.438 1640 2HG2 ILE 67 2HG2 ILE 67 6.530 -3.108 4.816 1641 3HG2 ILE 67 3HG2 ILE 67 7.227 -3.380 6.413 1642 1HD1 ILE 67 1HD1 ILE 67 8.659 -6.386 2.951 1643 2HD1 ILE 67 2HD1 ILE 67 9.957 -5.654 3.895 1644 3HD1 ILE 67 3HD1 ILE 67 9.858 -5.365 2.158 1645 H PHE 68 H PHE 68 10.422 -2.563 2.618 1646 HA PHE 68 HA PHE 68 12.843 -3.851 3.139 1647 1HB PHE 68 1HB PHE 68 11.990 -1.648 1.258 1648 2HB PHE 68 2HB PHE 68 13.633 -2.283 1.209 1649 HD1 PHE 68 HD1 PHE 68 10.848 -2.510 -0.595 1650 HD2 PHE 68 HD2 PHE 68 13.314 -5.122 1.758 1651 HE1 PHE 68 HE1 PHE 68 10.053 -4.453 -1.918 1652 HE2 PHE 68 HE2 PHE 68 12.520 -7.064 0.436 1653 HZ PHE 68 HZ PHE 68 10.890 -6.729 -1.402 1654 H ASN 69 H ASN 69 14.423 -3.365 4.589 1655 HA ASN 69 HA ASN 69 14.709 -0.578 5.577 1656 1HB ASN 69 1HB ASN 69 15.739 -3.312 6.398 1657 2HB ASN 69 2HB ASN 69 16.254 -1.830 7.204 1658 1HD2 ASN 69 1HD2 ASN 69 14.221 -4.283 7.764 1659 2HD2 ASN 69 2HD2 ASN 69 12.925 -3.472 8.502 1660 H HIS 70 H HIS 70 17.157 -0.021 6.047 1661 HA HIS 70 HA HIS 70 18.602 -0.286 3.464 1662 1HB HIS 70 1HB HIS 70 18.123 1.911 4.640 1663 2HB HIS 70 2HB HIS 70 19.205 1.386 5.929 1664 HD1 HIS 70 HD1 HIS 70 20.727 3.478 5.197 1665 HD2 HIS 70 HD2 HIS 70 20.435 0.403 2.398 1666 HE1 HIS 70 HE1 HIS 70 22.605 3.841 3.537 1667 H SER 71 H SER 71 19.838 -2.152 3.436 1668 HA SER 71 HA SER 71 21.460 -2.778 5.881 1669 1HB SER 71 1HB SER 71 19.815 -4.482 5.313 1670 2HB SER 71 2HB SER 71 20.338 -4.485 3.629 1671 HG SER 71 HG SER 71 21.517 -5.612 5.872 1672 H LYS 72 H LYS 72 23.659 -2.636 5.638 1673 HA LYS 72 HA LYS 72 24.960 -1.578 3.377 1674 1HB LYS 72 1HB LYS 72 25.663 -3.072 5.853 1675 2HB LYS 72 2HB LYS 72 26.902 -3.049 4.598 1676 1HG LYS 72 1HG LYS 72 25.609 -0.441 5.062 1677 2HG LYS 72 2HG LYS 72 26.519 -1.050 6.444 1678 1HD LYS 72 1HD LYS 72 28.540 -1.013 5.303 1679 2HD LYS 72 2HD LYS 72 27.772 -1.211 3.728 1680 1HE LYS 72 1HE LYS 72 28.306 1.048 3.598 1681 2HE LYS 72 2HE LYS 72 26.730 1.187 4.402 1682 1HZ LYS 72 1HZ LYS 72 27.983 0.900 6.545 1683 2HZ LYS 72 2HZ LYS 72 28.274 2.367 5.740 1684 3HZ LYS 72 3HZ LYS 72 29.419 1.115 5.664 1685 H ASP 73 H ASP 73 23.991 -4.881 4.051 1686 HA ASP 73 HA ASP 73 25.474 -5.836 1.634 1687 1HB ASP 73 1HB ASP 73 24.153 -7.261 3.975 1688 2HB ASP 73 2HB ASP 73 25.005 -8.075 2.663 1689 HA PRO 74 HA PRO 74 21.001 -5.358 0.402 1690 1HB PRO 74 1HB PRO 74 21.679 -4.699 -2.226 1691 2HB PRO 74 2HB PRO 74 21.346 -3.524 -0.943 1692 1HG PRO 74 1HG PRO 74 23.945 -4.483 -2.013 1693 2HG PRO 74 2HG PRO 74 23.488 -2.879 -1.423 1694 1HD PRO 74 1HD PRO 74 24.993 -4.606 0.023 1695 2HD PRO 74 2HD PRO 74 23.889 -3.432 0.772 1696 H ASN 75 H ASN 75 20.463 -7.544 0.342 1697 HA ASN 75 HA ASN 75 21.805 -9.327 -1.617 1698 1HB ASN 75 1HB ASN 75 19.790 -9.712 0.625 1699 2HB ASN 75 2HB ASN 75 20.404 -11.034 -0.368 1700 1HD2 ASN 75 1HD2 ASN 75 21.021 -11.354 2.246 1701 2HD2 ASN 75 2HD2 ASN 75 22.631 -10.932 2.578 1702 H ALA 76 H ALA 76 18.863 -7.518 -1.223 1703 HA ALA 76 HA ALA 76 17.732 -8.884 -3.643 1704 1HB ALA 76 1HB ALA 76 15.818 -7.542 -1.879 1705 2HB ALA 76 2HB ALA 76 16.745 -8.775 -1.025 1706 3HB ALA 76 3HB ALA 76 15.815 -9.207 -2.459 1707 H ARG 77 H ARG 77 15.943 -7.294 -4.603 1708 HA ARG 77 HA ARG 77 16.741 -4.442 -4.363 1709 1HB ARG 77 1HB ARG 77 17.621 -6.283 -6.398 1710 2HB ARG 77 2HB ARG 77 16.579 -5.072 -7.143 1711 1HG ARG 77 1HG ARG 77 18.268 -3.706 -5.303 1712 2HG ARG 77 2HG ARG 77 19.293 -4.782 -6.251 1713 1HD ARG 77 1HD ARG 77 17.323 -2.752 -7.369 1714 2HD ARG 77 2HD ARG 77 19.092 -2.643 -7.429 1715 HE ARG 77 HE ARG 77 17.419 -4.389 -9.084 1716 1HH1 ARG 77 1HH1 ARG 77 20.552 -3.904 -7.642 1717 2HH1 ARG 77 2HH1 ARG 77 21.360 -4.902 -8.799 1718 1HH2 ARG 77 1HH2 ARG 77 18.492 -5.680 -10.573 1719 2HH2 ARG 77 2HH2 ARG 77 20.205 -5.901 -10.446 1720 H HIS 78 H HIS 78 15.227 -3.060 -5.736 1721 HA HIS 78 HA HIS 78 12.532 -4.364 -5.948 1722 1HB HIS 78 1HB HIS 78 11.681 -2.114 -5.256 1723 2HB HIS 78 2HB HIS 78 12.750 -2.819 -4.043 1724 HD1 HIS 78 HD1 HIS 78 15.062 -1.718 -3.695 1725 HD2 HIS 78 HD2 HIS 78 12.783 0.121 -6.663 1726 HE1 HIS 78 HE1 HIS 78 16.231 0.460 -4.251 1727 H GLU 79 H GLU 79 11.683 -4.279 -7.983 1728 HA GLU 79 HA GLU 79 12.874 -2.345 -9.934 1729 1HB GLU 79 1HB GLU 79 12.873 -4.971 -10.127 1730 2HB GLU 79 2HB GLU 79 11.190 -4.755 -10.602 1731 1HG GLU 79 1HG GLU 79 11.771 -3.476 -12.505 1732 2HG GLU 79 2HG GLU 79 13.404 -3.177 -11.911 1733 H LEU 80 H LEU 80 11.195 -1.714 -11.696 1734 HA LEU 80 HA LEU 80 8.552 -1.169 -10.383 1735 1HB LEU 80 1HB LEU 80 10.509 0.492 -11.935 1736 2HB LEU 80 2HB LEU 80 8.794 0.875 -12.090 1737 HG LEU 80 HG LEU 80 9.939 0.452 -9.351 1738 1HD1 LEU 80 1HD1 LEU 80 10.819 2.486 -11.223 1739 2HD1 LEU 80 2HD1 LEU 80 11.391 2.161 -9.587 1740 3HD1 LEU 80 3HD1 LEU 80 10.004 3.220 -9.842 1741 1HD2 LEU 80 1HD2 LEU 80 7.451 0.865 -10.054 1742 2HD2 LEU 80 2HD2 LEU 80 7.966 2.541 -10.243 1743 3HD2 LEU 80 3HD2 LEU 80 8.106 1.747 -8.674 1744 H THR 81 H THR 81 6.716 -1.384 -11.688 1745 HA THR 81 HA THR 81 7.174 -2.657 -14.364 1746 HB THR 81 HB THR 81 5.059 -3.000 -12.208 1747 HG1 THR 81 HG1 THR 81 6.185 -4.690 -11.701 1748 1HG2 THR 81 1HG2 THR 81 4.797 -5.021 -14.143 1749 2HG2 THR 81 2HG2 THR 81 4.928 -3.517 -15.056 1750 3HG2 THR 81 3HG2 THR 81 3.669 -3.700 -13.834 1751 H ALA 82 H ALA 82 5.905 -1.903 -16.099 1752 HA ALA 82 HA ALA 82 4.655 -0.313 -17.321 1753 1HB ALA 82 1HB ALA 82 3.214 -0.936 -14.779 1754 2HB ALA 82 2HB ALA 82 2.688 -1.166 -16.446 1755 3HB ALA 82 3HB ALA 82 2.615 0.435 -15.712 1756 H GLY 83 H GLY 83 6.931 0.673 -15.707 1757 1HA GLY 83 1HA GLY 83 7.812 2.872 -15.480 1758 2HA GLY 83 2HA GLY 83 6.186 3.518 -15.699 1759 H LEU 84 H LEU 84 4.879 3.828 -13.872 1760 HA LEU 84 HA LEU 84 6.177 3.252 -11.227 1761 1HB LEU 84 1HB LEU 84 5.397 5.696 -12.538 1762 2HB LEU 84 2HB LEU 84 4.397 5.487 -11.103 1763 HG LEU 84 HG LEU 84 6.384 5.225 -9.707 1764 1HD1 LEU 84 1HD1 LEU 84 7.608 4.564 -12.183 1765 2HD1 LEU 84 2HD1 LEU 84 8.346 4.553 -10.581 1766 3HD1 LEU 84 3HD1 LEU 84 8.422 6.006 -11.578 1767 1HD2 LEU 84 1HD2 LEU 84 6.099 7.593 -11.498 1768 2HD2 LEU 84 2HD2 LEU 84 7.537 7.511 -10.481 1769 3HD2 LEU 84 3HD2 LEU 84 5.934 7.485 -9.746 1770 H LYS 85 H LYS 85 4.062 1.766 -12.842 1771 HA LYS 85 HA LYS 85 1.602 2.157 -11.252 1772 1HB LYS 85 1HB LYS 85 2.513 0.582 -13.646 1773 2HB LYS 85 2HB LYS 85 1.034 0.092 -12.820 1774 1HG LYS 85 1HG LYS 85 1.586 2.898 -13.832 1775 2HG LYS 85 2HG LYS 85 0.613 1.701 -14.688 1776 1HD LYS 85 1HD LYS 85 -1.181 2.217 -13.431 1777 2HD LYS 85 2HD LYS 85 -0.279 1.865 -11.957 1778 1HE LYS 85 1HE LYS 85 -0.750 4.136 -11.640 1779 2HE LYS 85 2HE LYS 85 0.808 4.252 -12.481 1780 1HZ LYS 85 1HZ LYS 85 -1.899 4.337 -13.716 1781 2HZ LYS 85 2HZ LYS 85 -0.448 4.276 -14.596 1782 3HZ LYS 85 3HZ LYS 85 -0.792 5.622 -13.620 1783 H ARG 86 H ARG 86 3.267 -0.871 -12.162 1784 HA ARG 86 HA ARG 86 2.685 -1.917 -9.427 1785 1HB ARG 86 1HB ARG 86 2.903 -2.954 -12.195 1786 2HB ARG 86 2HB ARG 86 3.570 -4.017 -10.956 1787 1HG ARG 86 1HG ARG 86 1.520 -4.505 -10.110 1788 2HG ARG 86 2HG ARG 86 0.975 -2.832 -10.233 1789 1HD ARG 86 1HD ARG 86 -0.091 -3.251 -12.195 1790 2HD ARG 86 2HD ARG 86 1.338 -4.060 -12.866 1791 HE ARG 86 HE ARG 86 0.186 -5.726 -10.843 1792 1HH1 ARG 86 1HH1 ARG 86 -0.438 -4.539 -14.055 1793 2HH1 ARG 86 2HH1 ARG 86 -1.377 -5.921 -14.502 1794 1HH2 ARG 86 1HH2 ARG 86 -1.037 -7.509 -11.446 1795 2HH2 ARG 86 2HH2 ARG 86 -1.715 -7.591 -13.038 1796 H MET 87 H MET 87 4.481 -3.647 -8.786 1797 HA MET 87 HA MET 87 7.197 -2.563 -9.416 1798 1HB MET 87 1HB MET 87 5.760 -2.862 -6.787 1799 2HB MET 87 2HB MET 87 7.518 -3.003 -6.828 1800 1HG MET 87 1HG MET 87 7.598 -0.792 -8.029 1801 2HG MET 87 2HG MET 87 5.858 -0.648 -7.776 1802 1HE MET 87 1HE MET 87 8.608 -2.092 -4.950 1803 2HE MET 87 2HE MET 87 9.322 -0.480 -4.902 1804 3HE MET 87 3HE MET 87 9.168 -1.331 -6.439 1805 H ARG 88 H ARG 88 8.873 -4.124 -9.229 1806 HA ARG 88 HA ARG 88 8.004 -6.949 -8.728 1807 1HB ARG 88 1HB ARG 88 8.005 -6.522 -11.113 1808 2HB ARG 88 2HB ARG 88 9.569 -5.720 -11.023 1809 1HG ARG 88 1HG ARG 88 10.321 -8.074 -10.022 1810 2HG ARG 88 2HG ARG 88 8.920 -8.636 -10.932 1811 1HD ARG 88 1HD ARG 88 11.182 -6.962 -12.080 1812 2HD ARG 88 2HD ARG 88 10.981 -8.705 -12.325 1813 HE ARG 88 HE ARG 88 8.536 -7.319 -12.959 1814 1HH1 ARG 88 1HH1 ARG 88 11.744 -7.959 -14.150 1815 2HH1 ARG 88 2HH1 ARG 88 11.282 -7.787 -15.807 1816 1HH2 ARG 88 1HH2 ARG 88 7.961 -7.101 -15.119 1817 2HH2 ARG 88 2HH2 ARG 88 9.158 -7.306 -16.355 1818 H ILE 89 H ILE 89 9.154 -7.297 -6.814 1819 HA ILE 89 HA ILE 89 11.914 -6.289 -6.527 1820 HB ILE 89 HB ILE 89 10.134 -8.006 -4.755 1821 1HG1 ILE 89 1HG1 ILE 89 10.646 -5.188 -4.054 1822 2HG1 ILE 89 2HG1 ILE 89 9.696 -5.405 -5.524 1823 1HG2 ILE 89 1HG2 ILE 89 11.671 -7.618 -3.011 1824 2HG2 ILE 89 2HG2 ILE 89 12.444 -6.284 -3.868 1825 3HG2 ILE 89 3HG2 ILE 89 12.709 -7.945 -4.399 1826 1HD1 ILE 89 1HD1 ILE 89 8.466 -5.326 -3.208 1827 2HD1 ILE 89 2HD1 ILE 89 9.023 -6.992 -3.059 1828 3HD1 ILE 89 3HD1 ILE 89 7.976 -6.530 -4.400 1829 H PHE 90 H PHE 90 13.751 -7.586 -6.629 1830 HA PHE 90 HA PHE 90 13.334 -10.509 -7.158 1831 1HB PHE 90 1HB PHE 90 14.576 -8.343 -8.725 1832 2HB PHE 90 2HB PHE 90 15.603 -9.768 -8.564 1833 HD1 PHE 90 HD1 PHE 90 15.324 -11.484 -10.117 1834 HD2 PHE 90 HD2 PHE 90 12.005 -8.914 -9.211 1835 HE1 PHE 90 HE1 PHE 90 13.949 -12.662 -11.811 1836 HE2 PHE 90 HE2 PHE 90 10.632 -10.091 -10.906 1837 HZ PHE 90 HZ PHE 90 11.601 -11.962 -12.204 1838 H THR 91 H THR 91 15.941 -11.318 -7.262 1839 HA THR 91 HA THR 91 17.096 -10.434 -4.638 1840 HB THR 91 HB THR 91 17.768 -12.890 -4.475 1841 HG1 THR 91 HG1 THR 91 17.563 -13.782 -6.383 1842 1HG2 THR 91 1HG2 THR 91 15.926 -12.310 -3.138 1843 2HG2 THR 91 2HG2 THR 91 15.286 -13.622 -4.127 1844 3HG2 THR 91 3HG2 THR 91 14.909 -11.948 -4.533 1845 H ILE 92 H ILE 92 18.739 -9.121 -5.546 1846 HA ILE 92 HA ILE 92 20.324 -9.733 -7.828 1847 HB ILE 92 HB ILE 92 21.821 -8.021 -6.842 1848 1HG1 ILE 92 1HG1 ILE 92 20.087 -8.279 -4.367 1849 2HG1 ILE 92 2HG1 ILE 92 21.704 -8.966 -4.512 1850 1HG2 ILE 92 1HG2 ILE 92 20.254 -6.558 -7.522 1851 2HG2 ILE 92 2HG2 ILE 92 19.469 -6.689 -5.949 1852 3HG2 ILE 92 3HG2 ILE 92 18.995 -7.764 -7.263 1853 1HD1 ILE 92 1HD1 ILE 92 22.696 -6.954 -4.198 1854 2HD1 ILE 92 2HD1 ILE 92 21.121 -6.406 -3.625 1855 3HD1 ILE 92 3HD1 ILE 92 21.587 -6.146 -5.306 1856 H LYS 93 H LYS 93 20.350 -11.116 -4.657 1857 HA LYS 93 HA LYS 93 22.760 -12.708 -5.379 1858 1HB LYS 93 1HB LYS 93 22.272 -11.064 -2.875 1859 2HB LYS 93 2HB LYS 93 23.520 -12.305 -2.972 1860 1HG LYS 93 1HG LYS 93 23.938 -10.821 -5.275 1861 2HG LYS 93 2HG LYS 93 23.493 -9.595 -4.088 1862 1HD LYS 93 1HD LYS 93 25.501 -11.734 -3.399 1863 2HD LYS 93 2HD LYS 93 26.000 -10.289 -4.278 1864 1HE LYS 93 1HE LYS 93 24.794 -8.964 -2.403 1865 2HE LYS 93 2HE LYS 93 24.844 -10.485 -1.491 1866 1HZ LYS 93 1HZ LYS 93 27.143 -9.038 -2.705 1867 2HZ LYS 93 2HZ LYS 93 27.250 -10.603 -2.056 1868 3HZ LYS 93 3HZ LYS 93 26.858 -9.292 -1.050 1869 HA PRO 94 HA PRO 94 20.097 -16.052 -4.156 1870 1HB PRO 94 1HB PRO 94 22.728 -17.110 -3.152 1871 2HB PRO 94 2HB PRO 94 21.469 -17.943 -4.088 1872 1HG PRO 94 1HG PRO 94 23.636 -17.060 -5.289 1873 2HG PRO 94 2HG PRO 94 22.056 -16.866 -6.056 1874 1HD PRO 94 1HD PRO 94 23.774 -14.832 -4.716 1875 2HD PRO 94 2HD PRO 94 22.688 -14.657 -6.111 1876 H ILE 95 H ILE 95 18.957 -16.387 -2.255 1877 HA ILE 95 HA ILE 95 20.222 -15.407 0.282 1878 HB ILE 95 HB ILE 95 17.368 -15.420 -0.758 1879 1HG1 ILE 95 1HG1 ILE 95 19.054 -13.093 0.177 1880 2HG1 ILE 95 2HG1 ILE 95 19.087 -13.658 -1.492 1881 1HG2 ILE 95 1HG2 ILE 95 17.088 -15.858 1.550 1882 2HG2 ILE 95 2HG2 ILE 95 16.976 -14.102 1.439 1883 3HG2 ILE 95 3HG2 ILE 95 18.470 -14.857 1.995 1884 1HD1 ILE 95 1HD1 ILE 95 17.443 -11.955 -1.490 1885 2HD1 ILE 95 2HD1 ILE 95 16.766 -12.494 0.047 1886 3HD1 ILE 95 3HD1 ILE 95 16.513 -13.452 -1.412 1887 H ALA 96 H ALA 96 20.111 -16.768 2.081 1888 HA ALA 96 HA ALA 96 19.420 -19.589 1.551 1889 1HB ALA 96 1HB ALA 96 21.520 -18.989 2.654 1890 2HB ALA 96 2HB ALA 96 20.499 -19.842 3.811 1891 3HB ALA 96 3HB ALA 96 20.645 -18.087 3.892 1892 H ILE 97 H ILE 97 18.111 -20.792 3.179 1893 HA ILE 97 HA ILE 97 15.566 -19.575 3.665 1894 HB ILE 97 HB ILE 97 16.921 -22.034 4.835 1895 1HG1 ILE 97 1HG1 ILE 97 14.886 -22.073 2.635 1896 2HG1 ILE 97 2HG1 ILE 97 16.551 -21.647 2.241 1897 1HG2 ILE 97 1HG2 ILE 97 14.484 -20.831 5.559 1898 2HG2 ILE 97 2HG2 ILE 97 15.014 -22.466 5.956 1899 3HG2 ILE 97 3HG2 ILE 97 14.043 -22.180 4.512 1900 1HD1 ILE 97 1HD1 ILE 97 17.063 -23.801 3.732 1901 2HD1 ILE 97 2HD1 ILE 97 16.687 -23.943 2.015 1902 3HD1 ILE 97 3HD1 ILE 97 15.434 -24.241 3.220 1903 H GLY 98 H GLY 98 15.233 -17.987 5.171 1904 1HA GLY 98 1HA GLY 98 14.986 -17.365 7.507 1905 2HA GLY 98 2HA GLY 98 16.370 -18.388 7.891 1906 H GLU 99 H GLU 99 16.111 -15.952 5.310 1907 HA GLU 99 HA GLU 99 18.435 -14.539 6.570 1908 1HB GLU 99 1HB GLU 99 17.659 -15.392 3.862 1909 2HB GLU 99 2HB GLU 99 18.208 -13.717 3.925 1910 1HG GLU 99 1HG GLU 99 19.890 -15.476 5.536 1911 2HG GLU 99 2HG GLU 99 19.843 -15.977 3.846 1912 H GLU 100 H GLU 100 18.433 -12.104 5.733 1913 HA GLU 100 HA GLU 100 15.693 -11.011 6.273 1914 1HB GLU 100 1HB GLU 100 17.984 -10.683 7.680 1915 2HB GLU 100 2HB GLU 100 18.163 -9.356 6.533 1916 1HG GLU 100 1HG GLU 100 15.451 -9.521 7.607 1917 2HG GLU 100 2HG GLU 100 16.654 -9.302 8.878 1918 H ILE 101 H ILE 101 14.755 -10.236 4.433 1919 HA ILE 101 HA ILE 101 16.428 -9.386 2.147 1920 HB ILE 101 HB ILE 101 13.430 -9.640 2.575 1921 1HG1 ILE 101 1HG1 ILE 101 15.428 -11.449 1.188 1922 2HG1 ILE 101 2HG1 ILE 101 14.652 -11.777 2.736 1923 1HG2 ILE 101 1HG2 ILE 101 13.124 -9.195 0.305 1924 2HG2 ILE 101 2HG2 ILE 101 14.795 -9.590 -0.098 1925 3HG2 ILE 101 3HG2 ILE 101 14.419 -8.069 0.711 1926 1HD1 ILE 101 1HD1 ILE 101 12.705 -11.090 0.678 1927 2HD1 ILE 101 2HD1 ILE 101 12.765 -12.504 1.730 1928 3HD1 ILE 101 3HD1 ILE 101 13.674 -12.490 0.218 1929 H THR 102 H THR 102 16.953 -7.291 1.846 1930 HA THR 102 HA THR 102 15.095 -5.110 2.544 1931 HB THR 102 HB THR 102 16.985 -4.053 3.940 1932 HG1 THR 102 HG1 THR 102 17.862 -6.730 4.119 1933 1HG2 THR 102 1HG2 THR 102 15.933 -6.642 5.094 1934 2HG2 THR 102 2HG2 THR 102 14.896 -5.239 4.832 1935 3HG2 THR 102 3HG2 THR 102 16.264 -5.130 5.940 1936 H ILE 103 H ILE 103 15.431 -3.415 1.087 1937 HA ILE 103 HA ILE 103 17.765 -3.680 -0.753 1938 HB ILE 103 HB ILE 103 16.380 -2.289 -2.237 1939 1HG1 ILE 103 1HG1 ILE 103 13.924 -2.161 -0.826 1940 2HG1 ILE 103 2HG1 ILE 103 15.163 -1.537 0.263 1941 1HG2 ILE 103 1HG2 ILE 103 15.132 -4.082 -2.816 1942 2HG2 ILE 103 2HG2 ILE 103 14.222 -4.024 -1.307 1943 3HG2 ILE 103 3HG2 ILE 103 15.772 -4.863 -1.369 1944 1HD1 ILE 103 1HD1 ILE 103 15.870 -0.382 -2.134 1945 2HD1 ILE 103 2HD1 ILE 103 14.911 0.408 -0.883 1946 3HD1 ILE 103 3HD1 ILE 103 14.110 -0.391 -2.236 1947 H SER 104 H SER 104 18.652 -1.482 -1.533 1948 HA SER 104 HA SER 104 19.093 0.254 0.862 1949 1HB SER 104 1HB SER 104 21.168 0.856 -0.348 1950 2HB SER 104 2HB SER 104 21.024 -0.896 -0.211 1951 HG SER 104 HG SER 104 21.500 0.215 -2.369 1952 H TYR 105 H TYR 105 19.988 2.554 -0.357 1953 HA TYR 105 HA TYR 105 17.634 3.454 -1.991 1954 1HB TYR 105 1HB TYR 105 19.244 5.049 0.037 1955 2HB TYR 105 2HB TYR 105 17.738 5.538 -0.735 1956 HD1 TYR 105 HD1 TYR 105 16.242 2.916 -0.568 1957 HD2 TYR 105 HD2 TYR 105 18.614 5.023 2.329 1958 HE1 TYR 105 HE1 TYR 105 14.959 1.844 1.264 1959 HE2 TYR 105 HE2 TYR 105 17.330 3.951 4.159 1960 HH TYR 105 HH TYR 105 15.474 1.283 3.783 1961 H GLY 106 H GLY 106 20.926 4.541 -1.065 1962 1HA GLY 106 1HA GLY 106 22.671 5.384 -2.385 1963 2HA GLY 106 2HA GLY 106 21.935 4.536 -3.744 1964 H ASP 107 H ASP 107 23.106 7.113 -3.971 1965 HA ASP 107 HA ASP 107 22.634 9.222 -4.909 1966 1HB ASP 107 1HB ASP 107 20.877 7.276 -5.922 1967 2HB ASP 107 2HB ASP 107 19.843 8.651 -5.535 1968 H ASP 108 H ASP 108 22.516 10.794 -3.368 1969 HA ASP 108 HA ASP 108 21.612 12.295 -1.806 1970 1HB ASP 108 1HB ASP 108 20.087 12.665 -3.668 1971 2HB ASP 108 2HB ASP 108 19.123 11.265 -3.208 1972 H TYR 109 H TYR 109 18.890 10.004 -1.744 1973 HA TYR 109 HA TYR 109 18.335 10.001 0.953 1974 1HB TYR 109 1HB TYR 109 17.789 8.438 -1.347 1975 2HB TYR 109 2HB TYR 109 18.225 7.298 -0.073 1976 HD1 TYR 109 HD1 TYR 109 16.651 6.710 1.564 1977 HD2 TYR 109 HD2 TYR 109 16.087 10.305 -0.719 1978 HE1 TYR 109 HE1 TYR 109 14.422 7.022 2.606 1979 HE2 TYR 109 HE2 TYR 109 13.858 10.617 0.323 1980 HH TYR 109 HH TYR 109 12.101 8.607 1.539 1981 H TRP 110 H TRP 110 19.804 9.834 2.603 1982 HA TRP 110 HA TRP 110 21.561 8.986 3.934 1983 1HB TRP 110 1HB TRP 110 19.770 6.933 3.001 1984 2HB TRP 110 2HB TRP 110 21.391 6.251 3.135 1985 HD1 TRP 110 HD1 TRP 110 22.572 6.333 5.539 1986 HE1 TRP 110 HE1 TRP 110 21.581 6.489 7.914 1987 HE3 TRP 110 HE3 TRP 110 17.842 7.898 4.419 1988 HZ2 TRP 110 HZ2 TRP 110 19.108 7.186 9.172 1989 HZ3 TRP 110 HZ3 TRP 110 16.191 8.300 6.222 1990 HH2 TRP 110 HH2 TRP 110 16.817 7.946 8.595 1991 H LEU 111 H LEU 111 23.271 6.793 3.485 1992 HA LEU 111 HA LEU 111 25.406 7.859 2.027 1993 1HB LEU 111 1HB LEU 111 24.931 5.678 3.569 1994 2HB LEU 111 2HB LEU 111 25.009 4.903 1.987 1995 HG LEU 111 HG LEU 111 27.126 6.899 2.696 1996 1HD1 LEU 111 1HD1 LEU 111 27.489 5.701 4.625 1997 2HD1 LEU 111 2HD1 LEU 111 28.327 4.627 3.505 1998 3HD1 LEU 111 3HD1 LEU 111 26.676 4.263 4.008 1999 1HD2 LEU 111 1HD2 LEU 111 28.479 5.271 1.347 2000 2HD2 LEU 111 2HD2 LEU 111 27.109 5.943 0.461 2001 3HD2 LEU 111 3HD2 LEU 111 27.018 4.310 1.121 2002 H SER 112 H SER 112 26.023 7.818 -0.134 2003 HA SER 112 HA SER 112 23.999 7.277 -2.150 2004 1HB SER 112 1HB SER 112 26.237 8.851 -1.881 2005 2HB SER 112 2HB SER 112 26.839 7.574 -2.937 2006 HG SER 112 HG SER 112 24.820 9.456 -3.365 2007 H ARG 113 H ARG 113 25.960 6.195 -4.110 2008 HA ARG 113 HA ARG 113 25.378 3.474 -4.115 2009 1HB ARG 113 1HB ARG 113 27.888 4.923 -5.028 2010 2HB ARG 113 2HB ARG 113 27.393 3.326 -5.589 2011 1HG ARG 113 1HG ARG 113 25.133 4.543 -6.165 2012 2HG ARG 113 2HG ARG 113 26.128 5.999 -6.124 2013 1HD ARG 113 1HD ARG 113 27.608 5.107 -7.838 2014 2HD ARG 113 2HD ARG 113 26.777 3.541 -7.792 2015 HE ARG 113 HE ARG 113 25.800 5.950 -9.111 2016 1HH1 ARG 113 1HH1 ARG 113 24.880 3.037 -7.442 2017 2HH1 ARG 113 2HH1 ARG 113 23.326 2.964 -8.198 2018 1HH2 ARG 113 1HH2 ARG 113 23.778 5.833 -10.079 2019 2HH2 ARG 113 2HH2 ARG 113 22.705 4.533 -9.680 2020 HA PRO 114 HA PRO 114 27.877 2.442 -0.472 2021 1HB PRO 114 1HB PRO 114 26.681 0.000 -0.038 2022 2HB PRO 114 2HB PRO 114 26.005 1.532 0.545 2023 1HG PRO 114 1HG PRO 114 25.231 -0.118 -1.801 2024 2HG PRO 114 2HG PRO 114 24.221 0.846 -0.715 2025 1HD PRO 114 1HD PRO 114 24.982 1.627 -3.239 2026 2HD PRO 114 2HD PRO 114 24.514 2.744 -1.943 2027 H ARG 115 H ARG 115 29.832 2.103 -1.655 2028 HA ARG 115 HA ARG 115 30.165 -0.245 -3.377 2029 1HB ARG 115 1HB ARG 115 31.530 2.238 -2.654 2030 2HB ARG 115 2HB ARG 115 32.657 0.886 -2.763 2031 1HG ARG 115 1HG ARG 115 32.608 1.144 -5.004 2032 2HG ARG 115 2HG ARG 115 30.938 0.578 -4.963 2033 1HD ARG 115 1HD ARG 115 30.065 2.750 -5.036 2034 2HD ARG 115 2HD ARG 115 31.536 3.468 -4.353 2035 HE ARG 115 HE ARG 115 32.088 2.141 -6.867 2036 1HH1 ARG 115 1HH1 ARG 115 30.752 5.030 -5.458 2037 2HH1 ARG 115 2HH1 ARG 115 31.108 6.002 -6.843 2038 1HH2 ARG 115 1HH2 ARG 115 32.539 3.423 -8.653 2039 2HH2 ARG 115 2HH2 ARG 115 32.112 5.101 -8.640 2040 H LEU 116 H LEU 116 30.007 -2.140 -2.122 2041 HA LEU 116 HA LEU 116 32.139 -2.481 -0.047 2042 1HB LEU 116 1HB LEU 116 29.338 -2.293 0.330 2043 2HB LEU 116 2HB LEU 116 29.734 -4.001 0.521 2044 HG LEU 116 HG LEU 116 31.760 -2.937 1.940 2045 1HD1 LEU 116 1HD1 LEU 116 29.623 -1.119 2.889 2046 2HD1 LEU 116 2HD1 LEU 116 30.376 -0.665 1.361 2047 3HD1 LEU 116 3HD1 LEU 116 31.366 -0.861 2.807 2048 1HD2 LEU 116 1HD2 LEU 116 30.526 -3.528 3.910 2049 2HD2 LEU 116 2HD2 LEU 116 29.950 -4.594 2.628 2050 3HD2 LEU 116 3HD2 LEU 116 28.984 -3.202 3.118 2051 H THR 117 H THR 117 32.939 -4.655 0.108 2052 HA THR 117 HA THR 117 32.098 -6.455 -2.143 2053 HB THR 117 HB THR 117 34.849 -6.337 -0.894 2054 HG1 THR 117 HG1 THR 117 33.966 -4.820 -3.116 2055 1HG2 THR 117 1HG2 THR 117 33.603 -7.372 -3.422 2056 2HG2 THR 117 2HG2 THR 117 34.735 -8.170 -2.330 2057 3HG2 THR 117 3HG2 THR 117 35.306 -6.913 -3.428 2058 H GLN 118 H GLN 118 32.510 -8.794 -1.671 2059 HA GLN 118 HA GLN 118 31.356 -9.700 0.734 2060 1HB GLN 118 1HB GLN 118 32.293 -10.746 -1.652 2061 2HB GLN 118 2HB GLN 118 33.385 -11.470 -0.470 2062 1HG GLN 118 1HG GLN 118 31.746 -12.772 0.416 2063 2HG GLN 118 2HG GLN 118 30.556 -11.471 0.354 2064 1HE2 GLN 118 1HE2 GLN 118 29.186 -11.340 -1.518 2065 2HE2 GLN 118 2HE2 GLN 118 29.202 -12.508 -2.750 2066 H ASN 119 H ASN 119 32.262 -8.902 2.657 2067 HA ASN 119 HA ASN 119 33.840 -8.684 4.402 2068 1HB ASN 119 1HB ASN 119 33.906 -11.296 3.219 2069 2HB ASN 119 2HB ASN 119 35.556 -10.862 3.665 2070 1HD2 ASN 119 1HD2 ASN 119 32.263 -10.481 5.125 2071 2HD2 ASN 119 2HD2 ASN 119 32.745 -10.951 6.683 2072 1H GLY 201 1H GLY 201 29.216 38.165 17.787 2073 2H GLY 201 2H GLY 201 28.560 38.370 16.234 2074 3H GLY 201 3H GLY 201 29.910 37.365 16.460 2075 1HA GLY 201 1HA GLY 201 28.628 35.789 17.699 2076 2HA GLY 201 2HA GLY 201 27.230 36.863 17.634 2077 H LYS 202 H LYS 202 26.713 37.563 15.240 2078 HA LYS 202 HA LYS 202 25.888 36.823 13.153 2079 1HB LYS 202 1HB LYS 202 28.679 36.378 13.422 2080 2HB LYS 202 2HB LYS 202 28.031 34.949 12.617 2081 1HG LYS 202 1HG LYS 202 27.301 36.150 10.772 2082 2HG LYS 202 2HG LYS 202 27.104 37.642 11.692 2083 1HD LYS 202 1HD LYS 202 29.103 38.299 10.880 2084 2HD LYS 202 2HD LYS 202 29.840 37.040 11.872 2085 1HE LYS 202 1HE LYS 202 29.594 35.420 10.025 2086 2HE LYS 202 2HE LYS 202 28.825 36.670 9.027 2087 1HZ LYS 202 1HZ LYS 202 30.801 38.046 9.305 2088 2HZ LYS 202 2HZ LYS 202 31.214 36.557 8.600 2089 3HZ LYS 202 3HZ LYS 202 31.538 36.837 10.244 2090 H ALA 203 H ALA 203 25.973 34.399 11.854 2091 HA ALA 203 HA ALA 203 24.973 32.405 13.855 2092 1HB ALA 203 1HB ALA 203 23.346 33.946 12.353 2093 2HB ALA 203 2HB ALA 203 22.942 32.274 12.746 2094 3HB ALA 203 3HB ALA 203 23.658 32.665 11.182 2095 HA PRO 204 HA PRO 204 27.419 29.438 11.742 2096 1HB PRO 204 1HB PRO 204 25.100 27.585 11.660 2097 2HB PRO 204 2HB PRO 204 26.670 27.380 12.454 2098 1HG PRO 204 1HG PRO 204 24.403 27.852 13.823 2099 2HG PRO 204 2HG PRO 204 25.985 28.427 14.366 2100 1HD PRO 204 1HD PRO 204 23.747 29.936 13.118 2101 2HD PRO 204 2HD PRO 204 24.938 30.464 14.326 2102 H ARG 205 H ARG 205 27.883 29.462 9.580 2103 HA ARG 205 HA ARG 205 25.767 30.022 7.614 2104 1HB ARG 205 1HB ARG 205 28.484 30.558 7.934 2105 2HB ARG 205 2HB ARG 205 28.456 29.355 6.644 2106 1HG ARG 205 1HG ARG 205 26.390 30.978 5.890 2107 2HG ARG 205 2HG ARG 205 27.476 32.145 6.645 2108 1HD ARG 205 1HD ARG 205 28.913 30.249 4.933 2109 2HD ARG 205 2HD ARG 205 27.708 31.198 4.041 2110 HE ARG 205 HE ARG 205 28.901 33.080 5.663 2111 1HH1 ARG 205 1HH1 ARG 205 30.118 30.686 3.449 2112 2HH1 ARG 205 2HH1 ARG 205 31.519 31.615 3.043 2113 1HH2 ARG 205 1HH2 ARG 205 30.727 34.267 5.120 2114 2HH2 ARG 205 2HH2 ARG 205 31.864 33.627 3.981 2115 H LYS 206 H LYS 206 24.515 28.213 7.156 2116 HA LYS 206 HA LYS 206 25.969 25.803 6.147 2117 1HB LYS 206 1HB LYS 206 24.334 26.127 8.535 2118 2HB LYS 206 2HB LYS 206 23.639 24.912 7.461 2119 1HG LYS 206 1HG LYS 206 26.559 24.950 8.271 2120 2HG LYS 206 2HG LYS 206 25.329 24.006 9.113 2121 1HD LYS 206 1HD LYS 206 25.667 23.771 6.128 2122 2HD LYS 206 2HD LYS 206 26.695 22.846 7.223 2123 1HE LYS 206 1HE LYS 206 24.952 21.500 7.927 2124 2HE LYS 206 2HE LYS 206 23.750 22.792 7.747 2125 1HZ LYS 206 1HZ LYS 206 24.262 22.642 5.282 2126 2HZ LYS 206 2HZ LYS 206 23.380 21.349 5.941 2127 3HZ LYS 206 3HZ LYS 206 25.039 21.170 5.623 2128 H GLN 207 H GLN 207 24.865 24.728 4.453 2129 HA GLN 207 HA GLN 207 23.103 26.253 2.809 2130 1HB GLN 207 1HB GLN 207 24.208 23.501 2.989 2131 2HB GLN 207 2HB GLN 207 22.738 23.659 2.028 2132 1HG GLN 207 1HG GLN 207 23.742 25.219 0.549 2133 2HG GLN 207 2HG GLN 207 25.077 25.533 1.657 2134 1HE2 GLN 207 1HE2 GLN 207 26.843 24.794 0.385 2135 2HE2 GLN 207 2HE2 GLN 207 26.982 23.204 -0.193 2136 H LEU 208 H LEU 208 20.834 25.671 2.255 2137 HA LEU 208 HA LEU 208 19.344 24.644 4.649 2138 1HB LEU 208 1HB LEU 208 18.832 26.809 2.598 2139 2HB LEU 208 2HB LEU 208 17.522 26.163 3.587 2140 HG LEU 208 HG LEU 208 20.072 27.072 4.896 2141 1HD1 LEU 208 1HD1 LEU 208 18.654 28.776 3.257 2142 2HD1 LEU 208 2HD1 LEU 208 19.632 29.283 4.634 2143 3HD1 LEU 208 3HD1 LEU 208 17.895 29.049 4.825 2144 1HD2 LEU 208 1HD2 LEU 208 17.300 26.369 5.648 2145 2HD2 LEU 208 2HD2 LEU 208 17.959 27.780 6.476 2146 3HD2 LEU 208 3HD2 LEU 208 18.789 26.227 6.581 2147 H ALA 209 H ALA 209 19.808 24.403 1.189 2148 HA ALA 209 HA ALA 209 18.009 22.033 1.148 2149 1HB ALA 209 1HB ALA 209 16.466 23.040 -0.202 2150 2HB ALA 209 2HB ALA 209 17.712 23.826 -1.173 2151 3HB ALA 209 3HB ALA 209 17.185 24.555 0.344 2152 H THR 210 H THR 210 18.894 20.426 -0.117 2153 HA THR 210 HA THR 210 20.948 21.190 -2.155 2154 HB THR 210 HB THR 210 21.161 18.992 -0.063 2155 HG1 THR 210 HG1 THR 210 22.624 20.346 0.919 2156 1HG2 THR 210 1HG2 THR 210 22.423 19.257 -2.539 2157 2HG2 THR 210 2HG2 THR 210 22.969 18.251 -1.196 2158 3HG2 THR 210 3HG2 THR 210 23.601 19.887 -1.387 2159 H LYS 211 H LYS 211 18.784 20.686 -3.383 2160 HA LYS 211 HA LYS 211 17.568 19.214 -4.774 2161 1HB LYS 211 1HB LYS 211 20.181 17.702 -4.403 2162 2HB LYS 211 2HB LYS 211 19.018 17.409 -5.696 2163 1HG LYS 211 1HG LYS 211 19.469 19.455 -6.740 2164 2HG LYS 211 2HG LYS 211 20.109 20.178 -5.264 2165 1HD LYS 211 1HD LYS 211 22.174 19.132 -5.488 2166 2HD LYS 211 2HD LYS 211 21.511 17.800 -6.435 2167 1HE LYS 211 1HE LYS 211 21.907 18.897 -8.385 2168 2HE LYS 211 2HE LYS 211 21.154 20.381 -7.772 2169 1HZ LYS 211 1HZ LYS 211 23.117 20.996 -6.671 2170 2HZ LYS 211 2HZ LYS 211 23.652 20.452 -8.189 2171 3HZ LYS 211 3HZ LYS 211 23.804 19.450 -6.825 2172 H ALA 212 H ALA 212 16.087 18.748 -2.913 2173 HA ALA 212 HA ALA 212 16.544 16.407 -1.241 2174 1HB ALA 212 1HB ALA 212 14.062 18.038 -1.903 2175 2HB ALA 212 2HB ALA 212 15.185 18.370 -0.584 2176 3HB ALA 212 3HB ALA 212 14.202 16.905 -0.558 2177 H ALA 213 H ALA 213 16.804 14.564 -2.579 2178 HA ALA 213 HA ALA 213 14.583 13.945 -4.485 2179 1HB ALA 213 1HB ALA 213 16.911 13.999 -5.331 2180 2HB ALA 213 2HB ALA 213 16.262 12.361 -5.414 2181 3HB ALA 213 3HB ALA 213 17.379 12.802 -4.123 2182 H ARG 214 H ARG 214 13.795 11.684 -4.485 2183 HA ARG 214 HA ARG 214 13.499 10.648 -1.733 2184 1HB ARG 214 1HB ARG 214 12.336 9.754 -4.399 2185 2HB ARG 214 2HB ARG 214 11.749 9.284 -2.804 2186 1HG ARG 214 1HG ARG 214 11.897 12.173 -3.689 2187 2HG ARG 214 2HG ARG 214 10.467 11.175 -3.948 2188 1HD ARG 214 1HD ARG 214 9.936 12.079 -1.869 2189 2HD ARG 214 2HD ARG 214 10.848 10.654 -1.334 2190 HE ARG 214 HE ARG 214 12.594 12.903 -1.912 2191 1HH1 ARG 214 1HH1 ARG 214 10.458 11.520 0.463 2192 2HH1 ARG 214 2HH1 ARG 214 11.251 12.296 1.790 2193 1HH2 ARG 214 1HH2 ARG 214 13.608 13.899 -0.173 2194 2HH2 ARG 214 2HH2 ARG 214 13.021 13.632 1.434 2195 1HN MLZ 215 1HN MLZ 215 13.069 7.880 -2.710 2196 HA MLZ 215 HA MLZ 215 15.774 6.887 -2.394 2197 1HB MLZ 215 1HB MLZ 215 12.999 5.860 -2.748 2198 2HB MLZ 215 2HB MLZ 215 14.298 4.751 -3.189 2199 1HG MLZ 215 1HG MLZ 215 14.681 6.205 -0.636 2200 2HG MLZ 215 2HG MLZ 215 15.004 4.516 -1.029 2201 1HD MLZ 215 1HD MLZ 215 12.213 5.645 -0.681 2202 2HD MLZ 215 2HD MLZ 215 12.668 3.947 -0.820 2203 1HE MLZ 215 1HE MLZ 215 12.634 5.642 1.552 2204 2HE MLZ 215 2HE MLZ 215 14.225 4.896 1.308 2205 HZ MLZ 215 HZ MLZ 215 13.226 2.763 1.097 2206 1HCM MLZ 215 1HCM MLZ 215 11.613 3.853 3.291 2207 2HCM MLZ 215 2HCM MLZ 215 13.369 3.991 3.378 2208 3HCM MLZ 215 3HCM MLZ 215 12.615 2.402 3.253 2209 H SER 216 H SER 216 17.177 6.126 -3.985 2210 HA SER 216 HA SER 216 18.047 5.750 -6.149 2211 1HB SER 216 1HB SER 216 16.112 7.620 -7.371 2212 2HB SER 216 2HB SER 216 16.918 8.261 -5.939 2213 HG SER 216 HG SER 216 18.437 8.671 -7.339 2214 H ALA 217 H ALA 217 17.149 5.394 -8.578 2215 HA ALA 217 HA ALA 217 14.962 3.389 -8.306 2216 1HB ALA 217 1HB ALA 217 14.867 6.009 -9.581 2217 2HB ALA 217 2HB ALA 217 13.547 4.882 -9.267 2218 3HB ALA 217 3HB ALA 217 14.508 4.728 -10.738 2219 HA PRO 218 HA PRO 218 17.817 1.203 -10.899 2220 1HB PRO 218 1HB PRO 218 16.131 -0.814 -11.727 2221 2HB PRO 218 2HB PRO 218 16.890 -0.775 -10.125 2222 1HG PRO 218 1HG PRO 218 14.123 -0.041 -10.936 2223 2HG PRO 218 2HG PRO 218 14.690 -0.850 -9.470 2224 1HD PRO 218 1HD PRO 218 13.989 1.787 -9.574 2225 2HD PRO 218 2HD PRO 218 15.162 1.127 -8.416 2226 H ALA 219 H ALA 219 17.308 -0.079 -13.258 2227 HA ALA 219 HA ALA 219 16.289 2.128 -15.000 2228 1HB ALA 219 1HB ALA 219 17.689 0.043 -16.398 2229 2HB ALA 219 2HB ALA 219 18.600 0.441 -14.941 2230 3HB ALA 219 3HB ALA 219 18.216 1.702 -16.113 2231 H THR 220 H THR 220 14.782 1.624 -16.665 2232 HA THR 220 HA THR 220 13.697 -1.159 -16.715 2233 HB THR 220 HB THR 220 12.034 1.375 -16.498 2234 HG1 THR 220 HG1 THR 220 12.261 1.231 -14.430 2235 1HG2 THR 220 1HG2 THR 220 11.191 -1.455 -15.887 2236 2HG2 THR 220 2HG2 THR 220 11.132 -0.829 -17.535 2237 3HG2 THR 220 3HG2 THR 220 10.178 -0.061 -16.266 2238 H GLY 221 H GLY 221 14.240 -1.603 -18.854 2239 1HA GLY 221 1HA GLY 221 12.997 0.155 -20.912 2240 2HA GLY 221 2HA GLY 221 14.692 -0.300 -21.086 2241 1HN SAH 301 1HN SAH 301 -10.724 -1.302 -7.926 2242 2HN SAH 301 2HN SAH 301 -9.201 -0.754 -7.408 2243 HA SAH 301 HA SAH 301 -11.362 0.921 -8.582 2244 1HB SAH 301 1HB SAH 301 -10.959 -0.128 -6.042 2245 2HB SAH 301 2HB SAH 301 -10.249 1.483 -5.928 2246 1HG SAH 301 1HG SAH 301 -12.843 1.116 -5.500 2247 2HG SAH 301 2HG SAH 301 -12.917 1.183 -7.261 2248 1H5* SAH 301 1H5* SAH 301 -14.544 2.734 -6.530 2249 2H5* SAH 301 2H5* SAH 301 -14.311 4.350 -5.864 2250 H4* SAH 301 H4* SAH 301 -13.232 4.742 -8.224 2251 H3* SAH 301 H3* SAH 301 -15.778 5.205 -6.947 2252 *HO3 SAH 301 *HO3 SAH 301 -13.929 6.470 -8.416 2253 H2* SAH 301 H2* SAH 301 -17.239 4.428 -8.453 2254 *HO2 SAH 301 *HO2 SAH 301 -17.465 5.823 -9.981 2255 H1* SAH 301 H1* SAH 301 -15.541 3.504 -10.586 2256 H8 SAH 301 H8 SAH 301 -16.018 1.542 -7.344 2257 1HN6 SAH 301 1HN6 SAH 301 -20.608 -1.198 -9.614 2258 2HN6 SAH 301 2HN6 SAH 301 -20.949 0.002 -8.388 2259 H2 SAH 301 H2 SAH 301 -19.487 2.230 -12.672 2260 1HN SAH 302 1HN SAH 302 10.957 -1.326 7.995 2261 2HN SAH 302 2HN SAH 302 9.422 -0.777 7.517 2262 HA SAH 302 HA SAH 302 11.619 0.883 8.645 2263 1HB SAH 302 1HB SAH 302 11.141 -0.148 6.109 2264 2HB SAH 302 2HB SAH 302 10.430 1.464 6.021 2265 1HG SAH 302 1HG SAH 302 13.012 1.095 5.521 2266 2HG SAH 302 2HG SAH 302 13.133 1.158 7.279 2267 1H5* SAH 302 1H5* SAH 302 14.741 2.708 6.512 2268 2H5* SAH 302 2H5* SAH 302 14.493 4.326 5.857 2269 H4* SAH 302 H4* SAH 302 13.475 4.712 8.246 2270 H3* SAH 302 H3* SAH 302 15.988 5.177 6.904 2271 *HO3 SAH 302 *HO3 SAH 302 14.180 6.439 8.424 2272 H2* SAH 302 H2* SAH 302 17.488 4.394 8.369 2273 *HO2 SAH 302 *HO2 SAH 302 17.755 5.785 9.894 2274 H1* SAH 302 H1* SAH 302 15.845 3.466 10.543 2275 H8 SAH 302 H8 SAH 302 16.235 1.512 7.281 2276 1HN6 SAH 302 1HN6 SAH 302 20.880 -1.238 9.425 2277 2HN6 SAH 302 2HN6 SAH 302 21.191 -0.035 8.194 2278 H2 SAH 302 H2 SAH 302 19.842 2.181 12.522 Start of MODEL 8 1 1H MET 1 1H MET 1 1.219 -10.664 -4.566 2 2H MET 1 2H MET 1 1.000 -12.267 -5.082 3 3H MET 1 3H MET 1 0.081 -11.658 -3.791 4 HA MET 1 HA MET 1 -0.886 -9.992 -5.390 5 1HB MET 1 1HB MET 1 0.956 -11.674 -7.048 6 2HB MET 1 2HB MET 1 -0.534 -11.111 -7.804 7 1HG MET 1 1HG MET 1 0.912 -9.051 -6.259 8 2HG MET 1 2HG MET 1 1.777 -9.645 -7.677 9 1HE MET 1 1HE MET 1 -0.498 -7.126 -6.367 10 2HE MET 1 2HE MET 1 -0.688 -6.222 -7.869 11 3HE MET 1 3HE MET 1 0.920 -6.696 -7.322 12 H PHE 2 H PHE 2 -0.452 -13.517 -5.471 13 HA PHE 2 HA PHE 2 -3.434 -13.781 -5.670 14 1HB PHE 2 1HB PHE 2 -2.965 -15.834 -7.002 15 2HB PHE 2 2HB PHE 2 -2.269 -14.402 -7.759 16 HD1 PHE 2 HD1 PHE 2 -1.573 -17.580 -6.094 17 HD2 PHE 2 HD2 PHE 2 0.172 -13.959 -7.610 18 HE1 PHE 2 HE1 PHE 2 0.672 -18.629 -6.015 19 HE2 PHE 2 HE2 PHE 2 2.417 -15.008 -7.532 20 HZ PHE 2 HZ PHE 2 2.668 -17.343 -6.734 21 H ASN 3 H ASN 3 -4.251 -14.745 -3.873 22 HA ASN 3 HA ASN 3 -2.507 -16.663 -2.363 23 1HB ASN 3 1HB ASN 3 -4.513 -14.626 -1.334 24 2HB ASN 3 2HB ASN 3 -3.561 -15.716 -0.327 25 1HD2 ASN 3 1HD2 ASN 3 -1.021 -15.568 -1.186 26 2HD2 ASN 3 2HD2 ASN 3 -0.443 -13.973 -1.237 27 H ASP 4 H ASP 4 -3.596 -18.498 -1.517 28 HA ASP 4 HA ASP 4 -5.649 -19.716 -2.923 29 1HB ASP 4 1HB ASP 4 -4.099 -20.562 -1.048 30 2HB ASP 4 2HB ASP 4 -5.306 -19.943 0.080 31 H ARG 5 H ARG 5 -6.080 -17.783 0.068 32 HA ARG 5 HA ARG 5 -8.909 -17.994 0.238 33 1HB ARG 5 1HB ARG 5 -6.893 -15.884 1.055 34 2HB ARG 5 2HB ARG 5 -8.590 -15.816 1.535 35 1HG ARG 5 1HG ARG 5 -7.055 -18.353 1.976 36 2HG ARG 5 2HG ARG 5 -6.821 -17.009 3.091 37 1HD ARG 5 1HD ARG 5 -9.171 -16.971 3.657 38 2HD ARG 5 2HD ARG 5 -9.549 -18.124 2.363 39 HE ARG 5 HE ARG 5 -8.733 -19.857 3.754 40 1HH1 ARG 5 1HH1 ARG 5 -7.638 -16.749 4.877 41 2HH1 ARG 5 2HH1 ARG 5 -6.922 -17.397 6.311 42 1HH2 ARG 5 1HH2 ARG 5 -7.797 -20.674 5.623 43 2HH2 ARG 5 2HH2 ARG 5 -7.010 -19.602 6.732 44 H VAL 6 H VAL 6 -6.887 -15.521 -1.384 45 HA VAL 6 HA VAL 6 -9.095 -14.972 -3.274 46 HB VAL 6 HB VAL 6 -9.032 -12.534 -2.650 47 1HG1 VAL 6 1HG1 VAL 6 -10.460 -12.751 -0.763 48 2HG1 VAL 6 2HG1 VAL 6 -9.634 -14.207 -0.207 49 3HG1 VAL 6 3HG1 VAL 6 -10.650 -14.265 -1.647 50 1HG2 VAL 6 1HG2 VAL 6 -7.902 -11.843 -0.622 51 2HG2 VAL 6 2HG2 VAL 6 -6.726 -12.668 -1.646 52 3HG2 VAL 6 3HG2 VAL 6 -7.434 -13.505 -0.264 53 H ILE 7 H ILE 7 -8.338 -13.842 -5.155 54 HA ILE 7 HA ILE 7 -5.350 -13.601 -5.336 55 HB ILE 7 HB ILE 7 -6.295 -15.445 -6.651 56 1HG1 ILE 7 1HG1 ILE 7 -5.793 -13.180 -8.589 57 2HG1 ILE 7 2HG1 ILE 7 -4.497 -13.888 -7.625 58 1HG2 ILE 7 1HG2 ILE 7 -7.935 -14.823 -8.503 59 2HG2 ILE 7 2HG2 ILE 7 -8.146 -13.281 -7.672 60 3HG2 ILE 7 3HG2 ILE 7 -8.585 -14.787 -6.864 61 1HD1 ILE 7 1HD1 ILE 7 -4.412 -15.152 -9.602 62 2HD1 ILE 7 2HD1 ILE 7 -6.166 -15.172 -9.776 63 3HD1 ILE 7 3HD1 ILE 7 -5.391 -16.164 -8.541 64 H VAL 8 H VAL 8 -4.673 -11.939 -7.033 65 HA VAL 8 HA VAL 8 -6.275 -9.483 -6.660 66 HB VAL 8 HB VAL 8 -3.823 -9.508 -6.342 67 1HG1 VAL 8 1HG1 VAL 8 -3.890 -11.159 -8.627 68 2HG1 VAL 8 2HG1 VAL 8 -2.457 -10.615 -7.754 69 3HG1 VAL 8 3HG1 VAL 8 -3.056 -9.689 -9.129 70 1HG2 VAL 8 1HG2 VAL 8 -4.233 -7.353 -6.975 71 2HG2 VAL 8 2HG2 VAL 8 -5.173 -7.842 -8.385 72 3HG2 VAL 8 3HG2 VAL 8 -3.411 -7.826 -8.461 73 H LYS 9 H LYS 9 -7.642 -8.725 -8.188 74 HA LYS 9 HA LYS 9 -7.185 -9.393 -11.041 75 1HB LYS 9 1HB LYS 9 -9.471 -10.165 -9.274 76 2HB LYS 9 2HB LYS 9 -9.792 -9.868 -10.979 77 1HG LYS 9 1HG LYS 9 -7.565 -11.384 -11.198 78 2HG LYS 9 2HG LYS 9 -8.214 -12.027 -9.697 79 1HD LYS 9 1HD LYS 9 -10.180 -12.744 -10.733 80 2HD LYS 9 2HD LYS 9 -9.992 -11.662 -12.093 81 1HE LYS 9 1HE LYS 9 -7.730 -13.172 -12.262 82 2HE LYS 9 2HE LYS 9 -8.883 -14.357 -11.653 83 1HZ LYS 9 1HZ LYS 9 -10.458 -13.433 -13.375 84 2HZ LYS 9 2HZ LYS 9 -9.156 -14.332 -13.991 85 3HZ LYS 9 3HZ LYS 9 -9.124 -12.636 -14.060 86 H LYS 10 H LYS 10 -8.577 -6.125 -11.688 87 HA LYS 10 HA LYS 10 -7.795 -7.027 -13.684 88 1HB LYS 10 1HB LYS 10 -5.987 -7.712 -11.555 89 2HB LYS 10 2HB LYS 10 -6.019 -9.029 -12.728 90 1HG LYS 10 1HG LYS 10 -5.204 -7.703 -14.443 91 2HG LYS 10 2HG LYS 10 -5.879 -6.224 -13.760 92 1HD LYS 10 1HD LYS 10 -3.423 -6.239 -13.545 93 2HD LYS 10 2HD LYS 10 -4.186 -6.293 -11.956 94 1HE LYS 10 1HE LYS 10 -2.533 -7.985 -11.816 95 2HE LYS 10 2HE LYS 10 -3.991 -8.900 -12.243 96 1HZ LYS 10 1HZ LYS 10 -3.399 -8.628 -14.590 97 2HZ LYS 10 2HZ LYS 10 -2.180 -9.455 -13.745 98 3HZ LYS 10 3HZ LYS 10 -1.974 -7.818 -14.147 99 H SER 11 H SER 11 -10.045 -7.912 -13.752 100 HA SER 11 HA SER 11 -9.989 -10.902 -13.844 101 1HB SER 11 1HB SER 11 -11.755 -10.926 -12.381 102 2HB SER 11 2HB SER 11 -11.325 -9.256 -12.038 103 HG SER 11 HG SER 11 -13.304 -8.946 -12.696 104 HA PRO 12 HA PRO 12 -11.834 -10.679 -17.822 105 1HB PRO 12 1HB PRO 12 -14.228 -12.077 -17.606 106 2HB PRO 12 2HB PRO 12 -12.637 -12.840 -17.777 107 1HG PRO 12 1HG PRO 12 -14.304 -12.441 -15.352 108 2HG PRO 12 2HG PRO 12 -13.235 -13.784 -15.779 109 1HD PRO 12 1HD PRO 12 -12.576 -11.853 -13.978 110 2HD PRO 12 2HD PRO 12 -11.377 -12.732 -14.948 111 H LEU 13 H LEU 13 -14.180 -10.028 -15.228 112 HA LEU 13 HA LEU 13 -16.056 -8.547 -16.831 113 1HB LEU 13 1HB LEU 13 -15.545 -9.283 -14.066 114 2HB LEU 13 2HB LEU 13 -16.086 -7.607 -14.163 115 HG LEU 13 HG LEU 13 -18.009 -9.140 -13.956 116 1HD1 LEU 13 1HD1 LEU 13 -19.184 -7.756 -15.294 117 2HD1 LEU 13 2HD1 LEU 13 -18.443 -8.439 -16.742 118 3HD1 LEU 13 3HD1 LEU 13 -17.643 -7.127 -15.876 119 1HD2 LEU 13 1HD2 LEU 13 -18.069 -11.102 -15.062 120 2HD2 LEU 13 2HD2 LEU 13 -16.463 -10.738 -15.695 121 3HD2 LEU 13 3HD2 LEU 13 -17.898 -10.277 -16.612 122 H GLY 14 H GLY 14 -13.100 -7.650 -15.104 123 1HA GLY 14 1HA GLY 14 -11.781 -5.731 -15.845 124 2HA GLY 14 2HA GLY 14 -13.274 -4.963 -16.383 125 H GLY 15 H GLY 15 -10.980 -4.744 -14.060 126 1HA GLY 15 1HA GLY 15 -11.828 -2.786 -12.475 127 2HA GLY 15 2HA GLY 15 -12.840 -4.085 -11.843 128 H TYR 16 H TYR 16 -10.284 -2.481 -10.910 129 HA TYR 16 HA TYR 16 -8.433 -4.722 -10.364 130 1HB TYR 16 1HB TYR 16 -8.483 -1.755 -10.234 131 2HB TYR 16 2HB TYR 16 -7.455 -2.552 -9.045 132 HD1 TYR 16 HD1 TYR 16 -8.012 -1.913 -12.622 133 HD2 TYR 16 HD2 TYR 16 -5.554 -3.940 -9.740 134 HE1 TYR 16 HE1 TYR 16 -6.295 -2.313 -14.367 135 HE2 TYR 16 HE2 TYR 16 -3.838 -4.340 -11.484 136 HH TYR 16 HH TYR 16 -3.639 -2.725 -14.269 137 H GLY 17 H GLY 17 -10.426 -5.680 -9.075 138 1HA GLY 17 1HA GLY 17 -10.321 -4.640 -6.270 139 2HA GLY 17 2HA GLY 17 -11.700 -5.517 -6.932 140 H VAL 18 H VAL 18 -11.308 -6.990 -5.027 141 HA VAL 18 HA VAL 18 -8.971 -8.820 -5.513 142 HB VAL 18 HB VAL 18 -8.957 -7.914 -3.275 143 1HG1 VAL 18 1HG1 VAL 18 -11.304 -8.688 -2.025 144 2HG1 VAL 18 2HG1 VAL 18 -11.848 -8.099 -3.592 145 3HG1 VAL 18 3HG1 VAL 18 -10.900 -7.052 -2.545 146 1HG2 VAL 18 1HG2 VAL 18 -8.970 -10.572 -3.712 147 2HG2 VAL 18 2HG2 VAL 18 -10.365 -10.456 -2.639 148 3HG2 VAL 18 3HG2 VAL 18 -8.787 -9.875 -2.102 149 H PHE 19 H PHE 19 -9.418 -10.899 -6.196 150 HA PHE 19 HA PHE 19 -12.243 -11.543 -6.768 151 1HB PHE 19 1HB PHE 19 -9.800 -11.914 -8.026 152 2HB PHE 19 2HB PHE 19 -10.184 -13.525 -7.416 153 HD1 PHE 19 HD1 PHE 19 -11.453 -14.888 -8.812 154 HD2 PHE 19 HD2 PHE 19 -11.971 -10.629 -9.013 155 HE1 PHE 19 HE1 PHE 19 -13.112 -15.176 -10.633 156 HE2 PHE 19 HE2 PHE 19 -13.630 -10.916 -10.833 157 HZ PHE 19 HZ PHE 19 -14.201 -13.190 -11.644 158 H ALA 20 H ALA 20 -13.339 -13.303 -5.840 159 HA ALA 20 HA ALA 20 -12.137 -14.416 -3.358 160 1HB ALA 20 1HB ALA 20 -14.710 -13.542 -4.282 161 2HB ALA 20 2HB ALA 20 -14.266 -14.075 -2.660 162 3HB ALA 20 3HB ALA 20 -14.837 -15.247 -3.848 163 H ARG 21 H ARG 21 -10.726 -16.008 -4.362 164 HA ARG 21 HA ARG 21 -11.578 -17.940 -6.298 165 1HB ARG 21 1HB ARG 21 -9.299 -17.289 -4.673 166 2HB ARG 21 2HB ARG 21 -9.605 -19.019 -4.546 167 1HG ARG 21 1HG ARG 21 -9.310 -19.378 -6.834 168 2HG ARG 21 2HG ARG 21 -9.675 -17.702 -7.243 169 1HD ARG 21 1HD ARG 21 -7.518 -16.996 -6.821 170 2HD ARG 21 2HD ARG 21 -7.279 -18.180 -5.521 171 HE ARG 21 HE ARG 21 -7.640 -19.487 -8.082 172 1HH1 ARG 21 1HH1 ARG 21 -5.340 -17.777 -6.106 173 2HH1 ARG 21 2HH1 ARG 21 -3.975 -18.542 -6.841 174 1HH2 ARG 21 1HH2 ARG 21 -5.852 -20.466 -9.020 175 2HH2 ARG 21 2HH2 ARG 21 -4.259 -20.052 -8.478 176 H LYS 22 H LYS 22 -12.230 -17.630 -2.908 177 HA LYS 22 HA LYS 22 -12.896 -20.481 -2.535 178 1HB LYS 22 1HB LYS 22 -12.233 -18.167 -0.977 179 2HB LYS 22 2HB LYS 22 -13.796 -18.749 -0.430 180 1HG LYS 22 1HG LYS 22 -12.830 -20.474 0.633 181 2HG LYS 22 2HG LYS 22 -12.060 -21.000 -0.861 182 1HD LYS 22 1HD LYS 22 -10.726 -18.650 0.096 183 2HD LYS 22 2HD LYS 22 -10.841 -19.811 1.415 184 1HE LYS 22 1HE LYS 22 -8.777 -20.175 0.059 185 2HE LYS 22 2HE LYS 22 -9.870 -21.567 -0.052 186 1HZ LYS 22 1HZ LYS 22 -10.605 -20.931 -2.138 187 2HZ LYS 22 2HZ LYS 22 -8.963 -20.505 -2.220 188 3HZ LYS 22 3HZ LYS 22 -10.136 -19.311 -1.939 189 H SER 23 H SER 23 -16.535 -19.990 -2.186 190 HA SER 23 HA SER 23 -14.102 -21.376 -1.175 191 1HB SER 23 1HB SER 23 -16.723 -22.335 -0.302 192 2HB SER 23 2HB SER 23 -16.646 -22.145 -2.053 193 HG SER 23 HG SER 23 -15.810 -24.177 -0.854 194 H PHE 24 H PHE 24 -16.245 -18.899 -0.214 195 HA PHE 24 HA PHE 24 -15.321 -19.188 2.614 196 1HB PHE 24 1HB PHE 24 -16.183 -16.914 0.811 197 2HB PHE 24 2HB PHE 24 -16.072 -16.695 2.557 198 HD1 PHE 24 HD1 PHE 24 -13.762 -18.260 3.336 199 HD2 PHE 24 HD2 PHE 24 -14.345 -15.839 -0.163 200 HE1 PHE 24 HE1 PHE 24 -11.311 -17.941 3.149 201 HE2 PHE 24 HE2 PHE 24 -11.893 -15.520 -0.352 202 HZ PHE 24 HZ PHE 24 -10.375 -16.571 1.304 203 H GLU 25 H GLU 25 -16.914 -18.501 4.298 204 HA GLU 25 HA GLU 25 -19.678 -19.380 3.572 205 1HB GLU 25 1HB GLU 25 -17.981 -20.253 5.495 206 2HB GLU 25 2HB GLU 25 -18.787 -18.966 6.391 207 1HG GLU 25 1HG GLU 25 -20.901 -20.207 5.132 208 2HG GLU 25 2HG GLU 25 -19.835 -21.565 5.493 209 H LYS 26 H LYS 26 -20.690 -18.128 6.084 210 HA LYS 26 HA LYS 26 -20.864 -15.319 5.069 211 1HB LYS 26 1HB LYS 26 -22.911 -16.766 5.191 212 2HB LYS 26 2HB LYS 26 -22.666 -16.901 6.929 213 1HG LYS 26 1HG LYS 26 -22.955 -14.519 7.210 214 2HG LYS 26 2HG LYS 26 -23.000 -14.268 5.476 215 1HD LYS 26 1HD LYS 26 -24.957 -16.134 5.862 216 2HD LYS 26 2HD LYS 26 -25.102 -15.168 7.321 217 1HE LYS 26 1HE LYS 26 -24.750 -13.273 5.309 218 2HE LYS 26 2HE LYS 26 -25.839 -14.471 4.580 219 1HZ LYS 26 1HZ LYS 26 -27.174 -12.973 5.847 220 2HZ LYS 26 2HZ LYS 26 -26.152 -13.096 7.198 221 3HZ LYS 26 3HZ LYS 26 -27.096 -14.426 6.723 222 H GLY 27 H GLY 27 -18.819 -14.774 6.223 223 1HA GLY 27 1HA GLY 27 -18.557 -13.230 8.227 224 2HA GLY 27 2HA GLY 27 -19.221 -14.557 9.180 225 H GLU 28 H GLU 28 -16.783 -14.572 6.563 226 HA GLU 28 HA GLU 28 -14.841 -15.719 8.545 227 1HB GLU 28 1HB GLU 28 -15.253 -16.495 5.637 228 2HB GLU 28 2HB GLU 28 -14.167 -17.281 6.780 229 1HG GLU 28 1HG GLU 28 -16.485 -17.437 8.171 230 2HG GLU 28 2HG GLU 28 -17.120 -17.487 6.526 231 H LEU 29 H LEU 29 -12.698 -15.039 8.294 232 HA LEU 29 HA LEU 29 -12.241 -12.538 6.871 233 1HB LEU 29 1HB LEU 29 -11.274 -13.651 9.097 234 2HB LEU 29 2HB LEU 29 -10.059 -14.279 7.983 235 HG LEU 29 HG LEU 29 -9.341 -12.127 8.958 236 1HD1 LEU 29 1HD1 LEU 29 -9.995 -11.275 6.203 237 2HD1 LEU 29 2HD1 LEU 29 -9.212 -12.851 6.332 238 3HD1 LEU 29 3HD1 LEU 29 -8.426 -11.418 6.994 239 1HD2 LEU 29 1HD2 LEU 29 -10.854 -10.502 9.314 240 2HD2 LEU 29 2HD2 LEU 29 -12.082 -11.467 8.495 241 3HD2 LEU 29 3HD2 LEU 29 -11.087 -10.342 7.573 242 H VAL 30 H VAL 30 -11.089 -12.263 4.932 243 HA VAL 30 HA VAL 30 -10.288 -14.780 3.516 244 HB VAL 30 HB VAL 30 -11.005 -13.503 1.460 245 1HG1 VAL 30 1HG1 VAL 30 -13.244 -13.586 3.478 246 2HG1 VAL 30 2HG1 VAL 30 -12.489 -15.068 2.893 247 3HG1 VAL 30 3HG1 VAL 30 -13.300 -13.986 1.761 248 1HG2 VAL 30 1HG2 VAL 30 -11.715 -11.360 1.561 249 2HG2 VAL 30 2HG2 VAL 30 -10.818 -11.325 3.078 250 3HG2 VAL 30 3HG2 VAL 30 -12.557 -11.612 3.090 251 H GLU 31 H GLU 31 -9.390 -11.515 4.383 252 HA GLU 31 HA GLU 31 -6.611 -11.996 3.726 253 1HB GLU 31 1HB GLU 31 -8.155 -11.444 1.559 254 2HB GLU 31 2HB GLU 31 -7.731 -9.804 2.050 255 1HG GLU 31 1HG GLU 31 -5.316 -10.548 2.128 256 2HG GLU 31 2HG GLU 31 -5.829 -12.069 1.398 257 H GLU 32 H GLU 32 -5.270 -10.235 4.466 258 HA GLU 32 HA GLU 32 -6.646 -7.907 5.716 259 1HB GLU 32 1HB GLU 32 -5.547 -10.289 6.985 260 2HB GLU 32 2HB GLU 32 -4.771 -8.829 7.596 261 1HG GLU 32 1HG GLU 32 -6.894 -7.886 8.223 262 2HG GLU 32 2HG GLU 32 -7.768 -9.160 7.372 263 H CYS 33 H CYS 33 -5.208 -6.109 6.050 264 HA CYS 33 HA CYS 33 -2.359 -6.439 5.287 265 1HB CYS 33 1HB CYS 33 -2.614 -4.698 3.525 266 2HB CYS 33 2HB CYS 33 -3.608 -6.113 3.181 267 HG CYS 33 HG CYS 33 -4.840 -3.580 3.132 268 H LEU 34 H LEU 34 -1.804 -3.689 4.979 269 HA LEU 34 HA LEU 34 -2.452 -2.656 7.719 270 1HB LEU 34 1HB LEU 34 -0.058 -2.263 5.884 271 2HB LEU 34 2HB LEU 34 -0.233 -1.517 7.473 272 HG LEU 34 HG LEU 34 -0.403 -4.510 7.078 273 1HD1 LEU 34 1HD1 LEU 34 1.786 -4.094 6.329 274 2HD1 LEU 34 2HD1 LEU 34 2.012 -4.363 8.057 275 3HD1 LEU 34 3HD1 LEU 34 1.997 -2.720 7.415 276 1HD2 LEU 34 1HD2 LEU 34 -1.076 -4.274 9.232 277 2HD2 LEU 34 2HD2 LEU 34 -0.504 -2.608 9.319 278 3HD2 LEU 34 3HD2 LEU 34 0.621 -3.942 9.576 279 H CYS 35 H CYS 35 -2.001 -0.102 7.671 280 HA CYS 35 HA CYS 35 -3.011 1.154 5.173 281 1HB CYS 35 1HB CYS 35 -4.388 1.054 7.868 282 2HB CYS 35 2HB CYS 35 -4.775 2.292 6.674 283 HG CYS 35 HG CYS 35 -5.699 -0.590 6.564 284 H ILE 36 H ILE 36 -3.070 3.632 5.515 285 HA ILE 36 HA ILE 36 -0.698 4.403 7.186 286 HB ILE 36 HB ILE 36 -2.055 5.857 4.887 287 1HG1 ILE 36 1HG1 ILE 36 0.414 4.092 4.874 288 2HG1 ILE 36 2HG1 ILE 36 -1.147 3.661 4.177 289 1HG2 ILE 36 1HG2 ILE 36 -0.537 7.070 6.622 290 2HG2 ILE 36 2HG2 ILE 36 -0.214 7.319 4.906 291 3HG2 ILE 36 3HG2 ILE 36 0.782 6.200 5.837 292 1HD1 ILE 36 1HD1 ILE 36 -0.125 6.276 3.291 293 2HD1 ILE 36 2HD1 ILE 36 -0.814 4.959 2.343 294 3HD1 ILE 36 3HD1 ILE 36 0.886 4.913 2.810 295 H VAL 37 H VAL 37 -0.928 6.112 8.696 296 HA VAL 37 HA VAL 37 -3.727 7.138 9.053 297 HB VAL 37 HB VAL 37 -1.626 6.503 11.154 298 1HG1 VAL 37 1HG1 VAL 37 -4.588 6.927 11.558 299 2HG1 VAL 37 2HG1 VAL 37 -3.453 8.278 11.595 300 3HG1 VAL 37 3HG1 VAL 37 -3.302 6.966 12.766 301 1HG2 VAL 37 1HG2 VAL 37 -4.121 4.966 10.381 302 2HG2 VAL 37 2HG2 VAL 37 -2.980 4.526 11.653 303 3HG2 VAL 37 3HG2 VAL 37 -2.477 4.486 9.962 304 H ARG 38 H ARG 38 -3.203 9.082 7.876 305 HA ARG 38 HA ARG 38 -1.221 10.877 9.237 306 1HB ARG 38 1HB ARG 38 -1.973 10.256 6.428 307 2HB ARG 38 2HB ARG 38 -1.676 11.961 6.769 308 1HG ARG 38 1HG ARG 38 0.236 9.742 7.545 309 2HG ARG 38 2HG ARG 38 0.373 10.670 6.051 310 1HD ARG 38 1HD ARG 38 0.276 12.760 7.635 311 2HD ARG 38 2HD ARG 38 0.746 11.602 8.893 312 HE ARG 38 HE ARG 38 2.461 11.014 6.805 313 1HH1 ARG 38 1HH1 ARG 38 1.617 13.924 8.518 314 2HH1 ARG 38 2HH1 ARG 38 3.170 14.647 8.278 315 1HH2 ARG 38 1HH2 ARG 38 4.468 11.973 6.506 316 2HH2 ARG 38 2HH2 ARG 38 4.774 13.553 7.147 317 H HIS 39 H HIS 39 -1.912 13.305 8.711 318 HA HIS 39 HA HIS 39 -4.669 13.619 9.739 319 1HB HIS 39 1HB HIS 39 -2.128 15.058 9.706 320 2HB HIS 39 2HB HIS 39 -3.466 16.120 9.269 321 HD1 HIS 39 HD1 HIS 39 -3.721 17.371 11.471 322 HD2 HIS 39 HD2 HIS 39 -3.795 13.232 11.961 323 HE1 HIS 39 HE1 HIS 39 -4.404 16.946 13.873 324 H ASN 40 H ASN 40 -5.889 15.585 8.651 325 HA ASN 40 HA ASN 40 -6.331 14.889 5.861 326 1HB ASN 40 1HB ASN 40 -7.896 15.772 7.792 327 2HB ASN 40 2HB ASN 40 -7.362 17.358 7.239 328 1HD2 ASN 40 1HD2 ASN 40 -9.475 14.696 6.528 329 2HD2 ASN 40 2HD2 ASN 40 -10.061 15.283 5.047 330 H ASP 41 H ASP 41 -6.819 17.980 5.400 331 HA ASP 41 HA ASP 41 -5.640 19.776 4.431 332 1HB ASP 41 1HB ASP 41 -4.219 19.015 6.640 333 2HB ASP 41 2HB ASP 41 -3.008 18.779 5.380 334 H ASP 42 H ASP 42 -2.783 19.458 3.522 335 HA ASP 42 HA ASP 42 -3.088 18.774 0.855 336 1HB ASP 42 1HB ASP 42 -0.616 18.351 0.953 337 2HB ASP 42 2HB ASP 42 -1.089 19.796 1.847 338 H TRP 43 H TRP 43 -2.746 16.558 3.568 339 HA TRP 43 HA TRP 43 -2.140 14.191 2.030 340 1HB TRP 43 1HB TRP 43 -1.719 14.332 4.421 341 2HB TRP 43 2HB TRP 43 -3.408 14.720 4.741 342 HD1 TRP 43 HD1 TRP 43 -4.971 12.760 5.228 343 HE1 TRP 43 HE1 TRP 43 -4.817 10.194 5.011 344 HE3 TRP 43 HE3 TRP 43 -0.484 12.341 2.825 345 HZ2 TRP 43 HZ2 TRP 43 -3.027 8.231 3.942 346 HZ3 TRP 43 HZ3 TRP 43 0.406 10.114 2.209 347 HH2 TRP 43 HH2 TRP 43 -0.846 8.058 2.789 348 H GLY 44 H GLY 44 -5.207 15.398 3.451 349 1HA GLY 44 1HA GLY 44 -6.884 13.380 2.372 350 2HA GLY 44 2HA GLY 44 -7.431 14.993 2.828 351 H THR 45 H THR 45 -5.399 16.146 0.861 352 HA THR 45 HA THR 45 -7.216 16.144 -1.446 353 HB THR 45 HB THR 45 -4.545 17.479 -0.873 354 HG1 THR 45 HG1 THR 45 -5.895 19.266 -0.455 355 1HG2 THR 45 1HG2 THR 45 -4.593 18.283 -2.977 356 2HG2 THR 45 2HG2 THR 45 -6.254 18.837 -2.768 357 3HG2 THR 45 3HG2 THR 45 -5.936 17.189 -3.317 358 H ALA 46 H ALA 46 -3.652 15.735 -1.298 359 HA ALA 46 HA ALA 46 -3.215 14.619 -3.800 360 1HB ALA 46 1HB ALA 46 -1.488 13.217 -2.168 361 2HB ALA 46 2HB ALA 46 -1.970 14.553 -1.122 362 3HB ALA 46 3HB ALA 46 -1.234 14.882 -2.690 363 H LEU 47 H LEU 47 -3.985 12.764 -0.831 364 HA LEU 47 HA LEU 47 -4.354 10.299 -2.438 365 1HB LEU 47 1HB LEU 47 -4.511 10.929 0.527 366 2HB LEU 47 2HB LEU 47 -4.584 9.309 -0.165 367 HG LEU 47 HG LEU 47 -2.322 10.259 -1.339 368 1HD1 LEU 47 1HD1 LEU 47 -2.663 11.641 1.298 369 2HD1 LEU 47 2HD1 LEU 47 -2.167 12.333 -0.246 370 3HD1 LEU 47 3HD1 LEU 47 -1.063 11.287 0.645 371 1HD2 LEU 47 1HD2 LEU 47 -2.802 8.762 1.198 372 2HD2 LEU 47 2HD2 LEU 47 -1.161 9.071 0.631 373 3HD2 LEU 47 3HD2 LEU 47 -2.283 8.150 -0.372 374 H GLU 48 H GLU 48 -6.308 12.582 -2.708 375 HA GLU 48 HA GLU 48 -8.696 11.941 -1.216 376 1HB GLU 48 1HB GLU 48 -9.732 13.459 -2.932 377 2HB GLU 48 2HB GLU 48 -8.273 14.138 -2.215 378 1HG GLU 48 1HG GLU 48 -7.529 14.425 -4.328 379 2HG GLU 48 2HG GLU 48 -7.317 12.679 -4.384 380 H ASP 49 H ASP 49 -8.218 9.463 -1.842 381 HA ASP 49 HA ASP 49 -10.306 8.734 -3.774 382 1HB ASP 49 1HB ASP 49 -7.734 9.176 -4.706 383 2HB ASP 49 2HB ASP 49 -7.746 7.433 -4.439 384 H TYR 50 H TYR 50 -7.370 7.080 -2.560 385 HA TYR 50 HA TYR 50 -9.106 4.897 -1.512 386 1HB TYR 50 1HB TYR 50 -6.079 5.083 -1.742 387 2HB TYR 50 2HB TYR 50 -7.037 3.617 -1.546 388 HD1 TYR 50 HD1 TYR 50 -5.058 4.871 -3.856 389 HD2 TYR 50 HD2 TYR 50 -9.262 4.084 -3.440 390 HE1 TYR 50 HE1 TYR 50 -5.269 4.686 -6.321 391 HE2 TYR 50 HE2 TYR 50 -9.471 3.902 -5.903 392 HH TYR 50 HH TYR 50 -7.728 3.269 -7.850 393 H LEU 51 H LEU 51 -8.921 7.487 -0.119 394 HA LEU 51 HA LEU 51 -7.288 6.854 2.288 395 1HB LEU 51 1HB LEU 51 -7.842 9.134 0.745 396 2HB LEU 51 2HB LEU 51 -8.763 9.380 2.228 397 HG LEU 51 HG LEU 51 -6.750 9.023 3.575 398 1HD1 LEU 51 1HD1 LEU 51 -4.573 9.045 1.976 399 2HD1 LEU 51 2HD1 LEU 51 -5.685 8.151 0.939 400 3HD1 LEU 51 3HD1 LEU 51 -5.312 7.551 2.555 401 1HD2 LEU 51 1HD2 LEU 51 -5.304 10.906 2.339 402 2HD2 LEU 51 2HD2 LEU 51 -6.835 11.286 3.131 403 3HD2 LEU 51 3HD2 LEU 51 -6.781 11.052 1.383 404 H PHE 52 H PHE 52 -8.364 5.790 3.901 405 HA PHE 52 HA PHE 52 -11.310 6.007 4.159 406 1HB PHE 52 1HB PHE 52 -9.075 4.373 5.380 407 2HB PHE 52 2HB PHE 52 -10.687 4.357 6.095 408 HD1 PHE 52 HD1 PHE 52 -12.504 3.197 5.054 409 HD2 PHE 52 HD2 PHE 52 -8.755 3.638 3.004 410 HE1 PHE 52 HE1 PHE 52 -13.250 1.568 3.340 411 HE2 PHE 52 HE2 PHE 52 -9.501 2.009 1.290 412 HZ PHE 52 HZ PHE 52 -11.748 0.974 1.457 413 H SER 53 H SER 53 -11.810 8.006 5.100 414 HA SER 53 HA SER 53 -10.103 9.074 7.250 415 1HB SER 53 1HB SER 53 -11.008 10.452 5.385 416 2HB SER 53 2HB SER 53 -12.644 10.098 5.938 417 HG SER 53 HG SER 53 -12.146 11.118 7.895 418 H ARG 54 H ARG 54 -10.667 9.208 9.389 419 HA ARG 54 HA ARG 54 -13.331 8.088 10.191 420 1HB ARG 54 1HB ARG 54 -10.986 6.873 10.591 421 2HB ARG 54 2HB ARG 54 -10.901 7.990 11.954 422 1HG ARG 54 1HG ARG 54 -12.814 7.084 12.976 423 2HG ARG 54 2HG ARG 54 -13.390 6.362 11.473 424 1HD ARG 54 1HD ARG 54 -12.303 4.435 11.961 425 2HD ARG 54 2HD ARG 54 -10.769 5.312 12.123 426 HE ARG 54 HE ARG 54 -12.101 5.983 14.437 427 1HH1 ARG 54 1HH1 ARG 54 -11.416 2.954 12.863 428 2HH1 ARG 54 2HH1 ARG 54 -11.376 2.067 14.347 429 1HH2 ARG 54 1HH2 ARG 54 -12.044 4.809 16.349 430 2HH2 ARG 54 2HH2 ARG 54 -11.728 3.107 16.306 431 H LYS 55 H LYS 55 -13.627 8.824 12.691 432 HA LYS 55 HA LYS 55 -13.731 11.726 12.627 433 1HB LYS 55 1HB LYS 55 -14.912 9.497 13.997 434 2HB LYS 55 2HB LYS 55 -14.292 10.611 15.215 435 1HG LYS 55 1HG LYS 55 -16.093 11.387 12.900 436 2HG LYS 55 2HG LYS 55 -16.626 11.159 14.565 437 1HD LYS 55 1HD LYS 55 -14.404 12.894 14.701 438 2HD LYS 55 2HD LYS 55 -15.388 13.478 13.359 439 1HE LYS 55 1HE LYS 55 -17.248 13.886 14.734 440 2HE LYS 55 2HE LYS 55 -16.700 12.742 15.974 441 1HZ LYS 55 1HZ LYS 55 -14.776 14.199 16.361 442 2HZ LYS 55 2HZ LYS 55 -16.240 14.998 16.681 443 3HZ LYS 55 3HZ LYS 55 -15.396 15.316 15.243 444 H ASN 56 H ASN 56 -11.364 12.061 12.486 445 HA ASN 56 HA ASN 56 -9.675 11.381 14.777 446 1HB ASN 56 1HB ASN 56 -9.416 14.014 15.079 447 2HB ASN 56 2HB ASN 56 -11.050 14.023 14.418 448 1HD2 ASN 56 1HD2 ASN 56 -9.091 12.504 17.031 449 2HD2 ASN 56 2HD2 ASN 56 -10.393 12.311 18.101 450 H MET 57 H MET 57 -9.717 11.272 11.742 451 HA MET 57 HA MET 57 -7.868 13.220 10.691 452 1HB MET 57 1HB MET 57 -5.811 11.827 10.786 453 2HB MET 57 2HB MET 57 -6.405 12.173 12.406 454 1HG MET 57 1HG MET 57 -7.608 9.759 11.285 455 2HG MET 57 2HG MET 57 -5.850 9.652 11.365 456 1HE MET 57 1HE MET 57 -4.479 9.365 13.449 457 2HE MET 57 2HE MET 57 -4.919 10.109 14.986 458 3HE MET 57 3HE MET 57 -4.768 11.103 13.537 459 H SER 58 H SER 58 -6.386 11.607 8.943 460 HA SER 58 HA SER 58 -8.488 10.067 7.460 461 1HB SER 58 1HB SER 58 -6.319 11.800 6.244 462 2HB SER 58 2HB SER 58 -7.756 11.159 5.448 463 HG SER 58 HG SER 58 -7.522 13.247 7.310 464 H ALA 59 H ALA 59 -7.750 8.121 6.545 465 HA ALA 59 HA ALA 59 -4.825 7.521 6.858 466 1HB ALA 59 1HB ALA 59 -5.661 6.184 8.525 467 2HB ALA 59 2HB ALA 59 -6.086 5.112 7.188 468 3HB ALA 59 3HB ALA 59 -7.294 6.213 7.855 469 H MET 60 H MET 60 -4.322 5.406 5.546 470 HA MET 60 HA MET 60 -5.658 5.617 2.866 471 1HB MET 60 1HB MET 60 -3.239 6.318 3.101 472 2HB MET 60 2HB MET 60 -2.863 4.672 3.611 473 1HG MET 60 1HG MET 60 -2.405 4.970 1.208 474 2HG MET 60 2HG MET 60 -3.703 3.806 1.462 475 1HE MET 60 1HE MET 60 -3.569 5.256 -1.586 476 2HE MET 60 2HE MET 60 -2.387 6.037 -0.535 477 3HE MET 60 3HE MET 60 -3.608 7.006 -1.360 478 H ALA 61 H ALA 61 -5.614 3.472 1.643 479 HA ALA 61 HA ALA 61 -6.558 1.325 3.394 480 1HB ALA 61 1HB ALA 61 -6.268 0.432 0.725 481 2HB ALA 61 2HB ALA 61 -6.636 2.153 0.607 482 3HB ALA 61 3HB ALA 61 -7.734 1.072 1.466 483 H LEU 62 H LEU 62 -3.699 1.876 1.338 484 HA LEU 62 HA LEU 62 -2.120 0.047 2.946 485 1HB LEU 62 1HB LEU 62 -0.927 0.785 0.418 486 2HB LEU 62 2HB LEU 62 -1.770 2.174 1.104 487 HG LEU 62 HG LEU 62 -0.600 1.589 3.314 488 1HD1 LEU 62 1HD1 LEU 62 0.495 -0.388 3.292 489 2HD1 LEU 62 2HD1 LEU 62 1.724 0.425 2.324 490 3HD1 LEU 62 3HD1 LEU 62 0.437 -0.483 1.532 491 1HD2 LEU 62 1HD2 LEU 62 1.200 2.989 2.782 492 2HD2 LEU 62 2HD2 LEU 62 0.042 3.379 1.510 493 3HD2 LEU 62 3HD2 LEU 62 1.391 2.294 1.173 494 H GLY 63 H GLY 63 -2.944 -2.073 2.699 495 1HA GLY 63 1HA GLY 63 -1.943 -3.555 0.460 496 2HA GLY 63 2HA GLY 63 -3.019 -4.193 1.701 497 H PHE 64 H PHE 64 -4.753 -5.070 0.707 498 HA PHE 64 HA PHE 64 -5.727 -4.028 -1.866 499 1HB PHE 64 1HB PHE 64 -6.514 -6.295 -0.003 500 2HB PHE 64 2HB PHE 64 -7.275 -6.020 -1.569 501 HD1 PHE 64 HD1 PHE 64 -5.983 -6.277 -3.663 502 HD2 PHE 64 HD2 PHE 64 -4.254 -7.145 0.172 503 HE1 PHE 64 HE1 PHE 64 -4.126 -7.489 -4.774 504 HE2 PHE 64 HE2 PHE 64 -2.397 -8.356 -0.939 505 HZ PHE 64 HZ PHE 64 -2.333 -8.528 -3.412 506 H GLY 65 H GLY 65 -6.079 -2.081 0.162 507 1HA GLY 65 1HA GLY 65 -8.899 -2.280 1.035 508 2HA GLY 65 2HA GLY 65 -7.766 -1.005 1.486 509 H ALA 66 H ALA 66 -6.929 -0.716 -1.388 510 HA ALA 66 HA ALA 66 -9.075 1.166 -2.154 511 1HB ALA 66 1HB ALA 66 -6.450 0.563 -3.547 512 2HB ALA 66 2HB ALA 66 -6.533 1.575 -2.105 513 3HB ALA 66 3HB ALA 66 -7.368 2.068 -3.576 514 H ILE 67 H ILE 67 -7.544 -1.798 -3.369 515 HA ILE 67 HA ILE 67 -8.507 -1.993 -5.967 516 HB ILE 67 HB ILE 67 -8.570 -4.479 -5.456 517 1HG1 ILE 67 1HG1 ILE 67 -7.478 -4.699 -2.969 518 2HG1 ILE 67 2HG1 ILE 67 -8.613 -3.379 -2.708 519 1HG2 ILE 67 1HG2 ILE 67 -6.477 -3.354 -6.059 520 2HG2 ILE 67 2HG2 ILE 67 -6.187 -4.610 -4.852 521 3HG2 ILE 67 3HG2 ILE 67 -6.219 -2.914 -4.369 522 1HD1 ILE 67 1HD1 ILE 67 -9.759 -5.536 -4.311 523 2HD1 ILE 67 2HD1 ILE 67 -10.398 -4.752 -2.866 524 3HD1 ILE 67 3HD1 ILE 67 -9.244 -6.076 -2.713 525 H PHE 68 H PHE 68 -10.349 -2.568 -2.974 526 HA PHE 68 HA PHE 68 -12.662 -3.794 -3.882 527 1HB PHE 68 1HB PHE 68 -12.243 -1.493 -1.950 528 2HB PHE 68 2HB PHE 68 -13.765 -2.371 -2.077 529 HD1 PHE 68 HD1 PHE 68 -11.107 -2.139 -0.020 530 HD2 PHE 68 HD2 PHE 68 -13.081 -5.128 -2.388 531 HE1 PHE 68 HE1 PHE 68 -10.217 -3.910 1.471 532 HE2 PHE 68 HE2 PHE 68 -12.193 -6.900 -0.898 533 HZ PHE 68 HZ PHE 68 -10.762 -6.289 1.031 534 H ASN 69 H ASN 69 -14.230 -3.271 -5.352 535 HA ASN 69 HA ASN 69 -14.276 -0.476 -6.421 536 1HB ASN 69 1HB ASN 69 -15.141 -3.174 -7.525 537 2HB ASN 69 2HB ASN 69 -15.347 -1.648 -8.385 538 1HD2 ASN 69 1HD2 ASN 69 -13.181 -4.235 -7.896 539 2HD2 ASN 69 2HD2 ASN 69 -11.784 -3.497 -8.522 540 H HIS 70 H HIS 70 -16.655 -0.142 -7.463 541 HA HIS 70 HA HIS 70 -18.535 -0.331 -5.174 542 1HB HIS 70 1HB HIS 70 -18.041 1.793 -6.444 543 2HB HIS 70 2HB HIS 70 -18.758 1.051 -7.874 544 HD1 HIS 70 HD1 HIS 70 -19.665 2.224 -4.392 545 HD2 HIS 70 HD2 HIS 70 -21.568 1.026 -7.903 546 HE1 HIS 70 HE1 HIS 70 -22.128 2.725 -4.079 547 H SER 71 H SER 71 -20.064 -1.935 -5.150 548 HA SER 71 HA SER 71 -21.140 -2.941 -7.741 549 1HB SER 71 1HB SER 71 -20.130 -4.746 -5.519 550 2HB SER 71 2HB SER 71 -20.584 -5.214 -7.158 551 HG SER 71 HG SER 71 -18.385 -3.613 -6.368 552 H LYS 72 H LYS 72 -23.193 -4.072 -7.465 553 HA LYS 72 HA LYS 72 -24.711 -3.119 -5.107 554 1HB LYS 72 1HB LYS 72 -25.528 -4.529 -7.661 555 2HB LYS 72 2HB LYS 72 -26.625 -3.831 -6.483 556 1HG LYS 72 1HG LYS 72 -24.922 -1.735 -6.955 557 2HG LYS 72 2HG LYS 72 -24.977 -2.509 -8.541 558 1HD LYS 72 1HD LYS 72 -27.008 -1.606 -8.885 559 2HD LYS 72 2HD LYS 72 -27.607 -2.530 -7.505 560 1HE LYS 72 1HE LYS 72 -27.981 -0.500 -6.521 561 2HE LYS 72 2HE LYS 72 -26.220 -0.408 -6.327 562 1HZ LYS 72 1HZ LYS 72 -27.311 1.462 -7.629 563 2HZ LYS 72 2HZ LYS 72 -27.580 0.323 -8.859 564 3HZ LYS 72 3HZ LYS 72 -25.994 0.694 -8.377 565 H ASP 73 H ASP 73 -22.725 -5.448 -5.015 566 HA ASP 73 HA ASP 73 -24.476 -7.286 -3.520 567 1HB ASP 73 1HB ASP 73 -24.259 -7.745 -6.160 568 2HB ASP 73 2HB ASP 73 -22.773 -8.538 -5.639 569 HA PRO 74 HA PRO 74 -20.045 -6.629 -2.096 570 1HB PRO 74 1HB PRO 74 -20.857 -6.247 0.557 571 2HB PRO 74 2HB PRO 74 -20.483 -4.949 -0.590 572 1HG PRO 74 1HG PRO 74 -23.111 -6.034 0.261 573 2HG PRO 74 2HG PRO 74 -22.658 -4.381 -0.172 574 1HD PRO 74 1HD PRO 74 -24.064 -6.003 -1.823 575 2HD PRO 74 2HD PRO 74 -22.952 -4.754 -2.420 576 H ASN 75 H ASN 75 -19.306 -8.727 -2.075 577 HA ASN 75 HA ASN 75 -20.748 -10.820 -0.576 578 1HB ASN 75 1HB ASN 75 -18.434 -10.652 -2.510 579 2HB ASN 75 2HB ASN 75 -18.749 -12.144 -1.625 580 1HD2 ASN 75 1HD2 ASN 75 -19.773 -13.504 -3.120 581 2HD2 ASN 75 2HD2 ASN 75 -21.109 -13.059 -4.069 582 H ALA 76 H ALA 76 -18.039 -8.686 -0.156 583 HA ALA 76 HA ALA 76 -17.488 -9.926 2.476 584 1HB ALA 76 1HB ALA 76 -15.138 -9.339 0.725 585 2HB ALA 76 2HB ALA 76 -16.080 -10.782 0.351 586 3HB ALA 76 3HB ALA 76 -15.336 -10.602 1.940 587 H ARG 77 H ARG 77 -17.396 -8.258 3.900 588 HA ARG 77 HA ARG 77 -16.789 -5.519 2.924 589 1HB ARG 77 1HB ARG 77 -18.294 -6.835 5.068 590 2HB ARG 77 2HB ARG 77 -17.336 -5.485 5.666 591 1HG ARG 77 1HG ARG 77 -18.305 -4.077 3.814 592 2HG ARG 77 2HG ARG 77 -19.379 -5.422 3.428 593 1HD ARG 77 1HD ARG 77 -20.374 -5.326 5.660 594 2HD ARG 77 2HD ARG 77 -19.224 -4.066 6.147 595 HE ARG 77 HE ARG 77 -20.404 -3.101 3.806 596 1HH1 ARG 77 1HH1 ARG 77 -21.512 -4.162 6.931 597 2HH1 ARG 77 2HH1 ARG 77 -22.890 -3.118 6.919 598 1HH2 ARG 77 1HH2 ARG 77 -22.201 -1.754 3.815 599 2HH2 ARG 77 2HH2 ARG 77 -23.279 -1.765 5.170 600 H HIS 78 H HIS 78 -15.616 -4.318 5.040 601 HA HIS 78 HA HIS 78 -13.164 -5.935 5.641 602 1HB HIS 78 1HB HIS 78 -11.881 -3.857 5.201 603 2HB HIS 78 2HB HIS 78 -12.815 -4.330 3.782 604 HD1 HIS 78 HD1 HIS 78 -14.917 -2.892 3.196 605 HD2 HIS 78 HD2 HIS 78 -12.734 -1.452 6.442 606 HE1 HIS 78 HE1 HIS 78 -15.765 -0.548 3.646 607 H GLU 79 H GLU 79 -12.176 -5.440 7.672 608 HA GLU 79 HA GLU 79 -13.896 -3.796 9.508 609 1HB GLU 79 1HB GLU 79 -13.883 -6.252 9.914 610 2HB GLU 79 2HB GLU 79 -12.128 -6.208 10.062 611 1HG GLU 79 1HG GLU 79 -12.659 -6.000 12.292 612 2HG GLU 79 2HG GLU 79 -12.732 -4.294 11.847 613 H LEU 80 H LEU 80 -12.828 -2.263 10.795 614 HA LEU 80 HA LEU 80 -9.894 -1.966 10.294 615 1HB LEU 80 1HB LEU 80 -11.269 -0.190 9.355 616 2HB LEU 80 2HB LEU 80 -12.138 -0.001 10.878 617 HG LEU 80 HG LEU 80 -10.060 0.702 11.980 618 1HD1 LEU 80 1HD1 LEU 80 -8.069 0.183 11.060 619 2HD1 LEU 80 2HD1 LEU 80 -8.424 1.254 9.705 620 3HD1 LEU 80 3HD1 LEU 80 -8.890 -0.444 9.631 621 1HD2 LEU 80 1HD2 LEU 80 -11.529 2.386 10.871 622 2HD2 LEU 80 2HD2 LEU 80 -10.554 2.235 9.408 623 3HD2 LEU 80 3HD2 LEU 80 -9.837 2.882 10.884 624 H THR 81 H THR 81 -8.579 -2.082 12.081 625 HA THR 81 HA THR 81 -9.448 -2.944 14.624 626 HB THR 81 HB THR 81 -7.135 -2.022 15.283 627 HG1 THR 81 HG1 THR 81 -5.921 -1.319 13.453 628 1HG2 THR 81 1HG2 THR 81 -6.607 -3.516 12.817 629 2HG2 THR 81 2HG2 THR 81 -7.894 -4.230 13.788 630 3HG2 THR 81 3HG2 THR 81 -6.297 -3.972 14.492 631 H ALA 82 H ALA 82 -8.740 -1.454 16.659 632 HA ALA 82 HA ALA 82 -10.717 0.499 17.063 633 1HB ALA 82 1HB ALA 82 -8.343 -0.549 18.336 634 2HB ALA 82 2HB ALA 82 -9.757 0.184 19.093 635 3HB ALA 82 3HB ALA 82 -8.410 1.198 18.575 636 H GLY 83 H GLY 83 -7.667 0.776 15.380 637 1HA GLY 83 1HA GLY 83 -8.214 3.692 14.997 638 2HA GLY 83 2HA GLY 83 -6.574 3.073 15.189 639 H LEU 84 H LEU 84 -6.286 4.132 13.017 640 HA LEU 84 HA LEU 84 -7.455 2.566 10.758 641 1HB LEU 84 1HB LEU 84 -5.962 5.208 10.960 642 2HB LEU 84 2HB LEU 84 -6.571 4.528 9.452 643 HG LEU 84 HG LEU 84 -8.485 4.781 11.729 644 1HD1 LEU 84 1HD1 LEU 84 -8.311 7.169 10.010 645 2HD1 LEU 84 2HD1 LEU 84 -6.945 6.969 11.108 646 3HD1 LEU 84 3HD1 LEU 84 -8.587 7.052 11.748 647 1HD2 LEU 84 1HD2 LEU 84 -10.056 4.719 10.050 648 2HD2 LEU 84 2HD2 LEU 84 -8.740 3.917 9.194 649 3HD2 LEU 84 3HD2 LEU 84 -9.047 5.634 8.930 650 H LYS 85 H LYS 85 -5.419 1.293 12.322 651 HA LYS 85 HA LYS 85 -2.890 1.645 10.853 652 1HB LYS 85 1HB LYS 85 -3.865 0.571 13.366 653 2HB LYS 85 2HB LYS 85 -2.616 -0.435 12.646 654 1HG LYS 85 1HG LYS 85 -1.156 1.547 12.440 655 2HG LYS 85 2HG LYS 85 -2.420 2.555 13.144 656 1HD LYS 85 1HD LYS 85 -2.167 0.476 14.970 657 2HD LYS 85 2HD LYS 85 -0.504 0.784 14.469 658 1HE LYS 85 1HE LYS 85 -1.863 3.305 14.857 659 2HE LYS 85 2HE LYS 85 -2.030 2.301 16.311 660 1HZ LYS 85 1HZ LYS 85 0.365 1.814 16.152 661 2HZ LYS 85 2HZ LYS 85 0.070 3.472 16.375 662 3HZ LYS 85 3HZ LYS 85 0.492 2.884 14.839 663 H ARG 86 H ARG 86 -4.732 -1.275 11.806 664 HA ARG 86 HA ARG 86 -3.780 -2.579 9.293 665 1HB ARG 86 1HB ARG 86 -4.441 -3.364 12.085 666 2HB ARG 86 2HB ARG 86 -4.864 -4.543 10.844 667 1HG ARG 86 1HG ARG 86 -2.681 -4.996 10.352 668 2HG ARG 86 2HG ARG 86 -2.185 -3.315 10.554 669 1HD ARG 86 1HD ARG 86 -1.509 -3.704 12.687 670 2HD ARG 86 2HD ARG 86 -3.042 -4.503 13.087 671 HE ARG 86 HE ARG 86 -0.595 -5.836 12.200 672 1HH1 ARG 86 1HH1 ARG 86 -4.073 -5.963 12.293 673 2HH1 ARG 86 2HH1 ARG 86 -4.124 -7.685 12.135 674 1HH2 ARG 86 1HH2 ARG 86 -0.688 -8.072 11.995 675 2HH2 ARG 86 2HH2 ARG 86 -2.224 -8.871 11.968 676 H MET 87 H MET 87 -5.274 -3.598 7.894 677 HA MET 87 HA MET 87 -8.155 -2.905 8.364 678 1HB MET 87 1HB MET 87 -6.304 -2.474 6.200 679 2HB MET 87 2HB MET 87 -7.597 -3.532 5.635 680 1HG MET 87 1HG MET 87 -9.189 -1.836 6.797 681 2HG MET 87 2HG MET 87 -7.806 -0.744 6.764 682 1HE MET 87 1HE MET 87 -10.469 -2.729 4.482 683 2HE MET 87 2HE MET 87 -10.862 -1.171 3.753 684 3HE MET 87 3HE MET 87 -10.800 -1.332 5.509 685 H ARG 88 H ARG 88 -9.717 -4.527 7.645 686 HA ARG 88 HA ARG 88 -8.572 -7.294 7.427 687 1HB ARG 88 1HB ARG 88 -10.265 -6.021 9.397 688 2HB ARG 88 2HB ARG 88 -11.141 -7.343 8.623 689 1HG ARG 88 1HG ARG 88 -9.313 -8.890 9.129 690 2HG ARG 88 2HG ARG 88 -8.363 -7.575 9.821 691 1HD ARG 88 1HD ARG 88 -9.644 -7.491 11.751 692 2HD ARG 88 2HD ARG 88 -11.118 -8.021 10.915 693 HE ARG 88 HE ARG 88 -10.437 -10.268 11.261 694 1HH1 ARG 88 1HH1 ARG 88 -7.788 -8.069 11.777 695 2HH1 ARG 88 2HH1 ARG 88 -6.734 -9.306 12.368 696 1HH2 ARG 88 1HH2 ARG 88 -9.049 -11.855 12.031 697 2HH2 ARG 88 2HH2 ARG 88 -7.439 -11.433 12.512 698 H ILE 89 H ILE 89 -10.311 -8.853 6.594 699 HA ILE 89 HA ILE 89 -12.272 -7.572 4.752 700 HB ILE 89 HB ILE 89 -10.180 -9.623 3.931 701 1HG1 ILE 89 1HG1 ILE 89 -10.285 -6.611 3.561 702 2HG1 ILE 89 2HG1 ILE 89 -9.059 -7.531 4.425 703 1HG2 ILE 89 1HG2 ILE 89 -11.719 -7.897 2.030 704 2HG2 ILE 89 2HG2 ILE 89 -12.550 -9.269 2.764 705 3HG2 ILE 89 3HG2 ILE 89 -11.094 -9.533 1.804 706 1HD1 ILE 89 1HD1 ILE 89 -9.019 -6.810 1.695 707 2HD1 ILE 89 2HD1 ILE 89 -9.310 -8.548 1.729 708 3HD1 ILE 89 3HD1 ILE 89 -7.893 -7.876 2.535 709 H PHE 90 H PHE 90 -13.928 -8.518 6.064 710 HA PHE 90 HA PHE 90 -13.925 -11.477 6.393 711 1HB PHE 90 1HB PHE 90 -15.103 -9.079 7.668 712 2HB PHE 90 2HB PHE 90 -16.180 -10.472 7.608 713 HD1 PHE 90 HD1 PHE 90 -15.076 -12.771 8.310 714 HD2 PHE 90 HD2 PHE 90 -13.577 -8.902 9.418 715 HE1 PHE 90 HE1 PHE 90 -13.851 -13.790 10.211 716 HE2 PHE 90 HE2 PHE 90 -12.354 -9.920 11.321 717 HZ PHE 90 HZ PHE 90 -12.491 -12.364 11.717 718 H THR 91 H THR 91 -15.667 -12.756 5.572 719 HA THR 91 HA THR 91 -17.017 -11.637 3.194 720 HB THR 91 HB THR 91 -17.807 -14.137 3.175 721 HG1 THR 91 HG1 THR 91 -15.576 -14.532 4.819 722 1HG2 THR 91 1HG2 THR 91 -15.007 -13.098 2.804 723 2HG2 THR 91 2HG2 THR 91 -16.192 -13.554 1.580 724 3HG2 THR 91 3HG2 THR 91 -15.365 -14.801 2.514 725 H ILE 92 H ILE 92 -18.947 -10.577 3.556 726 HA ILE 92 HA ILE 92 -20.540 -11.031 5.948 727 HB ILE 92 HB ILE 92 -21.995 -9.339 4.884 728 1HG1 ILE 92 1HG1 ILE 92 -20.177 -9.305 2.492 729 2HG1 ILE 92 2HG1 ILE 92 -21.533 -10.431 2.537 730 1HG2 ILE 92 1HG2 ILE 92 -20.299 -8.154 5.880 731 2HG2 ILE 92 2HG2 ILE 92 -19.938 -7.739 4.204 732 3HG2 ILE 92 3HG2 ILE 92 -19.038 -9.025 5.008 733 1HD1 ILE 92 1HD1 ILE 92 -22.866 -8.741 1.869 734 2HD1 ILE 92 2HD1 ILE 92 -21.555 -7.576 2.048 735 3HD1 ILE 92 3HD1 ILE 92 -22.575 -7.974 3.430 736 H LYS 93 H LYS 93 -20.368 -12.581 2.883 737 HA LYS 93 HA LYS 93 -22.800 -14.149 3.546 738 1HB LYS 93 1HB LYS 93 -23.643 -13.781 1.227 739 2HB LYS 93 2HB LYS 93 -23.532 -12.268 2.126 740 1HG LYS 93 1HG LYS 93 -21.558 -11.613 0.994 741 2HG LYS 93 2HG LYS 93 -21.261 -13.244 0.394 742 1HD LYS 93 1HD LYS 93 -22.135 -11.937 -1.443 743 2HD LYS 93 2HD LYS 93 -23.401 -13.053 -0.933 744 1HE LYS 93 1HE LYS 93 -24.757 -11.356 -0.206 745 2HE LYS 93 2HE LYS 93 -23.398 -10.438 0.471 746 1HZ LYS 93 1HZ LYS 93 -22.750 -9.743 -1.694 747 2HZ LYS 93 2HZ LYS 93 -24.418 -9.445 -1.578 748 3HZ LYS 93 3HZ LYS 93 -23.854 -10.793 -2.445 749 HA PRO 94 HA PRO 94 -20.382 -17.523 2.134 750 1HB PRO 94 1HB PRO 94 -22.724 -18.535 0.608 751 2HB PRO 94 2HB PRO 94 -21.835 -19.301 1.937 752 1HG PRO 94 1HG PRO 94 -24.298 -18.275 2.253 753 2HG PRO 94 2HG PRO 94 -23.089 -18.262 3.545 754 1HD PRO 94 1HD PRO 94 -24.027 -16.036 1.806 755 2HD PRO 94 2HD PRO 94 -23.499 -16.005 3.501 756 H ILE 95 H ILE 95 -18.912 -17.424 0.481 757 HA ILE 95 HA ILE 95 -19.855 -16.456 -2.194 758 HB ILE 95 HB ILE 95 -17.125 -16.436 -0.852 759 1HG1 ILE 95 1HG1 ILE 95 -19.097 -14.205 -1.436 760 2HG1 ILE 95 2HG1 ILE 95 -18.740 -14.868 0.158 761 1HG2 ILE 95 1HG2 ILE 95 -16.372 -16.220 -2.977 762 2HG2 ILE 95 2HG2 ILE 95 -17.121 -14.624 -2.957 763 3HG2 ILE 95 3HG2 ILE 95 -18.002 -16.003 -3.615 764 1HD1 ILE 95 1HD1 ILE 95 -17.411 -12.881 -0.065 765 2HD1 ILE 95 2HD1 ILE 95 -16.865 -13.353 -1.674 766 3HD1 ILE 95 3HD1 ILE 95 -16.309 -14.243 -0.258 767 H ALA 96 H ALA 96 -19.279 -17.664 -4.039 768 HA ALA 96 HA ALA 96 -18.339 -20.444 -3.501 769 1HB ALA 96 1HB ALA 96 -19.259 -20.709 -5.886 770 2HB ALA 96 2HB ALA 96 -19.816 -19.042 -5.749 771 3HB ALA 96 3HB ALA 96 -20.443 -20.274 -4.653 772 H ILE 97 H ILE 97 -16.712 -21.372 -4.925 773 HA ILE 97 HA ILE 97 -14.422 -19.747 -5.371 774 HB ILE 97 HB ILE 97 -15.239 -22.359 -6.703 775 1HG1 ILE 97 1HG1 ILE 97 -13.507 -22.778 -4.498 776 2HG1 ILE 97 2HG1 ILE 97 -14.782 -21.702 -3.937 777 1HG2 ILE 97 1HG2 ILE 97 -12.446 -21.921 -5.909 778 2HG2 ILE 97 2HG2 ILE 97 -13.007 -20.794 -7.143 779 3HG2 ILE 97 3HG2 ILE 97 -13.097 -22.532 -7.430 780 1HD1 ILE 97 1HD1 ILE 97 -15.085 -24.367 -3.960 781 2HD1 ILE 97 2HD1 ILE 97 -15.602 -24.029 -5.612 782 3HD1 ILE 97 3HD1 ILE 97 -16.437 -23.274 -4.255 783 H GLY 98 H GLY 98 -14.399 -18.068 -6.820 784 1HA GLY 98 1HA GLY 98 -14.107 -17.595 -9.261 785 2HA GLY 98 2HA GLY 98 -15.543 -18.581 -9.537 786 H GLU 99 H GLU 99 -15.234 -16.304 -6.867 787 HA GLU 99 HA GLU 99 -17.409 -14.664 -8.128 788 1HB GLU 99 1HB GLU 99 -16.817 -15.732 -5.411 789 2HB GLU 99 2HB GLU 99 -17.507 -14.110 -5.466 790 1HG GLU 99 1HG GLU 99 -18.681 -16.522 -6.880 791 2HG GLU 99 2HG GLU 99 -19.247 -15.903 -5.330 792 H GLU 100 H GLU 100 -17.359 -12.317 -7.267 793 HA GLU 100 HA GLU 100 -14.517 -11.365 -7.224 794 1HB GLU 100 1HB GLU 100 -16.350 -10.812 -9.062 795 2HB GLU 100 2HB GLU 100 -16.911 -9.652 -7.858 796 1HG GLU 100 1HG GLU 100 -14.062 -9.455 -8.015 797 2HG GLU 100 2HG GLU 100 -14.701 -9.401 -9.657 798 H ILE 101 H ILE 101 -13.874 -10.034 -5.529 799 HA ILE 101 HA ILE 101 -15.892 -9.606 -3.367 800 HB ILE 101 HB ILE 101 -12.861 -9.668 -3.254 801 1HG1 ILE 101 1HG1 ILE 101 -14.895 -11.820 -2.618 802 2HG1 ILE 101 2HG1 ILE 101 -13.769 -11.831 -3.967 803 1HG2 ILE 101 1HG2 ILE 101 -13.048 -9.271 -1.032 804 2HG2 ILE 101 2HG2 ILE 101 -14.460 -10.316 -0.883 805 3HG2 ILE 101 3HG2 ILE 101 -14.650 -8.651 -1.432 806 1HD1 ILE 101 1HD1 ILE 101 -13.289 -12.859 -1.411 807 2HD1 ILE 101 2HD1 ILE 101 -12.390 -11.341 -1.456 808 3HD1 ILE 101 3HD1 ILE 101 -12.085 -12.585 -2.669 809 H THR 102 H THR 102 -16.567 -7.570 -3.101 810 HA THR 102 HA THR 102 -14.700 -5.286 -3.420 811 HB THR 102 HB THR 102 -16.384 -4.183 -4.925 812 HG1 THR 102 HG1 THR 102 -18.061 -5.416 -5.706 813 1HG2 THR 102 1HG2 THR 102 -15.769 -5.389 -6.912 814 2HG2 THR 102 2HG2 THR 102 -15.536 -6.883 -6.003 815 3HG2 THR 102 3HG2 THR 102 -14.418 -5.536 -5.787 816 H ILE 103 H ILE 103 -15.309 -3.553 -2.042 817 HA ILE 103 HA ILE 103 -17.723 -4.074 -0.342 818 HB ILE 103 HB ILE 103 -16.472 -2.855 1.385 819 1HG1 ILE 103 1HG1 ILE 103 -13.923 -2.600 0.078 820 2HG1 ILE 103 2HG1 ILE 103 -15.142 -1.743 -0.865 821 1HG2 ILE 103 1HG2 ILE 103 -15.697 -5.305 0.222 822 2HG2 ILE 103 2HG2 ILE 103 -15.344 -4.746 1.857 823 3HG2 ILE 103 3HG2 ILE 103 -14.197 -4.438 0.554 824 1HD1 ILE 103 1HD1 ILE 103 -14.062 -1.132 1.808 825 2HD1 ILE 103 2HD1 ILE 103 -15.820 -1.036 1.701 826 3HD1 ILE 103 3HD1 ILE 103 -14.817 -0.061 0.628 827 H SER 104 H SER 104 -18.696 -1.976 0.559 828 HA SER 104 HA SER 104 -19.069 -0.072 -1.693 829 1HB SER 104 1HB SER 104 -20.723 -1.340 0.149 830 2HB SER 104 2HB SER 104 -20.604 0.299 0.789 831 HG SER 104 HG SER 104 -22.263 0.269 -0.679 832 H TYR 105 H TYR 105 -19.754 2.242 -0.418 833 HA TYR 105 HA TYR 105 -17.293 2.973 1.145 834 1HB TYR 105 1HB TYR 105 -18.868 4.743 -0.757 835 2HB TYR 105 2HB TYR 105 -17.269 5.051 -0.086 836 HD1 TYR 105 HD1 TYR 105 -15.856 2.529 -0.442 837 HD2 TYR 105 HD2 TYR 105 -18.624 4.500 -3.071 838 HE1 TYR 105 HE1 TYR 105 -14.824 1.387 -2.387 839 HE2 TYR 105 HE2 TYR 105 -17.591 3.358 -5.014 840 HH TYR 105 HH TYR 105 -14.627 1.855 -4.896 841 H GLY 106 H GLY 106 -20.493 4.384 0.334 842 1HA GLY 106 1HA GLY 106 -22.171 5.224 1.747 843 2HA GLY 106 2HA GLY 106 -21.405 4.349 3.072 844 H ASP 107 H ASP 107 -22.099 6.479 4.155 845 HA ASP 107 HA ASP 107 -21.385 8.428 5.268 846 1HB ASP 107 1HB ASP 107 -19.213 6.923 5.075 847 2HB ASP 107 2HB ASP 107 -18.707 8.161 3.928 848 H ASP 108 H ASP 108 -19.501 8.565 2.212 849 HA ASP 108 HA ASP 108 -21.142 10.908 1.380 850 1HB ASP 108 1HB ASP 108 -18.499 10.903 2.534 851 2HB ASP 108 2HB ASP 108 -18.384 11.449 0.865 852 H TYR 109 H TYR 109 -18.575 8.582 0.529 853 HA TYR 109 HA TYR 109 -18.216 9.039 -2.178 854 1HB TYR 109 1HB TYR 109 -18.111 6.781 -0.297 855 2HB TYR 109 2HB TYR 109 -18.346 6.276 -1.970 856 HD1 TYR 109 HD1 TYR 109 -16.727 7.032 -3.738 857 HD2 TYR 109 HD2 TYR 109 -16.027 7.688 0.449 858 HE1 TYR 109 HE1 TYR 109 -14.329 7.461 -4.206 859 HE2 TYR 109 HE2 TYR 109 -13.629 8.116 -0.020 860 HH TYR 109 HH TYR 109 -11.991 7.843 -1.612 861 H TRP 110 H TRP 110 -19.884 9.542 -3.558 862 HA TRP 110 HA TRP 110 -21.855 9.294 -4.817 863 1HB TRP 110 1HB TRP 110 -21.059 6.441 -4.151 864 2HB TRP 110 2HB TRP 110 -22.284 6.851 -5.352 865 HD1 TRP 110 HD1 TRP 110 -18.680 8.080 -4.603 866 HE1 TRP 110 HE1 TRP 110 -17.419 8.255 -6.845 867 HE3 TRP 110 HE3 TRP 110 -22.363 6.580 -7.806 868 HZ2 TRP 110 HZ2 TRP 110 -17.908 7.817 -9.629 869 HZ3 TRP 110 HZ3 TRP 110 -21.938 6.467 -10.244 870 HH2 TRP 110 HH2 TRP 110 -19.719 7.084 -11.159 871 H LEU 111 H LEU 111 -22.787 6.361 -3.129 872 HA LEU 111 HA LEU 111 -25.187 7.770 -2.130 873 1HB LEU 111 1HB LEU 111 -24.356 5.087 -2.958 874 2HB LEU 111 2HB LEU 111 -25.299 5.056 -1.467 875 HG LEU 111 HG LEU 111 -26.352 6.864 -3.552 876 1HD1 LEU 111 1HD1 LEU 111 -25.487 4.306 -4.365 877 2HD1 LEU 111 2HD1 LEU 111 -26.566 5.391 -5.243 878 3HD1 LEU 111 3HD1 LEU 111 -27.233 4.174 -4.155 879 1HD2 LEU 111 1HD2 LEU 111 -27.353 4.894 -1.524 880 2HD2 LEU 111 2HD2 LEU 111 -28.418 5.373 -2.846 881 3HD2 LEU 111 3HD2 LEU 111 -27.784 6.591 -1.739 882 H SER 112 H SER 112 -25.926 6.586 0.106 883 HA SER 112 HA SER 112 -23.617 6.556 2.001 884 1HB SER 112 1HB SER 112 -25.514 8.658 1.581 885 2HB SER 112 2HB SER 112 -25.864 7.934 3.151 886 HG SER 112 HG SER 112 -24.084 8.730 3.903 887 H ARG 113 H ARG 113 -27.164 6.148 1.690 888 HA ARG 113 HA ARG 113 -26.932 3.676 3.341 889 1HB ARG 113 1HB ARG 113 -27.751 5.994 4.410 890 2HB ARG 113 2HB ARG 113 -29.280 5.505 3.680 891 1HG ARG 113 1HG ARG 113 -28.242 3.190 4.916 892 2HG ARG 113 2HG ARG 113 -28.009 4.498 6.075 893 1HD ARG 113 1HD ARG 113 -30.360 5.066 6.020 894 2HD ARG 113 2HD ARG 113 -30.644 3.966 4.658 895 HE ARG 113 HE ARG 113 -29.507 2.321 6.556 896 1HH1 ARG 113 1HH1 ARG 113 -32.165 4.569 6.594 897 2HH1 ARG 113 2HH1 ARG 113 -33.030 3.695 7.809 898 1HH2 ARG 113 1HH2 ARG 113 -30.651 1.204 8.133 899 2HH2 ARG 113 2HH2 ARG 113 -32.182 1.805 8.675 900 HA PRO 114 HA PRO 114 -29.552 3.451 -0.604 901 1HB PRO 114 1HB PRO 114 -28.113 1.315 -1.670 902 2HB PRO 114 2HB PRO 114 -27.864 3.014 -2.108 903 1HG PRO 114 1HG PRO 114 -26.320 1.284 -0.252 904 2HG PRO 114 2HG PRO 114 -25.757 2.564 -1.334 905 1HD PRO 114 1HD PRO 114 -26.008 2.895 1.347 906 2HD PRO 114 2HD PRO 114 -26.214 4.223 0.187 907 H ARG 115 H ARG 115 -28.240 1.198 1.738 908 HA ARG 115 HA ARG 115 -29.168 -0.747 2.710 909 1HB ARG 115 1HB ARG 115 -31.400 1.096 1.933 910 2HB ARG 115 2HB ARG 115 -31.833 -0.518 2.494 911 1HG ARG 115 1HG ARG 115 -30.013 1.388 3.996 912 2HG ARG 115 2HG ARG 115 -31.727 1.164 4.346 913 1HD ARG 115 1HD ARG 115 -30.691 -1.442 4.266 914 2HD ARG 115 2HD ARG 115 -29.469 -0.497 5.138 915 HE ARG 115 HE ARG 115 -32.120 0.236 6.008 916 1HH1 ARG 115 1HH1 ARG 115 -29.712 -2.265 6.265 917 2HH1 ARG 115 2HH1 ARG 115 -30.258 -2.781 7.823 918 1HH2 ARG 115 1HH2 ARG 115 -32.809 -0.452 8.029 919 2HH2 ARG 115 2HH2 ARG 115 -31.997 -1.764 8.816 920 H LEU 116 H LEU 116 -28.209 -2.009 0.852 921 HA LEU 116 HA LEU 116 -29.990 -2.733 -1.371 922 1HB LEU 116 1HB LEU 116 -27.238 -2.686 -0.805 923 2HB LEU 116 2HB LEU 116 -27.633 -4.400 -0.932 924 HG LEU 116 HG LEU 116 -28.787 -2.587 -2.998 925 1HD1 LEU 116 1HD1 LEU 116 -26.668 -1.675 -3.238 926 2HD1 LEU 116 2HD1 LEU 116 -26.503 -3.110 -4.250 927 3HD1 LEU 116 3HD1 LEU 116 -25.865 -3.112 -2.605 928 1HD2 LEU 116 1HD2 LEU 116 -29.280 -4.650 -3.766 929 2HD2 LEU 116 2HD2 LEU 116 -28.229 -5.404 -2.568 930 3HD2 LEU 116 3HD2 LEU 116 -27.562 -4.856 -4.106 931 H THR 117 H THR 117 -30.331 -5.150 -1.796 932 HA THR 117 HA THR 117 -31.343 -7.173 -1.121 933 HB THR 117 HB THR 117 -29.351 -6.659 1.120 934 HG1 THR 117 HG1 THR 117 -28.515 -6.778 -1.018 935 1HG2 THR 117 1HG2 THR 117 -31.027 -9.044 0.386 936 2HG2 THR 117 2HG2 THR 117 -30.692 -8.372 1.982 937 3HG2 THR 117 3HG2 THR 117 -29.442 -9.276 1.125 938 H GLN 118 H GLN 118 -32.337 -4.444 0.024 939 HA GLN 118 HA GLN 118 -34.479 -5.537 1.625 940 1HB GLN 118 1HB GLN 118 -32.450 -5.679 3.141 941 2HB GLN 118 2HB GLN 118 -32.357 -3.921 3.080 942 1HG GLN 118 1HG GLN 118 -33.600 -4.388 5.047 943 2HG GLN 118 2HG GLN 118 -34.816 -3.941 3.850 944 1HE2 GLN 118 1HE2 GLN 118 -34.066 -6.294 6.146 945 2HE2 GLN 118 2HE2 GLN 118 -35.031 -7.557 5.549 946 H ASN 119 H ASN 119 -36.074 -3.925 2.067 947 HA ASN 119 HA ASN 119 -37.242 -1.920 1.617 948 1HB ASN 119 1HB ASN 119 -35.276 -1.377 3.256 949 2HB ASN 119 2HB ASN 119 -34.531 -0.606 1.856 950 1HD2 ASN 119 1HD2 ASN 119 -37.609 -0.600 3.733 951 2HD2 ASN 119 2HD2 ASN 119 -37.958 1.035 3.442 952 1H GLY 201 1H GLY 201 -25.629 36.090 -12.718 953 2H GLY 201 2H GLY 201 -25.551 36.213 -14.410 954 3H GLY 201 3H GLY 201 -24.167 35.778 -13.525 955 1HA GLY 201 1HA GLY 201 -26.580 34.112 -13.328 956 2HA GLY 201 2HA GLY 201 -25.532 33.958 -14.738 957 H LYS 202 H LYS 202 -24.438 34.800 -11.482 958 HA LYS 202 HA LYS 202 -22.910 32.217 -11.436 959 1HB LYS 202 1HB LYS 202 -22.297 35.072 -10.876 960 2HB LYS 202 2HB LYS 202 -21.585 33.911 -9.754 961 1HG LYS 202 1HG LYS 202 -20.399 32.803 -11.475 962 2HG LYS 202 2HG LYS 202 -21.397 33.519 -12.741 963 1HD LYS 202 1HD LYS 202 -19.643 35.187 -10.926 964 2HD LYS 202 2HD LYS 202 -19.059 34.522 -12.452 965 1HE LYS 202 1HE LYS 202 -21.151 35.633 -13.513 966 2HE LYS 202 2HE LYS 202 -21.241 36.568 -12.008 967 1HZ LYS 202 1HZ LYS 202 -18.813 37.034 -12.334 968 2HZ LYS 202 2HZ LYS 202 -19.830 37.765 -13.481 969 3HZ LYS 202 3HZ LYS 202 -18.950 36.372 -13.892 970 H ALA 203 H ALA 203 -24.971 34.425 -9.629 971 HA ALA 203 HA ALA 203 -26.021 34.194 -7.526 972 1HB ALA 203 1HB ALA 203 -26.907 31.983 -7.202 973 2HB ALA 203 2HB ALA 203 -25.550 31.244 -8.051 974 3HB ALA 203 3HB ALA 203 -26.747 32.180 -8.947 975 HA PRO 204 HA PRO 204 -21.750 33.281 -5.700 976 1HB PRO 204 1HB PRO 204 -22.170 35.993 -4.561 977 2HB PRO 204 2HB PRO 204 -20.739 35.325 -5.366 978 1HG PRO 204 1HG PRO 204 -22.342 37.142 -6.533 979 2HG PRO 204 2HG PRO 204 -21.489 35.893 -7.450 980 1HD PRO 204 1HD PRO 204 -24.365 36.068 -6.711 981 2HD PRO 204 2HD PRO 204 -23.605 35.381 -8.162 982 H ARG 205 H ARG 205 -24.618 34.934 -4.376 983 HA ARG 205 HA ARG 205 -24.256 34.480 -1.628 984 1HB ARG 205 1HB ARG 205 -26.468 34.891 -3.547 985 2HB ARG 205 2HB ARG 205 -26.955 34.112 -2.042 986 1HG ARG 205 1HG ARG 205 -25.656 35.960 -0.836 987 2HG ARG 205 2HG ARG 205 -25.586 36.787 -2.393 988 1HD ARG 205 1HD ARG 205 -28.287 35.836 -1.766 989 2HD ARG 205 2HD ARG 205 -27.673 36.993 -0.570 990 HE ARG 205 HE ARG 205 -26.955 37.967 -3.134 991 1HH1 ARG 205 1HH1 ARG 205 -29.824 37.323 -1.270 992 2HH1 ARG 205 2HH1 ARG 205 -30.743 38.561 -2.053 993 1HH2 ARG 205 1HH2 ARG 205 -28.169 39.567 -4.136 994 2HH2 ARG 205 2HH2 ARG 205 -29.816 39.823 -3.663 995 H LYS 206 H LYS 206 -26.471 32.436 -3.553 996 HA LYS 206 HA LYS 206 -26.268 30.226 -1.695 997 1HB LYS 206 1HB LYS 206 -27.978 31.087 -3.666 998 2HB LYS 206 2HB LYS 206 -27.183 29.733 -4.469 999 1HG LYS 206 1HG LYS 206 -27.650 28.499 -2.183 1000 2HG LYS 206 2HG LYS 206 -28.892 29.738 -2.001 1001 1HD LYS 206 1HD LYS 206 -28.610 27.979 -4.454 1002 2HD LYS 206 2HD LYS 206 -29.709 27.632 -3.120 1003 1HE LYS 206 1HE LYS 206 -30.160 30.344 -3.810 1004 2HE LYS 206 2HE LYS 206 -30.098 29.443 -5.337 1005 1HZ LYS 206 1HZ LYS 206 -31.627 28.587 -2.931 1006 2HZ LYS 206 2HZ LYS 206 -31.640 27.844 -4.458 1007 3HZ LYS 206 3HZ LYS 206 -32.317 29.388 -4.260 1008 H GLN 207 H GLN 207 -26.097 28.072 -3.613 1009 HA GLN 207 HA GLN 207 -24.504 26.669 -4.640 1010 1HB GLN 207 1HB GLN 207 -24.149 29.326 -5.618 1011 2HB GLN 207 2HB GLN 207 -22.541 28.646 -5.368 1012 1HG GLN 207 1HG GLN 207 -22.837 27.633 -7.373 1013 2HG GLN 207 2HG GLN 207 -23.928 26.543 -6.518 1014 1HE2 GLN 207 1HE2 GLN 207 -24.345 27.204 -9.280 1015 2HE2 GLN 207 2HE2 GLN 207 -25.769 28.120 -9.400 1016 H LEU 208 H LEU 208 -22.292 29.241 -3.527 1017 HA LEU 208 HA LEU 208 -20.435 29.110 -2.074 1018 1HB LEU 208 1HB LEU 208 -22.543 27.328 -0.820 1019 2HB LEU 208 2HB LEU 208 -21.019 27.681 -0.007 1020 HG LEU 208 HG LEU 208 -22.700 29.925 -1.099 1021 1HD1 LEU 208 1HD1 LEU 208 -24.365 29.078 0.254 1022 2HD1 LEU 208 2HD1 LEU 208 -23.441 29.956 1.473 1023 3HD1 LEU 208 3HD1 LEU 208 -23.228 28.215 1.290 1024 1HD2 LEU 208 1HD2 LEU 208 -20.332 29.570 0.582 1025 2HD2 LEU 208 2HD2 LEU 208 -21.539 30.615 1.332 1026 3HD2 LEU 208 3HD2 LEU 208 -20.899 31.010 -0.264 1027 H ALA 209 H ALA 209 -19.028 27.266 -0.867 1028 HA ALA 209 HA ALA 209 -18.280 25.368 -3.002 1029 1HB ALA 209 1HB ALA 209 -16.959 25.548 -0.311 1030 2HB ALA 209 2HB ALA 209 -16.845 26.937 -1.393 1031 3HB ALA 209 3HB ALA 209 -16.221 25.368 -1.903 1032 H THR 210 H THR 210 -17.768 23.074 -2.343 1033 HA THR 210 HA THR 210 -18.987 21.943 0.043 1034 HB THR 210 HB THR 210 -20.996 22.519 -1.253 1035 HG1 THR 210 HG1 THR 210 -21.084 20.563 -0.162 1036 1HG2 THR 210 1HG2 THR 210 -21.239 21.202 -3.490 1037 2HG2 THR 210 2HG2 THR 210 -19.479 21.106 -3.439 1038 3HG2 THR 210 3HG2 THR 210 -20.275 22.679 -3.486 1039 H LYS 211 H LYS 211 -18.701 19.569 0.081 1040 HA LYS 211 HA LYS 211 -17.363 18.221 -2.137 1041 1HB LYS 211 1HB LYS 211 -15.195 17.999 -0.917 1042 2HB LYS 211 2HB LYS 211 -15.574 19.685 -1.273 1043 1HG LYS 211 1HG LYS 211 -16.727 19.619 1.096 1044 2HG LYS 211 2HG LYS 211 -15.665 18.235 1.356 1045 1HD LYS 211 1HD LYS 211 -14.405 20.098 2.112 1046 2HD LYS 211 2HD LYS 211 -13.769 19.761 0.502 1047 1HE LYS 211 1HE LYS 211 -16.025 21.524 0.234 1048 2HE LYS 211 2HE LYS 211 -14.907 22.201 1.433 1049 1HZ LYS 211 1HZ LYS 211 -13.109 22.007 -0.063 1050 2HZ LYS 211 2HZ LYS 211 -14.368 22.691 -0.975 1051 3HZ LYS 211 3HZ LYS 211 -13.995 21.043 -1.143 1052 H ALA 212 H ALA 212 -17.927 16.097 -1.927 1053 HA ALA 212 HA ALA 212 -18.277 14.978 0.831 1054 1HB ALA 212 1HB ALA 212 -20.047 14.141 -1.444 1055 2HB ALA 212 2HB ALA 212 -20.352 15.707 -0.691 1056 3HB ALA 212 3HB ALA 212 -20.417 14.235 0.277 1057 H ALA 213 H ALA 213 -16.661 13.448 0.945 1058 HA ALA 213 HA ALA 213 -16.625 11.260 -1.018 1059 1HB ALA 213 1HB ALA 213 -14.356 11.713 -1.777 1060 2HB ALA 213 2HB ALA 213 -14.194 13.044 -0.631 1061 3HB ALA 213 3HB ALA 213 -15.300 13.187 -1.996 1062 H ARG 214 H ARG 214 -13.808 10.614 -0.227 1063 HA ARG 214 HA ARG 214 -12.681 9.425 1.462 1064 1HB ARG 214 1HB ARG 214 -14.465 11.044 3.316 1065 2HB ARG 214 2HB ARG 214 -12.894 10.344 3.697 1066 1HG ARG 214 1HG ARG 214 -12.617 11.981 1.358 1067 2HG ARG 214 2HG ARG 214 -13.438 12.918 2.607 1068 1HD ARG 214 1HD ARG 214 -11.613 12.127 4.220 1069 2HD ARG 214 2HD ARG 214 -10.740 11.545 2.789 1070 HE ARG 214 HE ARG 214 -11.155 14.346 3.522 1071 1HH1 ARG 214 1HH1 ARG 214 -10.672 12.093 0.912 1072 2HH1 ARG 214 2HH1 ARG 214 -10.018 13.293 -0.149 1073 1HH2 ARG 214 1HH2 ARG 214 -10.303 15.885 2.127 1074 2HH2 ARG 214 2HH2 ARG 214 -9.809 15.424 0.532 1075 1HN MLZ 215 1HN MLZ 215 -13.077 7.317 1.936 1076 HA MLZ 215 HA MLZ 215 -15.761 6.237 1.993 1077 1HB MLZ 215 1HB MLZ 215 -12.935 5.301 2.312 1078 2HB MLZ 215 2HB MLZ 215 -14.215 4.221 2.865 1079 1HG MLZ 215 1HG MLZ 215 -14.768 5.429 0.247 1080 2HG MLZ 215 2HG MLZ 215 -14.869 3.742 0.747 1081 1HD MLZ 215 1HD MLZ 215 -12.202 5.088 0.320 1082 2HD MLZ 215 2HD MLZ 215 -12.570 3.364 0.339 1083 1HE MLZ 215 1HE MLZ 215 -12.622 5.204 -1.907 1084 2HE MLZ 215 2HE MLZ 215 -14.203 4.426 -1.695 1085 HZ MLZ 215 HZ MLZ 215 -13.232 2.305 -1.727 1086 1HCM MLZ 215 1HCM MLZ 215 -13.199 3.728 -3.878 1087 2HCM MLZ 215 2HCM MLZ 215 -12.410 2.155 -3.855 1088 3HCM MLZ 215 3HCM MLZ 215 -11.455 3.622 -3.668 1089 H SER 216 H SER 216 -17.066 5.847 3.750 1090 HA SER 216 HA SER 216 -17.822 5.875 5.985 1091 1HB SER 216 1HB SER 216 -15.330 7.418 6.689 1092 2HB SER 216 2HB SER 216 -16.542 8.157 5.642 1093 HG SER 216 HG SER 216 -16.621 7.616 8.329 1094 H ALA 217 H ALA 217 -17.518 4.601 7.848 1095 HA ALA 217 HA ALA 217 -15.236 2.722 7.741 1096 1HB ALA 217 1HB ALA 217 -14.435 4.701 9.009 1097 2HB ALA 217 2HB ALA 217 -14.577 3.297 10.066 1098 3HB ALA 217 3HB ALA 217 -15.812 4.556 10.100 1099 HA PRO 218 HA PRO 218 -18.371 0.004 9.210 1100 1HB PRO 218 1HB PRO 218 -16.789 -1.765 10.666 1101 2HB PRO 218 2HB PRO 218 -17.008 -1.828 8.908 1102 1HG PRO 218 1HG PRO 218 -14.757 -0.728 10.505 1103 2HG PRO 218 2HG PRO 218 -14.734 -1.563 8.945 1104 1HD PRO 218 1HD PRO 218 -14.442 1.126 9.198 1105 2HD PRO 218 2HD PRO 218 -15.166 0.360 7.768 1106 H ALA 219 H ALA 219 -19.078 -1.031 11.425 1107 HA ALA 219 HA ALA 219 -19.564 0.975 13.335 1108 1HB ALA 219 1HB ALA 219 -20.537 -0.786 14.541 1109 2HB ALA 219 2HB ALA 219 -19.247 -1.914 14.122 1110 3HB ALA 219 3HB ALA 219 -20.467 -1.482 12.923 1111 H THR 220 H THR 220 -17.322 -1.776 13.864 1112 HA THR 220 HA THR 220 -15.385 -1.912 15.210 1113 HB THR 220 HB THR 220 -15.268 0.956 14.204 1114 HG1 THR 220 HG1 THR 220 -14.444 0.117 12.433 1115 1HG2 THR 220 1HG2 THR 220 -12.684 0.072 14.421 1116 2HG2 THR 220 2HG2 THR 220 -13.434 -0.701 15.818 1117 3HG2 THR 220 3HG2 THR 220 -13.502 1.052 15.638 1118 H GLY 221 H GLY 221 -17.298 -1.808 16.974 1119 1HA GLY 221 1HA GLY 221 -16.308 -0.023 19.073 1120 2HA GLY 221 2HA GLY 221 -17.957 0.330 18.557 1121 1H MET 1 1H MET 1 -1.083 -10.683 4.847 1122 2H MET 1 2H MET 1 -0.850 -12.286 5.355 1123 3H MET 1 3H MET 1 0.041 -11.673 4.046 1124 HA MET 1 HA MET 1 1.038 -10.008 5.627 1125 1HB MET 1 1HB MET 1 -0.766 -11.698 7.320 1126 2HB MET 1 2HB MET 1 0.738 -11.133 8.046 1127 1HG MET 1 1HG MET 1 -0.744 -9.073 6.537 1128 2HG MET 1 2HG MET 1 -1.579 -9.672 7.970 1129 1HE MET 1 1HE MET 1 0.663 -7.145 6.619 1130 2HE MET 1 2HE MET 1 0.881 -6.243 8.119 1131 3HE MET 1 3HE MET 1 -0.737 -6.720 7.605 1132 H PHE 2 H PHE 2 0.614 -13.534 5.711 1133 HA PHE 2 HA PHE 2 3.599 -13.791 5.847 1134 1HB PHE 2 1HB PHE 2 3.164 -15.848 7.184 1135 2HB PHE 2 2HB PHE 2 2.480 -14.419 7.958 1136 HD1 PHE 2 HD1 PHE 2 1.758 -17.595 6.301 1137 HD2 PHE 2 HD2 PHE 2 0.036 -13.982 7.861 1138 HE1 PHE 2 HE1 PHE 2 -0.486 -18.650 6.266 1139 HE2 PHE 2 HE2 PHE 2 -2.208 -15.037 7.826 1140 HZ PHE 2 HZ PHE 2 -2.469 -17.371 7.029 1141 H ASN 3 H ASN 3 4.383 -14.749 4.031 1142 HA ASN 3 HA ASN 3 2.611 -16.669 2.554 1143 1HB ASN 3 1HB ASN 3 4.592 -14.623 1.486 1144 2HB ASN 3 2HB ASN 3 3.622 -15.714 0.498 1145 1HD2 ASN 3 1HD2 ASN 3 1.100 -15.575 1.410 1146 2HD2 ASN 3 2HD2 ASN 3 0.518 -13.982 1.476 1147 H ASP 4 H ASP 4 3.689 -18.498 1.679 1148 HA ASP 4 HA ASP 4 5.772 -19.715 3.042 1149 1HB ASP 4 1HB ASP 4 4.186 -20.560 1.198 1150 2HB ASP 4 2HB ASP 4 5.367 -19.936 0.046 1151 H ARG 5 H ARG 5 6.137 -17.774 0.047 1152 HA ARG 5 HA ARG 5 8.962 -17.977 -0.178 1153 1HB ARG 5 1HB ARG 5 6.925 -15.870 -0.953 1154 2HB ARG 5 2HB ARG 5 8.611 -15.797 -1.467 1155 1HG ARG 5 1HG ARG 5 7.073 -18.337 -1.883 1156 2HG ARG 5 2HG ARG 5 6.811 -16.991 -2.992 1157 1HD ARG 5 1HD ARG 5 9.151 -16.946 -3.604 1158 2HD ARG 5 2HD ARG 5 9.558 -18.101 -2.320 1159 HE ARG 5 HE ARG 5 8.719 -19.833 -3.698 1160 1HH1 ARG 5 1HH1 ARG 5 7.592 -16.725 -4.791 1161 2HH1 ARG 5 2HH1 ARG 5 6.849 -17.373 -6.212 1162 1HH2 ARG 5 1HH2 ARG 5 7.746 -20.648 -5.549 1163 2HH2 ARG 5 2HH2 ARG 5 6.933 -19.576 -6.640 1164 H VAL 6 H VAL 6 6.970 -15.508 1.481 1165 HA VAL 6 HA VAL 6 9.214 -14.962 3.332 1166 HB VAL 6 HB VAL 6 9.131 -12.523 2.715 1167 1HG1 VAL 6 1HG1 VAL 6 10.520 -12.733 0.799 1168 2HG1 VAL 6 2HG1 VAL 6 9.686 -14.190 0.257 1169 3HG1 VAL 6 3HG1 VAL 6 10.732 -14.249 1.675 1170 1HG2 VAL 6 1HG2 VAL 6 7.958 -11.830 0.713 1171 2HG2 VAL 6 2HG2 VAL 6 6.805 -12.660 1.758 1172 3HG2 VAL 6 3HG2 VAL 6 7.487 -13.493 0.361 1173 H ILE 7 H ILE 7 8.492 -13.839 5.231 1174 HA ILE 7 HA ILE 7 5.509 -13.605 5.474 1175 HB ILE 7 HB ILE 7 6.484 -15.450 6.766 1176 1HG1 ILE 7 1HG1 ILE 7 6.017 -13.191 8.718 1177 2HG1 ILE 7 2HG1 ILE 7 4.704 -13.899 7.779 1178 1HG2 ILE 7 1HG2 ILE 7 8.162 -14.827 8.585 1179 2HG2 ILE 7 2HG2 ILE 7 8.351 -13.284 7.753 1180 3HG2 ILE 7 3HG2 ILE 7 8.777 -14.785 6.933 1181 1HD1 ILE 7 1HD1 ILE 7 4.662 -15.168 9.756 1182 2HD1 ILE 7 2HD1 ILE 7 6.420 -15.184 9.893 1183 3HD1 ILE 7 3HD1 ILE 7 5.622 -16.175 8.673 1184 H VAL 8 H VAL 8 4.862 -11.949 7.187 1185 HA VAL 8 HA VAL 8 6.448 -9.489 6.790 1186 HB VAL 8 HB VAL 8 3.992 -9.518 6.521 1187 1HG1 VAL 8 1HG1 VAL 8 4.110 -11.174 8.800 1188 2HG1 VAL 8 2HG1 VAL 8 2.659 -10.632 7.958 1189 3HG1 VAL 8 3HG1 VAL 8 3.284 -9.707 9.323 1190 1HG2 VAL 8 1HG2 VAL 8 4.410 -7.364 7.149 1191 2HG2 VAL 8 2HG2 VAL 8 5.380 -7.854 8.539 1192 3HG2 VAL 8 3HG2 VAL 8 3.620 -7.842 8.651 1193 H LYS 9 H LYS 9 7.845 -8.730 8.289 1194 HA LYS 9 HA LYS 9 7.447 -9.396 11.151 1195 1HB LYS 9 1HB LYS 9 9.705 -10.160 9.337 1196 2HB LYS 9 2HB LYS 9 10.048 -9.862 11.044 1197 1HG LYS 9 1HG LYS 9 7.837 -11.396 11.291 1198 2HG LYS 9 2HG LYS 9 8.463 -12.038 9.774 1199 1HD LYS 9 1HD LYS 9 10.461 -12.754 10.767 1200 2HD LYS 9 2HD LYS 9 10.284 -11.671 12.138 1201 1HE LYS 9 1HE LYS 9 8.017 -13.191 12.361 1202 2HE LYS 9 2HE LYS 9 9.172 -14.372 11.719 1203 1HZ LYS 9 1HZ LYS 9 10.781 -13.443 13.405 1204 2HZ LYS 9 2HZ LYS 9 9.495 -14.346 14.048 1205 3HZ LYS 9 3HZ LYS 9 9.460 -12.650 14.121 1206 H LYS 10 H LYS 10 8.848 -6.134 11.776 1207 HA LYS 10 HA LYS 10 8.109 -7.043 13.784 1208 1HB LYS 10 1HB LYS 10 6.259 -7.728 11.691 1209 2HB LYS 10 2HB LYS 10 6.319 -9.047 12.861 1210 1HG LYS 10 1HG LYS 10 5.535 -7.728 14.595 1211 2HG LYS 10 2HG LYS 10 6.193 -6.245 13.901 1212 1HD LYS 10 1HD LYS 10 3.733 -6.266 13.738 1213 2HD LYS 10 2HD LYS 10 4.464 -6.314 12.133 1214 1HE LYS 10 1HE LYS 10 2.812 -8.011 12.023 1215 2HE LYS 10 2HE LYS 10 4.281 -8.923 12.418 1216 1HZ LYS 10 1HZ LYS 10 3.736 -8.657 14.778 1217 2HZ LYS 10 2HZ LYS 10 2.503 -9.486 13.956 1218 3HZ LYS 10 3HZ LYS 10 2.300 -7.850 14.366 1219 H SER 11 H SER 11 10.362 -7.923 13.804 1220 HA SER 11 HA SER 11 10.316 -10.913 13.891 1221 1HB SER 11 1HB SER 11 12.051 -10.929 12.391 1222 2HB SER 11 2HB SER 11 11.610 -9.259 12.061 1223 HG SER 11 HG SER 11 13.601 -8.947 12.679 1224 HA PRO 12 HA PRO 12 12.242 -10.695 17.830 1225 1HB PRO 12 1HB PRO 12 14.634 -12.086 17.562 1226 2HB PRO 12 2HB PRO 12 13.049 -12.853 17.763 1227 1HG PRO 12 1HG PRO 12 14.664 -12.444 15.305 1228 2HG PRO 12 2HG PRO 12 13.608 -13.791 15.752 1229 1HD PRO 12 1HD PRO 12 12.907 -11.858 13.969 1230 2HD PRO 12 2HD PRO 12 11.731 -12.743 14.961 1231 H LEU 13 H LEU 13 14.531 -10.032 15.190 1232 HA LEU 13 HA LEU 13 16.437 -8.549 16.756 1233 1HB LEU 13 1HB LEU 13 15.871 -9.280 14.001 1234 2HB LEU 13 2HB LEU 13 16.410 -7.604 14.091 1235 HG LEU 13 HG LEU 13 18.332 -9.131 13.840 1236 1HD1 LEU 13 1HD1 LEU 13 19.531 -7.748 15.157 1237 2HD1 LEU 13 2HD1 LEU 13 18.821 -8.435 16.618 1238 3HD1 LEU 13 3HD1 LEU 13 18.000 -7.123 15.772 1239 1HD2 LEU 13 1HD2 LEU 13 18.419 -11.095 14.941 1240 2HD2 LEU 13 2HD2 LEU 13 16.826 -10.737 15.608 1241 3HD2 LEU 13 3HD2 LEU 13 18.278 -10.275 16.496 1242 H GLY 14 H GLY 14 13.444 -7.656 15.093 1243 1HA GLY 14 1HA GLY 14 12.135 -5.742 15.866 1244 2HA GLY 14 2HA GLY 14 13.638 -4.972 16.374 1245 H GLY 15 H GLY 15 11.296 -4.753 14.100 1246 1HA GLY 15 1HA GLY 15 12.106 -2.790 12.502 1247 2HA GLY 15 2HA GLY 15 13.108 -4.085 11.846 1248 H TYR 16 H TYR 16 10.529 -2.485 10.970 1249 HA TYR 16 HA TYR 16 8.673 -4.729 10.458 1250 1HB TYR 16 1HB TYR 16 8.712 -1.760 10.335 1251 2HB TYR 16 2HB TYR 16 7.662 -2.558 9.164 1252 HD1 TYR 16 HD1 TYR 16 8.291 -1.926 12.729 1253 HD2 TYR 16 HD2 TYR 16 5.780 -3.953 9.894 1254 HE1 TYR 16 HE1 TYR 16 6.612 -2.335 14.508 1255 HE2 TYR 16 HE2 TYR 16 4.101 -4.362 11.673 1256 HH TYR 16 HH TYR 16 3.955 -2.753 14.465 1257 H GLY 17 H GLY 17 10.641 -5.683 9.126 1258 1HA GLY 17 1HA GLY 17 10.473 -4.635 6.326 1259 2HA GLY 17 2HA GLY 17 11.868 -5.511 6.958 1260 H VAL 18 H VAL 18 11.423 -6.974 5.059 1261 HA VAL 18 HA VAL 18 9.119 -8.819 5.587 1262 HB VAL 18 HB VAL 18 9.059 -7.904 3.358 1263 1HG1 VAL 18 1HG1 VAL 18 11.384 -8.674 2.052 1264 2HG1 VAL 18 2HG1 VAL 18 11.961 -8.085 3.608 1265 3HG1 VAL 18 3HG1 VAL 18 10.991 -7.040 2.579 1266 1HG2 VAL 18 1HG2 VAL 18 9.084 -10.564 3.783 1267 2HG2 VAL 18 2HG2 VAL 18 10.455 -10.442 2.681 1268 3HG2 VAL 18 3HG2 VAL 18 8.867 -9.863 2.179 1269 H PHE 19 H PHE 19 9.588 -10.895 6.255 1270 HA PHE 19 HA PHE 19 12.430 -11.537 6.759 1271 1HB PHE 19 1HB PHE 19 10.010 -11.913 8.075 1272 2HB PHE 19 2HB PHE 19 10.385 -13.522 7.455 1273 HD1 PHE 19 HD1 PHE 19 11.685 -14.885 8.820 1274 HD2 PHE 19 HD2 PHE 19 12.197 -10.625 9.020 1275 HE1 PHE 19 HE1 PHE 19 13.382 -15.172 10.606 1276 HE2 PHE 19 HE2 PHE 19 13.894 -10.912 10.805 1277 HZ PHE 19 HZ PHE 19 14.486 -13.185 11.598 1278 H ALA 20 H ALA 20 13.505 -13.289 5.814 1279 HA ALA 20 HA ALA 20 12.255 -14.399 3.354 1280 1HB ALA 20 1HB ALA 20 14.844 -13.520 4.227 1281 2HB ALA 20 2HB ALA 20 14.368 -14.051 2.613 1282 3HB ALA 20 3HB ALA 20 14.966 -15.224 3.787 1283 H ARG 21 H ARG 21 10.868 -15.996 4.384 1284 HA ARG 21 HA ARG 21 11.768 -17.929 6.299 1285 1HB ARG 21 1HB ARG 21 9.452 -17.282 4.721 1286 2HB ARG 21 2HB ARG 21 9.758 -19.013 4.582 1287 1HG ARG 21 1HG ARG 21 9.513 -19.376 6.877 1288 2HG ARG 21 2HG ARG 21 9.882 -17.700 7.282 1289 1HD ARG 21 1HD ARG 21 7.715 -16.998 6.906 1290 2HD ARG 21 2HD ARG 21 7.452 -18.179 5.609 1291 HE ARG 21 HE ARG 21 7.869 -19.491 8.159 1292 1HH1 ARG 21 1HH1 ARG 21 5.525 -17.783 6.235 1293 2HH1 ARG 21 2HH1 ARG 21 4.177 -18.553 6.996 1294 1HH2 ARG 21 1HH2 ARG 21 6.103 -20.477 9.132 1295 2HH2 ARG 21 2HH2 ARG 21 4.498 -20.067 8.624 1296 H LYS 22 H LYS 22 12.347 -17.612 2.895 1297 HA LYS 22 HA LYS 22 13.012 -20.461 2.503 1298 1HB LYS 22 1HB LYS 22 12.313 -18.143 0.963 1299 2HB LYS 22 2HB LYS 22 13.873 -18.722 0.387 1300 1HG LYS 22 1HG LYS 22 12.882 -20.448 -0.664 1301 2HG LYS 22 2HG LYS 22 12.143 -20.977 0.845 1302 1HD LYS 22 1HD LYS 22 10.777 -18.630 -0.080 1303 2HD LYS 22 2HD LYS 22 10.870 -19.788 -1.405 1304 1HE LYS 22 1HE LYS 22 8.839 -20.160 -0.005 1305 2HE LYS 22 2HE LYS 22 9.938 -21.549 0.080 1306 1HZ LYS 22 1HZ LYS 22 10.714 -20.915 2.152 1307 2HZ LYS 22 2HZ LYS 22 9.074 -20.494 2.269 1308 3HZ LYS 22 3HZ LYS 22 10.238 -19.296 1.966 1309 H SER 23 H SER 23 16.642 -19.959 2.080 1310 HA SER 23 HA SER 23 14.191 -21.350 1.115 1311 1HB SER 23 1HB SER 23 16.797 -22.300 0.186 1312 2HB SER 23 2HB SER 23 16.755 -22.114 1.940 1313 HG SER 23 HG SER 23 15.900 -24.146 0.754 1314 H PHE 24 H PHE 24 16.307 -18.864 0.115 1315 HA PHE 24 HA PHE 24 15.326 -19.150 -2.693 1316 1HB PHE 24 1HB PHE 24 16.220 -16.879 -0.903 1317 2HB PHE 24 2HB PHE 24 16.072 -16.656 -2.646 1318 HD1 PHE 24 HD1 PHE 24 13.751 -18.225 -3.380 1319 HD2 PHE 24 HD2 PHE 24 14.400 -15.809 0.112 1320 HE1 PHE 24 HE1 PHE 24 11.304 -17.913 -3.142 1321 HE2 PHE 24 HE2 PHE 24 11.951 -15.497 0.352 1322 HZ PHE 24 HZ PHE 24 10.402 -16.549 -1.275 1323 H GLU 25 H GLU 25 16.883 -18.455 -4.408 1324 HA GLU 25 HA GLU 25 19.663 -19.329 -3.741 1325 1HB GLU 25 1HB GLU 25 17.929 -20.203 -5.630 1326 2HB GLU 25 2HB GLU 25 18.714 -18.911 -6.540 1327 1HG GLU 25 1HG GLU 25 20.856 -20.150 -5.328 1328 2HG GLU 25 2HG GLU 25 19.786 -21.510 -5.670 1329 H LYS 26 H LYS 26 20.620 -18.070 -6.270 1330 HA LYS 26 HA LYS 26 20.808 -15.262 -5.253 1331 1HB LYS 26 1HB LYS 26 22.856 -16.702 -5.421 1332 2HB LYS 26 2HB LYS 26 22.575 -16.836 -7.154 1333 1HG LYS 26 1HG LYS 26 22.837 -14.446 -7.444 1334 2HG LYS 26 2HG LYS 26 22.931 -14.206 -5.702 1335 1HD LYS 26 1HD LYS 26 24.898 -16.071 -6.126 1336 2HD LYS 26 2HD LYS 26 25.001 -15.096 -7.591 1337 1HE LYS 26 1HE LYS 26 24.689 -13.204 -5.564 1338 2HE LYS 26 2HE LYS 26 25.793 -14.403 -4.865 1339 1HZ LYS 26 1HZ LYS 26 27.096 -12.898 -6.157 1340 2HZ LYS 26 2HZ LYS 26 26.046 -13.021 -7.486 1341 3HZ LYS 26 3HZ LYS 26 27.003 -14.349 -7.034 1342 H GLY 27 H GLY 27 18.738 -14.720 -6.363 1343 1HA GLY 27 1HA GLY 27 18.432 -13.171 -8.358 1344 2HA GLY 27 2HA GLY 27 19.078 -14.495 -9.328 1345 H GLU 28 H GLU 28 16.695 -14.522 -6.661 1346 HA GLU 28 HA GLU 28 14.716 -15.670 -8.604 1347 1HB GLU 28 1HB GLU 28 15.193 -16.453 -5.705 1348 2HB GLU 28 2HB GLU 28 14.083 -17.238 -6.828 1349 1HG GLU 28 1HG GLU 28 16.371 -17.384 -8.269 1350 2HG GLU 28 2HG GLU 28 17.041 -17.436 -6.638 1351 H LEU 29 H LEU 29 12.574 -14.993 -8.312 1352 HA LEU 29 HA LEU 29 12.142 -12.499 -6.870 1353 1HB LEU 29 1HB LEU 29 11.132 -13.609 -9.078 1354 2HB LEU 29 2HB LEU 29 9.943 -14.243 -7.941 1355 HG LEU 29 HG LEU 29 9.199 -12.090 -8.896 1356 1HD1 LEU 29 1HD1 LEU 29 9.908 -11.244 -6.154 1357 2HD1 LEU 29 2HD1 LEU 29 9.126 -12.821 -6.270 1358 3HD1 LEU 29 3HD1 LEU 29 8.323 -11.388 -6.912 1359 1HD2 LEU 29 1HD2 LEU 29 10.702 -10.462 -9.280 1360 2HD2 LEU 29 2HD2 LEU 29 11.948 -11.425 -8.488 1361 3HD2 LEU 29 3HD2 LEU 29 10.970 -10.304 -7.544 1362 H VAL 30 H VAL 30 11.030 -12.232 -4.907 1363 HA VAL 30 HA VAL 30 10.263 -14.761 -3.483 1364 HB VAL 30 HB VAL 30 11.021 -13.486 -1.437 1365 1HG1 VAL 30 1HG1 VAL 30 13.218 -13.551 -3.501 1366 2HG1 VAL 30 2HG1 VAL 30 12.480 -15.038 -2.905 1367 3HG1 VAL 30 3HG1 VAL 30 13.311 -13.955 -1.787 1368 1HG2 VAL 30 1HG2 VAL 30 11.725 -11.332 -1.546 1369 2HG2 VAL 30 2HG2 VAL 30 10.797 -11.291 -3.044 1370 3HG2 VAL 30 3HG2 VAL 30 12.536 -11.577 -3.092 1371 H GLU 31 H GLU 31 9.342 -11.489 -4.321 1372 HA GLU 31 HA GLU 31 6.579 -11.978 -3.608 1373 1HB GLU 31 1HB GLU 31 8.164 -11.426 -1.472 1374 2HB GLU 31 2HB GLU 31 7.727 -9.786 -1.951 1375 1HG GLU 31 1HG GLU 31 5.313 -10.536 -1.981 1376 2HG GLU 31 2HG GLU 31 5.844 -12.058 -1.265 1377 H GLU 32 H GLU 32 5.215 -10.219 -4.312 1378 HA GLU 32 HA GLU 32 6.561 -7.885 -5.589 1379 1HB GLU 32 1HB GLU 32 5.439 -10.269 -6.841 1380 2HB GLU 32 2HB GLU 32 4.650 -8.806 -7.432 1381 1HG GLU 32 1HG GLU 32 6.757 -7.857 -8.103 1382 2HG GLU 32 2HG GLU 32 7.656 -9.129 -7.275 1383 H CYS 33 H CYS 33 5.111 -6.090 -5.888 1384 HA CYS 33 HA CYS 33 2.280 -6.427 -5.070 1385 1HB CYS 33 1HB CYS 33 2.568 -4.691 -3.309 1386 2HB CYS 33 2HB CYS 33 3.573 -6.104 -2.989 1387 HG CYS 33 HG CYS 33 4.798 -3.568 -2.959 1388 H LEU 34 H LEU 34 1.725 -3.680 -4.744 1389 HA LEU 34 HA LEU 34 2.315 -2.640 -7.495 1390 1HB LEU 34 1HB LEU 34 -0.042 -2.257 -5.610 1391 2HB LEU 34 2HB LEU 34 0.098 -1.507 -7.200 1392 HG LEU 34 HG LEU 34 0.283 -4.500 -6.815 1393 1HD1 LEU 34 1HD1 LEU 34 -1.891 -4.091 -6.020 1394 2HD1 LEU 34 2HD1 LEU 34 -2.152 -4.357 -7.744 1395 3HD1 LEU 34 3HD1 LEU 34 -2.127 -2.716 -7.098 1396 1HD2 LEU 34 1HD2 LEU 34 0.911 -4.258 -8.982 1397 2HD2 LEU 34 2HD2 LEU 34 0.333 -2.593 -9.054 1398 3HD2 LEU 34 3HD2 LEU 34 -0.794 -3.929 -9.290 1399 H CYS 35 H CYS 35 1.858 -0.087 -7.431 1400 HA CYS 35 HA CYS 35 2.914 1.164 -4.950 1401 1HB CYS 35 1HB CYS 35 4.237 1.075 -7.675 1402 2HB CYS 35 2HB CYS 35 4.645 2.312 -6.486 1403 HG CYS 35 HG CYS 35 5.579 -0.568 -6.402 1404 H ILE 36 H ILE 36 2.954 3.647 -5.290 1405 HA ILE 36 HA ILE 36 0.553 4.414 -6.912 1406 HB ILE 36 HB ILE 36 1.955 5.866 -4.637 1407 1HG1 ILE 36 1HG1 ILE 36 -0.510 4.096 -4.576 1408 2HG1 ILE 36 2HG1 ILE 36 1.067 3.666 -3.912 1409 1HG2 ILE 36 1HG2 ILE 36 0.398 7.079 -6.336 1410 2HG2 ILE 36 2HG2 ILE 36 0.110 7.323 -4.614 1411 3HG2 ILE 36 3HG2 ILE 36 -0.902 6.203 -5.527 1412 1HD1 ILE 36 1HD1 ILE 36 0.057 6.277 -2.999 1413 2HD1 ILE 36 2HD1 ILE 36 0.768 4.959 -2.068 1414 3HD1 ILE 36 3HD1 ILE 36 -0.941 4.911 -2.500 1415 H VAL 37 H VAL 37 0.749 6.126 -8.420 1416 HA VAL 37 HA VAL 37 3.537 7.161 -8.834 1417 HB VAL 37 HB VAL 37 1.392 6.525 -10.893 1418 1HG1 VAL 37 1HG1 VAL 37 4.345 6.957 -11.356 1419 2HG1 VAL 37 2HG1 VAL 37 3.206 8.304 -11.367 1420 3HG1 VAL 37 3HG1 VAL 37 3.035 6.995 -12.537 1421 1HG2 VAL 37 1HG2 VAL 37 3.908 4.991 -10.176 1422 2HG2 VAL 37 2HG2 VAL 37 2.741 4.552 -11.423 1423 3HG2 VAL 37 3HG2 VAL 37 2.274 4.506 -9.723 1424 H ARG 38 H ARG 38 3.033 9.100 -7.640 1425 HA ARG 38 HA ARG 38 1.019 10.894 -8.957 1426 1HB ARG 38 1HB ARG 38 1.830 10.268 -6.165 1427 2HB ARG 38 2HB ARG 38 1.522 11.973 -6.496 1428 1HG ARG 38 1HG ARG 38 -0.400 9.751 -7.237 1429 2HG ARG 38 2HG ARG 38 -0.509 10.675 -5.738 1430 1HD ARG 38 1HD ARG 38 -0.449 12.770 -7.320 1431 2HD ARG 38 2HD ARG 38 -0.943 11.613 -8.571 1432 HE ARG 38 HE ARG 38 -2.613 11.016 -6.449 1433 1HH1 ARG 38 1HH1 ARG 38 -1.812 13.932 -8.173 1434 2HH1 ARG 38 2HH1 ARG 38 -3.361 14.650 -7.898 1435 1HH2 ARG 38 1HH2 ARG 38 -4.615 11.969 -6.106 1436 2HH2 ARG 38 2HH2 ARG 38 -4.938 13.549 -6.737 1437 H HIS 39 H HIS 39 1.715 13.322 -8.439 1438 HA HIS 39 HA HIS 39 4.449 13.648 -9.522 1439 1HB HIS 39 1HB HIS 39 1.905 15.078 -9.435 1440 2HB HIS 39 2HB HIS 39 3.250 16.143 -9.023 1441 HD1 HIS 39 HD1 HIS 39 3.456 17.398 -11.227 1442 HD2 HIS 39 HD2 HIS 39 3.530 13.260 -11.729 1443 HE1 HIS 39 HE1 HIS 39 4.091 16.981 -13.643 1444 H ASN 40 H ASN 40 5.686 15.612 -8.457 1445 HA ASN 40 HA ASN 40 6.188 14.912 -5.678 1446 1HB ASN 40 1HB ASN 40 7.711 15.803 -7.639 1447 2HB ASN 40 2HB ASN 40 7.186 17.389 -7.074 1448 1HD2 ASN 40 1HD2 ASN 40 9.317 14.727 -6.410 1449 2HD2 ASN 40 2HD2 ASN 40 9.932 15.312 -4.940 1450 H ASP 41 H ASP 41 6.677 18.003 -5.220 1451 HA ASP 41 HA ASP 41 5.514 19.793 -4.223 1452 1HB ASP 41 1HB ASP 41 4.050 19.033 -6.404 1453 2HB ASP 41 2HB ASP 41 2.866 18.792 -5.120 1454 H ASP 42 H ASP 42 2.677 19.466 -3.256 1455 HA ASP 42 HA ASP 42 3.039 18.777 -0.598 1456 1HB ASP 42 1HB ASP 42 0.566 18.349 -0.646 1457 2HB ASP 42 2HB ASP 42 1.018 19.797 -1.546 1458 H TRP 43 H TRP 43 2.647 16.566 -3.308 1459 HA TRP 43 HA TRP 43 2.078 14.194 -1.763 1460 1HB TRP 43 1HB TRP 43 1.608 14.339 -4.144 1461 2HB TRP 43 2HB TRP 43 3.289 14.732 -4.498 1462 HD1 TRP 43 HD1 TRP 43 4.846 12.775 -5.019 1463 HE1 TRP 43 HE1 TRP 43 4.703 10.210 -4.808 1464 HE3 TRP 43 HE3 TRP 43 0.409 12.342 -2.531 1465 HZ2 TRP 43 HZ2 TRP 43 2.939 8.237 -3.721 1466 HZ3 TRP 43 HZ3 TRP 43 -0.474 10.110 -1.918 1467 HH2 TRP 43 HH2 TRP 43 0.781 8.059 -2.514 1468 H GLY 44 H GLY 44 5.112 15.412 -3.244 1469 1HA GLY 44 1HA GLY 44 6.816 13.396 -2.205 1470 2HA GLY 44 2HA GLY 44 7.350 15.011 -2.668 1471 H THR 45 H THR 45 5.355 16.153 -0.657 1472 HA THR 45 HA THR 45 7.220 16.152 1.612 1473 HB THR 45 HB THR 45 4.534 17.481 1.096 1474 HG1 THR 45 HG1 THR 45 5.871 19.273 0.655 1475 1HG2 THR 45 1HG2 THR 45 4.623 18.284 3.201 1476 2HG2 THR 45 2HG2 THR 45 6.278 18.842 2.958 1477 3HG2 THR 45 3HG2 THR 45 5.975 17.195 3.511 1478 H ALA 46 H ALA 46 3.655 15.734 1.537 1479 HA ALA 46 HA ALA 46 3.272 14.612 4.045 1480 1HB ALA 46 1HB ALA 46 1.515 13.209 2.447 1481 2HB ALA 46 2HB ALA 46 1.972 14.548 1.393 1482 3HB ALA 46 3HB ALA 46 1.267 14.873 2.977 1483 H LEU 47 H LEU 47 3.990 12.767 1.056 1484 HA LEU 47 HA LEU 47 4.401 10.305 2.658 1485 1HB LEU 47 1HB LEU 47 4.485 10.935 -0.314 1486 2HB LEU 47 2HB LEU 47 4.580 9.314 0.372 1487 HG LEU 47 HG LEU 47 2.351 10.260 1.618 1488 1HD1 LEU 47 1HD1 LEU 47 2.623 11.643 -1.044 1489 2HD1 LEU 47 2HD1 LEU 47 2.156 12.333 0.509 1490 3HD1 LEU 47 3HD1 LEU 47 1.038 11.283 -0.359 1491 1HD2 LEU 47 1HD2 LEU 47 2.770 8.766 -0.955 1492 2HD2 LEU 47 2HD2 LEU 47 1.140 9.071 -0.355 1493 3HD2 LEU 47 3HD2 LEU 47 2.280 8.144 0.620 1494 H GLU 48 H GLU 48 6.348 12.585 2.884 1495 HA GLU 48 HA GLU 48 8.708 11.955 1.344 1496 1HB GLU 48 1HB GLU 48 9.774 13.470 3.040 1497 2HB GLU 48 2HB GLU 48 8.298 14.147 2.355 1498 1HG GLU 48 1HG GLU 48 7.595 14.425 4.484 1499 2HG GLU 48 2HG GLU 48 7.393 12.674 4.541 1500 H ASP 49 H ASP 49 8.247 9.473 1.973 1501 HA ASP 49 HA ASP 49 10.376 8.745 3.859 1502 1HB ASP 49 1HB ASP 49 7.823 9.178 4.844 1503 2HB ASP 49 2HB ASP 49 7.834 7.436 4.574 1504 H TYR 50 H TYR 50 7.420 7.087 2.703 1505 HA TYR 50 HA TYR 50 9.139 4.911 1.614 1506 1HB TYR 50 1HB TYR 50 6.117 5.088 1.906 1507 2HB TYR 50 2HB TYR 50 7.074 3.625 1.688 1508 HD1 TYR 50 HD1 TYR 50 5.139 4.869 4.041 1509 HD2 TYR 50 HD2 TYR 50 9.336 4.095 3.536 1510 HE1 TYR 50 HE1 TYR 50 5.402 4.679 6.501 1511 HE2 TYR 50 HE2 TYR 50 9.597 3.907 5.994 1512 HH TYR 50 HH TYR 50 7.896 3.266 7.976 1513 H LEU 51 H LEU 51 8.920 7.505 0.231 1514 HA LEU 51 HA LEU 51 7.238 6.871 -2.142 1515 1HB LEU 51 1HB LEU 51 7.817 9.149 -0.607 1516 2HB LEU 51 2HB LEU 51 8.707 9.400 -2.108 1517 HG LEU 51 HG LEU 51 6.668 9.040 -3.414 1518 1HD1 LEU 51 1HD1 LEU 51 4.525 9.053 -1.770 1519 2HD1 LEU 51 2HD1 LEU 51 5.660 8.161 -0.758 1520 3HD1 LEU 51 3HD1 LEU 51 5.256 7.563 -2.367 1521 1HD2 LEU 51 1HD2 LEU 51 5.243 10.919 -2.147 1522 2HD2 LEU 51 2HD2 LEU 51 6.756 11.304 -2.969 1523 3HD2 LEU 51 3HD2 LEU 51 6.738 11.066 -1.221 1524 H PHE 52 H PHE 52 8.282 5.812 -3.780 1525 HA PHE 52 HA PHE 52 11.221 6.037 -4.100 1526 1HB PHE 52 1HB PHE 52 8.966 4.400 -5.277 1527 2HB PHE 52 2HB PHE 52 10.563 4.391 -6.025 1528 HD1 PHE 52 HD1 PHE 52 12.404 3.233 -5.025 1529 HD2 PHE 52 HD2 PHE 52 8.697 3.660 -2.897 1530 HE1 PHE 52 HE1 PHE 52 13.190 1.602 -3.330 1531 HE2 PHE 52 HE2 PHE 52 9.483 2.029 -1.202 1532 HZ PHE 52 HZ PHE 52 11.729 1.000 -1.418 1533 H SER 53 H SER 53 11.698 8.040 -5.045 1534 HA SER 53 HA SER 53 9.945 9.109 -7.157 1535 1HB SER 53 1HB SER 53 10.885 10.485 -5.309 1536 2HB SER 53 2HB SER 53 12.511 10.136 -5.896 1537 HG SER 53 HG SER 53 11.968 11.159 -7.840 1538 H ARG 54 H ARG 54 10.463 9.249 -9.307 1539 HA ARG 54 HA ARG 54 13.114 8.140 -10.170 1540 1HB ARG 54 1HB ARG 54 10.764 6.916 -10.520 1541 2HB ARG 54 2HB ARG 54 10.646 8.034 -11.879 1542 1HG ARG 54 1HG ARG 54 12.541 7.138 -12.942 1543 2HG ARG 54 2HG ARG 54 13.149 6.414 -11.453 1544 1HD ARG 54 1HD ARG 54 12.058 4.485 -11.923 1545 2HD ARG 54 2HD ARG 54 10.519 5.359 -12.052 1546 HE ARG 54 HE ARG 54 11.801 6.038 -14.391 1547 1HH1 ARG 54 1HH1 ARG 54 11.156 3.004 -12.810 1548 2HH1 ARG 54 2HH1 ARG 54 11.088 2.120 -14.294 1549 1HH2 ARG 54 1HH2 ARG 54 11.707 4.868 -16.304 1550 2HH2 ARG 54 2HH2 ARG 54 11.397 3.165 -16.258 1551 H LYS 55 H LYS 55 13.359 8.877 -12.668 1552 HA LYS 55 HA LYS 55 13.462 11.783 -12.612 1553 1HB LYS 55 1HB LYS 55 14.614 9.557 -14.005 1554 2HB LYS 55 2HB LYS 55 13.965 10.673 -15.207 1555 1HG LYS 55 1HG LYS 55 15.810 11.448 -12.925 1556 2HG LYS 55 2HG LYS 55 16.311 11.226 -14.602 1557 1HD LYS 55 1HD LYS 55 14.081 12.955 -14.688 1558 2HD LYS 55 2HD LYS 55 15.092 13.538 -13.364 1559 1HE LYS 55 1HE LYS 55 16.922 13.954 -14.777 1560 2HE LYS 55 2HE LYS 55 16.351 12.812 -16.008 1561 1HZ LYS 55 1HZ LYS 55 14.415 14.265 -16.352 1562 2HZ LYS 55 2HZ LYS 55 15.870 15.069 -16.701 1563 3HZ LYS 55 3HZ LYS 55 15.056 15.381 -15.244 1564 H ASN 56 H ASN 56 11.088 12.111 -12.408 1565 HA ASN 56 HA ASN 56 9.356 11.427 -14.666 1566 1HB ASN 56 1HB ASN 56 9.084 14.067 -14.960 1567 2HB ASN 56 2HB ASN 56 10.732 14.074 -14.333 1568 1HD2 ASN 56 1HD2 ASN 56 8.722 12.557 -16.907 1569 2HD2 ASN 56 2HD2 ASN 56 10.002 12.370 -18.006 1570 H MET 57 H MET 57 9.444 11.314 -11.641 1571 HA MET 57 HA MET 57 7.627 13.257 -10.543 1572 1HB MET 57 1HB MET 57 5.572 11.860 -10.598 1573 2HB MET 57 2HB MET 57 6.132 12.210 -12.230 1574 1HG MET 57 1HG MET 57 7.366 9.797 -11.139 1575 2HG MET 57 2HG MET 57 5.607 9.681 -11.184 1576 1HE MET 57 1HE MET 57 4.193 9.399 -13.238 1577 2HE MET 57 2HE MET 57 4.600 10.147 -14.783 1578 3HE MET 57 3HE MET 57 4.475 11.137 -13.328 1579 H SER 58 H SER 58 6.186 11.635 -8.768 1580 HA SER 58 HA SER 58 8.322 10.098 -7.333 1581 1HB SER 58 1HB SER 58 6.175 11.823 -6.068 1582 2HB SER 58 2HB SER 58 7.629 11.184 -5.303 1583 HG SER 58 HG SER 58 7.353 13.275 -7.155 1584 H ALA 59 H ALA 59 7.609 8.148 -6.406 1585 HA ALA 59 HA ALA 59 4.680 7.543 -6.657 1586 1HB ALA 59 1HB ALA 59 5.487 6.212 -8.346 1587 2HB ALA 59 2HB ALA 59 5.941 5.139 -7.022 1588 3HB ALA 59 3HB ALA 59 7.132 6.244 -7.710 1589 H MET 60 H MET 60 4.208 5.423 -5.343 1590 HA MET 60 HA MET 60 5.599 5.626 -2.690 1591 1HB MET 60 1HB MET 60 3.176 6.327 -2.874 1592 2HB MET 60 2HB MET 60 2.791 4.682 -3.379 1593 1HG MET 60 1HG MET 60 2.383 4.972 -0.967 1594 2HG MET 60 2HG MET 60 3.678 3.812 -1.250 1595 1HE MET 60 1HE MET 60 3.604 5.254 1.803 1596 2HE MET 60 2HE MET 60 2.397 6.034 0.780 1597 3HE MET 60 3HE MET 60 3.633 7.004 1.582 1598 H ALA 61 H ALA 61 5.580 3.480 -1.474 1599 HA ALA 61 HA ALA 61 6.503 1.338 -3.240 1600 1HB ALA 61 1HB ALA 61 6.265 0.441 -0.571 1601 2HB ALA 61 2HB ALA 61 6.632 2.162 -0.457 1602 3HB ALA 61 3HB ALA 61 7.715 1.086 -1.341 1603 H LEU 62 H LEU 62 3.682 1.881 -1.129 1604 HA LEU 62 HA LEU 62 2.074 0.052 -2.710 1605 1HB LEU 62 1HB LEU 62 0.932 0.781 -0.156 1606 2HB LEU 62 2HB LEU 62 1.757 2.175 -0.856 1607 HG LEU 62 HG LEU 62 0.544 1.592 -3.043 1608 1HD1 LEU 62 1HD1 LEU 62 -0.546 -0.389 -3.002 1609 2HD1 LEU 62 2HD1 LEU 62 -1.758 0.419 -2.007 1610 3HD1 LEU 62 3HD1 LEU 62 -0.452 -0.487 -1.244 1611 1HD2 LEU 62 1HD2 LEU 62 -1.248 2.986 -2.471 1612 2HD2 LEU 62 2HD2 LEU 62 -0.066 3.376 -1.222 1613 3HD2 LEU 62 3HD2 LEU 62 -1.405 2.286 -0.860 1614 H GLY 63 H GLY 63 2.908 -2.067 -2.484 1615 1HA GLY 63 1HA GLY 63 1.958 -3.556 -0.229 1616 2HA GLY 63 2HA GLY 63 3.009 -4.189 -1.492 1617 H PHE 64 H PHE 64 4.766 -5.063 -0.536 1618 HA PHE 64 HA PHE 64 5.791 -4.023 2.018 1619 1HB PHE 64 1HB PHE 64 6.543 -6.285 0.134 1620 2HB PHE 64 2HB PHE 64 7.336 -6.012 1.684 1621 HD1 PHE 64 HD1 PHE 64 6.089 -6.277 3.804 1622 HD2 PHE 64 HD2 PHE 64 4.283 -7.140 0.004 1623 HE1 PHE 64 HE1 PHE 64 4.258 -7.496 4.951 1624 HE2 PHE 64 HE2 PHE 64 2.452 -8.358 1.150 1625 HZ PHE 64 HZ PHE 64 2.440 -8.536 3.624 1626 H GLY 65 H GLY 65 6.096 -2.071 -0.011 1627 1HA GLY 65 1HA GLY 65 8.897 -2.262 -0.942 1628 2HA GLY 65 2HA GLY 65 7.752 -0.990 -1.369 1629 H ALA 66 H ALA 66 6.974 -0.708 1.523 1630 HA ALA 66 HA ALA 66 9.130 1.178 2.248 1631 1HB ALA 66 1HB ALA 66 6.536 0.566 3.694 1632 2HB ALA 66 2HB ALA 66 6.587 1.580 2.252 1633 3HB ALA 66 3HB ALA 66 7.450 2.072 3.708 1634 H ILE 67 H ILE 67 7.632 -1.793 3.488 1635 HA ILE 67 HA ILE 67 8.649 -1.991 6.065 1636 HB ILE 67 HB ILE 67 8.705 -4.476 5.547 1637 1HG1 ILE 67 1HG1 ILE 67 7.565 -4.693 3.082 1638 2HG1 ILE 67 2HG1 ILE 67 8.691 -3.370 2.801 1639 1HG2 ILE 67 1HG2 ILE 67 6.621 -3.353 6.196 1640 2HG2 ILE 67 2HG2 ILE 67 6.304 -4.606 4.996 1641 3HG2 ILE 67 3HG2 ILE 67 6.328 -2.910 4.514 1642 1HD1 ILE 67 1HD1 ILE 67 9.875 -5.528 4.375 1643 2HD1 ILE 67 2HD1 ILE 67 10.482 -4.738 2.920 1644 3HD1 ILE 67 3HD1 ILE 67 9.329 -6.066 2.787 1645 H PHE 68 H PHE 68 10.430 -2.554 3.033 1646 HA PHE 68 HA PHE 68 12.765 -3.777 3.891 1647 1HB PHE 68 1HB PHE 68 12.301 -1.473 1.973 1648 2HB PHE 68 2HB PHE 68 13.827 -2.347 2.067 1649 HD1 PHE 68 HD1 PHE 68 11.125 -2.117 0.066 1650 HD2 PHE 68 HD2 PHE 68 13.156 -5.106 2.386 1651 HE1 PHE 68 HE1 PHE 68 10.210 -3.887 -1.410 1652 HE2 PHE 68 HE2 PHE 68 12.242 -6.876 0.910 1653 HZ PHE 68 HZ PHE 68 10.769 -6.266 -0.988 1654 H ASN 69 H ASN 69 14.361 -3.254 5.329 1655 HA ASN 69 HA ASN 69 14.423 -0.460 6.403 1656 1HB ASN 69 1HB ASN 69 15.317 -3.158 7.483 1657 2HB ASN 69 2HB ASN 69 15.537 -1.634 8.342 1658 1HD2 ASN 69 1HD2 ASN 69 13.367 -4.223 7.892 1659 2HD2 ASN 69 2HD2 ASN 69 11.982 -3.493 8.548 1660 H HIS 70 H HIS 70 16.822 -0.123 7.396 1661 HA HIS 70 HA HIS 70 18.655 -0.302 5.069 1662 1HB HIS 70 1HB HIS 70 18.182 1.818 6.353 1663 2HB HIS 70 2HB HIS 70 18.930 1.075 7.767 1664 HD1 HIS 70 HD1 HIS 70 19.762 2.258 4.270 1665 HD2 HIS 70 HD2 HIS 70 21.739 1.056 7.737 1666 HE1 HIS 70 HE1 HIS 70 22.216 2.765 3.907 1667 H SER 71 H SER 71 20.187 -1.902 5.010 1668 HA SER 71 HA SER 71 21.318 -2.911 7.576 1669 1HB SER 71 1HB SER 71 20.268 -4.714 5.372 1670 2HB SER 71 2HB SER 71 20.758 -5.184 6.999 1671 HG SER 71 HG SER 71 18.537 -3.588 6.259 1672 H LYS 72 H LYS 72 23.369 -4.037 7.254 1673 HA LYS 72 HA LYS 72 24.824 -3.076 4.859 1674 1HB LYS 72 1HB LYS 72 25.693 -4.498 7.401 1675 2HB LYS 72 2HB LYS 72 26.778 -3.790 6.206 1676 1HG LYS 72 1HG LYS 72 25.082 -1.696 6.714 1677 2HG LYS 72 2HG LYS 72 25.173 -2.473 8.297 1678 1HD LYS 72 1HD LYS 72 27.205 -1.557 8.603 1679 2HD LYS 72 2HD LYS 72 27.799 -2.470 7.216 1680 1HE LYS 72 1HE LYS 72 28.126 -0.448 6.220 1681 2HE LYS 72 2HE LYS 72 26.361 -0.363 6.064 1682 1HZ LYS 72 1HZ LYS 72 27.475 1.508 7.346 1683 2HZ LYS 72 2HZ LYS 72 27.772 0.367 8.569 1684 3HZ LYS 72 3HZ LYS 72 26.176 0.735 8.119 1685 H ASP 73 H ASP 73 22.852 -5.409 4.811 1686 HA ASP 73 HA ASP 73 24.580 -7.237 3.279 1687 1HB ASP 73 1HB ASP 73 24.416 -7.704 5.921 1688 2HB ASP 73 2HB ASP 73 22.921 -8.500 5.428 1689 HA PRO 74 HA PRO 74 20.116 -6.590 1.947 1690 1HB PRO 74 1HB PRO 74 20.872 -6.200 -0.722 1691 2HB PRO 74 2HB PRO 74 20.519 -4.906 0.436 1692 1HG PRO 74 1HG PRO 74 23.131 -5.982 -0.472 1693 2HG PRO 74 2HG PRO 74 22.683 -4.331 -0.027 1694 1HD PRO 74 1HD PRO 74 24.127 -5.954 1.592 1695 2HD PRO 74 2HD PRO 74 23.024 -4.708 2.215 1696 H ASN 75 H ASN 75 19.377 -8.690 1.934 1697 HA ASN 75 HA ASN 75 20.797 -10.776 0.402 1698 1HB ASN 75 1HB ASN 75 18.523 -10.617 2.385 1699 2HB ASN 75 2HB ASN 75 18.824 -12.107 1.490 1700 1HD2 ASN 75 1HD2 ASN 75 19.883 -13.467 2.961 1701 2HD2 ASN 75 2HD2 ASN 75 21.236 -13.021 3.883 1702 H ALA 76 H ALA 76 18.076 -8.647 0.044 1703 HA ALA 76 HA ALA 76 17.473 -9.883 -2.580 1704 1HB ALA 76 1HB ALA 76 15.158 -9.306 -0.779 1705 2HB ALA 76 2HB ALA 76 16.112 -10.747 -0.428 1706 3HB ALA 76 3HB ALA 76 15.334 -10.566 -2.001 1707 H ARG 77 H ARG 77 17.348 -8.212 -3.997 1708 HA ARG 77 HA ARG 77 16.754 -5.478 -3.003 1709 1HB ARG 77 1HB ARG 77 18.218 -6.785 -5.181 1710 2HB ARG 77 2HB ARG 77 17.243 -5.434 -5.755 1711 1HG ARG 77 1HG ARG 77 18.249 -4.029 -3.921 1712 2HG ARG 77 2HG ARG 77 19.333 -5.373 -3.560 1713 1HD ARG 77 1HD ARG 77 20.282 -5.269 -5.812 1714 2HD ARG 77 2HD ARG 77 19.119 -4.011 -6.272 1715 HE ARG 77 HE ARG 77 20.344 -3.048 -3.954 1716 1HH1 ARG 77 1HH1 ARG 77 21.389 -4.100 -7.103 1717 2HH1 ARG 77 2HH1 ARG 77 22.765 -3.052 -7.118 1718 1HH2 ARG 77 1HH2 ARG 77 22.137 -1.697 -3.996 1719 2HH2 ARG 77 2HH2 ARG 77 23.187 -1.701 -5.374 1720 H HIS 78 H HIS 78 15.535 -4.275 -5.091 1721 HA HIS 78 HA HIS 78 13.075 -5.897 -5.645 1722 1HB HIS 78 1HB HIS 78 11.796 -3.822 -5.174 1723 2HB HIS 78 2HB HIS 78 12.761 -4.296 -3.776 1724 HD1 HIS 78 HD1 HIS 78 14.871 -2.854 -3.229 1725 HD2 HIS 78 HD2 HIS 78 12.618 -1.413 -6.427 1726 HE1 HIS 78 HE1 HIS 78 15.704 -0.507 -3.693 1727 H GLU 79 H GLU 79 12.047 -5.399 -7.658 1728 HA GLU 79 HA GLU 79 13.721 -3.747 -9.522 1729 1HB GLU 79 1HB GLU 79 13.709 -6.200 -9.932 1730 2HB GLU 79 2HB GLU 79 11.950 -6.163 -10.044 1731 1HG GLU 79 1HG GLU 79 12.433 -5.948 -12.284 1732 2HG GLU 79 2HG GLU 79 12.511 -4.243 -11.837 1733 H LEU 80 H LEU 80 12.628 -2.221 -10.780 1734 HA LEU 80 HA LEU 80 9.701 -1.927 -10.221 1735 1HB LEU 80 1HB LEU 80 11.090 -0.148 -9.307 1736 2HB LEU 80 2HB LEU 80 11.926 0.047 -10.848 1737 HG LEU 80 HG LEU 80 9.818 0.753 -11.906 1738 1HD1 LEU 80 1HD1 LEU 80 7.854 0.221 -10.944 1739 2HD1 LEU 80 2HD1 LEU 80 8.234 1.289 -9.594 1740 3HD1 LEU 80 3HD1 LEU 80 8.707 -0.408 -9.535 1741 1HD2 LEU 80 1HD2 LEU 80 11.312 2.433 -10.822 1742 2HD2 LEU 80 2HD2 LEU 80 10.368 2.276 -9.341 1743 3HD2 LEU 80 3HD2 LEU 80 9.618 2.925 -10.799 1744 H THR 81 H THR 81 8.349 -2.041 -11.981 1745 HA THR 81 HA THR 81 9.168 -2.896 -14.541 1746 HB THR 81 HB THR 81 6.838 -1.978 -15.152 1747 HG1 THR 81 HG1 THR 81 5.661 -1.281 -13.296 1748 1HG2 THR 81 1HG2 THR 81 6.365 -3.478 -12.679 1749 2HG2 THR 81 2HG2 THR 81 7.633 -4.187 -13.678 1750 3HG2 THR 81 3HG2 THR 81 6.022 -3.931 -14.348 1751 H ALA 82 H ALA 82 8.413 -1.403 -16.560 1752 HA ALA 82 HA ALA 82 10.376 0.557 -17.000 1753 1HB ALA 82 1HB ALA 82 7.978 -0.494 -18.227 1754 2HB ALA 82 2HB ALA 82 9.376 0.243 -19.011 1755 3HB ALA 82 3HB ALA 82 8.038 1.253 -18.463 1756 H GLY 83 H GLY 83 7.362 0.822 -15.253 1757 1HA GLY 83 1HA GLY 83 7.909 3.738 -14.876 1758 2HA GLY 83 2HA GLY 83 6.267 3.115 -15.035 1759 H LEU 84 H LEU 84 6.021 4.169 -12.855 1760 HA LEU 84 HA LEU 84 7.240 2.601 -10.624 1761 1HB LEU 84 1HB LEU 84 5.737 5.240 -10.789 1762 2HB LEU 84 2HB LEU 84 6.380 4.558 -9.296 1763 HG LEU 84 HG LEU 84 8.245 4.820 -11.612 1764 1HD1 LEU 84 1HD1 LEU 84 8.101 7.204 -9.883 1765 2HD1 LEU 84 2HD1 LEU 84 6.713 7.004 -10.954 1766 3HD1 LEU 84 3HD1 LEU 84 8.341 7.092 -11.627 1767 1HD2 LEU 84 1HD2 LEU 84 9.851 4.760 -9.965 1768 2HD2 LEU 84 2HD2 LEU 84 8.554 3.953 -9.084 1769 3HD2 LEU 84 3HD2 LEU 84 8.862 5.670 -8.823 1770 H LYS 85 H LYS 85 5.175 1.327 -12.148 1771 HA LYS 85 HA LYS 85 2.673 1.673 -10.613 1772 1HB LYS 85 1HB LYS 85 3.605 0.595 -13.176 1773 2HB LYS 85 2HB LYS 85 2.368 -0.407 -12.418 1774 1HG LYS 85 1HG LYS 85 0.912 1.570 -12.178 1775 2HG LYS 85 2HG LYS 85 2.158 2.582 -12.907 1776 1HD LYS 85 1HD LYS 85 1.871 0.507 -14.731 1777 2HD LYS 85 2HD LYS 85 0.218 0.810 -14.195 1778 1HE LYS 85 1HE LYS 85 1.563 3.334 -14.606 1779 2HE LYS 85 2HE LYS 85 1.702 2.335 -16.065 1780 1HZ LYS 85 1HZ LYS 85 -0.687 1.842 -15.857 1781 2HZ LYS 85 2HZ LYS 85 -0.401 3.500 -16.083 1782 3HZ LYS 85 3HZ LYS 85 -0.789 2.908 -14.539 1783 H ARG 86 H ARG 86 4.506 -1.244 -11.625 1784 HA ARG 86 HA ARG 86 3.610 -2.556 -9.095 1785 1HB ARG 86 1HB ARG 86 4.214 -3.333 -11.902 1786 2HB ARG 86 2HB ARG 86 4.665 -4.514 -10.672 1787 1HG ARG 86 1HG ARG 86 2.494 -4.973 -10.137 1788 2HG ARG 86 2HG ARG 86 1.990 -3.293 -10.324 1789 1HD ARG 86 1HD ARG 86 1.272 -3.679 -12.444 1790 2HD ARG 86 2HD ARG 86 2.798 -4.473 -12.877 1791 HE ARG 86 HE ARG 86 0.373 -5.814 -11.942 1792 1HH1 ARG 86 1HH1 ARG 86 3.848 -5.933 -12.108 1793 2HH1 ARG 86 2HH1 ARG 86 3.907 -7.655 -11.955 1794 1HH2 ARG 86 1HH2 ARG 86 0.475 -8.051 -11.745 1795 2HH2 ARG 86 2HH2 ARG 86 2.014 -8.846 -11.751 1796 H MET 87 H MET 87 5.134 -3.575 -7.729 1797 HA MET 87 HA MET 87 8.003 -2.872 -8.258 1798 1HB MET 87 1HB MET 87 6.196 -2.451 -6.055 1799 2HB MET 87 2HB MET 87 7.503 -3.507 -5.519 1800 1HG MET 87 1HG MET 87 9.067 -1.805 -6.709 1801 2HG MET 87 2HG MET 87 7.681 -0.717 -6.645 1802 1HE MET 87 1HE MET 87 10.396 -2.698 -4.424 1803 2HE MET 87 2HE MET 87 10.800 -1.142 -3.699 1804 3HE MET 87 3HE MET 87 10.703 -1.299 -5.453 1805 H ARG 88 H ARG 88 9.586 -4.490 -7.575 1806 HA ARG 88 HA ARG 88 8.451 -7.257 -7.340 1807 1HB ARG 88 1HB ARG 88 10.100 -5.982 -9.341 1808 2HB ARG 88 2HB ARG 88 10.995 -7.303 -8.588 1809 1HG ARG 88 1HG ARG 88 9.160 -8.853 -9.059 1810 2HG ARG 88 2HG ARG 88 8.192 -7.539 -9.729 1811 1HD ARG 88 1HD ARG 88 9.433 -7.449 -11.685 1812 2HD ARG 88 2HD ARG 88 10.924 -7.977 -10.881 1813 HE ARG 88 HE ARG 88 10.243 -10.224 -11.217 1814 1HH1 ARG 88 1HH1 ARG 88 7.578 -8.031 -11.674 1815 2HH1 ARG 88 2HH1 ARG 88 6.515 -9.269 -12.246 1816 1HH2 ARG 88 1HH2 ARG 88 8.843 -11.813 -11.962 1817 2HH2 ARG 88 2HH2 ARG 88 7.223 -11.394 -12.408 1818 H ILE 89 H ILE 89 10.212 -8.819 -6.547 1819 HA ILE 89 HA ILE 89 12.205 -7.537 -4.742 1820 HB ILE 89 HB ILE 89 10.136 -9.595 -3.881 1821 1HG1 ILE 89 1HG1 ILE 89 10.241 -6.586 -3.508 1822 2HG1 ILE 89 2HG1 ILE 89 9.000 -7.506 -4.349 1823 1HG2 ILE 89 1HG2 ILE 89 11.710 -7.867 -2.011 1824 2HG2 ILE 89 2HG2 ILE 89 12.529 -9.236 -2.764 1825 3HG2 ILE 89 3HG2 ILE 89 11.094 -9.502 -1.774 1826 1HD1 ILE 89 1HD1 ILE 89 9.014 -6.790 -1.619 1827 2HD1 ILE 89 2HD1 ILE 89 9.308 -8.528 -1.664 1828 3HD1 ILE 89 3HD1 ILE 89 7.873 -7.857 -2.438 1829 H PHE 90 H PHE 90 13.836 -8.477 -6.092 1830 HA PHE 90 HA PHE 90 13.834 -11.435 -6.425 1831 1HB PHE 90 1HB PHE 90 14.979 -9.031 -7.719 1832 2HB PHE 90 2HB PHE 90 16.061 -10.421 -7.685 1833 HD1 PHE 90 HD1 PHE 90 14.948 -12.722 -8.368 1834 HD2 PHE 90 HD2 PHE 90 13.417 -8.854 -9.436 1835 HE1 PHE 90 HE1 PHE 90 13.687 -13.740 -10.246 1836 HE2 PHE 90 HE2 PHE 90 12.158 -9.871 -11.315 1837 HZ PHE 90 HZ PHE 90 12.293 -12.314 -11.720 1838 H THR 91 H THR 91 15.595 -12.711 -5.642 1839 HA THR 91 HA THR 91 16.992 -11.595 -3.290 1840 HB THR 91 HB THR 91 17.789 -14.092 -3.294 1841 HG1 THR 91 HG1 THR 91 15.525 -14.489 -4.892 1842 1HG2 THR 91 1HG2 THR 91 14.994 -13.061 -2.863 1843 2HG2 THR 91 2HG2 THR 91 16.205 -13.517 -1.665 1844 3HG2 THR 91 3HG2 THR 91 15.362 -14.764 -2.584 1845 H ILE 92 H ILE 92 18.912 -10.528 -3.690 1846 HA ILE 92 HA ILE 92 20.455 -10.973 -6.116 1847 HB ILE 92 HB ILE 92 21.929 -9.280 -5.078 1848 1HG1 ILE 92 1HG1 ILE 92 20.160 -9.256 -2.649 1849 2HG1 ILE 92 2HG1 ILE 92 21.518 -10.378 -2.725 1850 1HG2 ILE 92 1HG2 ILE 92 20.210 -8.098 -6.036 1851 2HG2 ILE 92 2HG2 ILE 92 19.882 -7.687 -4.352 1852 3HG2 ILE 92 3HG2 ILE 92 18.968 -8.973 -5.140 1853 1HD1 ILE 92 1HD1 ILE 92 22.860 -8.687 -2.080 1854 2HD1 ILE 92 2HD1 ILE 92 21.542 -7.524 -2.230 1855 3HD1 ILE 92 3HD1 ILE 92 22.535 -7.916 -3.634 1856 H LYS 93 H LYS 93 20.350 -12.530 -3.052 1857 HA LYS 93 HA LYS 93 22.772 -14.091 -3.768 1858 1HB LYS 93 1HB LYS 93 23.663 -13.726 -1.465 1859 2HB LYS 93 2HB LYS 93 23.530 -12.211 -2.359 1860 1HG LYS 93 1HG LYS 93 21.577 -11.563 -1.185 1861 2HG LYS 93 2HG LYS 93 21.296 -13.196 -0.582 1862 1HD LYS 93 1HD LYS 93 22.205 -11.891 1.239 1863 2HD LYS 93 2HD LYS 93 23.463 -13.002 0.700 1864 1HE LYS 93 1HE LYS 93 24.800 -11.301 -0.051 1865 2HE LYS 93 2HE LYS 93 23.425 -10.385 -0.697 1866 1HZ LYS 93 1HZ LYS 93 22.820 -9.696 1.481 1867 2HZ LYS 93 2HZ LYS 93 24.484 -9.394 1.332 1868 3HZ LYS 93 3HZ LYS 93 23.942 -10.745 2.207 1869 HA PRO 94 HA PRO 94 20.393 -17.473 -2.313 1870 1HB PRO 94 1HB PRO 94 22.768 -18.483 -0.839 1871 2HB PRO 94 2HB PRO 94 21.854 -19.248 -2.150 1872 1HG PRO 94 1HG PRO 94 24.307 -18.215 -2.516 1873 2HG PRO 94 2HG PRO 94 23.072 -18.203 -3.782 1874 1HD PRO 94 1HD PRO 94 24.040 -15.978 -2.057 1875 2HD PRO 94 2HD PRO 94 23.477 -15.945 -3.741 1876 H ILE 95 H ILE 95 18.957 -17.382 -0.630 1877 HA ILE 95 HA ILE 95 19.952 -16.417 2.027 1878 HB ILE 95 HB ILE 95 17.196 -16.401 0.741 1879 1HG1 ILE 95 1HG1 ILE 95 19.173 -14.167 1.290 1880 2HG1 ILE 95 2HG1 ILE 95 18.785 -14.827 -0.298 1881 1HG2 ILE 95 1HG2 ILE 95 16.485 -16.192 2.881 1882 2HG2 ILE 95 2HG2 ILE 95 17.230 -14.594 2.849 1883 3HG2 ILE 95 3HG2 ILE 95 18.128 -15.972 3.484 1884 1HD1 ILE 95 1HD1 ILE 95 17.456 -12.844 -0.043 1885 2HD1 ILE 95 2HD1 ILE 95 16.944 -13.321 1.576 1886 3HD1 ILE 95 3HD1 ILE 95 16.361 -14.209 0.169 1887 H ALA 96 H ALA 96 19.417 -17.631 3.881 1888 HA ALA 96 HA ALA 96 18.474 -20.412 3.356 1889 1HB ALA 96 1HB ALA 96 19.443 -20.680 5.721 1890 2HB ALA 96 2HB ALA 96 19.994 -19.011 5.576 1891 3HB ALA 96 3HB ALA 96 20.601 -20.239 4.465 1892 H ILE 97 H ILE 97 16.878 -21.347 4.811 1893 HA ILE 97 HA ILE 97 14.594 -19.730 5.309 1894 HB ILE 97 HB ILE 97 15.445 -22.341 6.617 1895 1HG1 ILE 97 1HG1 ILE 97 13.669 -22.759 4.446 1896 2HG1 ILE 97 2HG1 ILE 97 14.932 -21.680 3.860 1897 1HG2 ILE 97 1HG2 ILE 97 12.633 -21.909 5.884 1898 2HG2 ILE 97 2HG2 ILE 97 13.219 -20.783 7.108 1899 3HG2 ILE 97 3HG2 ILE 97 13.319 -22.521 7.389 1900 1HD1 ILE 97 1HD1 ILE 97 15.239 -24.345 3.874 1901 2HD1 ILE 97 2HD1 ILE 97 15.789 -24.008 5.515 1902 3HD1 ILE 97 3HD1 ILE 97 16.595 -23.249 4.143 1903 H GLY 98 H GLY 98 14.597 -18.053 6.761 1904 1HA GLY 98 1HA GLY 98 14.354 -17.585 9.208 1905 2HA GLY 98 2HA GLY 98 15.798 -18.569 9.453 1906 H GLU 99 H GLU 99 15.430 -16.287 6.796 1907 HA GLU 99 HA GLU 99 17.624 -14.643 8.015 1908 1HB GLU 99 1HB GLU 99 16.980 -15.708 5.308 1909 2HB GLU 99 2HB GLU 99 17.667 -14.084 5.352 1910 1HG GLU 99 1HG GLU 99 18.876 -16.496 6.737 1911 2HG GLU 99 2HG GLU 99 19.408 -15.873 5.176 1912 H GLU 100 H GLU 100 17.551 -12.296 7.161 1913 HA GLU 100 HA GLU 100 14.706 -11.350 7.181 1914 1HB GLU 100 1HB GLU 100 16.577 -10.797 8.978 1915 2HB GLU 100 2HB GLU 100 17.109 -9.633 7.764 1916 1HG GLU 100 1HG GLU 100 14.264 -9.443 7.982 1917 2HG GLU 100 2HG GLU 100 14.937 -9.392 9.610 1918 H ILE 101 H ILE 101 14.023 -10.016 5.498 1919 HA ILE 101 HA ILE 101 16.002 -9.583 3.298 1920 HB ILE 101 HB ILE 101 12.966 -9.649 3.246 1921 1HG1 ILE 101 1HG1 ILE 101 14.990 -11.797 2.560 1922 2HG1 ILE 101 2HG1 ILE 101 13.894 -11.817 3.940 1923 1HG2 ILE 101 1HG2 ILE 101 13.105 -9.245 1.020 1924 2HG2 ILE 101 2HG2 ILE 101 14.517 -10.285 0.836 1925 3HG2 ILE 101 3HG2 ILE 101 14.714 -8.622 1.388 1926 1HD1 ILE 101 1HD1 ILE 101 13.363 -12.836 1.387 1927 2HD1 ILE 101 2HD1 ILE 101 12.461 -11.322 1.455 1928 3HD1 ILE 101 3HD1 ILE 101 12.184 -12.568 2.672 1929 H THR 102 H THR 102 16.667 -7.541 3.018 1930 HA THR 102 HA THR 102 14.797 -5.265 3.383 1931 HB THR 102 HB THR 102 16.508 -4.159 4.855 1932 HG1 THR 102 HG1 THR 102 18.204 -5.389 5.600 1933 1HG2 THR 102 1HG2 THR 102 15.936 -5.371 6.852 1934 2HG2 THR 102 2HG2 THR 102 15.689 -6.863 5.945 1935 3HG2 THR 102 3HG2 THR 102 14.563 -5.519 5.755 1936 H ILE 103 H ILE 103 15.373 -3.526 1.997 1937 HA ILE 103 HA ILE 103 17.752 -4.036 0.246 1938 HB ILE 103 HB ILE 103 16.462 -2.817 -1.451 1939 1HG1 ILE 103 1HG1 ILE 103 13.941 -2.572 -0.092 1940 2HG1 ILE 103 2HG1 ILE 103 15.177 -1.713 0.828 1941 1HG2 ILE 103 1HG2 ILE 103 15.718 -5.271 -0.278 1942 2HG2 ILE 103 2HG2 ILE 103 15.330 -4.710 -1.905 1943 3HG2 ILE 103 3HG2 ILE 103 14.209 -4.408 -0.577 1944 1HD1 ILE 103 1HD1 ILE 103 14.040 -1.099 -1.820 1945 2HD1 ILE 103 2HD1 ILE 103 15.799 -0.999 -1.751 1946 3HD1 ILE 103 3HD1 ILE 103 14.817 -0.028 -0.654 1947 H SER 104 H SER 104 18.701 -1.934 -0.670 1948 HA SER 104 HA SER 104 19.116 -0.034 1.578 1949 1HB SER 104 1HB SER 104 20.735 -1.294 -0.300 1950 2HB SER 104 2HB SER 104 20.599 0.346 -0.934 1951 HG SER 104 HG SER 104 22.287 0.317 0.500 1952 H TYR 105 H TYR 105 19.767 2.284 0.296 1953 HA TYR 105 HA TYR 105 17.274 3.012 -1.215 1954 1HB TYR 105 1HB TYR 105 18.884 4.782 0.657 1955 2HB TYR 105 2HB TYR 105 17.270 5.088 0.020 1956 HD1 TYR 105 HD1 TYR 105 15.871 2.561 0.400 1957 HD2 TYR 105 HD2 TYR 105 18.688 4.533 2.975 1958 HE1 TYR 105 HE1 TYR 105 14.882 1.413 2.362 1959 HE2 TYR 105 HE2 TYR 105 17.698 3.385 4.937 1960 HH TYR 105 HH TYR 105 14.735 1.874 4.878 1961 H GLY 106 H GLY 106 20.486 4.427 -0.470 1962 1HA GLY 106 1HA GLY 106 22.133 5.276 -1.914 1963 2HA GLY 106 2HA GLY 106 21.342 4.403 -3.225 1964 H ASP 107 H ASP 107 22.008 6.536 -4.317 1965 HA ASP 107 HA ASP 107 21.266 8.486 -5.411 1966 1HB ASP 107 1HB ASP 107 19.103 6.975 -5.176 1967 2HB ASP 107 2HB ASP 107 18.617 8.210 -4.015 1968 H ASP 108 H ASP 108 19.448 8.608 -2.317 1969 HA ASP 108 HA ASP 108 21.098 10.957 -1.512 1970 1HB ASP 108 1HB ASP 108 18.430 10.949 -2.611 1971 2HB ASP 108 2HB ASP 108 18.349 11.495 -0.938 1972 H TYR 109 H TYR 109 18.555 8.623 -0.614 1973 HA TYR 109 HA TYR 109 18.250 9.073 2.101 1974 1HB TYR 109 1HB TYR 109 18.112 6.819 0.218 1975 2HB TYR 109 2HB TYR 109 18.383 6.312 1.884 1976 HD1 TYR 109 HD1 TYR 109 16.799 7.060 3.687 1977 HD2 TYR 109 HD2 TYR 109 16.011 7.722 -0.483 1978 HE1 TYR 109 HE1 TYR 109 14.411 7.481 4.205 1979 HE2 TYR 109 HE2 TYR 109 13.622 8.144 0.036 1980 HH TYR 109 HH TYR 109 12.018 7.863 1.661 1981 H TRP 110 H TRP 110 19.945 9.578 3.448 1982 HA TRP 110 HA TRP 110 21.942 9.332 4.665 1983 1HB TRP 110 1HB TRP 110 21.140 6.479 4.009 1984 2HB TRP 110 2HB TRP 110 22.389 6.889 5.185 1985 HD1 TRP 110 HD1 TRP 110 18.767 8.110 4.513 1986 HE1 TRP 110 HE1 TRP 110 17.552 8.278 6.781 1987 HE3 TRP 110 HE3 TRP 110 22.520 6.613 7.637 1988 HZ2 TRP 110 HZ2 TRP 110 18.100 7.834 9.553 1989 HZ3 TRP 110 HZ3 TRP 110 22.146 6.494 10.083 1990 HH2 TRP 110 HH2 TRP 110 19.944 7.103 11.045 1991 H LEU 111 H LEU 111 22.846 6.405 2.951 1992 HA LEU 111 HA LEU 111 25.221 7.823 1.906 1993 1HB LEU 111 1HB LEU 111 24.415 5.136 2.745 1994 2HB LEU 111 2HB LEU 111 25.327 5.110 1.235 1995 HG LEU 111 HG LEU 111 26.419 6.916 3.302 1996 1HD1 LEU 111 1HD1 LEU 111 25.577 4.354 4.126 1997 2HD1 LEU 111 2HD1 LEU 111 26.671 5.440 4.984 1998 3HD1 LEU 111 3HD1 LEU 111 27.319 4.227 3.880 1999 1HD2 LEU 111 1HD2 LEU 111 27.382 4.953 1.249 2000 2HD2 LEU 111 2HD2 LEU 111 28.473 5.431 2.550 2001 3HD2 LEU 111 3HD2 LEU 111 27.814 6.650 1.458 2002 H SER 112 H SER 112 25.918 6.645 -0.347 2003 HA SER 112 HA SER 112 23.570 6.614 -2.194 2004 1HB SER 112 1HB SER 112 25.470 8.718 -1.809 2005 2HB SER 112 2HB SER 112 25.790 7.999 -3.388 2006 HG SER 112 HG SER 112 23.992 8.793 -4.101 2007 H ARG 113 H ARG 113 27.124 6.217 -1.955 2008 HA ARG 113 HA ARG 113 26.864 3.741 -3.611 2009 1HB ARG 113 1HB ARG 113 27.655 6.067 -4.690 2010 2HB ARG 113 2HB ARG 113 29.200 5.580 -3.992 2011 1HG ARG 113 1HG ARG 113 28.143 3.264 -5.212 2012 2HG ARG 113 2HG ARG 113 27.882 4.575 -6.363 2013 1HD ARG 113 1HD ARG 113 30.232 5.149 -6.355 2014 2HD ARG 113 2HD ARG 113 30.547 4.046 -5.002 2015 HE ARG 113 HE ARG 113 29.375 2.403 -6.879 2016 1HH1 ARG 113 1HH1 ARG 113 32.026 4.658 -6.967 2017 2HH1 ARG 113 2HH1 ARG 113 32.868 3.789 -8.202 2018 1HH2 ARG 113 1HH2 ARG 113 30.489 1.292 -8.482 2019 2HH2 ARG 113 2HH2 ARG 113 32.007 1.898 -9.055 2020 HA PRO 114 HA PRO 114 29.565 3.519 0.281 2021 1HB PRO 114 1HB PRO 114 28.154 1.375 1.372 2022 2HB PRO 114 2HB PRO 114 27.910 3.073 1.818 2023 1HG PRO 114 1HG PRO 114 26.332 1.342 -0.010 2024 2HG PRO 114 2HG PRO 114 25.788 2.619 1.087 2025 1HD PRO 114 1HD PRO 114 25.983 2.956 -1.598 2026 2HD PRO 114 2HD PRO 114 26.210 4.283 -0.439 2027 H ARG 115 H ARG 115 28.211 1.266 -2.039 2028 HA ARG 115 HA ARG 115 29.123 -0.674 -3.034 2029 1HB ARG 115 1HB ARG 115 31.367 1.172 -2.299 2030 2HB ARG 115 2HB ARG 115 31.792 -0.440 -2.875 2031 1HG ARG 115 1HG ARG 115 29.936 1.466 -4.332 2032 2HG ARG 115 2HG ARG 115 31.643 1.246 -4.718 2033 1HD ARG 115 1HD ARG 115 30.616 -1.362 -4.623 2034 2HD ARG 115 2HD ARG 115 29.373 -0.419 -5.467 2035 HE ARG 115 HE ARG 115 32.005 0.323 -6.390 2036 1HH1 ARG 115 1HH1 ARG 115 29.598 -2.183 -6.603 2037 2HH1 ARG 115 2HH1 ARG 115 30.112 -2.695 -8.173 2038 1HH2 ARG 115 1HH2 ARG 115 32.653 -0.359 -8.426 2039 2HH2 ARG 115 2HH2 ARG 115 31.828 -1.671 -9.199 2040 H LEU 116 H LEU 116 28.206 -1.943 -1.159 2041 HA LEU 116 HA LEU 116 30.034 -2.667 1.025 2042 1HB LEU 116 1HB LEU 116 27.271 -2.626 0.516 2043 2HB LEU 116 2HB LEU 116 27.673 -4.339 0.631 2044 HG LEU 116 HG LEU 116 28.865 -2.527 2.677 2045 1HD1 LEU 116 1HD1 LEU 116 26.749 -1.621 2.963 2046 2HD1 LEU 116 2HD1 LEU 116 26.608 -3.059 3.975 2047 3HD1 LEU 116 3HD1 LEU 116 25.937 -3.059 2.344 2048 1HD2 LEU 116 1HD2 LEU 116 29.379 -4.591 3.430 2049 2HD2 LEU 116 2HD2 LEU 116 28.305 -5.346 2.252 2050 3HD2 LEU 116 3HD2 LEU 116 27.669 -4.803 3.805 2051 H THR 117 H THR 117 30.389 -5.084 1.437 2052 HA THR 117 HA THR 117 31.392 -7.103 0.738 2053 HB THR 117 HB THR 117 29.353 -6.589 -1.461 2054 HG1 THR 117 HG1 THR 117 28.562 -6.715 0.694 2055 1HG2 THR 117 1HG2 THR 117 31.050 -8.972 -0.767 2056 2HG2 THR 117 2HG2 THR 117 30.680 -8.297 -2.354 2057 3HG2 THR 117 3HG2 THR 117 29.452 -9.206 -1.474 2058 H GLN 118 H GLN 118 32.356 -4.370 -0.422 2059 HA GLN 118 HA GLN 118 34.468 -5.454 -2.069 2060 1HB GLN 118 1HB GLN 118 32.407 -5.597 -3.544 2061 2HB GLN 118 2HB GLN 118 32.312 -3.840 -3.476 2062 1HG GLN 118 1HG GLN 118 33.515 -4.299 -5.470 2063 2HG GLN 118 2HG GLN 118 34.754 -3.852 -4.297 2064 1HE2 GLN 118 1HE2 GLN 118 33.963 -6.202 -6.583 2065 2HE2 GLN 118 2HE2 GLN 118 34.943 -7.463 -6.008 2066 H ASN 119 H ASN 119 36.049 -3.836 -2.541 2067 HA ASN 119 HA ASN 119 37.221 -1.829 -2.110 2068 1HB ASN 119 1HB ASN 119 35.220 -1.288 -3.707 2069 2HB ASN 119 2HB ASN 119 34.503 -0.521 -2.291 2070 1HD2 ASN 119 1HD2 ASN 119 37.541 -0.504 -4.231 2071 2HD2 ASN 119 2HD2 ASN 119 37.891 1.131 -3.943 2072 1H GLY 201 1H GLY 201 25.812 36.120 12.545 2073 2H GLY 201 2H GLY 201 25.769 36.239 14.238 2074 3H GLY 201 3H GLY 201 24.369 35.803 13.382 2075 1HA GLY 201 1HA GLY 201 26.781 34.143 13.131 2076 2HA GLY 201 2HA GLY 201 25.763 33.983 14.562 2077 H LYS 202 H LYS 202 24.600 34.830 11.331 2078 HA LYS 202 HA LYS 202 23.078 32.243 11.311 2079 1HB LYS 202 1HB LYS 202 22.446 35.097 10.770 2080 2HB LYS 202 2HB LYS 202 21.714 33.938 9.661 2081 1HG LYS 202 1HG LYS 202 20.566 32.823 11.404 2082 2HG LYS 202 2HG LYS 202 21.589 33.538 12.649 2083 1HD LYS 202 1HD LYS 202 19.794 35.206 10.875 2084 2HD LYS 202 2HD LYS 202 19.243 34.537 12.411 2085 1HE LYS 202 1HE LYS 202 21.354 35.651 13.432 2086 2HE LYS 202 2HE LYS 202 21.410 36.589 11.927 2087 1HZ LYS 202 1HZ LYS 202 18.988 37.048 12.304 2088 2HZ LYS 202 2HZ LYS 202 20.027 37.779 13.431 2089 3HZ LYS 202 3HZ LYS 202 19.159 36.383 13.857 2090 H ALA 203 H ALA 203 25.096 34.460 9.467 2091 HA ALA 203 HA ALA 203 26.102 34.236 7.342 2092 1HB ALA 203 1HB ALA 203 26.987 32.029 6.994 2093 2HB ALA 203 2HB ALA 203 25.649 31.284 7.870 2094 3HB ALA 203 3HB ALA 203 26.862 32.221 8.743 2095 HA PRO 204 HA PRO 204 21.797 33.317 5.603 2096 1HB PRO 204 1HB PRO 204 22.186 36.032 4.461 2097 2HB PRO 204 2HB PRO 204 20.774 35.359 5.294 2098 1HG PRO 204 1HG PRO 204 22.396 37.177 6.431 2099 2HG PRO 204 2HG PRO 204 21.565 35.924 7.363 2100 1HD PRO 204 1HD PRO 204 24.425 36.109 6.566 2101 2HD PRO 204 2HD PRO 204 23.697 35.416 8.030 2102 H ARG 205 H ARG 205 24.633 34.980 4.223 2103 HA ARG 205 HA ARG 205 24.215 34.530 1.482 2104 1HB ARG 205 1HB ARG 205 26.465 34.943 3.356 2105 2HB ARG 205 2HB ARG 205 26.923 34.168 1.839 2106 1HG ARG 205 1HG ARG 205 25.595 36.016 0.665 2107 2HG ARG 205 2HG ARG 205 25.555 36.839 2.225 2108 1HD ARG 205 1HD ARG 205 28.245 35.896 1.540 2109 2HD ARG 205 2HD ARG 205 27.603 37.054 0.359 2110 HE ARG 205 HE ARG 205 26.936 38.021 2.940 2111 1HH1 ARG 205 1HH1 ARG 205 29.767 37.388 1.015 2112 2HH1 ARG 205 2HH1 ARG 205 30.700 38.627 1.782 2113 1HH2 ARG 205 1HH2 ARG 205 28.167 39.622 3.920 2114 2HH2 ARG 205 2HH2 ARG 205 29.803 39.883 3.414 2115 H LYS 206 H LYS 206 26.475 32.488 3.356 2116 HA LYS 206 HA LYS 206 26.239 30.282 1.498 2117 1HB LYS 206 1HB LYS 206 27.987 31.143 3.436 2118 2HB LYS 206 2HB LYS 206 27.212 29.785 4.252 2119 1HG LYS 206 1HG LYS 206 27.635 28.557 1.953 2120 2HG LYS 206 2HG LYS 206 28.870 29.799 1.749 2121 1HD LYS 206 1HD LYS 206 28.642 28.035 4.204 2122 2HD LYS 206 2HD LYS 206 29.715 27.693 2.846 2123 1HE LYS 206 1HE LYS 206 30.173 30.405 3.532 2124 2HE LYS 206 2HE LYS 206 30.145 29.501 5.058 2125 1HZ LYS 206 1HZ LYS 206 31.626 28.653 2.620 2126 2HZ LYS 206 2HZ LYS 206 31.672 27.907 4.144 2127 3HZ LYS 206 3HZ LYS 206 32.341 29.454 3.936 2128 H GLN 207 H GLN 207 26.113 28.123 3.414 2129 HA GLN 207 HA GLN 207 24.544 26.714 4.471 2130 1HB GLN 207 1HB GLN 207 24.203 29.368 5.462 2131 2HB GLN 207 2HB GLN 207 22.592 28.685 5.244 2132 1HG GLN 207 1HG GLN 207 22.932 27.668 7.241 2133 2HG GLN 207 2HG GLN 207 24.007 26.582 6.360 2134 1HE2 GLN 207 1HE2 GLN 207 24.480 27.238 9.114 2135 2HE2 GLN 207 2HE2 GLN 207 25.904 28.157 9.207 2136 H LEU 208 H LEU 208 22.304 29.282 3.410 2137 HA LEU 208 HA LEU 208 20.418 29.150 1.995 2138 1HB LEU 208 1HB LEU 208 22.503 27.377 0.694 2139 2HB LEU 208 2HB LEU 208 20.962 27.728 -0.087 2140 HG LEU 208 HG LEU 208 22.660 29.973 0.976 2141 1HD1 LEU 208 1HD1 LEU 208 24.298 29.133 -0.414 2142 2HD1 LEU 208 2HD1 LEU 208 23.348 30.011 -1.612 2143 3HD1 LEU 208 3HD1 LEU 208 23.142 28.269 -1.428 2144 1HD2 LEU 208 1HD2 LEU 208 20.259 29.615 -0.657 2145 2HD2 LEU 208 2HD2 LEU 208 21.447 30.666 -1.429 2146 3HD2 LEU 208 3HD2 LEU 208 20.839 31.055 0.180 2147 H ALA 209 H ALA 209 18.990 27.305 0.813 2148 HA ALA 209 HA ALA 209 18.291 25.401 2.960 2149 1HB ALA 209 1HB ALA 209 16.915 25.583 0.297 2150 2HB ALA 209 2HB ALA 209 16.819 26.970 1.383 2151 3HB ALA 209 3HB ALA 209 16.210 25.398 1.903 2152 H THR 210 H THR 210 17.771 23.106 2.306 2153 HA THR 210 HA THR 210 18.943 21.984 -0.107 2154 HB THR 210 HB THR 210 20.977 22.562 1.148 2155 HG1 THR 210 HG1 THR 210 21.048 20.609 0.051 2156 1HG2 THR 210 1HG2 THR 210 21.270 21.241 3.377 2157 2HG2 THR 210 2HG2 THR 210 19.509 21.141 3.362 2158 3HG2 THR 210 3HG2 THR 210 20.303 22.715 3.396 2159 H LYS 211 H LYS 211 18.662 19.610 -0.144 2160 HA LYS 211 HA LYS 211 17.374 18.254 2.097 2161 1HB LYS 211 1HB LYS 211 15.182 18.029 0.923 2162 2HB LYS 211 2HB LYS 211 15.564 19.715 1.274 2163 1HG LYS 211 1HG LYS 211 16.668 19.657 -1.118 2164 2HG LYS 211 2HG LYS 211 15.605 18.271 -1.360 2165 1HD LYS 211 1HD LYS 211 14.324 20.132 -2.085 2166 2HD LYS 211 2HD LYS 211 13.723 19.790 -0.463 2167 1HE LYS 211 1HE LYS 211 15.979 21.558 -0.238 2168 2HE LYS 211 2HE LYS 211 14.835 22.235 -1.412 2169 1HZ LYS 211 1HZ LYS 211 13.068 22.033 0.120 2170 2HZ LYS 211 2HZ LYS 211 14.345 22.718 1.008 2171 3HZ LYS 211 3HZ LYS 211 13.980 21.069 1.180 2172 H ALA 212 H ALA 212 17.939 16.131 1.871 2173 HA ALA 212 HA ALA 212 18.235 15.019 -0.896 2174 1HB ALA 212 1HB ALA 212 20.053 14.182 1.340 2175 2HB ALA 212 2HB ALA 212 20.338 15.750 0.585 2176 3HB ALA 212 3HB ALA 212 20.387 14.280 -0.388 2177 H ALA 213 H ALA 213 16.620 13.486 -0.980 2178 HA ALA 213 HA ALA 213 16.630 11.293 0.979 2179 1HB ALA 213 1HB ALA 213 14.377 11.739 1.785 2180 2HB ALA 213 2HB ALA 213 14.187 13.071 0.646 2181 3HB ALA 213 3HB ALA 213 15.321 13.214 1.989 2182 H ARG 214 H ARG 214 13.799 10.642 0.245 2183 HA ARG 214 HA ARG 214 12.641 9.453 -1.423 2184 1HB ARG 214 1HB ARG 214 14.383 11.081 -3.310 2185 2HB ARG 214 2HB ARG 214 12.806 10.378 -3.661 2186 1HG ARG 214 1HG ARG 214 12.572 12.009 -1.313 2187 2HG ARG 214 2HG ARG 214 13.365 12.951 -2.576 2188 1HD ARG 214 1HD ARG 214 11.510 12.159 -4.152 2189 2HD ARG 214 2HD ARG 214 10.668 11.571 -2.706 2190 HE ARG 214 HE ARG 214 11.060 14.375 -3.440 2191 1HH1 ARG 214 1HH1 ARG 214 10.637 12.116 -0.826 2192 2HH1 ARG 214 2HH1 ARG 214 10.002 13.311 0.251 2193 1HH2 ARG 214 1HH2 ARG 214 10.233 15.909 -2.025 2194 2HH2 ARG 214 2HH2 ARG 214 9.774 15.443 -0.421 2195 1HN MLZ 215 1HN MLZ 215 13.034 7.347 -1.909 2196 HA MLZ 215 HA MLZ 215 15.717 6.274 -2.025 2197 1HB MLZ 215 1HB MLZ 215 12.887 5.332 -2.288 2198 2HB MLZ 215 2HB MLZ 215 14.158 4.257 -2.869 2199 1HG MLZ 215 1HG MLZ 215 14.762 5.461 -0.260 2200 2HG MLZ 215 2HG MLZ 215 14.857 3.774 -0.767 2201 1HD MLZ 215 1HD MLZ 215 12.196 5.113 -0.281 2202 2HD MLZ 215 2HD MLZ 215 12.568 3.390 -0.311 2203 1HE MLZ 215 1HE MLZ 215 12.662 5.225 1.937 2204 2HE MLZ 215 2HE MLZ 215 14.239 4.452 1.690 2205 HZ MLZ 215 HZ MLZ 215 13.274 2.328 1.739 2206 1HCM MLZ 215 1HCM MLZ 215 13.285 3.747 3.889 2207 2HCM MLZ 215 2HCM MLZ 215 12.498 2.170 3.878 2208 3HCM MLZ 215 3HCM MLZ 215 11.534 3.637 3.715 2209 H SER 216 H SER 216 16.984 5.895 -3.810 2210 HA SER 216 HA SER 216 17.695 5.926 -6.059 2211 1HB SER 216 1HB SER 216 15.186 7.464 -6.709 2212 2HB SER 216 2HB SER 216 16.417 8.204 -5.685 2213 HG SER 216 HG SER 216 16.442 7.669 -8.374 2214 H ALA 217 H ALA 217 17.356 4.655 -7.919 2215 HA ALA 217 HA ALA 217 15.082 2.770 -7.768 2216 1HB ALA 217 1HB ALA 217 14.249 4.750 -9.015 2217 2HB ALA 217 2HB ALA 217 14.374 3.349 -10.078 2218 3HB ALA 217 3HB ALA 217 15.604 4.610 -10.135 2219 HA PRO 218 HA PRO 218 18.193 0.064 -9.308 2220 1HB PRO 218 1HB PRO 218 16.585 -1.707 -10.734 2221 2HB PRO 218 2HB PRO 218 16.841 -1.773 -8.982 2222 1HG PRO 218 1HG PRO 218 14.554 -0.675 -10.529 2223 2HG PRO 218 2HG PRO 218 14.565 -1.513 -8.972 2224 1HD PRO 218 1HD PRO 218 14.262 1.175 -9.212 2225 2HD PRO 218 2HD PRO 218 15.017 0.408 -7.800 2226 H ALA 219 H ALA 219 18.856 -0.965 -11.539 2227 HA ALA 219 HA ALA 219 19.297 1.046 -13.455 2228 1HB ALA 219 1HB ALA 219 20.249 -0.709 -14.684 2229 2HB ALA 219 2HB ALA 219 18.972 -1.841 -14.241 2230 3HB ALA 219 3HB ALA 219 20.215 -1.410 -13.066 2231 H THR 220 H THR 220 17.052 -1.710 -13.943 2232 HA THR 220 HA THR 220 15.088 -1.847 -15.249 2233 HB THR 220 HB THR 220 14.985 1.019 -14.235 2234 HG1 THR 220 HG1 THR 220 14.199 0.174 -12.449 2235 1HG2 THR 220 1HG2 THR 220 12.399 0.128 -14.400 2236 2HG2 THR 220 2HG2 THR 220 13.121 -0.640 -15.814 2237 3HG2 THR 220 3HG2 THR 220 13.189 1.113 -15.632 2238 H GLY 221 H GLY 221 16.963 -1.735 -17.052 2239 1HA GLY 221 1HA GLY 221 15.926 0.053 -19.126 2240 2HA GLY 221 2HA GLY 221 17.585 0.408 -18.643 2241 1HN SAH 301 1HN SAH 301 -9.937 -1.253 -7.674 2242 2HN SAH 301 2HN SAH 301 -8.406 -0.955 -8.347 2243 HA SAH 301 HA SAH 301 -9.072 1.530 -8.164 2244 1HB SAH 301 1HB SAH 301 -11.141 -0.053 -6.732 2245 2HB SAH 301 2HB SAH 301 -10.552 1.368 -5.874 2246 1HG SAH 301 1HG SAH 301 -12.419 1.269 -8.027 2247 2HG SAH 301 2HG SAH 301 -10.965 2.064 -8.629 2248 1H5* SAH 301 1H5* SAH 301 -14.022 2.257 -7.528 2249 2H5* SAH 301 2H5* SAH 301 -14.297 3.447 -6.258 2250 H4* SAH 301 H4* SAH 301 -13.348 4.993 -8.250 2251 H3* SAH 301 H3* SAH 301 -15.843 4.437 -6.900 2252 *HO3 SAH 301 *HO3 SAH 301 -16.063 6.726 -7.965 2253 H2* SAH 301 H2* SAH 301 -17.249 4.045 -8.597 2254 *HO2 SAH 301 *HO2 SAH 301 -17.737 5.679 -9.872 2255 H1* SAH 301 H1* SAH 301 -15.561 4.313 -10.910 2256 H8 SAH 301 H8 SAH 301 -15.617 1.286 -8.542 2257 1HN6 SAH 301 1HN6 SAH 301 -20.463 -0.746 -11.736 2258 2HN6 SAH 301 2HN6 SAH 301 -19.305 -1.144 -10.487 2259 H2 SAH 301 H2 SAH 301 -19.099 3.118 -13.582 2260 1HN SAH 302 1HN SAH 302 10.110 -1.249 7.743 2261 2HN SAH 302 2HN SAH 302 8.595 -0.957 8.450 2262 HA SAH 302 HA SAH 302 9.252 1.529 8.260 2263 1HB SAH 302 1HB SAH 302 11.293 -0.047 6.781 2264 2HB SAH 302 2HB SAH 302 10.684 1.375 5.937 2265 1HG SAH 302 1HG SAH 302 12.594 1.277 8.051 2266 2HG SAH 302 2HG SAH 302 11.151 2.065 8.685 2267 1H5* SAH 302 1H5* SAH 302 14.184 2.269 7.522 2268 2H5* SAH 302 2H5* SAH 302 14.430 3.463 6.249 2269 H4* SAH 302 H4* SAH 302 13.519 5.003 8.264 2270 H3* SAH 302 H3* SAH 302 15.986 4.455 6.861 2271 *HO3 SAH 302 *HO3 SAH 302 16.224 6.742 7.925 2272 H2* SAH 302 H2* SAH 302 17.427 4.062 8.527 2273 *HO2 SAH 302 *HO2 SAH 302 17.938 5.695 9.796 2274 H1* SAH 302 H1* SAH 302 15.788 4.322 10.876 2275 H8 SAH 302 H8 SAH 302 15.802 1.300 8.498 2276 1HN6 SAH 302 1HN6 SAH 302 20.719 -0.727 11.589 2277 2HN6 SAH 302 2HN6 SAH 302 19.537 -1.125 10.363 2278 H2 SAH 302 H2 SAH 302 19.383 3.131 13.471 Start of MODEL 9 1 1H MET 1 1H MET 1 1.191 -11.150 -5.041 2 2H MET 1 2H MET 1 1.451 -10.403 -6.543 3 3H MET 1 3H MET 1 0.978 -12.032 -6.476 4 HA MET 1 HA MET 1 -0.729 -9.861 -5.394 5 1HB MET 1 1HB MET 1 0.007 -10.628 -8.141 6 2HB MET 1 2HB MET 1 -1.734 -10.623 -7.866 7 1HG MET 1 1HG MET 1 -0.044 -8.318 -6.919 8 2HG MET 1 2HG MET 1 -0.565 -8.402 -8.601 9 1HE MET 1 1HE MET 1 -2.595 -6.842 -9.160 10 2HE MET 1 2HE MET 1 -1.415 -6.126 -8.061 11 3HE MET 1 3HE MET 1 -3.140 -5.896 -7.774 12 H PHE 2 H PHE 2 -1.356 -12.596 -7.565 13 HA PHE 2 HA PHE 2 -3.650 -13.563 -6.287 14 1HB PHE 2 1HB PHE 2 -2.939 -15.762 -7.417 15 2HB PHE 2 2HB PHE 2 -3.026 -14.348 -8.465 16 HD1 PHE 2 HD1 PHE 2 -1.145 -13.644 -9.689 17 HD2 PHE 2 HD2 PHE 2 -0.634 -16.352 -6.394 18 HE1 PHE 2 HE1 PHE 2 1.243 -13.928 -10.294 19 HE2 PHE 2 HE2 PHE 2 1.755 -16.636 -6.999 20 HZ PHE 2 HZ PHE 2 2.691 -15.422 -8.948 21 H ASN 3 H ASN 3 -4.045 -14.946 -4.565 22 HA ASN 3 HA ASN 3 -1.726 -16.216 -3.186 23 1HB ASN 3 1HB ASN 3 -2.422 -13.831 -2.360 24 2HB ASN 3 2HB ASN 3 -3.823 -14.653 -1.673 25 1HD2 ASN 3 1HD2 ASN 3 -3.095 -14.342 0.547 26 2HD2 ASN 3 2HD2 ASN 3 -1.757 -15.182 1.170 27 H ASP 4 H ASP 4 -2.297 -18.148 -2.151 28 HA ASP 4 HA ASP 4 -4.447 -19.701 -2.976 29 1HB ASP 4 1HB ASP 4 -3.946 -21.019 -0.918 30 2HB ASP 4 2HB ASP 4 -2.471 -20.480 -1.720 31 H ARG 5 H ARG 5 -4.413 -17.336 -0.335 32 HA ARG 5 HA ARG 5 -7.043 -18.084 0.684 33 1HB ARG 5 1HB ARG 5 -4.995 -15.919 1.083 34 2HB ARG 5 2HB ARG 5 -6.615 -15.681 1.739 35 1HG ARG 5 1HG ARG 5 -4.851 -18.089 2.283 36 2HG ARG 5 2HG ARG 5 -5.096 -16.741 3.393 37 1HD ARG 5 1HD ARG 5 -7.687 -17.583 2.629 38 2HD ARG 5 2HD ARG 5 -6.772 -19.059 2.993 39 HE ARG 5 HE ARG 5 -7.525 -17.020 4.918 40 1HH1 ARG 5 1HH1 ARG 5 -5.029 -19.282 4.035 41 2HH1 ARG 5 2HH1 ARG 5 -4.437 -19.428 5.653 42 1HH2 ARG 5 1HH2 ARG 5 -6.738 -17.227 7.010 43 2HH2 ARG 5 2HH2 ARG 5 -5.395 -18.275 7.326 44 H VAL 6 H VAL 6 -5.770 -15.445 -1.363 45 HA VAL 6 HA VAL 6 -8.430 -15.159 -2.626 46 HB VAL 6 HB VAL 6 -8.450 -12.712 -2.046 47 1HG1 VAL 6 1HG1 VAL 6 -9.572 -14.565 -0.655 48 2HG1 VAL 6 2HG1 VAL 6 -9.318 -13.014 0.145 49 3HG1 VAL 6 3HG1 VAL 6 -8.232 -14.364 0.474 50 1HG2 VAL 6 1HG2 VAL 6 -6.211 -13.450 -0.142 51 2HG2 VAL 6 2HG2 VAL 6 -6.910 -11.851 -0.394 52 3HG2 VAL 6 3HG2 VAL 6 -5.956 -12.607 -1.670 53 H ILE 7 H ILE 7 -8.265 -14.167 -4.690 54 HA ILE 7 HA ILE 7 -5.461 -13.595 -5.592 55 HB ILE 7 HB ILE 7 -6.562 -15.611 -6.541 56 1HG1 ILE 7 1HG1 ILE 7 -6.379 -13.352 -8.557 57 2HG1 ILE 7 2HG1 ILE 7 -4.999 -14.254 -7.933 58 1HG2 ILE 7 1HG2 ILE 7 -8.651 -13.578 -7.351 59 2HG2 ILE 7 2HG2 ILE 7 -8.880 -15.027 -6.372 60 3HG2 ILE 7 3HG2 ILE 7 -8.529 -15.172 -8.094 61 1HD1 ILE 7 1HD1 ILE 7 -5.354 -15.677 -9.659 62 2HD1 ILE 7 2HD1 ILE 7 -6.961 -15.023 -9.971 63 3HD1 ILE 7 3HD1 ILE 7 -6.737 -16.257 -8.731 64 H VAL 8 H VAL 8 -5.378 -11.961 -7.428 65 HA VAL 8 HA VAL 8 -7.107 -9.668 -6.743 66 HB VAL 8 HB VAL 8 -4.671 -9.411 -6.984 67 1HG1 VAL 8 1HG1 VAL 8 -5.056 -11.170 -9.170 68 2HG1 VAL 8 2HG1 VAL 8 -3.534 -10.475 -8.612 69 3HG1 VAL 8 3HG1 VAL 8 -4.477 -9.652 -9.855 70 1HG2 VAL 8 1HG2 VAL 8 -5.100 -7.901 -9.329 71 2HG2 VAL 8 2HG2 VAL 8 -5.235 -7.333 -7.664 72 3HG2 VAL 8 3HG2 VAL 8 -6.660 -7.947 -8.505 73 H LYS 9 H LYS 9 -8.933 -9.253 -7.853 74 HA LYS 9 HA LYS 9 -9.006 -9.682 -10.764 75 1HB LYS 9 1HB LYS 9 -10.363 -11.283 -8.756 76 2HB LYS 9 2HB LYS 9 -11.414 -10.739 -10.051 77 1HG LYS 9 1HG LYS 9 -9.933 -11.708 -11.707 78 2HG LYS 9 2HG LYS 9 -8.732 -12.080 -10.474 79 1HD LYS 9 1HD LYS 9 -10.378 -13.576 -9.372 80 2HD LYS 9 2HD LYS 9 -11.514 -13.262 -10.682 81 1HE LYS 9 1HE LYS 9 -9.693 -14.063 -12.276 82 2HE LYS 9 2HE LYS 9 -8.829 -14.652 -10.848 83 1HZ LYS 9 1HZ LYS 9 -10.435 -16.275 -11.913 84 2HZ LYS 9 2HZ LYS 9 -11.686 -15.267 -11.362 85 3HZ LYS 9 3HZ LYS 9 -10.645 -16.013 -10.248 86 H LYS 10 H LYS 10 -11.100 -6.757 -10.682 87 HA LYS 10 HA LYS 10 -10.318 -7.100 -12.837 88 1HB LYS 10 1HB LYS 10 -8.161 -8.058 -10.991 89 2HB LYS 10 2HB LYS 10 -7.958 -8.278 -12.723 90 1HG LYS 10 1HG LYS 10 -7.625 -6.068 -13.065 91 2HG LYS 10 2HG LYS 10 -8.955 -5.623 -11.995 92 1HD LYS 10 1HD LYS 10 -7.483 -5.099 -10.373 93 2HD LYS 10 2HD LYS 10 -6.863 -6.750 -10.395 94 1HE LYS 10 1HE LYS 10 -5.076 -6.198 -11.740 95 2HE LYS 10 2HE LYS 10 -6.003 -4.959 -12.605 96 1HZ LYS 10 1HZ LYS 10 -4.280 -4.107 -10.978 97 2HZ LYS 10 2HZ LYS 10 -5.268 -4.717 -9.739 98 3HZ LYS 10 3HZ LYS 10 -5.851 -3.498 -10.767 99 H SER 11 H SER 11 -12.226 -8.925 -11.900 100 HA SER 11 HA SER 11 -11.813 -11.664 -12.141 101 1HB SER 11 1HB SER 11 -13.987 -11.075 -11.627 102 2HB SER 11 2HB SER 11 -13.969 -9.685 -12.709 103 HG SER 11 HG SER 11 -15.261 -11.694 -13.257 104 HA PRO 12 HA PRO 12 -10.629 -12.739 -16.223 105 1HB PRO 12 1HB PRO 12 -13.138 -14.313 -16.568 106 2HB PRO 12 2HB PRO 12 -11.452 -14.847 -16.691 107 1HG PRO 12 1HG PRO 12 -13.009 -15.466 -14.592 108 2HG PRO 12 2HG PRO 12 -11.269 -15.206 -14.435 109 1HD PRO 12 1HD PRO 12 -13.516 -13.462 -13.617 110 2HD PRO 12 2HD PRO 12 -11.896 -13.630 -12.913 111 H LEU 13 H LEU 13 -13.817 -11.455 -15.626 112 HA LEU 13 HA LEU 13 -14.259 -10.780 -18.479 113 1HB LEU 13 1HB LEU 13 -15.798 -11.222 -16.083 114 2HB LEU 13 2HB LEU 13 -16.179 -9.620 -16.714 115 HG LEU 13 HG LEU 13 -17.651 -11.338 -17.710 116 1HD1 LEU 13 1HD1 LEU 13 -17.625 -10.195 -19.660 117 2HD1 LEU 13 2HD1 LEU 13 -16.020 -10.800 -20.072 118 3HD1 LEU 13 3HD1 LEU 13 -16.189 -9.375 -19.047 119 1HD2 LEU 13 1HD2 LEU 13 -15.772 -13.117 -17.513 120 2HD2 LEU 13 2HD2 LEU 13 -15.208 -12.484 -19.059 121 3HD2 LEU 13 3HD2 LEU 13 -16.821 -13.184 -18.929 122 H GLY 14 H GLY 14 -13.880 -9.083 -15.343 123 1HA GLY 14 1HA GLY 14 -12.193 -7.051 -16.073 124 2HA GLY 14 2HA GLY 14 -13.750 -6.474 -16.666 125 H GLY 15 H GLY 15 -12.592 -4.948 -14.749 126 1HA GLY 15 1HA GLY 15 -13.937 -3.988 -12.865 127 2HA GLY 15 2HA GLY 15 -14.142 -5.641 -12.285 128 H TYR 16 H TYR 16 -13.157 -4.187 -10.368 129 HA TYR 16 HA TYR 16 -10.310 -5.006 -10.189 130 1HB TYR 16 1HB TYR 16 -11.392 -2.185 -10.227 131 2HB TYR 16 2HB TYR 16 -9.923 -2.548 -9.324 132 HD1 TYR 16 HD1 TYR 16 -7.872 -3.195 -10.445 133 HD2 TYR 16 HD2 TYR 16 -11.455 -2.401 -12.677 134 HE1 TYR 16 HE1 TYR 16 -6.548 -3.107 -12.539 135 HE2 TYR 16 HE2 TYR 16 -10.130 -2.314 -14.772 136 HH TYR 16 HH TYR 16 -7.894 -3.286 -15.574 137 H GLY 17 H GLY 17 -11.069 -6.381 -8.466 138 1HA GLY 17 1HA GLY 17 -11.457 -4.975 -5.900 139 2HA GLY 17 2HA GLY 17 -12.758 -6.060 -6.388 140 H VAL 18 H VAL 18 -11.990 -7.136 -4.265 141 HA VAL 18 HA VAL 18 -9.530 -8.785 -4.701 142 HB VAL 18 HB VAL 18 -11.289 -8.195 -2.290 143 1HG1 VAL 18 1HG1 VAL 18 -10.176 -10.494 -2.335 144 2HG1 VAL 18 2HG1 VAL 18 -9.755 -9.466 -0.965 145 3HG1 VAL 18 3HG1 VAL 18 -8.632 -9.641 -2.314 146 1HG2 VAL 18 1HG2 VAL 18 -9.895 -6.309 -3.040 147 2HG2 VAL 18 2HG2 VAL 18 -8.470 -7.348 -3.029 148 3HG2 VAL 18 3HG2 VAL 18 -9.287 -6.956 -1.517 149 H PHE 19 H PHE 19 -9.844 -10.861 -5.423 150 HA PHE 19 HA PHE 19 -12.575 -11.961 -5.508 151 1HB PHE 19 1HB PHE 19 -10.173 -12.102 -6.998 152 2HB PHE 19 2HB PHE 19 -10.447 -13.729 -6.376 153 HD1 PHE 19 HD1 PHE 19 -12.422 -10.907 -7.881 154 HD2 PHE 19 HD2 PHE 19 -11.774 -15.147 -7.652 155 HE1 PHE 19 HE1 PHE 19 -14.171 -11.267 -9.603 156 HE2 PHE 19 HE2 PHE 19 -13.522 -15.508 -9.373 157 HZ PHE 19 HZ PHE 19 -14.716 -13.570 -10.354 158 H ALA 20 H ALA 20 -13.355 -13.412 -4.061 159 HA ALA 20 HA ALA 20 -11.528 -14.531 -2.000 160 1HB ALA 20 1HB ALA 20 -14.198 -13.506 -2.142 161 2HB ALA 20 2HB ALA 20 -13.327 -14.055 -0.710 162 3HB ALA 20 3HB ALA 20 -14.297 -15.195 -1.643 163 H ARG 21 H ARG 21 -10.578 -16.183 -3.433 164 HA ARG 21 HA ARG 21 -12.021 -18.103 -4.951 165 1HB ARG 21 1HB ARG 21 -9.364 -17.620 -3.926 166 2HB ARG 21 2HB ARG 21 -9.763 -19.324 -3.710 167 1HG ARG 21 1HG ARG 21 -10.036 -19.687 -6.000 168 2HG ARG 21 2HG ARG 21 -10.375 -17.988 -6.330 169 1HD ARG 21 1HD ARG 21 -8.121 -18.545 -7.146 170 2HD ARG 21 2HD ARG 21 -7.978 -17.462 -5.748 171 HE ARG 21 HE ARG 21 -8.028 -20.015 -4.640 172 1HH1 ARG 21 1HH1 ARG 21 -6.099 -18.383 -7.035 173 2HH1 ARG 21 2HH1 ARG 21 -4.685 -19.317 -6.692 174 1HH2 ARG 21 1HH2 ARG 21 -6.179 -21.215 -4.213 175 2HH2 ARG 21 2HH2 ARG 21 -4.727 -20.909 -5.107 176 H LYS 22 H LYS 22 -11.568 -17.742 -1.512 177 HA LYS 22 HA LYS 22 -12.488 -20.465 -0.855 178 1HB LYS 22 1HB LYS 22 -12.119 -18.022 0.926 179 2HB LYS 22 2HB LYS 22 -12.058 -19.712 1.413 180 1HG LYS 22 1HG LYS 22 -10.125 -19.705 -0.488 181 2HG LYS 22 2HG LYS 22 -9.974 -18.060 0.127 182 1HD LYS 22 1HD LYS 22 -8.628 -19.111 1.664 183 2HD LYS 22 2HD LYS 22 -10.177 -19.358 2.470 184 1HE LYS 22 1HE LYS 22 -9.149 -21.520 2.422 185 2HE LYS 22 2HE LYS 22 -10.323 -21.553 1.093 186 1HZ LYS 22 1HZ LYS 22 -8.619 -20.960 -0.451 187 2HZ LYS 22 2HZ LYS 22 -8.039 -22.278 0.448 188 3HZ LYS 22 3HZ LYS 22 -7.487 -20.709 0.790 189 H SER 23 H SER 23 -15.799 -19.409 0.450 190 HA SER 23 HA SER 23 -13.371 -21.066 0.959 191 1HB SER 23 1HB SER 23 -15.383 -22.314 0.554 192 2HB SER 23 2HB SER 23 -15.141 -22.366 2.300 193 HG SER 23 HG SER 23 -17.299 -21.692 1.273 194 H PHE 24 H PHE 24 -15.161 -18.402 2.226 195 HA PHE 24 HA PHE 24 -13.564 -18.556 4.752 196 1HB PHE 24 1HB PHE 24 -14.736 -16.344 3.054 197 2HB PHE 24 2HB PHE 24 -14.149 -16.028 4.678 198 HD1 PHE 24 HD1 PHE 24 -13.193 -15.429 1.561 199 HD2 PHE 24 HD2 PHE 24 -11.786 -17.733 4.903 200 HE1 PHE 24 HE1 PHE 24 -10.880 -15.288 0.682 201 HE2 PHE 24 HE2 PHE 24 -9.468 -17.591 4.022 202 HZ PHE 24 HZ PHE 24 -9.019 -16.366 1.911 203 H GLU 25 H GLU 25 -14.649 -18.376 6.740 204 HA GLU 25 HA GLU 25 -17.580 -18.770 6.671 205 1HB GLU 25 1HB GLU 25 -15.289 -19.225 8.483 206 2HB GLU 25 2HB GLU 25 -16.771 -18.744 9.305 207 1HG GLU 25 1HG GLU 25 -17.998 -20.569 8.329 208 2HG GLU 25 2HG GLU 25 -16.664 -20.959 7.245 209 H LYS 26 H LYS 26 -18.835 -17.509 8.428 210 HA LYS 26 HA LYS 26 -18.632 -14.685 7.902 211 1HB LYS 26 1HB LYS 26 -20.724 -15.843 8.428 212 2HB LYS 26 2HB LYS 26 -20.107 -16.312 10.000 213 1HG LYS 26 1HG LYS 26 -19.953 -13.954 10.657 214 2HG LYS 26 2HG LYS 26 -20.546 -13.459 9.080 215 1HD LYS 26 1HD LYS 26 -22.424 -15.274 9.889 216 2HD LYS 26 2HD LYS 26 -21.990 -14.520 11.413 217 1HE LYS 26 1HE LYS 26 -22.226 -12.280 10.111 218 2HE LYS 26 2HE LYS 26 -23.156 -13.238 8.944 219 1HZ LYS 26 1HZ LYS 26 -24.558 -12.336 10.746 220 2HZ LYS 26 2HZ LYS 26 -23.633 -13.195 11.882 221 3HZ LYS 26 3HZ LYS 26 -24.553 -14.034 10.727 222 H GLY 27 H GLY 27 -16.685 -13.769 8.598 223 1HA GLY 27 1HA GLY 27 -15.864 -12.507 10.612 224 2HA GLY 27 2HA GLY 27 -16.099 -13.998 11.524 225 H GLU 28 H GLU 28 -15.075 -15.485 9.023 226 HA GLU 28 HA GLU 28 -12.439 -15.996 9.836 227 1HB GLU 28 1HB GLU 28 -14.182 -16.922 7.961 228 2HB GLU 28 2HB GLU 28 -13.043 -16.069 6.919 229 1HG GLU 28 1HG GLU 28 -12.313 -18.173 8.982 230 2HG GLU 28 2HG GLU 28 -12.360 -18.422 7.236 231 H LEU 29 H LEU 29 -10.650 -14.712 9.815 232 HA LEU 29 HA LEU 29 -10.584 -12.096 8.630 233 1HB LEU 29 1HB LEU 29 -9.276 -13.188 10.603 234 2HB LEU 29 2HB LEU 29 -8.189 -13.799 9.359 235 HG LEU 29 HG LEU 29 -7.400 -11.645 10.323 236 1HD1 LEU 29 1HD1 LEU 29 -8.274 -11.018 7.524 237 2HD1 LEU 29 2HD1 LEU 29 -7.209 -12.397 7.798 238 3HD1 LEU 29 3HD1 LEU 29 -6.699 -10.779 8.282 239 1HD2 LEU 29 1HD2 LEU 29 -10.111 -10.967 10.181 240 2HD2 LEU 29 2HD2 LEU 29 -9.339 -9.969 8.949 241 3HD2 LEU 29 3HD2 LEU 29 -8.784 -9.892 10.621 242 H VAL 30 H VAL 30 -10.549 -11.795 6.432 243 HA VAL 30 HA VAL 30 -9.597 -13.792 4.559 244 HB VAL 30 HB VAL 30 -10.253 -10.831 4.326 245 1HG1 VAL 30 1HG1 VAL 30 -10.743 -11.946 1.872 246 2HG1 VAL 30 2HG1 VAL 30 -9.304 -12.834 2.375 247 3HG1 VAL 30 3HG1 VAL 30 -9.268 -11.073 2.288 248 1HG2 VAL 30 1HG2 VAL 30 -12.258 -12.253 3.106 249 2HG2 VAL 30 2HG2 VAL 30 -12.327 -11.655 4.763 250 3HG2 VAL 30 3HG2 VAL 30 -11.834 -13.318 4.446 251 H GLU 31 H GLU 31 -8.341 -10.557 5.470 252 HA GLU 31 HA GLU 31 -5.585 -11.431 5.480 253 1HB GLU 31 1HB GLU 31 -6.240 -11.550 3.039 254 2HB GLU 31 2HB GLU 31 -6.527 -9.810 3.087 255 1HG GLU 31 1HG GLU 31 -4.058 -9.846 4.146 256 2HG GLU 31 2HG GLU 31 -3.954 -11.313 3.173 257 H GLU 32 H GLU 32 -4.266 -9.793 6.348 258 HA GLU 32 HA GLU 32 -5.579 -7.128 6.772 259 1HB GLU 32 1HB GLU 32 -4.424 -7.198 9.002 260 2HB GLU 32 2HB GLU 32 -5.583 -8.512 8.795 261 1HG GLU 32 1HG GLU 32 -3.830 -10.082 8.290 262 2HG GLU 32 2HG GLU 32 -2.630 -8.794 8.180 263 H CYS 33 H CYS 33 -4.054 -5.330 6.984 264 HA CYS 33 HA CYS 33 -1.250 -5.842 6.145 265 1HB CYS 33 1HB CYS 33 -1.573 -4.243 4.239 266 2HB CYS 33 2HB CYS 33 -2.570 -5.688 4.076 267 HG CYS 33 HG CYS 33 -3.625 -2.846 4.733 268 H LEU 34 H LEU 34 -0.357 -3.351 5.707 269 HA LEU 34 HA LEU 34 -0.899 -1.943 8.282 270 1HB LEU 34 1HB LEU 34 1.310 -1.585 6.221 271 2HB LEU 34 2HB LEU 34 1.299 -0.948 7.864 272 HG LEU 34 HG LEU 34 1.313 -3.885 7.098 273 1HD1 LEU 34 1HD1 LEU 34 3.534 -3.404 8.628 274 2HD1 LEU 34 2HD1 LEU 34 3.405 -1.898 7.718 275 3HD1 LEU 34 3HD1 LEU 34 3.531 -3.437 6.865 276 1HD2 LEU 34 1HD2 LEU 34 1.406 -2.529 9.811 277 2HD2 LEU 34 2HD2 LEU 34 1.571 -4.262 9.528 278 3HD2 LEU 34 3HD2 LEU 34 0.047 -3.451 9.168 279 H CYS 35 H CYS 35 -0.844 0.533 8.105 280 HA CYS 35 HA CYS 35 -1.805 1.544 5.468 281 1HB CYS 35 1HB CYS 35 -3.249 1.642 8.138 282 2HB CYS 35 2HB CYS 35 -3.716 2.630 6.754 283 HG CYS 35 HG CYS 35 -4.152 0.372 5.420 284 H ILE 36 H ILE 36 -1.819 3.947 5.415 285 HA ILE 36 HA ILE 36 0.379 5.054 7.086 286 HB ILE 36 HB ILE 36 -1.190 6.263 4.781 287 1HG1 ILE 36 1HG1 ILE 36 1.492 4.857 4.667 288 2HG1 ILE 36 2HG1 ILE 36 -0.030 4.071 4.248 289 1HG2 ILE 36 1HG2 ILE 36 1.614 7.014 5.184 290 2HG2 ILE 36 2HG2 ILE 36 0.582 7.440 6.549 291 3HG2 ILE 36 3HG2 ILE 36 0.202 8.041 4.935 292 1HD1 ILE 36 1HD1 ILE 36 0.646 6.704 2.976 293 2HD1 ILE 36 2HD1 ILE 36 -0.340 5.383 2.349 294 3HD1 ILE 36 3HD1 ILE 36 1.417 5.238 2.371 295 H VAL 37 H VAL 37 0.050 6.892 8.434 296 HA VAL 37 HA VAL 37 -2.827 7.561 8.962 297 HB VAL 37 HB VAL 37 -0.481 7.345 10.887 298 1HG1 VAL 37 1HG1 VAL 37 -3.451 7.570 11.449 299 2HG1 VAL 37 2HG1 VAL 37 -2.335 8.935 11.512 300 3HG1 VAL 37 3HG1 VAL 37 -2.142 7.585 12.631 301 1HG2 VAL 37 1HG2 VAL 37 -1.203 5.167 9.896 302 2HG2 VAL 37 2HG2 VAL 37 -2.839 5.481 10.474 303 3HG2 VAL 37 3HG2 VAL 37 -1.522 5.264 11.628 304 H ARG 38 H ARG 38 -2.702 9.482 7.643 305 HA ARG 38 HA ARG 38 -0.895 11.625 8.721 306 1HB ARG 38 1HB ARG 38 -2.134 11.238 5.973 307 2HB ARG 38 2HB ARG 38 -1.039 12.543 6.421 308 1HG ARG 38 1HG ARG 38 -0.303 9.618 6.673 309 2HG ARG 38 2HG ARG 38 0.046 10.572 5.231 310 1HD ARG 38 1HD ARG 38 1.282 12.213 6.690 311 2HD ARG 38 2HD ARG 38 1.060 11.098 8.047 312 HE ARG 38 HE ARG 38 2.120 9.749 5.704 313 1HH1 ARG 38 1HH1 ARG 38 2.945 11.744 8.435 314 2HH1 ARG 38 2HH1 ARG 38 4.581 11.185 8.489 315 1HH2 ARG 38 1HH2 ARG 38 4.247 9.039 5.794 316 2HH2 ARG 38 2HH2 ARG 38 5.315 9.665 7.006 317 H HIS 39 H HIS 39 -1.886 13.865 8.426 318 HA HIS 39 HA HIS 39 -4.668 13.854 9.408 319 1HB HIS 39 1HB HIS 39 -2.313 15.410 9.687 320 2HB HIS 39 2HB HIS 39 -3.495 16.456 8.900 321 HD1 HIS 39 HD1 HIS 39 -4.287 17.867 10.840 322 HD2 HIS 39 HD2 HIS 39 -4.358 13.794 11.723 323 HE1 HIS 39 HE1 HIS 39 -5.444 17.640 13.082 324 H ASN 40 H ASN 40 -5.908 15.960 8.398 325 HA ASN 40 HA ASN 40 -6.534 15.237 5.662 326 1HB ASN 40 1HB ASN 40 -7.270 17.653 7.355 327 2HB ASN 40 2HB ASN 40 -8.132 17.107 5.917 328 1HD2 ASN 40 1HD2 ASN 40 -8.352 14.381 6.265 329 2HD2 ASN 40 2HD2 ASN 40 -9.184 14.020 7.699 330 H ASP 41 H ASP 41 -6.856 18.301 5.066 331 HA ASP 41 HA ASP 41 -5.631 19.987 3.968 332 1HB ASP 41 1HB ASP 41 -4.171 19.278 6.162 333 2HB ASP 41 2HB ASP 41 -3.019 18.903 4.881 334 H ASP 42 H ASP 42 -2.848 19.526 2.964 335 HA ASP 42 HA ASP 42 -3.287 18.722 0.353 336 1HB ASP 42 1HB ASP 42 -0.843 18.225 2.093 337 2HB ASP 42 2HB ASP 42 -0.838 18.307 0.332 338 H TRP 43 H TRP 43 -2.657 16.606 3.133 339 HA TRP 43 HA TRP 43 -2.151 14.153 1.847 340 1HB TRP 43 1HB TRP 43 -2.021 14.462 4.248 341 2HB TRP 43 2HB TRP 43 -3.723 14.905 4.337 342 HD1 TRP 43 HD1 TRP 43 -5.282 13.036 5.023 343 HE1 TRP 43 HE1 TRP 43 -5.217 10.458 4.982 344 HE3 TRP 43 HE3 TRP 43 -0.801 12.297 2.680 345 HZ2 TRP 43 HZ2 TRP 43 -3.494 8.362 4.075 346 HZ3 TRP 43 HZ3 TRP 43 0.024 10.001 2.243 347 HH2 TRP 43 HH2 TRP 43 -1.316 8.035 2.937 348 H GLY 44 H GLY 44 -5.365 15.352 2.919 349 1HA GLY 44 1HA GLY 44 -6.870 13.303 1.644 350 2HA GLY 44 2HA GLY 44 -7.510 14.882 2.100 351 H THR 45 H THR 45 -5.551 16.332 0.420 352 HA THR 45 HA THR 45 -7.082 16.412 -2.025 353 HB THR 45 HB THR 45 -4.276 17.461 -1.585 354 HG1 THR 45 HG1 THR 45 -5.270 19.213 -0.536 355 1HG2 THR 45 1HG2 THR 45 -6.663 18.200 -3.254 356 2HG2 THR 45 2HG2 THR 45 -4.975 18.042 -3.739 357 3HG2 THR 45 3HG2 THR 45 -5.496 19.443 -2.803 358 H ALA 46 H ALA 46 -3.593 15.642 -1.655 359 HA ALA 46 HA ALA 46 -3.308 14.449 -4.230 360 1HB ALA 46 1HB ALA 46 -1.358 15.125 -3.058 361 2HB ALA 46 2HB ALA 46 -1.293 13.366 -2.961 362 3HB ALA 46 3HB ALA 46 -1.859 14.305 -1.580 363 H LEU 47 H LEU 47 -3.736 12.896 -1.027 364 HA LEU 47 HA LEU 47 -4.214 10.288 -2.340 365 1HB LEU 47 1HB LEU 47 -3.916 11.292 0.509 366 2HB LEU 47 2HB LEU 47 -4.329 9.618 0.151 367 HG LEU 47 HG LEU 47 -1.934 9.745 0.456 368 1HD1 LEU 47 1HD1 LEU 47 -1.766 9.696 -2.457 369 2HD1 LEU 47 2HD1 LEU 47 -3.143 8.774 -1.855 370 3HD1 LEU 47 3HD1 LEU 47 -1.516 8.391 -1.297 371 1HD2 LEU 47 1HD2 LEU 47 -1.757 11.747 -1.793 372 2HD2 LEU 47 2HD2 LEU 47 -0.520 11.307 -0.617 373 3HD2 LEU 47 3HD2 LEU 47 -1.913 12.260 -0.113 374 H GLU 48 H GLU 48 -6.229 12.452 -2.670 375 HA GLU 48 HA GLU 48 -8.445 12.247 -0.971 376 1HB GLU 48 1HB GLU 48 -7.745 13.500 -3.296 377 2HB GLU 48 2HB GLU 48 -9.032 12.423 -3.835 378 1HG GLU 48 1HG GLU 48 -9.480 13.922 -1.309 379 2HG GLU 48 2HG GLU 48 -9.537 14.851 -2.806 380 H ASP 49 H ASP 49 -7.215 9.841 -3.157 381 HA ASP 49 HA ASP 49 -9.801 8.346 -3.035 382 1HB ASP 49 1HB ASP 49 -7.438 8.500 -4.883 383 2HB ASP 49 2HB ASP 49 -8.384 7.012 -4.851 384 H TYR 50 H TYR 50 -9.712 6.064 -2.528 385 HA TYR 50 HA TYR 50 -9.025 4.217 -1.229 386 1HB TYR 50 1HB TYR 50 -6.283 5.244 -2.048 387 2HB TYR 50 2HB TYR 50 -6.701 3.587 -1.632 388 HD1 TYR 50 HD1 TYR 50 -5.350 4.252 -4.180 389 HD2 TYR 50 HD2 TYR 50 -9.541 4.107 -3.232 390 HE1 TYR 50 HE1 TYR 50 -5.876 3.783 -6.556 391 HE2 TYR 50 HE2 TYR 50 -10.060 3.640 -5.607 392 HH TYR 50 HH TYR 50 -8.446 2.466 -7.638 393 H LEU 51 H LEU 51 -9.139 7.004 0.022 394 HA LEU 51 HA LEU 51 -7.158 6.609 2.226 395 1HB LEU 51 1HB LEU 51 -7.557 8.746 0.678 396 2HB LEU 51 2HB LEU 51 -8.837 9.070 1.845 397 HG LEU 51 HG LEU 51 -7.200 8.930 3.686 398 1HD1 LEU 51 1HD1 LEU 51 -5.238 7.880 3.372 399 2HD1 LEU 51 2HD1 LEU 51 -4.765 9.109 2.199 400 3HD1 LEU 51 3HD1 LEU 51 -5.625 7.666 1.664 401 1HD2 LEU 51 1HD2 LEU 51 -5.635 10.868 2.635 402 2HD2 LEU 51 2HD2 LEU 51 -7.304 11.154 3.131 403 3HD2 LEU 51 3HD2 LEU 51 -6.928 10.853 1.435 404 H PHE 52 H PHE 52 -8.155 5.340 3.777 405 HA PHE 52 HA PHE 52 -11.007 5.753 4.454 406 1HB PHE 52 1HB PHE 52 -8.789 3.899 5.394 407 2HB PHE 52 2HB PHE 52 -10.421 3.855 6.060 408 HD1 PHE 52 HD1 PHE 52 -12.100 2.607 4.992 409 HD2 PHE 52 HD2 PHE 52 -8.557 3.690 2.819 410 HE1 PHE 52 HE1 PHE 52 -12.838 1.200 3.088 411 HE2 PHE 52 HE2 PHE 52 -9.295 2.283 0.914 412 HZ PHE 52 HZ PHE 52 -11.436 1.038 1.049 413 H SER 53 H SER 53 -11.269 7.645 5.645 414 HA SER 53 HA SER 53 -9.288 8.221 7.804 415 1HB SER 53 1HB SER 53 -9.522 10.076 6.372 416 2HB SER 53 2HB SER 53 -11.244 9.788 6.130 417 HG SER 53 HG SER 53 -10.057 10.600 8.572 418 H ARG 54 H ARG 54 -9.996 8.573 9.945 419 HA ARG 54 HA ARG 54 -12.811 7.690 10.507 420 1HB ARG 54 1HB ARG 54 -11.815 6.915 12.673 421 2HB ARG 54 2HB ARG 54 -11.061 6.147 11.276 422 1HG ARG 54 1HG ARG 54 -9.098 7.385 11.488 423 2HG ARG 54 2HG ARG 54 -9.898 8.696 12.354 424 1HD ARG 54 1HD ARG 54 -9.542 5.915 13.521 425 2HD ARG 54 2HD ARG 54 -8.422 7.256 13.825 426 HE ARG 54 HE ARG 54 -10.979 8.299 14.302 427 1HH1 ARG 54 1HH1 ARG 54 -9.030 5.691 15.535 428 2HH1 ARG 54 2HH1 ARG 54 -9.745 5.754 17.108 429 1HH2 ARG 54 1HH2 ARG 54 -11.892 8.361 16.351 430 2HH2 ARG 54 2HH2 ARG 54 -11.353 7.254 17.569 431 H LYS 55 H LYS 55 -13.107 8.507 13.077 432 HA LYS 55 HA LYS 55 -13.335 11.394 12.819 433 1HB LYS 55 1HB LYS 55 -14.724 9.433 14.063 434 2HB LYS 55 2HB LYS 55 -13.733 9.970 15.420 435 1HG LYS 55 1HG LYS 55 -14.564 12.356 14.303 436 2HG LYS 55 2HG LYS 55 -15.977 11.323 14.092 437 1HD LYS 55 1HD LYS 55 -15.418 10.657 16.612 438 2HD LYS 55 2HD LYS 55 -14.659 12.248 16.613 439 1HE LYS 55 1HE LYS 55 -17.259 12.365 15.317 440 2HE LYS 55 2HE LYS 55 -17.398 11.717 16.963 441 1HZ LYS 55 1HZ LYS 55 -16.165 13.546 17.819 442 2HZ LYS 55 2HZ LYS 55 -17.372 14.205 16.822 443 3HZ LYS 55 3HZ LYS 55 -15.771 14.104 16.264 444 H ASN 56 H ASN 56 -10.958 11.744 12.613 445 HA ASN 56 HA ASN 56 -9.224 11.297 14.906 446 1HB ASN 56 1HB ASN 56 -9.886 14.153 14.331 447 2HB ASN 56 2HB ASN 56 -10.947 13.220 15.378 448 1HD2 ASN 56 1HD2 ASN 56 -10.314 14.376 17.327 449 2HD2 ASN 56 2HD2 ASN 56 -8.765 14.207 18.001 450 H MET 57 H MET 57 -9.305 11.032 11.885 451 HA MET 57 HA MET 57 -7.527 12.998 10.734 452 1HB MET 57 1HB MET 57 -5.440 11.698 10.873 453 2HB MET 57 2HB MET 57 -6.053 12.037 12.490 454 1HG MET 57 1HG MET 57 -7.319 9.660 11.767 455 2HG MET 57 2HG MET 57 -5.683 9.485 11.152 456 1HE MET 57 1HE MET 57 -4.473 11.716 13.700 457 2HE MET 57 2HE MET 57 -3.770 10.620 12.511 458 3HE MET 57 3HE MET 57 -3.513 10.336 14.232 459 H SER 58 H SER 58 -6.054 11.450 8.986 460 HA SER 58 HA SER 58 -8.084 9.712 7.630 461 1HB SER 58 1HB SER 58 -8.114 11.758 6.435 462 2HB SER 58 2HB SER 58 -6.377 11.995 6.628 463 HG SER 58 HG SER 58 -7.785 10.378 4.848 464 H ALA 59 H ALA 59 -7.227 7.821 6.731 465 HA ALA 59 HA ALA 59 -4.245 7.499 6.811 466 1HB ALA 59 1HB ALA 59 -5.393 6.501 8.779 467 2HB ALA 59 2HB ALA 59 -4.660 5.256 7.766 468 3HB ALA 59 3HB ALA 59 -6.399 5.542 7.694 469 H MET 60 H MET 60 -3.401 6.101 5.183 470 HA MET 60 HA MET 60 -5.195 5.679 2.856 471 1HB MET 60 1HB MET 60 -3.052 6.780 2.502 472 2HB MET 60 2HB MET 60 -2.201 5.488 3.345 473 1HG MET 60 1HG MET 60 -1.954 5.210 0.922 474 2HG MET 60 2HG MET 60 -2.917 3.890 1.585 475 1HE MET 60 1HE MET 60 -2.447 6.905 -0.135 476 2HE MET 60 2HE MET 60 -4.005 7.629 -0.531 477 3HE MET 60 3HE MET 60 -3.274 6.456 -1.627 478 H ALA 61 H ALA 61 -5.330 3.577 1.821 479 HA ALA 61 HA ALA 61 -5.208 1.324 3.722 480 1HB ALA 61 1HB ALA 61 -5.873 0.705 0.950 481 2HB ALA 61 2HB ALA 61 -6.747 2.133 1.504 482 3HB ALA 61 3HB ALA 61 -6.901 0.610 2.380 483 H LEU 62 H LEU 62 -2.930 0.980 3.968 484 HA LEU 62 HA LEU 62 -0.874 -0.037 3.418 485 1HB LEU 62 1HB LEU 62 -0.761 0.925 0.695 486 2HB LEU 62 2HB LEU 62 -1.501 2.153 1.721 487 HG LEU 62 HG LEU 62 0.425 1.804 3.339 488 1HD1 LEU 62 1HD1 LEU 62 0.926 -0.396 1.718 489 2HD1 LEU 62 2HD1 LEU 62 2.033 0.269 2.919 490 3HD1 LEU 62 3HD1 LEU 62 2.165 0.761 1.230 491 1HD2 LEU 62 1HD2 LEU 62 0.221 3.621 1.514 492 2HD2 LEU 62 2HD2 LEU 62 1.388 2.658 0.608 493 3HD2 LEU 62 3HD2 LEU 62 1.826 3.324 2.181 494 H GLY 63 H GLY 63 -2.325 -2.107 3.335 495 1HA GLY 63 1HA GLY 63 -1.451 -3.734 1.175 496 2HA GLY 63 2HA GLY 63 -2.713 -4.185 2.318 497 H PHE 64 H PHE 64 -3.902 -5.157 0.547 498 HA PHE 64 HA PHE 64 -4.840 -3.400 -1.632 499 1HB PHE 64 1HB PHE 64 -5.110 -6.313 -0.855 500 2HB PHE 64 2HB PHE 64 -6.021 -5.640 -2.206 501 HD1 PHE 64 HD1 PHE 64 -2.536 -5.845 -0.846 502 HD2 PHE 64 HD2 PHE 64 -5.032 -5.527 -4.327 503 HE1 PHE 64 HE1 PHE 64 -0.538 -6.067 -2.298 504 HE2 PHE 64 HE2 PHE 64 -3.035 -5.750 -5.780 505 HZ PHE 64 HZ PHE 64 -0.788 -6.019 -4.766 506 H GLY 65 H GLY 65 -5.842 -2.275 0.641 507 1HA GLY 65 1HA GLY 65 -8.547 -3.388 1.107 508 2HA GLY 65 2HA GLY 65 -7.810 -2.071 2.015 509 H ALA 66 H ALA 66 -7.028 -1.017 -0.866 510 HA ALA 66 HA ALA 66 -9.428 0.695 -1.046 511 1HB ALA 66 1HB ALA 66 -7.233 1.714 -0.990 512 2HB ALA 66 2HB ALA 66 -7.875 1.944 -2.617 513 3HB ALA 66 3HB ALA 66 -6.671 0.692 -2.313 514 H ILE 67 H ILE 67 -8.733 -2.233 -2.441 515 HA ILE 67 HA ILE 67 -9.487 -1.527 -5.210 516 HB ILE 67 HB ILE 67 -9.096 -4.222 -3.862 517 1HG1 ILE 67 1HG1 ILE 67 -6.850 -3.734 -5.350 518 2HG1 ILE 67 2HG1 ILE 67 -7.229 -2.126 -4.731 519 1HG2 ILE 67 1HG2 ILE 67 -10.062 -3.567 -6.401 520 2HG2 ILE 67 2HG2 ILE 67 -9.419 -5.131 -5.905 521 3HG2 ILE 67 3HG2 ILE 67 -8.361 -3.946 -6.670 522 1HD1 ILE 67 1HD1 ILE 67 -7.426 -4.372 -2.796 523 2HD1 ILE 67 2HD1 ILE 67 -6.855 -2.721 -2.552 524 3HD1 ILE 67 3HD1 ILE 67 -5.802 -3.914 -3.313 525 H PHE 68 H PHE 68 -11.043 -2.613 -2.304 526 HA PHE 68 HA PHE 68 -13.218 -4.077 -3.250 527 1HB PHE 68 1HB PHE 68 -13.157 -1.921 -1.106 528 2HB PHE 68 2HB PHE 68 -14.326 -3.235 -1.200 529 HD1 PHE 68 HD1 PHE 68 -11.897 -2.367 0.835 530 HD2 PHE 68 HD2 PHE 68 -12.622 -5.516 -1.994 531 HE1 PHE 68 HE1 PHE 68 -10.343 -3.844 2.080 532 HE2 PHE 68 HE2 PHE 68 -11.069 -6.993 -0.748 533 HZ PHE 68 HZ PHE 68 -9.927 -6.157 1.289 534 H ASN 69 H ASN 69 -15.231 -3.544 -4.166 535 HA ASN 69 HA ASN 69 -15.514 -0.721 -5.149 536 1HB ASN 69 1HB ASN 69 -16.754 -3.287 -6.208 537 2HB ASN 69 2HB ASN 69 -16.727 -1.720 -7.012 538 1HD2 ASN 69 1HD2 ASN 69 -14.494 -4.272 -5.812 539 2HD2 ASN 69 2HD2 ASN 69 -13.333 -4.029 -6.992 540 H HIS 70 H HIS 70 -18.219 -0.997 -5.926 541 HA HIS 70 HA HIS 70 -19.579 -1.062 -3.266 542 1HB HIS 70 1HB HIS 70 -19.727 1.028 -4.516 543 2HB HIS 70 2HB HIS 70 -20.239 0.170 -5.969 544 HD1 HIS 70 HD1 HIS 70 -21.476 0.194 -2.346 545 HD2 HIS 70 HD2 HIS 70 -22.964 0.451 -6.232 546 HE1 HIS 70 HE1 HIS 70 -23.992 0.395 -2.138 547 H SER 71 H SER 71 -21.180 -2.607 -2.911 548 HA SER 71 HA SER 71 -22.342 -4.064 -5.219 549 1HB SER 71 1HB SER 71 -21.015 -5.573 -2.961 550 2HB SER 71 2HB SER 71 -21.433 -6.158 -4.571 551 HG SER 71 HG SER 71 -19.290 -5.771 -4.651 552 H LYS 72 H LYS 72 -23.424 -2.285 -3.123 553 HA LYS 72 HA LYS 72 -25.288 -2.198 -1.681 554 1HB LYS 72 1HB LYS 72 -25.610 -4.566 -3.443 555 2HB LYS 72 2HB LYS 72 -26.605 -4.578 -1.988 556 1HG LYS 72 1HG LYS 72 -26.448 -2.273 -3.953 557 2HG LYS 72 2HG LYS 72 -27.743 -3.469 -3.911 558 1HD LYS 72 1HD LYS 72 -27.995 -2.799 -1.419 559 2HD LYS 72 2HD LYS 72 -27.047 -1.377 -1.853 560 1HE LYS 72 1HE LYS 72 -29.035 -0.453 -2.483 561 2HE LYS 72 2HE LYS 72 -28.956 -1.536 -3.885 562 1HZ LYS 72 1HZ LYS 72 -30.100 -2.212 -1.220 563 2HZ LYS 72 2HZ LYS 72 -30.003 -3.268 -2.546 564 3HZ LYS 72 3HZ LYS 72 -30.999 -1.895 -2.625 565 H ASP 73 H ASP 73 -24.887 -5.715 -1.466 566 HA ASP 73 HA ASP 73 -24.351 -5.415 1.454 567 1HB ASP 73 1HB ASP 73 -25.094 -7.819 -0.254 568 2HB ASP 73 2HB ASP 73 -25.072 -7.771 1.508 569 HA PRO 74 HA PRO 74 -20.143 -6.209 -0.225 570 1HB PRO 74 1HB PRO 74 -18.967 -5.481 2.219 571 2HB PRO 74 2HB PRO 74 -19.211 -4.399 0.838 572 1HG PRO 74 1HG PRO 74 -20.814 -4.705 3.318 573 2HG PRO 74 2HG PRO 74 -20.475 -3.255 2.363 574 1HD PRO 74 1HD PRO 74 -22.859 -4.514 2.289 575 2HD PRO 74 2HD PRO 74 -22.178 -3.683 0.874 576 H ASN 75 H ASN 75 -20.040 -8.444 -0.250 577 HA ASN 75 HA ASN 75 -20.717 -10.278 1.747 578 1HB ASN 75 1HB ASN 75 -18.461 -10.352 -0.291 579 2HB ASN 75 2HB ASN 75 -19.131 -11.769 0.516 580 1HD2 ASN 75 1HD2 ASN 75 -19.424 -9.863 -2.269 581 2HD2 ASN 75 2HD2 ASN 75 -20.981 -10.345 -2.741 582 H ALA 76 H ALA 76 -17.899 -8.204 1.591 583 HA ALA 76 HA ALA 76 -17.023 -9.291 4.228 584 1HB ALA 76 1HB ALA 76 -15.367 -10.362 3.081 585 2HB ALA 76 2HB ALA 76 -14.664 -8.760 2.857 586 3HB ALA 76 3HB ALA 76 -15.698 -9.453 1.607 587 H ARG 77 H ARG 77 -15.623 -7.751 5.392 588 HA ARG 77 HA ARG 77 -15.693 -4.958 4.320 589 1HB ARG 77 1HB ARG 77 -17.547 -5.803 6.036 590 2HB ARG 77 2HB ARG 77 -16.264 -5.534 7.214 591 1HG ARG 77 1HG ARG 77 -16.308 -3.294 5.440 592 2HG ARG 77 2HG ARG 77 -17.962 -3.594 5.974 593 1HD ARG 77 1HD ARG 77 -17.442 -3.215 8.223 594 2HD ARG 77 2HD ARG 77 -15.732 -3.630 8.000 595 HE ARG 77 HE ARG 77 -16.051 -1.443 6.356 596 1HH1 ARG 77 1HH1 ARG 77 -16.837 -2.078 9.687 597 2HH1 ARG 77 2HH1 ARG 77 -16.646 -0.426 10.161 598 1HH2 ARG 77 1HH2 ARG 77 -15.809 0.695 6.996 599 2HH2 ARG 77 2HH2 ARG 77 -16.069 1.134 8.651 600 H HIS 78 H HIS 78 -14.430 -3.594 6.244 601 HA HIS 78 HA HIS 78 -11.879 -5.107 6.700 602 1HB HIS 78 1HB HIS 78 -10.804 -2.887 6.353 603 2HB HIS 78 2HB HIS 78 -11.779 -3.354 4.960 604 HD1 HIS 78 HD1 HIS 78 -13.448 -1.659 4.207 605 HD2 HIS 78 HD2 HIS 78 -12.381 -1.094 8.197 606 HE1 HIS 78 HE1 HIS 78 -14.633 0.444 4.975 607 H GLU 79 H GLU 79 -10.551 -3.995 8.514 608 HA GLU 79 HA GLU 79 -12.290 -2.876 10.667 609 1HB GLU 79 1HB GLU 79 -11.923 -5.478 10.626 610 2HB GLU 79 2HB GLU 79 -10.300 -5.088 11.192 611 1HG GLU 79 1HG GLU 79 -11.735 -5.492 13.120 612 2HG GLU 79 2HG GLU 79 -11.320 -3.779 13.065 613 H LEU 80 H LEU 80 -11.045 -1.724 12.296 614 HA LEU 80 HA LEU 80 -8.227 -1.117 11.460 615 1HB LEU 80 1HB LEU 80 -10.494 0.623 12.461 616 2HB LEU 80 2HB LEU 80 -8.826 1.183 12.447 617 HG LEU 80 HG LEU 80 -10.004 -0.012 9.958 618 1HD1 LEU 80 1HD1 LEU 80 -10.159 2.942 10.351 619 2HD1 LEU 80 2HD1 LEU 80 -11.400 1.958 11.129 620 3HD1 LEU 80 3HD1 LEU 80 -11.183 1.884 9.380 621 1HD2 LEU 80 1HD2 LEU 80 -8.354 1.394 8.894 622 2HD2 LEU 80 2HD2 LEU 80 -7.564 0.561 10.232 623 3HD2 LEU 80 3HD2 LEU 80 -8.042 2.248 10.405 624 H THR 81 H THR 81 -6.704 -1.004 13.135 625 HA THR 81 HA THR 81 -7.345 -2.340 15.629 626 HB THR 81 HB THR 81 -4.921 -1.637 16.088 627 HG1 THR 81 HG1 THR 81 -3.892 -0.791 14.175 628 1HG2 THR 81 1HG2 THR 81 -5.730 -3.746 14.848 629 2HG2 THR 81 2HG2 THR 81 -4.055 -3.261 14.587 630 3HG2 THR 81 3HG2 THR 81 -5.278 -2.902 13.367 631 H ALA 82 H ALA 82 -5.911 0.912 15.146 632 HA ALA 82 HA ALA 82 -7.861 2.288 16.764 633 1HB ALA 82 1HB ALA 82 -5.964 2.582 18.638 634 2HB ALA 82 2HB ALA 82 -5.464 1.005 18.026 635 3HB ALA 82 3HB ALA 82 -7.087 1.223 18.681 636 H GLY 83 H GLY 83 -4.490 2.143 15.646 637 1HA GLY 83 1HA GLY 83 -4.477 5.123 15.481 638 2HA GLY 83 2HA GLY 83 -3.031 4.114 15.513 639 H LEU 84 H LEU 84 -5.783 3.210 13.548 640 HA LEU 84 HA LEU 84 -5.950 2.952 11.201 641 1HB LEU 84 1HB LEU 84 -4.559 5.606 11.648 642 2HB LEU 84 2HB LEU 84 -5.017 5.068 10.033 643 HG LEU 84 HG LEU 84 -7.018 5.099 12.290 644 1HD1 LEU 84 1HD1 LEU 84 -5.697 7.375 11.300 645 2HD1 LEU 84 2HD1 LEU 84 -7.198 7.346 12.226 646 3HD1 LEU 84 3HD1 LEU 84 -7.249 7.342 10.463 647 1HD2 LEU 84 1HD2 LEU 84 -8.485 4.521 10.667 648 2HD2 LEU 84 2HD2 LEU 84 -7.073 4.166 9.671 649 3HD2 LEU 84 3HD2 LEU 84 -7.856 5.742 9.561 650 H LYS 85 H LYS 85 -3.491 1.858 12.600 651 HA LYS 85 HA LYS 85 -1.417 2.171 10.502 652 1HB LYS 85 1HB LYS 85 -1.604 1.340 13.333 653 2HB LYS 85 2HB LYS 85 -0.344 0.559 12.384 654 1HG LYS 85 1HG LYS 85 0.812 2.528 12.056 655 2HG LYS 85 2HG LYS 85 -0.649 3.515 12.108 656 1HD LYS 85 1HD LYS 85 -0.726 2.705 14.621 657 2HD LYS 85 2HD LYS 85 0.998 2.443 14.367 658 1HE LYS 85 1HE LYS 85 0.943 4.880 13.368 659 2HE LYS 85 2HE LYS 85 -0.550 5.024 14.316 660 1HZ LYS 85 1HZ LYS 85 1.524 5.584 15.571 661 2HZ LYS 85 2HZ LYS 85 2.006 3.964 15.404 662 3HZ LYS 85 3HZ LYS 85 0.599 4.345 16.275 663 H ARG 86 H ARG 86 -3.489 -0.313 11.977 664 HA ARG 86 HA ARG 86 -2.580 -2.222 9.845 665 1HB ARG 86 1HB ARG 86 -2.900 -2.361 12.755 666 2HB ARG 86 2HB ARG 86 -3.749 -3.669 11.930 667 1HG ARG 86 1HG ARG 86 -1.813 -4.691 11.364 668 2HG ARG 86 2HG ARG 86 -1.099 -3.181 10.798 669 1HD ARG 86 1HD ARG 86 -0.272 -2.628 12.941 670 2HD ARG 86 2HD ARG 86 -1.394 -3.734 13.756 671 HE ARG 86 HE ARG 86 0.088 -5.369 12.054 672 1HH1 ARG 86 1HH1 ARG 86 0.811 -3.111 14.603 673 2HH1 ARG 86 2HH1 ARG 86 2.251 -3.941 15.080 674 1HH2 ARG 86 1HH2 ARG 86 1.963 -6.429 12.691 675 2HH2 ARG 86 2HH2 ARG 86 2.901 -5.805 14.007 676 H MET 87 H MET 87 -4.175 -3.075 8.545 677 HA MET 87 HA MET 87 -7.030 -2.585 9.331 678 1HB MET 87 1HB MET 87 -5.420 -1.926 6.922 679 2HB MET 87 2HB MET 87 -7.029 -2.569 6.597 680 1HG MET 87 1HG MET 87 -7.877 -0.858 8.318 681 2HG MET 87 2HG MET 87 -6.289 -0.106 8.183 682 1HE MET 87 1HE MET 87 -8.877 -1.860 6.381 683 2HE MET 87 2HE MET 87 -8.327 -1.632 4.720 684 3HE MET 87 3HE MET 87 -9.662 -0.665 5.348 685 H ARG 88 H ARG 88 -7.969 -4.567 9.656 686 HA ARG 88 HA ARG 88 -6.935 -6.921 8.144 687 1HB ARG 88 1HB ARG 88 -8.813 -6.669 10.522 688 2HB ARG 88 2HB ARG 88 -8.128 -8.173 9.909 689 1HG ARG 88 1HG ARG 88 -6.055 -7.747 10.795 690 2HG ARG 88 2HG ARG 88 -6.195 -6.005 10.556 691 1HD ARG 88 1HD ARG 88 -7.796 -5.885 12.455 692 2HD ARG 88 2HD ARG 88 -7.593 -7.628 12.714 693 HE ARG 88 HE ARG 88 -4.994 -6.564 12.614 694 1HH1 ARG 88 1HH1 ARG 88 -7.858 -6.155 14.550 695 2HH1 ARG 88 2HH1 ARG 88 -6.970 -5.729 15.971 696 1HH2 ARG 88 1HH2 ARG 88 -3.863 -6.008 14.473 697 2HH2 ARG 88 2HH2 ARG 88 -4.725 -5.646 15.931 698 H ILE 89 H ILE 89 -8.180 -7.828 6.536 699 HA ILE 89 HA ILE 89 -10.826 -6.639 5.957 700 HB ILE 89 HB ILE 89 -9.002 -8.641 4.573 701 1HG1 ILE 89 1HG1 ILE 89 -9.745 -6.010 3.398 702 2HG1 ILE 89 2HG1 ILE 89 -8.678 -5.967 4.801 703 1HG2 ILE 89 1HG2 ILE 89 -11.574 -7.391 3.555 704 2HG2 ILE 89 2HG2 ILE 89 -11.391 -9.077 4.038 705 3HG2 ILE 89 3HG2 ILE 89 -10.508 -8.460 2.643 706 1HD1 ILE 89 1HD1 ILE 89 -8.012 -7.978 2.717 707 2HD1 ILE 89 2HD1 ILE 89 -6.943 -6.955 3.677 708 3HD1 ILE 89 3HD1 ILE 89 -7.771 -6.288 2.266 709 H PHE 90 H PHE 90 -12.273 -7.509 7.478 710 HA PHE 90 HA PHE 90 -12.272 -10.411 8.034 711 1HB PHE 90 1HB PHE 90 -13.554 -7.905 9.058 712 2HB PHE 90 2HB PHE 90 -14.375 -9.430 9.385 713 HD1 PHE 90 HD1 PHE 90 -13.314 -11.167 10.763 714 HD2 PHE 90 HD2 PHE 90 -11.386 -7.397 10.039 715 HE1 PHE 90 HE1 PHE 90 -11.723 -11.626 12.609 716 HE2 PHE 90 HE2 PHE 90 -9.795 -7.856 11.885 717 HZ PHE 90 HZ PHE 90 -9.963 -9.971 13.170 718 H THR 91 H THR 91 -14.901 -11.027 8.295 719 HA THR 91 HA THR 91 -16.150 -10.463 5.630 720 HB THR 91 HB THR 91 -16.786 -12.932 5.702 721 HG1 THR 91 HG1 THR 91 -14.766 -13.027 7.681 722 1HG2 THR 91 1HG2 THR 91 -14.801 -13.566 4.656 723 2HG2 THR 91 2HG2 THR 91 -13.795 -12.691 5.810 724 3HG2 THR 91 3HG2 THR 91 -14.687 -11.808 4.571 725 H ILE 92 H ILE 92 -17.798 -9.127 6.487 726 HA ILE 92 HA ILE 92 -19.200 -9.461 8.916 727 HB ILE 92 HB ILE 92 -20.948 -8.116 7.720 728 1HG1 ILE 92 1HG1 ILE 92 -19.192 -8.422 5.278 729 2HG1 ILE 92 2HG1 ILE 92 -20.609 -9.436 5.553 730 1HG2 ILE 92 1HG2 ILE 92 -19.185 -6.792 8.563 731 2HG2 ILE 92 2HG2 ILE 92 -19.279 -6.319 6.866 732 3HG2 ILE 92 3HG2 ILE 92 -18.026 -7.438 7.403 733 1HD1 ILE 92 1HD1 ILE 92 -21.622 -7.731 4.379 734 2HD1 ILE 92 2HD1 ILE 92 -20.450 -6.526 4.915 735 3HD1 ILE 92 3HD1 ILE 92 -21.739 -7.047 6.000 736 H LYS 93 H LYS 93 -19.412 -11.279 5.950 737 HA LYS 93 HA LYS 93 -21.454 -13.039 7.208 738 1HB LYS 93 1HB LYS 93 -22.760 -12.946 5.066 739 2HB LYS 93 2HB LYS 93 -22.686 -11.383 5.878 740 1HG LYS 93 1HG LYS 93 -21.724 -10.474 4.059 741 2HG LYS 93 2HG LYS 93 -20.393 -11.623 4.181 742 1HD LYS 93 1HD LYS 93 -21.257 -12.132 2.070 743 2HD LYS 93 2HD LYS 93 -22.108 -13.293 3.090 744 1HE LYS 93 1HE LYS 93 -24.127 -12.118 2.965 745 2HE LYS 93 2HE LYS 93 -23.321 -10.575 2.624 746 1HZ LYS 93 1HZ LYS 93 -23.153 -12.907 0.796 747 2HZ LYS 93 2HZ LYS 93 -22.750 -11.290 0.467 748 3HZ LYS 93 3HZ LYS 93 -24.377 -11.738 0.653 749 HA PRO 94 HA PRO 94 -19.148 -16.372 5.549 750 1HB PRO 94 1HB PRO 94 -21.609 -17.370 4.183 751 2HB PRO 94 2HB PRO 94 -20.556 -18.196 5.346 752 1HG PRO 94 1HG PRO 94 -22.977 -17.260 6.022 753 2HG PRO 94 2HG PRO 94 -21.620 -17.282 7.156 754 1HD PRO 94 1HD PRO 94 -22.849 -14.993 5.725 755 2HD PRO 94 2HD PRO 94 -22.035 -15.042 7.306 756 H ILE 95 H ILE 95 -18.249 -17.155 3.517 757 HA ILE 95 HA ILE 95 -19.178 -15.736 1.054 758 HB ILE 95 HB ILE 95 -16.422 -15.802 2.319 759 1HG1 ILE 95 1HG1 ILE 95 -18.203 -13.525 1.407 760 2HG1 ILE 95 2HG1 ILE 95 -17.997 -14.048 3.079 761 1HG2 ILE 95 1HG2 ILE 95 -15.512 -14.785 0.334 762 2HG2 ILE 95 2HG2 ILE 95 -17.110 -14.671 -0.409 763 3HG2 ILE 95 3HG2 ILE 95 -16.353 -16.247 -0.178 764 1HD1 ILE 95 1HD1 ILE 95 -15.539 -13.600 2.854 765 2HD1 ILE 95 2HD1 ILE 95 -16.529 -12.151 2.673 766 3HD1 ILE 95 3HD1 ILE 95 -15.848 -12.938 1.249 767 H ALA 96 H ALA 96 -19.160 -17.083 -0.715 768 HA ALA 96 HA ALA 96 -18.169 -19.858 -0.340 769 1HB ALA 96 1HB ALA 96 -20.211 -18.381 -1.882 770 2HB ALA 96 2HB ALA 96 -20.253 -20.036 -1.270 771 3HB ALA 96 3HB ALA 96 -19.430 -19.677 -2.789 772 H ILE 97 H ILE 97 -17.105 -20.878 -2.300 773 HA ILE 97 HA ILE 97 -14.740 -19.461 -3.078 774 HB ILE 97 HB ILE 97 -16.162 -21.904 -4.200 775 1HG1 ILE 97 1HG1 ILE 97 -13.790 -22.508 -2.740 776 2HG1 ILE 97 2HG1 ILE 97 -14.748 -21.400 -1.757 777 1HG2 ILE 97 1HG2 ILE 97 -14.559 -21.998 -5.776 778 2HG2 ILE 97 2HG2 ILE 97 -13.321 -21.994 -4.520 779 3HG2 ILE 97 3HG2 ILE 97 -13.898 -20.470 -5.195 780 1HD1 ILE 97 1HD1 ILE 97 -16.722 -23.025 -2.590 781 2HD1 ILE 97 2HD1 ILE 97 -15.775 -23.365 -1.141 782 3HD1 ILE 97 3HD1 ILE 97 -15.381 -24.169 -2.661 783 H GLY 98 H GLY 98 -14.642 -17.813 -4.547 784 1HA GLY 98 1HA GLY 98 -14.858 -17.050 -6.850 785 2HA GLY 98 2HA GLY 98 -16.332 -18.009 -6.991 786 H GLU 99 H GLU 99 -15.661 -15.967 -4.202 787 HA GLU 99 HA GLU 99 -18.036 -14.312 -4.957 788 1HB GLU 99 1HB GLU 99 -16.805 -15.395 -2.501 789 2HB GLU 99 2HB GLU 99 -17.380 -13.736 -2.345 790 1HG GLU 99 1HG GLU 99 -19.043 -16.023 -3.442 791 2HG GLU 99 2HG GLU 99 -19.127 -15.443 -1.778 792 H GLU 100 H GLU 100 -17.820 -12.057 -5.184 793 HA GLU 100 HA GLU 100 -15.059 -11.014 -5.358 794 1HB GLU 100 1HB GLU 100 -17.309 -10.656 -6.836 795 2HB GLU 100 2HB GLU 100 -17.451 -9.275 -5.747 796 1HG GLU 100 1HG GLU 100 -14.725 -9.603 -6.748 797 2HG GLU 100 2HG GLU 100 -15.885 -9.391 -8.058 798 H ILE 101 H ILE 101 -14.139 -10.077 -3.612 799 HA ILE 101 HA ILE 101 -15.772 -9.293 -1.292 800 HB ILE 101 HB ILE 101 -12.790 -9.353 -1.884 801 1HG1 ILE 101 1HG1 ILE 101 -14.318 -11.203 -0.062 802 2HG1 ILE 101 2HG1 ILE 101 -14.231 -11.521 -1.794 803 1HG2 ILE 101 1HG2 ILE 101 -12.496 -8.239 0.048 804 2HG2 ILE 101 2HG2 ILE 101 -13.370 -9.511 0.900 805 3HG2 ILE 101 3HG2 ILE 101 -14.243 -8.120 0.259 806 1HD1 ILE 101 1HD1 ILE 101 -12.072 -12.195 -1.664 807 2HD1 ILE 101 2HD1 ILE 101 -12.334 -12.288 0.078 808 3HD1 ILE 101 3HD1 ILE 101 -11.629 -10.835 -0.632 809 H THR 102 H THR 102 -16.467 -7.249 -1.016 810 HA THR 102 HA THR 102 -14.807 -4.961 -1.945 811 HB THR 102 HB THR 102 -16.781 -3.996 -3.072 812 HG1 THR 102 HG1 THR 102 -18.639 -4.720 -2.481 813 1HG2 THR 102 1HG2 THR 102 -16.913 -5.522 -4.952 814 2HG2 THR 102 2HG2 THR 102 -16.399 -6.875 -3.943 815 3HG2 THR 102 3HG2 THR 102 -15.268 -5.573 -4.315 816 H ILE 103 H ILE 103 -16.237 -2.857 -1.195 817 HA ILE 103 HA ILE 103 -17.638 -3.373 1.365 818 HB ILE 103 HB ILE 103 -16.038 -1.931 2.592 819 1HG1 ILE 103 1HG1 ILE 103 -13.863 -1.947 0.725 820 2HG1 ILE 103 2HG1 ILE 103 -15.263 -1.206 -0.050 821 1HG2 ILE 103 1HG2 ILE 103 -15.693 -4.440 2.342 822 2HG2 ILE 103 2HG2 ILE 103 -14.246 -3.515 2.742 823 3HG2 ILE 103 3HG2 ILE 103 -14.509 -4.066 1.089 824 1HD1 ILE 103 1HD1 ILE 103 -14.767 -0.391 2.758 825 2HD1 ILE 103 2HD1 ILE 103 -15.264 0.584 1.375 826 3HD1 ILE 103 3HD1 ILE 103 -13.567 0.149 1.584 827 H SER 104 H SER 104 -18.673 -1.382 2.189 828 HA SER 104 HA SER 104 -19.410 0.443 -0.035 829 1HB SER 104 1HB SER 104 -21.079 -0.763 1.418 830 2HB SER 104 2HB SER 104 -20.484 0.161 2.796 831 HG SER 104 HG SER 104 -22.288 0.880 1.008 832 H TYR 105 H TYR 105 -20.020 2.771 1.135 833 HA TYR 105 HA TYR 105 -17.513 3.661 2.531 834 1HB TYR 105 1HB TYR 105 -19.171 5.240 0.532 835 2HB TYR 105 2HB TYR 105 -17.569 5.644 1.144 836 HD1 TYR 105 HD1 TYR 105 -16.068 3.172 0.963 837 HD2 TYR 105 HD2 TYR 105 -18.989 4.772 -1.750 838 HE1 TYR 105 HE1 TYR 105 -15.042 1.893 -0.898 839 HE2 TYR 105 HE2 TYR 105 -17.963 3.494 -3.610 840 HH TYR 105 HH TYR 105 -14.924 2.080 -3.412 841 H GLY 106 H GLY 106 -20.723 5.021 1.690 842 1HA GLY 106 1HA GLY 106 -22.385 5.936 3.077 843 2HA GLY 106 2HA GLY 106 -21.589 5.160 4.444 844 H ASP 107 H ASP 107 -22.055 7.200 5.594 845 HA ASP 107 HA ASP 107 -21.381 9.273 6.481 846 1HB ASP 107 1HB ASP 107 -18.974 7.981 5.272 847 2HB ASP 107 2HB ASP 107 -18.820 9.676 5.735 848 H ASP 108 H ASP 108 -19.287 9.605 3.644 849 HA ASP 108 HA ASP 108 -21.157 11.702 2.596 850 1HB ASP 108 1HB ASP 108 -18.581 11.942 3.787 851 2HB ASP 108 2HB ASP 108 -18.380 12.281 2.068 852 H TYR 109 H TYR 109 -18.580 9.365 1.863 853 HA TYR 109 HA TYR 109 -18.207 9.710 -0.872 854 1HB TYR 109 1HB TYR 109 -17.990 7.613 1.138 855 2HB TYR 109 2HB TYR 109 -18.399 6.934 -0.437 856 HD1 TYR 109 HD1 TYR 109 -16.119 9.514 1.064 857 HD2 TYR 109 HD2 TYR 109 -16.665 6.476 -1.922 858 HE1 TYR 109 HE1 TYR 109 -13.773 9.824 0.321 859 HE2 TYR 109 HE2 TYR 109 -14.319 6.785 -2.666 860 HH TYR 109 HH TYR 109 -12.013 8.143 -0.954 861 H TRP 110 H TRP 110 -20.008 10.254 -2.135 862 HA TRP 110 HA TRP 110 -22.619 9.193 -2.000 863 1HB TRP 110 1HB TRP 110 -22.820 10.139 -4.226 864 2HB TRP 110 2HB TRP 110 -21.734 11.172 -3.300 865 HD1 TRP 110 HD1 TRP 110 -19.158 11.168 -3.955 866 HE1 TRP 110 HE1 TRP 110 -17.914 10.335 -6.059 867 HE3 TRP 110 HE3 TRP 110 -22.822 8.335 -6.053 868 HZ2 TRP 110 HZ2 TRP 110 -18.426 8.668 -8.341 869 HZ3 TRP 110 HZ3 TRP 110 -22.437 7.134 -8.170 870 HH2 TRP 110 HH2 TRP 110 -20.245 7.294 -9.330 871 H LEU 111 H LEU 111 -23.285 7.111 -2.237 872 HA LEU 111 HA LEU 111 -21.513 5.101 -3.432 873 1HB LEU 111 1HB LEU 111 -23.322 5.163 -1.393 874 2HB LEU 111 2HB LEU 111 -24.326 4.482 -2.672 875 HG LEU 111 HG LEU 111 -22.676 2.702 -3.050 876 1HD1 LEU 111 1HD1 LEU 111 -21.009 4.498 -1.489 877 2HD1 LEU 111 2HD1 LEU 111 -20.535 3.135 -2.503 878 3HD1 LEU 111 3HD1 LEU 111 -20.988 2.867 -0.819 879 1HD2 LEU 111 1HD2 LEU 111 -24.416 2.340 -1.341 880 2HD2 LEU 111 2HD2 LEU 111 -23.366 3.052 -0.116 881 3HD2 LEU 111 3HD2 LEU 111 -22.917 1.531 -0.887 882 H SER 112 H SER 112 -23.805 3.474 -4.410 883 HA SER 112 HA SER 112 -24.252 4.915 -7.001 884 1HB SER 112 1HB SER 112 -22.931 2.522 -6.359 885 2HB SER 112 2HB SER 112 -24.480 2.003 -7.030 886 HG SER 112 HG SER 112 -24.062 3.149 -8.875 887 H ARG 113 H ARG 113 -26.302 5.761 -6.055 888 HA ARG 113 HA ARG 113 -28.637 5.658 -5.699 889 1HB ARG 113 1HB ARG 113 -27.920 4.427 -8.032 890 2HB ARG 113 2HB ARG 113 -28.782 3.116 -7.227 891 1HG ARG 113 1HG ARG 113 -30.737 4.549 -6.915 892 2HG ARG 113 2HG ARG 113 -29.873 5.919 -7.612 893 1HD ARG 113 1HD ARG 113 -29.552 4.161 -9.633 894 2HD ARG 113 2HD ARG 113 -31.082 3.555 -8.971 895 HE ARG 113 HE ARG 113 -32.110 5.583 -9.643 896 1HH1 ARG 113 1HH1 ARG 113 -28.641 5.885 -9.635 897 2HH1 ARG 113 2HH1 ARG 113 -28.667 7.457 -10.354 898 1HH2 ARG 113 1HH2 ARG 113 -32.116 7.625 -10.576 899 2HH2 ARG 113 2HH2 ARG 113 -30.618 8.437 -10.884 900 HA PRO 114 HA PRO 114 -27.883 1.968 -2.796 901 1HB PRO 114 1HB PRO 114 -27.749 3.490 -0.469 902 2HB PRO 114 2HB PRO 114 -26.340 2.895 -1.362 903 1HG PRO 114 1HG PRO 114 -27.578 5.592 -1.339 904 2HG PRO 114 2HG PRO 114 -25.879 5.130 -1.503 905 1HD PRO 114 1HD PRO 114 -27.431 5.949 -3.590 906 2HD PRO 114 2HD PRO 114 -26.045 4.853 -3.770 907 H ARG 115 H ARG 115 -29.445 4.943 -1.539 908 HA ARG 115 HA ARG 115 -31.672 5.347 -0.872 909 1HB ARG 115 1HB ARG 115 -31.731 3.690 -3.170 910 2HB ARG 115 2HB ARG 115 -32.895 2.992 -2.044 911 1HG ARG 115 1HG ARG 115 -34.345 4.682 -2.396 912 2HG ARG 115 2HG ARG 115 -33.100 5.887 -2.069 913 1HD ARG 115 1HD ARG 115 -32.954 6.355 -4.280 914 2HD ARG 115 2HD ARG 115 -32.579 4.658 -4.630 915 HE ARG 115 HE ARG 115 -35.340 4.765 -4.058 916 1HH1 ARG 115 1HH1 ARG 115 -33.124 6.078 -6.399 917 2HH1 ARG 115 2HH1 ARG 115 -34.318 6.158 -7.647 918 1HH2 ARG 115 1HH2 ARG 115 -36.873 4.879 -5.695 919 2HH2 ARG 115 2HH2 ARG 115 -36.425 5.485 -7.254 920 H LEU 116 H LEU 116 -31.726 1.777 -1.038 921 HA LEU 116 HA LEU 116 -32.172 0.192 0.656 922 1HB LEU 116 1HB LEU 116 -30.369 2.304 1.791 923 2HB LEU 116 2HB LEU 116 -31.015 1.094 2.899 924 HG LEU 116 HG LEU 116 -28.838 0.381 1.964 925 1HD1 LEU 116 1HD1 LEU 116 -29.503 -1.802 1.753 926 2HD1 LEU 116 2HD1 LEU 116 -30.739 -1.417 0.556 927 3HD1 LEU 116 3HD1 LEU 116 -31.054 -1.139 2.269 928 1HD2 LEU 116 1HD2 LEU 116 -28.642 -0.101 -0.434 929 2HD2 LEU 116 2HD2 LEU 116 -29.048 1.599 -0.192 930 3HD2 LEU 116 3HD2 LEU 116 -30.295 0.458 -0.696 931 H THR 117 H THR 117 -34.304 2.045 0.182 932 HA THR 117 HA THR 117 -35.322 3.350 2.493 933 HB THR 117 HB THR 117 -36.825 1.909 0.276 934 HG1 THR 117 HG1 THR 117 -36.619 3.901 -0.805 935 1HG2 THR 117 1HG2 THR 117 -37.528 3.923 2.360 936 2HG2 THR 117 2HG2 THR 117 -38.518 2.647 1.651 937 3HG2 THR 117 3HG2 THR 117 -38.236 4.143 0.760 938 H GLN 118 H GLN 118 -37.024 2.608 3.967 939 HA GLN 118 HA GLN 118 -36.795 -0.310 4.571 940 1HB GLN 118 1HB GLN 118 -36.649 2.106 6.063 941 2HB GLN 118 2HB GLN 118 -38.126 1.290 6.578 942 1HG GLN 118 1HG GLN 118 -36.974 -0.362 7.618 943 2HG GLN 118 2HG GLN 118 -35.850 -0.537 6.269 944 1HE2 GLN 118 1HE2 GLN 118 -36.444 1.245 9.287 945 2HE2 GLN 118 2HE2 GLN 118 -34.875 1.878 9.423 946 H ASN 119 H ASN 119 -38.528 0.283 2.452 947 HA ASN 119 HA ASN 119 -41.226 -0.049 3.727 948 1HB ASN 119 1HB ASN 119 -40.743 2.120 2.498 949 2HB ASN 119 2HB ASN 119 -40.547 1.168 1.026 950 1HD2 ASN 119 1HD2 ASN 119 -42.890 2.538 3.227 951 2HD2 ASN 119 2HD2 ASN 119 -44.274 1.977 2.420 952 1H GLY 201 1H GLY 201 -28.995 17.585 -8.706 953 2H GLY 201 2H GLY 201 -30.207 18.045 -9.803 954 3H GLY 201 3H GLY 201 -30.517 18.074 -8.134 955 1HA GLY 201 1HA GLY 201 -29.319 19.973 -7.776 956 2HA GLY 201 2HA GLY 201 -28.315 19.698 -9.199 957 H LYS 202 H LYS 202 -29.987 22.069 -8.402 958 HA LYS 202 HA LYS 202 -31.978 22.105 -10.629 959 1HB LYS 202 1HB LYS 202 -31.693 23.240 -7.939 960 2HB LYS 202 2HB LYS 202 -32.172 24.452 -9.128 961 1HG LYS 202 1HG LYS 202 -34.142 23.295 -9.693 962 2HG LYS 202 2HG LYS 202 -33.545 21.771 -9.036 963 1HD LYS 202 1HD LYS 202 -35.070 22.496 -7.396 964 2HD LYS 202 2HD LYS 202 -33.515 23.029 -6.757 965 1HE LYS 202 1HE LYS 202 -33.892 25.291 -7.510 966 2HE LYS 202 2HE LYS 202 -35.320 24.800 -8.441 967 1HZ LYS 202 1HZ LYS 202 -34.955 24.824 -5.500 968 2HZ LYS 202 2HZ LYS 202 -36.160 23.880 -6.234 969 3HZ LYS 202 3HZ LYS 202 -36.177 25.569 -6.413 970 H ALA 203 H ALA 203 -29.172 23.868 -9.323 971 HA ALA 203 HA ALA 203 -28.992 25.325 -11.941 972 1HB ALA 203 1HB ALA 203 -29.641 26.681 -9.923 973 2HB ALA 203 2HB ALA 203 -28.113 27.202 -10.632 974 3HB ALA 203 3HB ALA 203 -28.116 26.218 -9.169 975 HA PRO 204 HA PRO 204 -24.995 23.549 -12.393 976 1HB PRO 204 1HB PRO 204 -23.661 25.662 -13.606 977 2HB PRO 204 2HB PRO 204 -24.746 24.548 -14.458 978 1HG PRO 204 1HG PRO 204 -25.256 27.298 -13.447 979 2HG PRO 204 2HG PRO 204 -25.844 26.509 -14.917 980 1HD PRO 204 1HD PRO 204 -27.377 26.859 -12.703 981 2HD PRO 204 2HD PRO 204 -27.594 25.500 -13.827 982 H ARG 205 H ARG 205 -23.482 23.318 -10.798 983 HA ARG 205 HA ARG 205 -22.924 25.602 -8.986 984 1HB ARG 205 1HB ARG 205 -22.626 22.612 -8.990 985 2HB ARG 205 2HB ARG 205 -21.625 23.555 -7.885 986 1HG ARG 205 1HG ARG 205 -23.446 24.306 -6.661 987 2HG ARG 205 2HG ARG 205 -24.550 24.174 -8.029 988 1HD ARG 205 1HD ARG 205 -24.556 21.731 -7.838 989 2HD ARG 205 2HD ARG 205 -23.355 21.809 -6.535 990 HE ARG 205 HE ARG 205 -25.077 22.523 -5.071 991 1HH1 ARG 205 1HH1 ARG 205 -26.046 22.873 -8.396 992 2HH1 ARG 205 2HH1 ARG 205 -27.668 23.316 -7.992 993 1HH2 ARG 205 1HH2 ARG 205 -27.189 23.101 -4.571 994 2HH2 ARG 205 2HH2 ARG 205 -28.312 23.445 -5.844 995 H LYS 206 H LYS 206 -20.688 26.169 -8.471 996 HA LYS 206 HA LYS 206 -18.777 25.537 -10.698 997 1HB LYS 206 1HB LYS 206 -19.914 27.947 -9.941 998 2HB LYS 206 2HB LYS 206 -18.358 27.987 -9.111 999 1HG LYS 206 1HG LYS 206 -17.800 28.883 -11.195 1000 2HG LYS 206 2HG LYS 206 -17.421 27.177 -11.432 1001 1HD LYS 206 1HD LYS 206 -18.708 27.838 -13.340 1002 2HD LYS 206 2HD LYS 206 -19.800 26.907 -12.315 1003 1HE LYS 206 1HE LYS 206 -21.200 28.697 -12.369 1004 2HE LYS 206 2HE LYS 206 -20.002 29.569 -11.394 1005 1HZ LYS 206 1HZ LYS 206 -20.231 29.439 -14.348 1006 2HZ LYS 206 2HZ LYS 206 -18.791 29.917 -13.584 1007 3HZ LYS 206 3HZ LYS 206 -20.212 30.820 -13.358 1008 H GLN 207 H GLN 207 -19.073 26.255 -7.216 1009 HA GLN 207 HA GLN 207 -16.275 25.675 -6.643 1010 1HB GLN 207 1HB GLN 207 -18.762 25.858 -4.899 1011 2HB GLN 207 2HB GLN 207 -17.102 25.888 -4.304 1012 1HG GLN 207 1HG GLN 207 -16.971 28.097 -4.711 1013 2HG GLN 207 2HG GLN 207 -17.366 27.825 -6.408 1014 1HE2 GLN 207 1HE2 GLN 207 -18.398 29.645 -3.906 1015 2HE2 GLN 207 2HE2 GLN 207 -20.067 29.684 -4.211 1016 H LEU 208 H LEU 208 -15.677 23.858 -5.121 1017 HA LEU 208 HA LEU 208 -17.455 21.479 -5.248 1018 1HB LEU 208 1HB LEU 208 -15.061 22.016 -6.860 1019 2HB LEU 208 2HB LEU 208 -14.950 20.494 -5.975 1020 HG LEU 208 HG LEU 208 -17.380 21.265 -7.608 1021 1HD1 LEU 208 1HD1 LEU 208 -14.947 19.641 -8.411 1022 2HD1 LEU 208 2HD1 LEU 208 -15.479 21.161 -9.129 1023 3HD1 LEU 208 3HD1 LEU 208 -16.451 19.703 -9.330 1024 1HD2 LEU 208 1HD2 LEU 208 -17.777 18.809 -7.504 1025 2HD2 LEU 208 2HD2 LEU 208 -17.736 19.542 -5.901 1026 3HD2 LEU 208 3HD2 LEU 208 -16.341 18.641 -6.493 1027 H ALA 209 H ALA 209 -16.551 19.689 -3.864 1028 HA ALA 209 HA ALA 209 -14.975 20.828 -1.584 1029 1HB ALA 209 1HB ALA 209 -16.309 19.444 -0.200 1030 2HB ALA 209 2HB ALA 209 -16.717 18.360 -1.529 1031 3HB ALA 209 3HB ALA 209 -17.443 19.966 -1.446 1032 H THR 210 H THR 210 -12.885 20.100 -1.590 1033 HA THR 210 HA THR 210 -12.295 17.424 -2.784 1034 HB THR 210 HB THR 210 -9.912 18.434 -2.613 1035 HG1 THR 210 HG1 THR 210 -9.854 20.230 -1.562 1036 1HG2 THR 210 1HG2 THR 210 -12.162 19.206 -4.383 1037 2HG2 THR 210 2HG2 THR 210 -10.590 18.520 -4.794 1038 3HG2 THR 210 3HG2 THR 210 -10.739 20.246 -4.463 1039 H LYS 211 H LYS 211 -11.996 19.337 0.177 1040 HA LYS 211 HA LYS 211 -10.495 17.204 1.563 1041 1HB LYS 211 1HB LYS 211 -10.670 19.957 1.720 1042 2HB LYS 211 2HB LYS 211 -11.655 19.449 3.092 1043 1HG LYS 211 1HG LYS 211 -9.775 17.977 3.837 1044 2HG LYS 211 2HG LYS 211 -8.792 18.624 2.524 1045 1HD LYS 211 1HD LYS 211 -8.195 20.297 3.914 1046 2HD LYS 211 2HD LYS 211 -9.856 20.880 3.814 1047 1HE LYS 211 1HE LYS 211 -9.432 18.616 5.686 1048 2HE LYS 211 2HE LYS 211 -8.684 20.152 6.162 1049 1HZ LYS 211 1HZ LYS 211 -11.491 19.864 5.218 1050 2HZ LYS 211 2HZ LYS 211 -10.763 21.276 5.817 1051 3HZ LYS 211 3HZ LYS 211 -11.044 19.961 6.854 1052 H ALA 212 H ALA 212 -11.447 16.738 3.900 1053 HA ALA 212 HA ALA 212 -13.131 15.604 5.108 1054 1HB ALA 212 1HB ALA 212 -14.752 17.145 5.548 1055 2HB ALA 212 2HB ALA 212 -15.300 17.154 3.872 1056 3HB ALA 212 3HB ALA 212 -13.937 18.162 4.360 1057 H ALA 213 H ALA 213 -15.681 14.840 4.547 1058 HA ALA 213 HA ALA 213 -16.884 13.179 3.376 1059 1HB ALA 213 1HB ALA 213 -15.961 15.280 1.599 1060 2HB ALA 213 2HB ALA 213 -17.490 14.403 1.565 1061 3HB ALA 213 3HB ALA 213 -16.083 13.755 0.722 1062 H ARG 214 H ARG 214 -14.918 11.840 4.417 1063 HA ARG 214 HA ARG 214 -13.308 10.576 2.236 1064 1HB ARG 214 1HB ARG 214 -13.064 10.940 5.218 1065 2HB ARG 214 2HB ARG 214 -12.168 9.643 4.426 1066 1HG ARG 214 1HG ARG 214 -12.063 12.551 3.573 1067 2HG ARG 214 2HG ARG 214 -10.865 11.782 4.614 1068 1HD ARG 214 1HD ARG 214 -9.789 11.103 2.734 1069 2HD ARG 214 2HD ARG 214 -11.181 10.063 2.379 1070 HE ARG 214 HE ARG 214 -11.864 11.660 0.778 1071 1HH1 ARG 214 1HH1 ARG 214 -9.709 13.102 3.101 1072 2HH1 ARG 214 2HH1 ARG 214 -9.670 14.625 2.282 1073 1HH2 ARG 214 1HH2 ARG 214 -11.797 13.646 -0.265 1074 2HH2 ARG 214 2HH2 ARG 214 -10.841 14.933 0.391 1075 1HN MLZ 215 1HN MLZ 215 -12.805 8.115 3.246 1076 HA MLZ 215 HA MLZ 215 -15.332 6.709 2.872 1077 1HB MLZ 215 1HB MLZ 215 -12.433 6.169 3.079 1078 2HB MLZ 215 2HB MLZ 215 -13.452 4.864 3.687 1079 1HG MLZ 215 1HG MLZ 215 -14.205 6.116 1.080 1080 2HG MLZ 215 2HG MLZ 215 -14.389 4.446 1.617 1081 1HD MLZ 215 1HD MLZ 215 -11.866 5.825 0.674 1082 2HD MLZ 215 2HD MLZ 215 -11.841 4.281 1.525 1083 1HE MLZ 215 1HE MLZ 215 -13.815 4.232 -0.607 1084 2HE MLZ 215 2HE MLZ 215 -12.405 3.181 -0.376 1085 HZ MLZ 215 HZ MLZ 215 -10.993 4.877 -1.302 1086 1HCM MLZ 215 1HCM MLZ 215 -11.903 3.423 -2.914 1087 2HCM MLZ 215 2HCM MLZ 215 -11.978 5.050 -3.581 1088 3HCM MLZ 215 3HCM MLZ 215 -13.424 4.309 -2.904 1089 H SER 216 H SER 216 -16.724 6.119 4.489 1090 HA SER 216 HA SER 216 -17.538 5.631 6.651 1091 1HB SER 216 1HB SER 216 -16.960 7.307 8.217 1092 2HB SER 216 2HB SER 216 -15.300 7.409 7.630 1093 HG SER 216 HG SER 216 -15.974 8.500 5.864 1094 H ALA 217 H ALA 217 -16.452 5.145 9.049 1095 HA ALA 217 HA ALA 217 -14.630 2.861 8.524 1096 1HB ALA 217 1HB ALA 217 -13.784 5.420 9.424 1097 2HB ALA 217 2HB ALA 217 -12.822 3.943 9.363 1098 3HB ALA 217 3HB ALA 217 -13.713 4.355 10.828 1099 HA PRO 218 HA PRO 218 -16.874 0.895 11.741 1100 1HB PRO 218 1HB PRO 218 -14.837 -0.175 13.324 1101 2HB PRO 218 2HB PRO 218 -15.463 -0.920 11.843 1102 1HG PRO 218 1HG PRO 218 -13.005 0.692 12.268 1103 2HG PRO 218 2HG PRO 218 -13.284 -0.678 11.185 1104 1HD PRO 218 1HD PRO 218 -13.179 1.891 10.323 1105 2HD PRO 218 2HD PRO 218 -14.170 0.647 9.531 1106 H ALA 219 H ALA 219 -16.768 0.685 14.352 1107 HA ALA 219 HA ALA 219 -16.997 1.903 16.364 1108 1HB ALA 219 1HB ALA 219 -14.497 1.680 16.000 1109 2HB ALA 219 2HB ALA 219 -14.956 3.087 16.959 1110 3HB ALA 219 3HB ALA 219 -14.524 3.281 15.261 1111 H THR 220 H THR 220 -18.953 2.976 15.376 1112 HA THR 220 HA THR 220 -18.535 5.920 15.251 1113 HB THR 220 HB THR 220 -20.173 5.751 13.192 1114 HG1 THR 220 HG1 THR 220 -20.017 3.830 12.108 1115 1HG2 THR 220 1HG2 THR 220 -17.351 4.764 12.755 1116 2HG2 THR 220 2HG2 THR 220 -17.685 6.417 13.274 1117 3HG2 THR 220 3HG2 THR 220 -18.304 5.835 11.728 1118 H GLY 221 H GLY 221 -19.621 4.961 17.459 1119 1HA GLY 221 1HA GLY 221 -21.537 5.106 18.808 1120 2HA GLY 221 2HA GLY 221 -22.319 5.947 17.469 1121 1H MET 1 1H MET 1 -1.233 -11.040 5.242 1122 2H MET 1 2H MET 1 -1.454 -10.294 6.752 1123 3H MET 1 3H MET 1 -1.006 -11.931 6.671 1124 HA MET 1 HA MET 1 0.713 -9.781 5.564 1125 1HB MET 1 1HB MET 1 0.013 -10.549 8.321 1126 2HB MET 1 2HB MET 1 1.749 -10.565 8.016 1127 1HG MET 1 1HG MET 1 0.073 -8.235 7.107 1128 2HG MET 1 2HG MET 1 0.620 -8.333 8.780 1129 1HE MET 1 1HE MET 1 2.680 -6.800 9.310 1130 2HE MET 1 2HE MET 1 1.492 -6.065 8.235 1131 3HE MET 1 3HE MET 1 3.214 -5.856 7.920 1132 H PHE 2 H PHE 2 1.339 -12.532 7.715 1133 HA PHE 2 HA PHE 2 3.597 -13.523 6.395 1134 1HB PHE 2 1HB PHE 2 2.878 -15.717 7.529 1135 2HB PHE 2 2HB PHE 2 3.001 -14.308 8.580 1136 HD1 PHE 2 HD1 PHE 2 1.150 -13.585 9.839 1137 HD2 PHE 2 HD2 PHE 2 0.549 -16.273 6.543 1138 HE1 PHE 2 HE1 PHE 2 -1.231 -13.840 10.482 1139 HE2 PHE 2 HE2 PHE 2 -1.833 -16.528 7.187 1140 HZ PHE 2 HZ PHE 2 -2.721 -15.310 9.156 1141 H ASN 3 H ASN 3 3.946 -14.904 4.662 1142 HA ASN 3 HA ASN 3 1.588 -16.139 3.317 1143 1HB ASN 3 1HB ASN 3 2.301 -13.760 2.489 1144 2HB ASN 3 2HB ASN 3 3.680 -14.597 1.775 1145 1HD2 ASN 3 1HD2 ASN 3 2.918 -14.268 -0.432 1146 2HD2 ASN 3 2HD2 ASN 3 1.560 -15.088 -1.035 1147 H ASP 4 H ASP 4 2.117 -18.073 2.264 1148 HA ASP 4 HA ASP 4 4.259 -19.658 3.048 1149 1HB ASP 4 1HB ASP 4 3.707 -20.961 0.994 1150 2HB ASP 4 2HB ASP 4 2.252 -20.406 1.822 1151 H ARG 5 H ARG 5 4.212 -17.282 0.417 1152 HA ARG 5 HA ARG 5 6.815 -18.060 -0.649 1153 1HB ARG 5 1HB ARG 5 4.789 -15.867 -1.005 1154 2HB ARG 5 2HB ARG 5 6.400 -15.647 -1.687 1155 1HG ARG 5 1HG ARG 5 4.596 -18.030 -2.211 1156 2HG ARG 5 2HG ARG 5 4.838 -16.681 -3.320 1157 1HD ARG 5 1HD ARG 5 7.432 -17.560 -2.603 1158 2HD ARG 5 2HD ARG 5 6.493 -19.022 -2.957 1159 HE ARG 5 HE ARG 5 7.239 -16.986 -4.886 1160 1HH1 ARG 5 1HH1 ARG 5 4.730 -19.218 -3.970 1161 2HH1 ARG 5 2HH1 ARG 5 4.108 -19.350 -5.579 1162 1HH2 ARG 5 1HH2 ARG 5 6.414 -17.174 -6.965 1163 2HH2 ARG 5 2HH2 ARG 5 5.053 -18.203 -7.263 1164 H VAL 6 H VAL 6 5.612 -15.409 1.425 1165 HA VAL 6 HA VAL 6 8.295 -15.167 2.648 1166 HB VAL 6 HB VAL 6 8.338 -12.718 2.077 1167 1HG1 VAL 6 1HG1 VAL 6 9.412 -14.580 0.660 1168 2HG1 VAL 6 2HG1 VAL 6 9.164 -13.022 -0.129 1169 3HG1 VAL 6 3HG1 VAL 6 8.056 -14.357 -0.445 1170 1HG2 VAL 6 1HG2 VAL 6 6.057 -13.419 0.208 1171 2HG2 VAL 6 2HG2 VAL 6 6.781 -11.830 0.454 1172 3HG2 VAL 6 3HG2 VAL 6 5.839 -12.579 1.743 1173 H ILE 7 H ILE 7 8.176 -14.182 4.720 1174 HA ILE 7 HA ILE 7 5.397 -13.576 5.670 1175 HB ILE 7 HB ILE 7 6.487 -15.610 6.593 1176 1HG1 ILE 7 1HG1 ILE 7 6.368 -13.356 8.619 1177 2HG1 ILE 7 2HG1 ILE 7 4.966 -14.238 8.015 1178 1HG2 ILE 7 1HG2 ILE 7 8.617 -13.608 7.375 1179 2HG2 ILE 7 2HG2 ILE 7 8.810 -15.056 6.387 1180 3HG2 ILE 7 3HG2 ILE 7 8.486 -15.203 8.114 1181 1HD1 ILE 7 1HD1 ILE 7 5.331 -15.673 9.730 1182 2HD1 ILE 7 2HD1 ILE 7 6.952 -15.041 10.017 1183 3HD1 ILE 7 3HD1 ILE 7 6.691 -16.267 8.777 1184 H VAL 8 H VAL 8 5.367 -11.948 7.513 1185 HA VAL 8 HA VAL 8 7.113 -9.675 6.808 1186 HB VAL 8 HB VAL 8 4.685 -9.387 7.091 1187 1HG1 VAL 8 1HG1 VAL 8 5.084 -11.160 9.263 1188 2HG1 VAL 8 2HG1 VAL 8 3.562 -10.443 8.734 1189 3HG1 VAL 8 3HG1 VAL 8 4.536 -9.637 9.963 1190 1HG2 VAL 8 1HG2 VAL 8 5.172 -7.893 9.434 1191 2HG2 VAL 8 2HG2 VAL 8 5.288 -7.320 7.770 1192 3HG2 VAL 8 3HG2 VAL 8 6.718 -7.955 8.585 1193 H LYS 9 H LYS 9 8.959 -9.293 7.890 1194 HA LYS 9 HA LYS 9 9.074 -9.722 10.804 1195 1HB LYS 9 1HB LYS 9 10.394 -11.340 8.744 1196 2HB LYS 9 2HB LYS 9 11.462 -10.807 10.041 1197 1HG LYS 9 1HG LYS 9 9.997 -11.768 11.715 1198 2HG LYS 9 2HG LYS 9 8.770 -12.121 10.501 1199 1HD LYS 9 1HD LYS 9 10.374 -13.643 9.366 1200 2HD LYS 9 2HD LYS 9 11.538 -13.344 10.658 1201 1HE LYS 9 1HE LYS 9 9.732 -14.133 12.286 1202 2HE LYS 9 2HE LYS 9 8.837 -14.703 10.865 1203 1HZ LYS 9 1HZ LYS 9 10.442 -16.347 11.896 1204 2HZ LYS 9 2HZ LYS 9 11.696 -15.352 11.328 1205 3HZ LYS 9 3HZ LYS 9 10.626 -16.080 10.229 1206 H LYS 10 H LYS 10 11.228 -6.840 10.688 1207 HA LYS 10 HA LYS 10 10.461 -7.174 12.857 1208 1HB LYS 10 1HB LYS 10 8.258 -8.095 11.044 1209 2HB LYS 10 2HB LYS 10 8.079 -8.326 12.782 1210 1HG LYS 10 1HG LYS 10 7.784 -6.107 13.135 1211 2HG LYS 10 2HG LYS 10 9.101 -5.676 12.044 1212 1HD LYS 10 1HD LYS 10 7.610 -5.125 10.451 1213 2HD LYS 10 2HD LYS 10 6.969 -6.768 10.476 1214 1HE LYS 10 1HE LYS 10 5.208 -6.199 11.849 1215 2HE LYS 10 2HE LYS 10 6.152 -4.970 12.711 1216 1HZ LYS 10 1HZ LYS 10 4.429 -4.093 11.109 1217 2HZ LYS 10 2HZ LYS 10 5.389 -4.713 9.853 1218 3HZ LYS 10 3HZ LYS 10 6.005 -3.506 10.875 1219 H SER 11 H SER 11 12.328 -9.020 11.880 1220 HA SER 11 HA SER 11 11.883 -11.754 12.118 1221 1HB SER 11 1HB SER 11 14.055 -11.191 11.569 1222 2HB SER 11 2HB SER 11 14.074 -9.806 12.658 1223 HG SER 11 HG SER 11 15.349 -11.833 13.175 1224 HA PRO 12 HA PRO 12 10.754 -12.829 16.216 1225 1HB PRO 12 1HB PRO 12 13.248 -14.437 16.512 1226 2HB PRO 12 2HB PRO 12 11.558 -14.949 16.663 1227 1HG PRO 12 1HG PRO 12 13.069 -15.582 14.535 1228 2HG PRO 12 2HG PRO 12 11.328 -15.298 14.412 1229 1HD PRO 12 1HD PRO 12 13.586 -13.581 13.559 1230 2HD PRO 12 2HD PRO 12 11.952 -13.724 12.881 1231 H LEU 13 H LEU 13 13.948 -11.585 15.569 1232 HA LEU 13 HA LEU 13 14.446 -10.927 18.417 1233 1HB LEU 13 1HB LEU 13 15.940 -11.380 15.994 1234 2HB LEU 13 2HB LEU 13 16.352 -9.785 16.625 1235 HG LEU 13 HG LEU 13 17.817 -11.526 17.590 1236 1HD1 LEU 13 1HD1 LEU 13 17.839 -10.390 19.544 1237 2HD1 LEU 13 2HD1 LEU 13 16.234 -10.976 19.980 1238 3HD1 LEU 13 3HD1 LEU 13 16.403 -9.550 18.957 1239 1HD2 LEU 13 1HD2 LEU 13 15.912 -13.279 17.417 1240 2HD2 LEU 13 2HD2 LEU 13 15.382 -12.645 18.974 1241 3HD2 LEU 13 3HD2 LEU 13 16.984 -13.365 18.815 1242 H GLY 14 H GLY 14 14.037 -9.212 15.295 1243 1HA GLY 14 1HA GLY 14 12.389 -7.161 16.061 1244 2HA GLY 14 2HA GLY 14 13.963 -6.607 16.629 1245 H GLY 15 H GLY 15 12.793 -5.059 14.738 1246 1HA GLY 15 1HA GLY 15 14.119 -4.109 12.835 1247 2HA GLY 15 2HA GLY 15 14.293 -5.762 12.245 1248 H TYR 16 H TYR 16 13.296 -4.288 10.351 1249 HA TYR 16 HA TYR 16 10.438 -5.063 10.213 1250 1HB TYR 16 1HB TYR 16 11.554 -2.258 10.248 1251 2HB TYR 16 2HB TYR 16 10.066 -2.601 9.368 1252 HD1 TYR 16 HD1 TYR 16 8.025 -3.226 10.521 1253 HD2 TYR 16 HD2 TYR 16 11.655 -2.489 12.695 1254 HE1 TYR 16 HE1 TYR 16 6.737 -3.131 12.637 1255 HE2 TYR 16 HE2 TYR 16 10.366 -2.393 14.813 1256 HH TYR 16 HH TYR 16 8.132 -3.340 15.648 1257 H GLY 17 H GLY 17 11.147 -6.456 8.476 1258 1HA GLY 17 1HA GLY 17 11.509 -5.036 5.911 1259 2HA GLY 17 2HA GLY 17 12.804 -6.141 6.370 1260 H VAL 18 H VAL 18 11.978 -7.197 4.264 1261 HA VAL 18 HA VAL 18 9.513 -8.819 4.726 1262 HB VAL 18 HB VAL 18 11.239 -8.238 2.291 1263 1HG1 VAL 18 1HG1 VAL 18 10.098 -10.524 2.345 1264 2HG1 VAL 18 2HG1 VAL 18 9.667 -9.485 0.986 1265 3HG1 VAL 18 3HG1 VAL 18 8.565 -9.652 2.353 1266 1HG2 VAL 18 1HG2 VAL 18 9.882 -6.338 3.071 1267 2HG2 VAL 18 2HG2 VAL 18 8.444 -7.359 3.080 1268 3HG2 VAL 18 3HG2 VAL 18 9.240 -6.971 1.555 1269 H PHE 19 H PHE 19 9.815 -10.897 5.438 1270 HA PHE 19 HA PHE 19 12.530 -12.037 5.475 1271 1HB PHE 19 1HB PHE 19 10.150 -12.152 7.001 1272 2HB PHE 19 2HB PHE 19 10.393 -13.779 6.368 1273 HD1 PHE 19 HD1 PHE 19 12.431 -10.987 7.851 1274 HD2 PHE 19 HD2 PHE 19 11.723 -15.218 7.618 1275 HE1 PHE 19 HE1 PHE 19 14.204 -11.378 9.541 1276 HE2 PHE 19 HE2 PHE 19 13.497 -15.608 9.307 1277 HZ PHE 19 HZ PHE 19 14.736 -13.688 10.270 1278 H ALA 20 H ALA 20 13.270 -13.491 4.007 1279 HA ALA 20 HA ALA 20 11.388 -14.575 1.976 1280 1HB ALA 20 1HB ALA 20 14.075 -13.587 2.073 1281 2HB ALA 20 2HB ALA 20 13.173 -14.119 0.654 1282 3HB ALA 20 3HB ALA 20 14.144 -15.275 1.566 1283 H ARG 21 H ARG 21 10.442 -16.220 3.418 1284 HA ARG 21 HA ARG 21 11.886 -18.165 4.901 1285 1HB ARG 21 1HB ARG 21 9.218 -17.645 3.923 1286 2HB ARG 21 2HB ARG 21 9.591 -19.353 3.694 1287 1HG ARG 21 1HG ARG 21 9.898 -19.729 5.977 1288 2HG ARG 21 2HG ARG 21 10.265 -18.036 6.308 1289 1HD ARG 21 1HD ARG 21 8.018 -18.566 7.160 1290 2HD ARG 21 2HD ARG 21 7.866 -17.476 5.769 1291 HE ARG 21 HE ARG 21 7.864 -20.024 4.651 1292 1HH1 ARG 21 1HH1 ARG 21 5.997 -18.377 7.084 1293 2HH1 ARG 21 2HH1 ARG 21 4.565 -19.292 6.761 1294 1HH2 ARG 21 1HH2 ARG 21 5.992 -21.199 4.250 1295 2HH2 ARG 21 2HH2 ARG 21 4.560 -20.878 5.170 1296 H LYS 22 H LYS 22 11.380 -17.786 1.472 1297 HA LYS 22 HA LYS 22 12.254 -20.517 0.789 1298 1HB LYS 22 1HB LYS 22 11.887 -18.063 -0.976 1299 2HB LYS 22 2HB LYS 22 11.795 -19.750 -1.468 1300 1HG LYS 22 1HG LYS 22 9.894 -19.725 0.465 1301 2HG LYS 22 2HG LYS 22 9.755 -18.075 -0.140 1302 1HD LYS 22 1HD LYS 22 8.369 -19.104 -1.660 1303 2HD LYS 22 2HD LYS 22 9.901 -19.368 -2.492 1304 1HE LYS 22 1HE LYS 22 8.845 -21.518 -2.436 1305 2HE LYS 22 2HE LYS 22 10.041 -21.571 -1.127 1306 1HZ LYS 22 1HZ LYS 22 8.371 -20.960 0.449 1307 2HZ LYS 22 2HZ LYS 22 7.759 -22.268 -0.445 1308 3HZ LYS 22 3HZ LYS 22 7.223 -20.690 -0.772 1309 H SER 23 H SER 23 15.555 -19.500 -0.567 1310 HA SER 23 HA SER 23 13.097 -21.123 -1.042 1311 1HB SER 23 1HB SER 23 15.098 -22.400 -0.676 1312 2HB SER 23 2HB SER 23 14.828 -22.441 -2.418 1313 HG SER 23 HG SER 23 17.011 -21.800 -1.423 1314 H PHE 24 H PHE 24 14.895 -18.476 -2.329 1315 HA PHE 24 HA PHE 24 13.259 -18.602 -4.829 1316 1HB PHE 24 1HB PHE 24 14.489 -16.409 -3.143 1317 2HB PHE 24 2HB PHE 24 13.875 -16.083 -4.760 1318 HD1 PHE 24 HD1 PHE 24 12.983 -15.482 -1.619 1319 HD2 PHE 24 HD2 PHE 24 11.490 -17.755 -4.945 1320 HE1 PHE 24 HE1 PHE 24 10.687 -15.314 -0.701 1321 HE2 PHE 24 HE2 PHE 24 9.191 -17.586 -4.025 1322 HZ PHE 24 HZ PHE 24 8.792 -16.365 -1.903 1323 H GLU 25 H GLU 25 14.313 -18.427 -6.833 1324 HA GLU 25 HA GLU 25 17.239 -18.860 -6.816 1325 1HB GLU 25 1HB GLU 25 14.911 -19.279 -8.590 1326 2HB GLU 25 2HB GLU 25 16.386 -18.812 -9.435 1327 1HG GLU 25 1HG GLU 25 17.607 -20.657 -8.487 1328 2HG GLU 25 2HG GLU 25 16.286 -21.035 -7.381 1329 H LYS 26 H LYS 26 18.483 -17.606 -8.587 1330 HA LYS 26 HA LYS 26 18.326 -14.783 -8.048 1331 1HB LYS 26 1HB LYS 26 20.392 -15.970 -8.618 1332 2HB LYS 26 2HB LYS 26 19.733 -16.426 -10.185 1333 1HG LYS 26 1HG LYS 26 19.590 -14.053 -10.825 1334 2HG LYS 26 2HG LYS 26 20.233 -13.583 -9.252 1335 1HD LYS 26 1HD LYS 26 22.088 -15.419 -10.098 1336 2HD LYS 26 2HD LYS 26 21.628 -14.649 -11.616 1337 1HE LYS 26 1HE LYS 26 21.917 -12.411 -10.308 1338 2HE LYS 26 2HE LYS 26 22.850 -13.391 -9.161 1339 1HZ LYS 26 1HZ LYS 26 24.233 -12.500 -10.983 1340 2HZ LYS 26 2HZ LYS 26 23.278 -13.343 -12.106 1341 3HZ LYS 26 3HZ LYS 26 24.205 -14.198 -10.970 1342 H GLY 27 H GLY 27 16.378 -13.839 -8.708 1343 1HA GLY 27 1HA GLY 27 15.540 -12.559 -10.703 1344 2HA GLY 27 2HA GLY 27 15.740 -14.049 -11.625 1345 H GLU 28 H GLU 28 14.739 -15.533 -9.112 1346 HA GLU 28 HA GLU 28 12.084 -16.006 -9.883 1347 1HB GLU 28 1HB GLU 28 13.844 -16.962 -8.041 1348 2HB GLU 28 2HB GLU 28 12.733 -16.098 -6.978 1349 1HG GLU 28 1HG GLU 28 11.942 -18.185 -9.035 1350 2HG GLU 28 2HG GLU 28 12.015 -18.441 -7.291 1351 H LEU 29 H LEU 29 10.311 -14.699 -9.827 1352 HA LEU 29 HA LEU 29 10.299 -12.087 -8.631 1353 1HB LEU 29 1HB LEU 29 8.944 -13.154 -10.586 1354 2HB LEU 29 2HB LEU 29 7.870 -13.756 -9.325 1355 HG LEU 29 HG LEU 29 7.094 -11.588 -10.268 1356 1HD1 LEU 29 1HD1 LEU 29 8.023 -10.984 -7.482 1357 2HD1 LEU 29 2HD1 LEU 29 6.936 -12.348 -7.744 1358 3HD1 LEU 29 3HD1 LEU 29 6.439 -10.721 -8.212 1359 1HD2 LEU 29 1HD2 LEU 29 9.815 -10.946 -10.169 1360 2HD2 LEU 29 2HD2 LEU 29 9.078 -9.943 -8.921 1361 3HD2 LEU 29 3HD2 LEU 29 8.496 -9.852 -10.583 1362 H VAL 30 H VAL 30 10.305 -11.795 -6.431 1363 HA VAL 30 HA VAL 30 9.360 -13.787 -4.550 1364 HB VAL 30 HB VAL 30 10.058 -10.835 -4.318 1365 1HG1 VAL 30 1HG1 VAL 30 10.574 -11.966 -1.876 1366 2HG1 VAL 30 2HG1 VAL 30 9.116 -12.833 -2.358 1367 3HG1 VAL 30 3HG1 VAL 30 9.104 -11.072 -2.263 1368 1HG2 VAL 30 1HG2 VAL 30 12.064 -12.288 -3.136 1369 2HG2 VAL 30 2HG2 VAL 30 12.113 -11.684 -4.792 1370 3HG2 VAL 30 3HG2 VAL 30 11.603 -13.342 -4.473 1371 H GLU 31 H GLU 31 8.130 -10.531 -5.427 1372 HA GLU 31 HA GLU 31 5.364 -11.369 -5.395 1373 1HB GLU 31 1HB GLU 31 6.058 -11.507 -2.966 1374 2HB GLU 31 2HB GLU 31 6.367 -9.771 -3.011 1375 1HG GLU 31 1HG GLU 31 3.880 -9.770 -4.029 1376 2HG GLU 31 2HG GLU 31 3.773 -11.240 -3.060 1377 H GLU 32 H GLU 32 4.052 -9.711 -6.234 1378 HA GLU 32 HA GLU 32 5.392 -7.062 -6.670 1379 1HB GLU 32 1HB GLU 32 4.199 -7.108 -8.880 1380 2HB GLU 32 2HB GLU 32 5.344 -8.438 -8.698 1381 1HG GLU 32 1HG GLU 32 3.579 -9.987 -8.169 1382 2HG GLU 32 2HG GLU 32 2.398 -8.684 -8.035 1383 H CYS 33 H CYS 33 3.886 -5.244 -6.850 1384 HA CYS 33 HA CYS 33 1.090 -5.722 -5.966 1385 1HB CYS 33 1HB CYS 33 1.467 -4.136 -4.060 1386 2HB CYS 33 2HB CYS 33 2.448 -5.594 -3.919 1387 HG CYS 33 HG CYS 33 3.529 -2.763 -4.583 1388 H LEU 34 H LEU 34 0.239 -3.221 -5.503 1389 HA LEU 34 HA LEU 34 0.755 -1.810 -8.082 1390 1HB LEU 34 1HB LEU 34 -1.414 -1.432 -5.982 1391 2HB LEU 34 2HB LEU 34 -1.422 -0.789 -7.623 1392 HG LEU 34 HG LEU 34 -1.461 -3.729 -6.868 1393 1HD1 LEU 34 1HD1 LEU 34 -3.701 -3.212 -8.359 1394 2HD1 LEU 34 2HD1 LEU 34 -3.538 -1.712 -7.445 1395 3HD1 LEU 34 3HD1 LEU 34 -3.670 -3.252 -6.596 1396 1HD2 LEU 34 1HD2 LEU 34 -1.583 -2.360 -9.573 1397 2HD2 LEU 34 2HD2 LEU 34 -1.765 -4.092 -9.295 1398 3HD2 LEU 34 3HD2 LEU 34 -0.225 -3.302 -8.957 1399 H CYS 35 H CYS 35 0.736 0.665 -7.894 1400 HA CYS 35 HA CYS 35 1.754 1.653 -5.270 1401 1HB CYS 35 1HB CYS 35 3.154 1.743 -7.963 1402 2HB CYS 35 2HB CYS 35 3.657 2.719 -6.584 1403 HG CYS 35 HG CYS 35 4.086 0.451 -5.266 1404 H ILE 36 H ILE 36 1.794 4.057 -5.209 1405 HA ILE 36 HA ILE 36 -0.412 5.198 -6.838 1406 HB ILE 36 HB ILE 36 1.213 6.377 -4.555 1407 1HG1 ILE 36 1HG1 ILE 36 -1.486 5.006 -4.401 1408 2HG1 ILE 36 2HG1 ILE 36 0.033 4.199 -4.011 1409 1HG2 ILE 36 1HG2 ILE 36 -1.588 7.166 -4.908 1410 2HG2 ILE 36 2HG2 ILE 36 -0.574 7.585 -6.289 1411 3HG2 ILE 36 3HG2 ILE 36 -0.158 8.173 -4.679 1412 1HD1 ILE 36 1HD1 ILE 36 -0.587 6.835 -2.718 1413 2HD1 ILE 36 2HD1 ILE 36 0.392 5.499 -2.113 1414 3HD1 ILE 36 3HD1 ILE 36 -1.367 5.377 -2.105 1415 H VAL 37 H VAL 37 -0.080 7.036 -8.185 1416 HA VAL 37 HA VAL 37 2.796 7.670 -8.758 1417 HB VAL 37 HB VAL 37 0.415 7.493 -10.644 1418 1HG1 VAL 37 1HG1 VAL 37 3.378 7.684 -11.256 1419 2HG1 VAL 37 2HG1 VAL 37 2.278 9.062 -11.294 1420 3HG1 VAL 37 3HG1 VAL 37 2.050 7.721 -12.416 1421 1HG2 VAL 37 1HG2 VAL 37 1.124 5.301 -9.675 1422 2HG2 VAL 37 2HG2 VAL 37 2.755 5.595 -10.280 1423 3HG2 VAL 37 3HG2 VAL 37 1.415 5.401 -11.412 1424 H ARG 38 H ARG 38 2.718 9.587 -7.431 1425 HA ARG 38 HA ARG 38 0.924 11.758 -8.471 1426 1HB ARG 38 1HB ARG 38 2.201 11.344 -5.744 1427 2HB ARG 38 2HB ARG 38 1.116 12.665 -6.170 1428 1HG ARG 38 1HG ARG 38 0.338 9.751 -6.419 1429 2HG ARG 38 2HG ARG 38 0.025 10.704 -4.969 1430 1HD ARG 38 1HD ARG 38 -1.215 12.366 -6.400 1431 2HD ARG 38 2HD ARG 38 -1.027 11.252 -7.767 1432 HE ARG 38 HE ARG 38 -2.067 9.909 -5.409 1433 1HH1 ARG 38 1HH1 ARG 38 -2.912 11.926 -8.118 1434 2HH1 ARG 38 2HH1 ARG 38 -4.555 11.389 -8.147 1435 1HH2 ARG 38 1HH2 ARG 38 -4.204 9.227 -5.466 1436 2HH2 ARG 38 2HH2 ARG 38 -5.284 9.872 -6.657 1437 H HIS 39 H HIS 39 1.946 13.983 -8.184 1438 HA HIS 39 HA HIS 39 4.711 13.940 -9.212 1439 1HB HIS 39 1HB HIS 39 2.372 15.529 -9.446 1440 2HB HIS 39 2HB HIS 39 3.581 16.555 -8.674 1441 HD1 HIS 39 HD1 HIS 39 4.359 17.964 -10.622 1442 HD2 HIS 39 HD2 HIS 39 4.361 13.894 -11.522 1443 HE1 HIS 39 HE1 HIS 39 5.475 17.731 -12.884 1444 H ASN 40 H ASN 40 5.995 16.026 -8.215 1445 HA ASN 40 HA ASN 40 6.658 15.285 -5.492 1446 1HB ASN 40 1HB ASN 40 7.398 17.699 -7.189 1447 2HB ASN 40 2HB ASN 40 8.275 17.134 -5.767 1448 1HD2 ASN 40 1HD2 ASN 40 8.454 14.407 -6.129 1449 2HD2 ASN 40 2HD2 ASN 40 9.257 14.041 -7.579 1450 H ASP 41 H ASP 41 7.029 18.341 -4.891 1451 HA ASP 41 HA ASP 41 5.846 20.038 -3.766 1452 1HB ASP 41 1HB ASP 41 4.340 19.358 -5.938 1453 2HB ASP 41 2HB ASP 41 3.204 18.993 -4.639 1454 H ASP 42 H ASP 42 3.074 19.611 -2.717 1455 HA ASP 42 HA ASP 42 3.546 18.790 -0.116 1456 1HB ASP 42 1HB ASP 42 1.066 18.332 -1.817 1457 2HB ASP 42 2HB ASP 42 1.093 18.407 -0.055 1458 H TRP 43 H TRP 43 2.843 16.694 -2.893 1459 HA TRP 43 HA TRP 43 2.328 14.242 -1.608 1460 1HB TRP 43 1HB TRP 43 2.158 14.561 -4.007 1461 2HB TRP 43 2HB TRP 43 3.865 14.984 -4.122 1462 HD1 TRP 43 HD1 TRP 43 5.387 13.095 -4.839 1463 HE1 TRP 43 HE1 TRP 43 5.290 10.520 -4.808 1464 HE3 TRP 43 HE3 TRP 43 0.937 12.407 -2.425 1465 HZ2 TRP 43 HZ2 TRP 43 3.556 8.443 -3.883 1466 HZ3 TRP 43 HZ3 TRP 43 0.091 10.117 -1.987 1467 HH2 TRP 43 HH2 TRP 43 1.393 8.140 -2.709 1468 H GLY 44 H GLY 44 5.536 15.404 -2.730 1469 1HA GLY 44 1HA GLY 44 7.036 13.331 -1.488 1470 2HA GLY 44 2HA GLY 44 7.689 14.902 -1.949 1471 H THR 45 H THR 45 5.779 16.371 -0.229 1472 HA THR 45 HA THR 45 7.350 16.425 2.188 1473 HB THR 45 HB THR 45 4.549 17.510 1.799 1474 HG1 THR 45 HG1 THR 45 5.550 19.251 0.740 1475 1HG2 THR 45 1HG2 THR 45 6.975 18.210 3.430 1476 2HG2 THR 45 2HG2 THR 45 5.293 18.072 3.944 1477 3HG2 THR 45 3HG2 THR 45 5.817 19.470 3.004 1478 H ALA 46 H ALA 46 3.846 15.699 1.875 1479 HA ALA 46 HA ALA 46 3.585 14.496 4.451 1480 1HB ALA 46 1HB ALA 46 1.627 15.205 3.313 1481 2HB ALA 46 2HB ALA 46 1.536 13.447 3.210 1482 3HB ALA 46 3HB ALA 46 2.092 14.385 1.823 1483 H LEU 47 H LEU 47 3.945 12.953 1.233 1484 HA LEU 47 HA LEU 47 4.409 10.335 2.531 1485 1HB LEU 47 1HB LEU 47 4.075 11.353 -0.310 1486 2HB LEU 47 2HB LEU 47 4.473 9.673 0.034 1487 HG LEU 47 HG LEU 47 2.074 9.831 -0.230 1488 1HD1 LEU 47 1HD1 LEU 47 1.954 9.774 2.685 1489 2HD1 LEU 47 2HD1 LEU 47 3.309 8.836 2.058 1490 3HD1 LEU 47 3HD1 LEU 47 1.668 8.477 1.526 1491 1HD2 LEU 47 1HD2 LEU 47 1.963 11.828 2.029 1492 2HD2 LEU 47 2HD2 LEU 47 0.698 11.405 0.877 1493 3HD2 LEU 47 3HD2 LEU 47 2.094 12.343 0.348 1494 H GLU 48 H GLU 48 6.451 12.465 2.837 1495 HA GLU 48 HA GLU 48 8.640 12.239 1.083 1496 1HB GLU 48 1HB GLU 48 7.998 13.495 3.446 1497 2HB GLU 48 2HB GLU 48 9.282 12.399 3.955 1498 1HG GLU 48 1HG GLU 48 9.709 13.906 1.421 1499 2HG GLU 48 2HG GLU 48 9.799 14.827 2.922 1500 H ASP 49 H ASP 49 7.414 9.848 3.294 1501 HA ASP 49 HA ASP 49 9.980 8.318 3.122 1502 1HB ASP 49 1HB ASP 49 7.651 8.494 5.011 1503 2HB ASP 49 2HB ASP 49 8.576 6.994 4.957 1504 H TYR 50 H TYR 50 9.856 6.035 2.608 1505 HA TYR 50 HA TYR 50 9.120 4.205 1.313 1506 1HB TYR 50 1HB TYR 50 6.406 5.265 2.183 1507 2HB TYR 50 2HB TYR 50 6.795 3.604 1.753 1508 HD1 TYR 50 HD1 TYR 50 5.495 4.277 4.326 1509 HD2 TYR 50 HD2 TYR 50 9.667 4.082 3.306 1510 HE1 TYR 50 HE1 TYR 50 6.055 3.792 6.692 1511 HE2 TYR 50 HE2 TYR 50 10.221 3.599 5.672 1512 HH TYR 50 HH TYR 50 8.625 2.444 7.729 1513 H LEU 51 H LEU 51 9.251 6.997 0.071 1514 HA LEU 51 HA LEU 51 7.226 6.635 -2.099 1515 1HB LEU 51 1HB LEU 51 7.680 8.760 -0.550 1516 2HB LEU 51 2HB LEU 51 8.944 9.073 -1.738 1517 HG LEU 51 HG LEU 51 7.274 8.961 -3.551 1518 1HD1 LEU 51 1HD1 LEU 51 5.303 7.934 -3.207 1519 2HD1 LEU 51 2HD1 LEU 51 4.866 9.166 -2.022 1520 3HD1 LEU 51 3HD1 LEU 51 5.717 7.709 -1.508 1521 1HD2 LEU 51 1HD2 LEU 51 5.753 10.915 -2.467 1522 2HD2 LEU 51 2HD2 LEU 51 7.416 11.181 -2.990 1523 3HD2 LEU 51 3HD2 LEU 51 7.065 10.879 -1.289 1524 H PHE 52 H PHE 52 8.180 5.359 -3.671 1525 HA PHE 52 HA PHE 52 11.025 5.736 -4.396 1526 1HB PHE 52 1HB PHE 52 8.768 3.917 -5.305 1527 2HB PHE 52 2HB PHE 52 10.388 3.854 -5.999 1528 HD1 PHE 52 HD1 PHE 52 12.068 2.580 -4.964 1529 HD2 PHE 52 HD2 PHE 52 8.577 3.700 -2.727 1530 HE1 PHE 52 HE1 PHE 52 12.820 1.156 -3.078 1531 HE2 PHE 52 HE2 PHE 52 9.329 2.276 -0.841 1532 HZ PHE 52 HZ PHE 52 11.450 1.004 -1.016 1533 H SER 53 H SER 53 11.290 7.633 -5.583 1534 HA SER 53 HA SER 53 9.283 8.242 -7.707 1535 1HB SER 53 1HB SER 53 9.565 10.087 -6.273 1536 2HB SER 53 2HB SER 53 11.288 9.776 -6.061 1537 HG SER 53 HG SER 53 10.070 10.613 -8.479 1538 H ARG 54 H ARG 54 9.963 8.590 -9.857 1539 HA ARG 54 HA ARG 54 12.755 7.679 -10.474 1540 1HB ARG 54 1HB ARG 54 11.710 6.920 -12.622 1541 2HB ARG 54 2HB ARG 54 10.970 6.157 -11.215 1542 1HG ARG 54 1HG ARG 54 9.020 7.422 -11.390 1543 2HG ARG 54 2HG ARG 54 9.823 8.726 -12.264 1544 1HD ARG 54 1HD ARG 54 9.411 5.955 -13.437 1545 2HD ARG 54 2HD ARG 54 8.304 7.312 -13.716 1546 HE ARG 54 HE ARG 54 10.866 8.323 -14.232 1547 1HH1 ARG 54 1HH1 ARG 54 8.863 5.746 -15.442 1548 2HH1 ARG 54 2HH1 ARG 54 9.552 5.806 -17.027 1549 1HH2 ARG 54 1HH2 ARG 54 11.745 8.382 -16.296 1550 2HH2 ARG 54 2HH2 ARG 54 11.172 7.286 -17.509 1551 H LYS 55 H LYS 55 13.020 8.496 -13.040 1552 HA LYS 55 HA LYS 55 13.294 11.383 -12.787 1553 1HB LYS 55 1HB LYS 55 14.631 9.407 -14.056 1554 2HB LYS 55 2HB LYS 55 13.623 9.962 -15.392 1555 1HG LYS 55 1HG LYS 55 14.503 12.333 -14.279 1556 2HG LYS 55 2HG LYS 55 15.907 11.281 -14.096 1557 1HD LYS 55 1HD LYS 55 15.296 10.632 -16.608 1558 2HD LYS 55 2HD LYS 55 14.558 12.234 -16.590 1559 1HE LYS 55 1HE LYS 55 17.181 12.311 -15.338 1560 2HE LYS 55 2HE LYS 55 17.283 11.668 -16.988 1561 1HZ LYS 55 1HZ LYS 55 16.060 13.516 -17.816 1562 2HZ LYS 55 2HZ LYS 55 17.292 14.156 -16.837 1563 3HZ LYS 55 3HZ LYS 55 15.699 14.073 -16.253 1564 H ASN 56 H ASN 56 10.916 11.762 -12.525 1565 HA ASN 56 HA ASN 56 9.137 11.335 -14.794 1566 1HB ASN 56 1HB ASN 56 9.853 14.200 -14.220 1567 2HB ASN 56 2HB ASN 56 10.881 13.249 -15.290 1568 1HD2 ASN 56 1HD2 ASN 56 10.229 14.421 -17.223 1569 2HD2 ASN 56 2HD2 ASN 56 8.667 14.274 -17.872 1570 H MET 57 H MET 57 9.253 11.069 -11.782 1571 HA MET 57 HA MET 57 7.540 13.063 -10.589 1572 1HB MET 57 1HB MET 57 5.429 11.781 -10.697 1573 2HB MET 57 2HB MET 57 6.017 12.118 -12.323 1574 1HG MET 57 1HG MET 57 7.264 9.719 -11.629 1575 2HG MET 57 2HG MET 57 5.628 9.556 -10.993 1576 1HE MET 57 1HE MET 57 4.416 11.823 -13.508 1577 2HE MET 57 2HE MET 57 3.719 10.730 -12.311 1578 3HE MET 57 3HE MET 57 3.430 10.457 -14.030 1579 H SER 58 H SER 58 6.072 11.517 -8.822 1580 HA SER 58 HA SER 58 8.102 9.748 -7.508 1581 1HB SER 58 1HB SER 58 8.179 11.790 -6.307 1582 2HB SER 58 2HB SER 58 6.442 12.048 -6.468 1583 HG SER 58 HG SER 58 7.860 10.406 -4.719 1584 H ALA 59 H ALA 59 7.236 7.864 -6.601 1585 HA ALA 59 HA ALA 59 4.251 7.582 -6.629 1586 1HB ALA 59 1HB ALA 59 5.350 6.576 -8.623 1587 2HB ALA 59 2HB ALA 59 4.619 5.338 -7.602 1588 3HB ALA 59 3HB ALA 59 6.362 5.600 -7.558 1589 H MET 60 H MET 60 3.415 6.187 -4.995 1590 HA MET 60 HA MET 60 5.241 5.732 -2.700 1591 1HB MET 60 1HB MET 60 3.120 6.862 -2.307 1592 2HB MET 60 2HB MET 60 2.237 5.584 -3.138 1593 1HG MET 60 1HG MET 60 2.027 5.299 -0.713 1594 2HG MET 60 2HG MET 60 2.962 3.970 -1.398 1595 1HE MET 60 1HE MET 60 2.560 6.983 0.341 1596 2HE MET 60 2HE MET 60 4.134 7.685 0.714 1597 3HE MET 60 3HE MET 60 3.406 6.518 1.818 1598 H ALA 61 H ALA 61 5.362 3.623 -1.678 1599 HA ALA 61 HA ALA 61 5.184 1.379 -3.581 1600 1HB ALA 61 1HB ALA 61 5.886 0.743 -0.824 1601 2HB ALA 61 2HB ALA 61 6.770 2.162 -1.387 1602 3HB ALA 61 3HB ALA 61 6.889 0.640 -2.271 1603 H LEU 62 H LEU 62 2.896 1.069 -3.792 1604 HA LEU 62 HA LEU 62 0.837 0.076 -3.211 1605 1HB LEU 62 1HB LEU 62 0.783 1.029 -0.483 1606 2HB LEU 62 2HB LEU 62 1.521 2.251 -1.516 1607 HG LEU 62 HG LEU 62 -0.436 1.934 -3.103 1608 1HD1 LEU 62 1HD1 LEU 62 -0.939 -0.266 -1.481 1609 2HD1 LEU 62 2HD1 LEU 62 -2.057 0.418 -2.661 1610 3HD1 LEU 62 3HD1 LEU 62 -2.154 0.905 -0.969 1611 1HD2 LEU 62 1HD2 LEU 62 -0.178 3.740 -1.275 1612 2HD2 LEU 62 2HD2 LEU 62 -1.342 2.789 -0.353 1613 3HD2 LEU 62 3HD2 LEU 62 -1.798 3.467 -1.916 1614 H GLY 63 H GLY 63 2.262 -2.012 -3.160 1615 1HA GLY 63 1HA GLY 63 1.404 -3.637 -0.992 1616 2HA GLY 63 2HA GLY 63 2.640 -4.099 -2.157 1617 H PHE 64 H PHE 64 3.845 -5.094 -0.411 1618 HA PHE 64 HA PHE 64 4.845 -3.358 1.757 1619 1HB PHE 64 1HB PHE 64 5.062 -6.273 0.967 1620 2HB PHE 64 2HB PHE 64 6.004 -5.615 2.305 1621 HD1 PHE 64 HD1 PHE 64 2.494 -5.770 1.003 1622 HD2 PHE 64 HD2 PHE 64 5.053 -5.499 4.442 1623 HE1 PHE 64 HE1 PHE 64 0.519 -5.972 2.488 1624 HE2 PHE 64 HE2 PHE 64 3.078 -5.701 5.928 1625 HZ PHE 64 HZ PHE 64 0.810 -5.937 4.951 1626 H GLY 65 H GLY 65 5.822 -2.234 -0.523 1627 1HA GLY 65 1HA GLY 65 8.505 -3.384 -1.036 1628 2HA GLY 65 2HA GLY 65 7.766 -2.060 -1.933 1629 H ALA 66 H ALA 66 7.050 -1.002 0.969 1630 HA ALA 66 HA ALA 66 9.475 0.678 1.111 1631 1HB ALA 66 1HB ALA 66 7.292 1.727 1.095 1632 2HB ALA 66 2HB ALA 66 7.964 1.942 2.712 1633 3HB ALA 66 3HB ALA 66 6.739 0.707 2.424 1634 H ILE 67 H ILE 67 8.764 -2.245 2.507 1635 HA ILE 67 HA ILE 67 9.573 -1.560 5.265 1636 HB ILE 67 HB ILE 67 9.125 -4.244 3.913 1637 1HG1 ILE 67 1HG1 ILE 67 6.910 -3.733 5.441 1638 2HG1 ILE 67 2HG1 ILE 67 7.300 -2.127 4.823 1639 1HG2 ILE 67 1HG2 ILE 67 10.141 -3.611 6.438 1640 2HG2 ILE 67 2HG2 ILE 67 9.469 -5.165 5.948 1641 3HG2 ILE 67 3HG2 ILE 67 8.441 -3.970 6.735 1642 1HD1 ILE 67 1HD1 ILE 67 7.431 -4.368 2.878 1643 2HD1 ILE 67 2HD1 ILE 67 6.878 -2.709 2.647 1644 3HD1 ILE 67 3HD1 ILE 67 5.823 -3.891 3.423 1645 H PHE 68 H PHE 68 11.066 -2.655 2.329 1646 HA PHE 68 HA PHE 68 13.237 -4.150 3.233 1647 1HB PHE 68 1HB PHE 68 13.169 -1.985 1.099 1648 2HB PHE 68 2HB PHE 68 14.322 -3.315 1.168 1649 HD1 PHE 68 HD1 PHE 68 11.871 -2.407 -0.823 1650 HD2 PHE 68 HD2 PHE 68 12.602 -5.576 1.982 1651 HE1 PHE 68 HE1 PHE 68 10.276 -3.858 -2.047 1652 HE2 PHE 68 HE2 PHE 68 11.009 -7.028 0.757 1653 HZ PHE 68 HZ PHE 68 9.844 -6.169 -1.257 1654 H ASN 69 H ASN 69 15.273 -3.647 4.117 1655 HA ASN 69 HA ASN 69 15.609 -0.832 5.107 1656 1HB ASN 69 1HB ASN 69 16.833 -3.420 6.134 1657 2HB ASN 69 2HB ASN 69 16.841 -1.856 6.945 1658 1HD2 ASN 69 1HD2 ASN 69 14.565 -4.381 5.767 1659 2HD2 ASN 69 2HD2 ASN 69 13.403 -4.102 6.964 1660 H HIS 70 H HIS 70 18.323 -1.147 5.838 1661 HA HIS 70 HA HIS 70 19.636 -1.220 3.154 1662 1HB HIS 70 1HB HIS 70 19.833 0.865 4.409 1663 2HB HIS 70 2HB HIS 70 20.358 -0.006 5.849 1664 HD1 HIS 70 HD1 HIS 70 21.534 0.016 2.206 1665 HD2 HIS 70 HD2 HIS 70 23.091 0.238 6.067 1666 HE1 HIS 70 HE1 HIS 70 24.049 0.185 1.957 1667 H SER 71 H SER 71 21.211 -2.783 2.766 1668 HA SER 71 HA SER 71 22.394 -4.263 5.048 1669 1HB SER 71 1HB SER 71 21.008 -5.746 2.807 1670 2HB SER 71 2HB SER 71 21.446 -6.343 4.408 1671 HG SER 71 HG SER 71 19.310 -5.929 4.525 1672 H LYS 72 H LYS 72 23.463 -2.491 2.941 1673 HA LYS 72 HA LYS 72 25.303 -2.422 1.469 1674 1HB LYS 72 1HB LYS 72 25.623 -4.802 3.215 1675 2HB LYS 72 2HB LYS 72 26.594 -4.821 1.744 1676 1HG LYS 72 1HG LYS 72 26.499 -2.522 3.721 1677 2HG LYS 72 2HG LYS 72 27.778 -3.734 3.652 1678 1HD LYS 72 1HD LYS 72 27.997 -3.057 1.158 1679 2HD LYS 72 2HD LYS 72 27.075 -1.625 1.613 1680 1HE LYS 72 1HE LYS 72 29.086 -0.729 2.213 1681 2HE LYS 72 2HE LYS 72 29.016 -1.817 3.613 1682 1HZ LYS 72 1HZ LYS 72 30.106 -2.497 0.926 1683 2HZ LYS 72 2HZ LYS 72 30.017 -3.557 2.250 1684 3HZ LYS 72 3HZ LYS 72 31.033 -2.197 2.317 1685 H ASP 73 H ASP 73 24.852 -5.933 1.246 1686 HA ASP 73 HA ASP 73 24.274 -5.613 -1.663 1687 1HB ASP 73 1HB ASP 73 25.011 -8.035 0.024 1688 2HB ASP 73 2HB ASP 73 24.961 -7.979 -1.738 1689 HA PRO 74 HA PRO 74 20.082 -6.360 0.084 1690 1HB PRO 74 1HB PRO 74 18.875 -5.608 -2.338 1691 2HB PRO 74 2HB PRO 74 19.156 -4.534 -0.956 1692 1HG PRO 74 1HG PRO 74 20.713 -4.851 -3.464 1693 2HG PRO 74 2HG PRO 74 20.409 -3.400 -2.498 1694 1HD PRO 74 1HD PRO 74 22.778 -4.691 -2.469 1695 2HD PRO 74 2HD PRO 74 22.131 -3.856 -1.040 1696 H ASN 75 H ASN 75 19.947 -8.595 0.103 1697 HA ASN 75 HA ASN 75 20.570 -10.428 -1.913 1698 1HB ASN 75 1HB ASN 75 18.347 -10.481 0.163 1699 2HB ASN 75 2HB ASN 75 18.985 -11.904 -0.661 1700 1HD2 ASN 75 1HD2 ASN 75 19.350 -10.012 2.127 1701 2HD2 ASN 75 2HD2 ASN 75 20.909 -10.517 2.570 1702 H ALA 76 H ALA 76 17.782 -8.318 -1.701 1703 HA ALA 76 HA ALA 76 16.847 -9.384 -4.327 1704 1HB ALA 76 1HB ALA 76 15.198 -10.438 -3.157 1705 2HB ALA 76 2HB ALA 76 14.520 -8.828 -2.915 1706 3HB ALA 76 3HB ALA 76 15.565 -9.539 -1.685 1707 H ARG 77 H ARG 77 15.450 -7.821 -5.462 1708 HA ARG 77 HA ARG 77 15.573 -5.033 -4.381 1709 1HB ARG 77 1HB ARG 77 17.387 -5.896 -6.130 1710 2HB ARG 77 2HB ARG 77 16.088 -5.605 -7.286 1711 1HG ARG 77 1HG ARG 77 16.191 -3.373 -5.505 1712 2HG ARG 77 2HG ARG 77 17.831 -3.692 -6.068 1713 1HD ARG 77 1HD ARG 77 17.280 -3.297 -8.306 1714 2HD ARG 77 2HD ARG 77 15.568 -3.691 -8.056 1715 HE ARG 77 HE ARG 77 15.943 -1.516 -6.409 1716 1HH1 ARG 77 1HH1 ARG 77 16.664 -2.147 -9.755 1717 2HH1 ARG 77 2HH1 ARG 77 16.487 -0.491 -10.220 1718 1HH2 ARG 77 1HH2 ARG 77 15.718 0.628 -7.037 1719 2HH2 ARG 77 2HH2 ARG 77 15.956 1.070 -8.695 1720 H HIS 78 H HIS 78 14.296 -3.646 -6.278 1721 HA HIS 78 HA HIS 78 11.718 -5.124 -6.696 1722 1HB HIS 78 1HB HIS 78 10.678 -2.892 -6.323 1723 2HB HIS 78 2HB HIS 78 11.670 -3.376 -4.948 1724 HD1 HIS 78 HD1 HIS 78 13.374 -1.706 -4.218 1725 HD2 HIS 78 HD2 HIS 78 12.247 -1.111 -8.187 1726 HE1 HIS 78 HE1 HIS 78 14.574 0.384 -4.998 1727 H GLU 79 H GLU 79 10.374 -3.988 -8.483 1728 HA GLU 79 HA GLU 79 12.091 -2.883 -10.661 1729 1HB GLU 79 1HB GLU 79 11.694 -5.479 -10.623 1730 2HB GLU 79 2HB GLU 79 10.066 -5.067 -11.161 1731 1HG GLU 79 1HG GLU 79 11.461 -5.481 -13.115 1732 2HG GLU 79 2HG GLU 79 11.070 -3.763 -13.046 1733 H LEU 80 H LEU 80 10.835 -1.708 -12.265 1734 HA LEU 80 HA LEU 80 8.039 -1.067 -11.380 1735 1HB LEU 80 1HB LEU 80 10.316 0.645 -12.416 1736 2HB LEU 80 2HB LEU 80 8.653 1.228 -12.370 1737 HG LEU 80 HG LEU 80 9.856 0.008 -9.904 1738 1HD1 LEU 80 1HD1 LEU 80 10.043 2.962 -10.288 1739 2HD1 LEU 80 2HD1 LEU 80 11.257 1.965 -11.090 1740 3HD1 LEU 80 3HD1 LEU 80 11.069 1.886 -9.338 1741 1HD2 LEU 80 1HD2 LEU 80 8.242 1.432 -8.805 1742 2HD2 LEU 80 2HD2 LEU 80 7.416 0.615 -10.132 1743 3HD2 LEU 80 3HD2 LEU 80 7.913 2.298 -10.306 1744 H THR 81 H THR 81 6.490 -0.928 -13.028 1745 HA THR 81 HA THR 81 7.071 -2.263 -15.537 1746 HB THR 81 HB THR 81 4.649 -1.526 -15.952 1747 HG1 THR 81 HG1 THR 81 3.664 -0.674 -14.020 1748 1HG2 THR 81 1HG2 THR 81 5.451 -3.650 -14.735 1749 2HG2 THR 81 2HG2 THR 81 3.788 -3.144 -14.443 1750 3HG2 THR 81 3HG2 THR 81 5.035 -2.806 -13.243 1751 H ALA 82 H ALA 82 5.688 1.006 -15.019 1752 HA ALA 82 HA ALA 82 7.629 2.363 -16.664 1753 1HB ALA 82 1HB ALA 82 5.705 2.689 -18.504 1754 2HB ALA 82 2HB ALA 82 5.194 1.117 -17.890 1755 3HB ALA 82 3HB ALA 82 6.809 1.315 -18.572 1756 H GLY 83 H GLY 83 4.275 2.258 -15.490 1757 1HA GLY 83 1HA GLY 83 4.304 5.237 -15.313 1758 2HA GLY 83 2HA GLY 83 2.845 4.247 -15.325 1759 H LEU 84 H LEU 84 5.617 3.300 -13.409 1760 HA LEU 84 HA LEU 84 5.820 3.030 -11.066 1761 1HB LEU 84 1HB LEU 84 4.457 5.703 -11.480 1762 2HB LEU 84 2HB LEU 84 4.935 5.153 -9.875 1763 HG LEU 84 HG LEU 84 6.898 5.168 -12.165 1764 1HD1 LEU 84 1HD1 LEU 84 5.623 7.456 -11.145 1765 2HD1 LEU 84 2HD1 LEU 84 7.108 7.412 -12.096 1766 3HD1 LEU 84 3HD1 LEU 84 7.189 7.400 -10.335 1767 1HD2 LEU 84 1HD2 LEU 84 8.384 4.564 -10.570 1768 2HD2 LEU 84 2HD2 LEU 84 6.985 4.223 -9.552 1769 3HD2 LEU 84 3HD2 LEU 84 7.790 5.789 -9.449 1770 H LYS 85 H LYS 85 3.324 1.973 -12.428 1771 HA LYS 85 HA LYS 85 1.292 2.302 -10.282 1772 1HB LYS 85 1HB LYS 85 1.418 1.480 -13.138 1773 2HB LYS 85 2HB LYS 85 0.163 0.714 -12.163 1774 1HG LYS 85 1HG LYS 85 -0.961 2.697 -11.810 1775 2HG LYS 85 2HG LYS 85 0.512 3.665 -11.883 1776 1HD LYS 85 1HD LYS 85 0.536 2.864 -14.400 1777 2HD LYS 85 2HD LYS 85 -1.189 2.625 -14.122 1778 1HE LYS 85 1HE LYS 85 -1.083 5.057 -13.111 1779 2HE LYS 85 2HE LYS 85 0.396 5.184 -14.083 1780 1HZ LYS 85 1HZ LYS 85 -1.691 5.776 -15.301 1781 2HZ LYS 85 2HZ LYS 85 -2.192 4.162 -15.131 1782 3HZ LYS 85 3HZ LYS 85 -0.794 4.528 -16.025 1783 H ARG 86 H ARG 86 3.304 -0.200 -11.814 1784 HA ARG 86 HA ARG 86 2.407 -2.105 -9.674 1785 1HB ARG 86 1HB ARG 86 2.676 -2.237 -12.590 1786 2HB ARG 86 2HB ARG 86 3.521 -3.559 -11.784 1787 1HG ARG 86 1HG ARG 86 1.581 -4.558 -11.189 1788 2HG ARG 86 2HG ARG 86 0.897 -3.041 -10.605 1789 1HD ARG 86 1HD ARG 86 0.042 -2.469 -12.732 1790 2HD ARG 86 2HD ARG 86 1.135 -3.586 -13.570 1791 HE ARG 86 HE ARG 86 -0.340 -5.208 -11.849 1792 1HH1 ARG 86 1HH1 ARG 86 -1.075 -2.931 -14.378 1793 2HH1 ARG 86 2HH1 ARG 86 -2.534 -3.740 -14.833 1794 1HH2 ARG 86 1HH2 ARG 86 -2.238 -6.241 -12.458 1795 2HH2 ARG 86 2HH2 ARG 86 -3.190 -5.600 -13.756 1796 H MET 87 H MET 87 4.011 -2.985 -8.405 1797 HA MET 87 HA MET 87 6.859 -2.528 -9.236 1798 1HB MET 87 1HB MET 87 5.299 -1.857 -6.798 1799 2HB MET 87 2HB MET 87 6.904 -2.523 -6.502 1800 1HG MET 87 1HG MET 87 7.747 -0.816 -8.231 1801 2HG MET 87 2HG MET 87 6.170 -0.044 -8.067 1802 1HE MET 87 1HE MET 87 8.764 -1.838 -6.315 1803 2HE MET 87 2HE MET 87 8.246 -1.610 -4.644 1804 3HE MET 87 3HE MET 87 9.582 -0.658 -5.291 1805 H ARG 88 H ARG 88 7.766 -4.520 -9.584 1806 HA ARG 88 HA ARG 88 6.728 -6.867 -8.063 1807 1HB ARG 88 1HB ARG 88 8.568 -6.631 -10.472 1808 2HB ARG 88 2HB ARG 88 7.874 -8.128 -9.853 1809 1HG ARG 88 1HG ARG 88 5.792 -7.671 -10.703 1810 2HG ARG 88 2HG ARG 88 5.959 -5.932 -10.459 1811 1HD ARG 88 1HD ARG 88 7.527 -5.825 -12.387 1812 2HD ARG 88 2HD ARG 88 7.299 -7.565 -12.648 1813 HE ARG 88 HE ARG 88 4.716 -6.468 -12.499 1814 1HH1 ARG 88 1HH1 ARG 88 7.553 -6.088 -14.482 1815 2HH1 ARG 88 2HH1 ARG 88 6.646 -5.645 -15.886 1816 1HH2 ARG 88 1HH2 ARG 88 3.561 -5.890 -14.337 1817 2HH2 ARG 88 2HH2 ARG 88 4.404 -5.533 -15.808 1818 H ILE 89 H ILE 89 7.988 -7.795 -6.481 1819 HA ILE 89 HA ILE 89 10.659 -6.645 -5.940 1820 HB ILE 89 HB ILE 89 8.832 -8.628 -4.535 1821 1HG1 ILE 89 1HG1 ILE 89 9.628 -6.012 -3.362 1822 2HG1 ILE 89 2HG1 ILE 89 8.539 -5.951 -4.748 1823 1HG2 ILE 89 1HG2 ILE 89 11.436 -7.416 -3.555 1824 2HG2 ILE 89 2HG2 ILE 89 11.224 -9.098 -4.042 1825 3HG2 ILE 89 3HG2 ILE 89 10.372 -8.474 -2.629 1826 1HD1 ILE 89 1HD1 ILE 89 7.882 -7.960 -2.662 1827 2HD1 ILE 89 2HD1 ILE 89 6.810 -6.920 -3.600 1828 3HD1 ILE 89 3HD1 ILE 89 7.670 -6.271 -2.202 1829 H PHE 90 H PHE 90 12.066 -7.527 -7.493 1830 HA PHE 90 HA PHE 90 12.020 -10.427 -8.058 1831 1HB PHE 90 1HB PHE 90 13.316 -7.933 -9.093 1832 2HB PHE 90 2HB PHE 90 14.112 -9.467 -9.440 1833 HD1 PHE 90 HD1 PHE 90 13.006 -11.186 -10.806 1834 HD2 PHE 90 HD2 PHE 90 11.140 -7.394 -10.035 1835 HE1 PHE 90 HE1 PHE 90 11.377 -11.616 -12.627 1836 HE2 PHE 90 HE2 PHE 90 9.512 -7.825 -11.856 1837 HZ PHE 90 HZ PHE 90 9.630 -9.936 -13.152 1838 H THR 91 H THR 91 14.636 -11.076 -8.365 1839 HA THR 91 HA THR 91 15.937 -10.538 -5.719 1840 HB THR 91 HB THR 91 16.538 -13.015 -5.811 1841 HG1 THR 91 HG1 THR 91 14.484 -13.076 -7.755 1842 1HG2 THR 91 1HG2 THR 91 14.564 -13.627 -4.734 1843 2HG2 THR 91 2HG2 THR 91 13.550 -12.735 -5.868 1844 3HG2 THR 91 3HG2 THR 91 14.473 -11.868 -4.640 1845 H ILE 92 H ILE 92 17.587 -9.221 -6.598 1846 HA ILE 92 HA ILE 92 18.943 -9.562 -9.051 1847 HB ILE 92 HB ILE 92 20.729 -8.245 -7.880 1848 1HG1 ILE 92 1HG1 ILE 92 19.010 -8.539 -5.411 1849 2HG1 ILE 92 2HG1 ILE 92 20.409 -9.570 -5.713 1850 1HG2 ILE 92 1HG2 ILE 92 18.969 -6.896 -8.689 1851 2HG2 ILE 92 2HG2 ILE 92 19.097 -6.431 -6.992 1852 3HG2 ILE 92 3HG2 ILE 92 17.821 -7.531 -7.512 1853 1HD1 ILE 92 1HD1 ILE 92 21.463 -7.882 -4.550 1854 2HD1 ILE 92 2HD1 ILE 92 20.298 -6.660 -5.062 1855 3HD1 ILE 92 3HD1 ILE 92 21.562 -7.194 -6.171 1856 H LYS 93 H LYS 93 19.181 -11.396 -6.097 1857 HA LYS 93 HA LYS 93 21.178 -13.177 -7.396 1858 1HB LYS 93 1HB LYS 93 22.522 -13.110 -5.276 1859 2HB LYS 93 2HB LYS 93 22.454 -11.542 -6.081 1860 1HG LYS 93 1HG LYS 93 21.534 -10.628 -4.242 1861 2HG LYS 93 2HG LYS 93 20.187 -11.761 -4.345 1862 1HD LYS 93 1HD LYS 93 21.080 -12.288 -2.252 1863 2HD LYS 93 2HD LYS 93 21.899 -13.456 -3.290 1864 1HE LYS 93 1HE LYS 93 23.935 -12.308 -3.194 1865 2HE LYS 93 2HE LYS 93 23.155 -10.756 -2.834 1866 1HZ LYS 93 1HZ LYS 93 22.986 -13.093 -1.013 1867 2HZ LYS 93 2HZ LYS 93 22.610 -11.472 -0.671 1868 3HZ LYS 93 3HZ LYS 93 24.228 -11.941 -0.886 1869 HA PRO 94 HA PRO 94 18.858 -16.486 -5.711 1870 1HB PRO 94 1HB PRO 94 21.328 -17.522 -4.390 1871 2HB PRO 94 2HB PRO 94 20.245 -18.330 -5.538 1872 1HG PRO 94 1HG PRO 94 22.666 -17.423 -6.251 1873 2HG PRO 94 2HG PRO 94 21.290 -17.421 -7.363 1874 1HD PRO 94 1HD PRO 94 22.574 -15.156 -5.938 1875 2HD PRO 94 2HD PRO 94 21.738 -15.183 -7.504 1876 H ILE 95 H ILE 95 17.983 -17.265 -3.666 1877 HA ILE 95 HA ILE 95 18.972 -15.868 -1.215 1878 HB ILE 95 HB ILE 95 16.193 -15.894 -2.433 1879 1HG1 ILE 95 1HG1 ILE 95 18.020 -13.644 -1.543 1880 2HG1 ILE 95 2HG1 ILE 95 17.779 -14.157 -3.213 1881 1HG2 ILE 95 1HG2 ILE 95 15.333 -14.871 -0.428 1882 2HG2 ILE 95 2HG2 ILE 95 16.944 -14.783 0.285 1883 3HG2 ILE 95 3HG2 ILE 95 16.161 -16.347 0.063 1884 1HD1 ILE 95 1HD1 ILE 95 15.331 -13.678 -2.945 1885 2HD1 ILE 95 2HD1 ILE 95 16.342 -12.244 -2.775 1886 3HD1 ILE 95 3HD1 ILE 95 15.675 -13.027 -1.343 1887 H ALA 96 H ALA 96 18.965 -17.222 0.551 1888 HA ALA 96 HA ALA 96 17.934 -19.981 0.181 1889 1HB ALA 96 1HB ALA 96 20.023 -18.543 1.695 1890 2HB ALA 96 2HB ALA 96 20.030 -20.194 1.075 1891 3HB ALA 96 3HB ALA 96 19.239 -19.831 2.609 1892 H ILE 97 H ILE 97 16.888 -20.997 2.155 1893 HA ILE 97 HA ILE 97 14.556 -19.552 2.978 1894 HB ILE 97 HB ILE 97 15.963 -22.018 4.067 1895 1HG1 ILE 97 1HG1 ILE 97 13.560 -22.585 2.645 1896 2HG1 ILE 97 2HG1 ILE 97 14.515 -21.486 1.650 1897 1HG2 ILE 97 1HG2 ILE 97 14.386 -22.097 5.669 1898 2HG2 ILE 97 2HG2 ILE 97 13.128 -22.072 4.434 1899 3HG2 ILE 97 3HG2 ILE 97 13.736 -20.558 5.105 1900 1HD1 ILE 97 1HD1 ILE 97 16.482 -23.139 2.443 1901 2HD1 ILE 97 2HD1 ILE 97 15.506 -23.461 1.009 1902 3HD1 ILE 97 3HD1 ILE 97 15.128 -24.266 2.533 1903 H GLY 98 H GLY 98 14.504 -17.909 4.454 1904 1HA GLY 98 1HA GLY 98 14.769 -17.158 6.756 1905 2HA GLY 98 2HA GLY 98 16.232 -18.136 6.868 1906 H GLU 99 H GLU 99 15.543 -16.072 4.102 1907 HA GLU 99 HA GLU 99 17.950 -14.451 4.824 1908 1HB GLU 99 1HB GLU 99 16.663 -15.511 2.383 1909 2HB GLU 99 2HB GLU 99 17.258 -13.859 2.223 1910 1HG GLU 99 1HG GLU 99 18.909 -16.171 3.282 1911 2HG GLU 99 2HG GLU 99 18.972 -15.586 1.619 1912 H GLU 100 H GLU 100 17.765 -12.199 5.061 1913 HA GLU 100 HA GLU 100 15.023 -11.117 5.287 1914 1HB GLU 100 1HB GLU 100 17.303 -10.796 6.725 1915 2HB GLU 100 2HB GLU 100 17.444 -9.413 5.639 1916 1HG GLU 100 1HG GLU 100 14.732 -9.709 6.685 1917 2HG GLU 100 2HG GLU 100 15.917 -9.518 7.976 1918 H ILE 101 H ILE 101 14.079 -10.163 3.558 1919 HA ILE 101 HA ILE 101 15.688 -9.395 1.214 1920 HB ILE 101 HB ILE 101 12.717 -9.415 1.854 1921 1HG1 ILE 101 1HG1 ILE 101 14.190 -11.277 0.000 1922 2HG1 ILE 101 2HG1 ILE 101 14.129 -11.600 1.732 1923 1HG2 ILE 101 1HG2 ILE 101 12.405 -8.289 -0.068 1924 2HG2 ILE 101 2HG2 ILE 101 13.248 -9.570 -0.940 1925 3HG2 ILE 101 3HG2 ILE 101 14.150 -8.192 -0.308 1926 1HD1 ILE 101 1HD1 ILE 101 11.960 -12.246 1.636 1927 2HD1 ILE 101 2HD1 ILE 101 12.191 -12.335 -0.110 1928 3HD1 ILE 101 3HD1 ILE 101 11.517 -10.876 0.617 1929 H THR 102 H THR 102 16.410 -7.356 0.931 1930 HA THR 102 HA THR 102 14.793 -5.051 1.897 1931 HB THR 102 HB THR 102 16.798 -4.115 2.995 1932 HG1 THR 102 HG1 THR 102 18.636 -4.861 2.371 1933 1HG2 THR 102 1HG2 THR 102 16.940 -5.651 4.867 1934 2HG2 THR 102 2HG2 THR 102 16.392 -6.992 3.862 1935 3HG2 THR 102 3HG2 THR 102 15.285 -5.677 4.257 1936 H ILE 103 H ILE 103 16.238 -2.961 1.132 1937 HA ILE 103 HA ILE 103 17.588 -3.485 -1.453 1938 HB ILE 103 HB ILE 103 15.987 -2.018 -2.648 1939 1HG1 ILE 103 1HG1 ILE 103 13.843 -2.013 -0.744 1940 2HG1 ILE 103 2HG1 ILE 103 15.266 -1.293 0.010 1941 1HG2 ILE 103 1HG2 ILE 103 15.613 -4.523 -2.401 1942 2HG2 ILE 103 2HG2 ILE 103 14.172 -3.578 -2.774 1943 3HG2 ILE 103 3HG2 ILE 103 14.456 -4.139 -1.127 1944 1HD1 ILE 103 1HD1 ILE 103 14.733 -0.461 -2.786 1945 2HD1 ILE 103 2HD1 ILE 103 15.266 0.502 -1.408 1946 3HD1 ILE 103 3HD1 ILE 103 13.560 0.091 -1.590 1947 H SER 104 H SER 104 18.635 -1.505 -2.287 1948 HA SER 104 HA SER 104 19.433 0.301 -0.069 1949 1HB SER 104 1HB SER 104 21.061 -0.921 -1.553 1950 2HB SER 104 2HB SER 104 20.456 0.017 -2.919 1951 HG SER 104 HG SER 104 22.299 0.705 -1.158 1952 H TYR 105 H TYR 105 20.054 2.626 -1.240 1953 HA TYR 105 HA TYR 105 17.536 3.554 -2.590 1954 1HB TYR 105 1HB TYR 105 19.247 5.103 -0.613 1955 2HB TYR 105 2HB TYR 105 17.641 5.530 -1.197 1956 HD1 TYR 105 HD1 TYR 105 16.111 3.078 -1.000 1957 HD2 TYR 105 HD2 TYR 105 19.098 4.629 1.669 1958 HE1 TYR 105 HE1 TYR 105 15.099 1.805 0.873 1959 HE2 TYR 105 HE2 TYR 105 18.087 3.357 3.541 1960 HH TYR 105 HH TYR 105 15.026 1.984 3.389 1961 H GLY 106 H GLY 106 20.777 4.867 -1.799 1962 1HA GLY 106 1HA GLY 106 22.427 5.768 -3.209 1963 2HA GLY 106 2HA GLY 106 21.598 5.008 -4.566 1964 H ASP 107 H ASP 107 22.071 7.045 -5.717 1965 HA ASP 107 HA ASP 107 21.409 9.131 -6.584 1966 1HB ASP 107 1HB ASP 107 19.006 7.866 -5.339 1967 2HB ASP 107 2HB ASP 107 18.867 9.564 -5.793 1968 H ASP 108 H ASP 108 19.368 9.479 -3.711 1969 HA ASP 108 HA ASP 108 21.283 11.547 -2.687 1970 1HB ASP 108 1HB ASP 108 18.691 11.825 -3.833 1971 2HB ASP 108 2HB ASP 108 18.523 12.160 -2.109 1972 H TYR 109 H TYR 109 18.688 9.241 -1.919 1973 HA TYR 109 HA TYR 109 18.366 9.580 0.823 1974 1HB TYR 109 1HB TYR 109 18.087 7.494 -1.191 1975 2HB TYR 109 2HB TYR 109 18.514 6.804 0.375 1976 HD1 TYR 109 HD1 TYR 109 16.243 9.419 -1.079 1977 HD2 TYR 109 HD2 TYR 109 16.799 6.362 1.887 1978 HE1 TYR 109 HE1 TYR 109 13.914 9.757 -0.294 1979 HE2 TYR 109 HE2 TYR 109 14.471 6.699 2.671 1980 HH TYR 109 HH TYR 109 12.154 8.094 1.004 1981 H TRP 110 H TRP 110 20.194 10.096 2.059 1982 HA TRP 110 HA TRP 110 22.788 9.002 1.875 1983 1HB TRP 110 1HB TRP 110 23.040 9.935 4.101 1984 2HB TRP 110 2HB TRP 110 21.952 10.986 3.197 1985 HD1 TRP 110 HD1 TRP 110 19.387 11.014 3.895 1986 HE1 TRP 110 HE1 TRP 110 18.168 10.187 6.016 1987 HE3 TRP 110 HE3 TRP 110 23.049 8.125 5.921 1988 HZ2 TRP 110 HZ2 TRP 110 18.697 8.506 8.284 1989 HZ3 TRP 110 HZ3 TRP 110 22.684 6.920 8.039 1990 HH2 TRP 110 HH2 TRP 110 20.514 7.104 9.236 1991 H LEU 111 H LEU 111 23.431 6.910 2.093 1992 HA LEU 111 HA LEU 111 21.653 4.918 3.310 1993 1HB LEU 111 1HB LEU 111 23.429 4.965 1.241 1994 2HB LEU 111 2HB LEU 111 24.445 4.265 2.500 1995 HG LEU 111 HG LEU 111 22.778 2.506 2.899 1996 1HD1 LEU 111 1HD1 LEU 111 21.109 4.330 1.371 1997 2HD1 LEU 111 2HD1 LEU 111 20.633 2.970 2.387 1998 3HD1 LEU 111 3HD1 LEU 111 21.055 2.702 0.696 1999 1HD2 LEU 111 1HD2 LEU 111 24.485 2.128 1.160 2000 2HD2 LEU 111 2HD2 LEU 111 23.424 2.858 -0.045 2001 3HD2 LEU 111 3HD2 LEU 111 22.968 1.340 0.728 2002 H SER 112 H SER 112 23.940 3.258 4.243 2003 HA SER 112 HA SER 112 24.450 4.683 6.832 2004 1HB SER 112 1HB SER 112 23.089 2.308 6.207 2005 2HB SER 112 2HB SER 112 24.640 1.767 6.847 2006 HG SER 112 HG SER 112 24.269 2.912 8.702 2007 H ARG 113 H ARG 113 26.495 5.506 5.855 2008 HA ARG 113 HA ARG 113 28.821 5.374 5.459 2009 1HB ARG 113 1HB ARG 113 28.127 4.142 7.799 2010 2HB ARG 113 2HB ARG 113 28.959 2.824 6.974 2011 1HG ARG 113 1HG ARG 113 30.927 4.232 6.635 2012 2HG ARG 113 2HG ARG 113 30.094 5.611 7.353 2013 1HD ARG 113 1HD ARG 113 29.782 3.849 9.371 2014 2HD ARG 113 2HD ARG 113 31.293 3.226 8.681 2015 HE ARG 113 HE ARG 113 32.359 5.238 9.343 2016 1HH1 ARG 113 1HH1 ARG 113 28.895 5.585 9.395 2017 2HH1 ARG 113 2HH1 ARG 113 28.953 7.154 10.119 2018 1HH2 ARG 113 1HH2 ARG 113 32.407 7.276 10.283 2019 2HH2 ARG 113 2HH2 ARG 113 30.925 8.106 10.620 2020 HA PRO 114 HA PRO 114 27.970 1.705 2.555 2021 1HB PRO 114 1HB PRO 114 27.817 3.238 0.236 2022 2HB PRO 114 2HB PRO 114 26.415 2.659 1.152 2023 1HG PRO 114 1HG PRO 114 27.689 5.338 1.117 2024 2HG PRO 114 2HG PRO 114 25.987 4.899 1.307 2025 1HD PRO 114 1HD PRO 114 27.583 5.688 3.372 2026 2HD PRO 114 2HD PRO 114 26.186 4.610 3.569 2027 H ARG 115 H ARG 115 29.550 4.665 1.283 2028 HA ARG 115 HA ARG 115 31.771 5.042 0.580 2029 1HB ARG 115 1HB ARG 115 31.846 3.376 2.870 2030 2HB ARG 115 2HB ARG 115 32.982 2.667 1.722 2031 1HG ARG 115 1HG ARG 115 34.460 4.337 2.056 2032 2HG ARG 115 2HG ARG 115 33.226 5.559 1.755 2033 1HD ARG 115 1HD ARG 115 33.123 6.020 3.970 2034 2HD ARG 115 2HD ARG 115 32.732 4.326 4.320 2035 HE ARG 115 HE ARG 115 35.484 4.399 3.701 2036 1HH1 ARG 115 1HH1 ARG 115 33.324 5.732 6.085 2037 2HH1 ARG 115 2HH1 ARG 115 34.540 5.792 7.313 2038 1HH2 ARG 115 1HH2 ARG 115 37.045 4.487 5.313 2039 2HH2 ARG 115 2HH2 ARG 115 36.631 5.093 6.882 2040 H LEU 116 H LEU 116 31.780 1.471 0.731 2041 HA LEU 116 HA LEU 116 32.177 -0.113 -0.976 2042 1HB LEU 116 1HB LEU 116 30.383 2.027 -2.073 2043 2HB LEU 116 2HB LEU 116 30.995 0.813 -3.195 2044 HG LEU 116 HG LEU 116 28.825 0.124 -2.227 2045 1HD1 LEU 116 1HD1 LEU 116 29.465 -2.068 -2.035 2046 2HD1 LEU 116 2HD1 LEU 116 30.727 -1.704 -0.858 2047 3HD1 LEU 116 3HD1 LEU 116 31.015 -1.423 -2.575 2048 1HD2 LEU 116 1HD2 LEU 116 28.663 -0.364 0.173 2049 2HD2 LEU 116 2HD2 LEU 116 29.086 1.331 -0.071 2050 3HD2 LEU 116 3HD2 LEU 116 30.327 0.172 0.408 2051 H THR 117 H THR 117 34.341 1.711 -0.531 2052 HA THR 117 HA THR 117 35.337 3.011 -2.853 2053 HB THR 117 HB THR 117 36.858 1.542 -0.668 2054 HG1 THR 117 HG1 THR 117 36.696 3.533 0.424 2055 1HG2 THR 117 1HG2 THR 117 37.552 3.555 -2.756 2056 2HG2 THR 117 2HG2 THR 117 38.538 2.264 -2.069 2057 3HG2 THR 117 3HG2 THR 117 38.289 3.759 -1.167 2058 H GLN 118 H GLN 118 37.004 2.253 -4.359 2059 HA GLN 118 HA GLN 118 36.727 -0.660 -4.969 2060 1HB GLN 118 1HB GLN 118 36.588 1.764 -6.450 2061 2HB GLN 118 2HB GLN 118 38.045 0.931 -6.993 2062 1HG GLN 118 1HG GLN 118 36.854 -0.701 -8.019 2063 2HG GLN 118 2HG GLN 118 35.751 -0.867 -6.653 2064 1HE2 GLN 118 1HE2 GLN 118 36.317 0.919 -9.673 2065 2HE2 GLN 118 2HE2 GLN 118 34.755 1.573 -9.781 2066 H ASN 119 H ASN 119 38.502 -0.097 -2.878 2067 HA ASN 119 HA ASN 119 41.174 -0.459 -4.200 2068 1HB ASN 119 1HB ASN 119 40.740 1.711 -2.954 2069 2HB ASN 119 2HB ASN 119 40.557 0.755 -1.483 2070 1HD2 ASN 119 1HD2 ASN 119 42.880 2.104 -3.718 2071 2HD2 ASN 119 2HD2 ASN 119 44.270 1.522 -2.937 2072 1H GLY 201 1H GLY 201 29.385 17.283 8.504 2073 2H GLY 201 2H GLY 201 30.622 17.722 9.582 2074 3H GLY 201 3H GLY 201 30.904 17.755 7.908 2075 1HA GLY 201 1HA GLY 201 29.725 19.670 7.577 2076 2HA GLY 201 2HA GLY 201 28.742 19.403 9.016 2077 H LYS 202 H LYS 202 30.431 21.754 8.200 2078 HA LYS 202 HA LYS 202 32.460 21.755 10.393 2079 1HB LYS 202 1HB LYS 202 32.144 22.905 7.713 2080 2HB LYS 202 2HB LYS 202 32.659 24.106 8.898 2081 1HG LYS 202 1HG LYS 202 34.623 22.921 9.426 2082 2HG LYS 202 2HG LYS 202 33.995 21.408 8.773 2083 1HD LYS 202 1HD LYS 202 35.502 22.120 7.110 2084 2HD LYS 202 2HD LYS 202 33.943 22.675 6.499 2085 1HE LYS 202 1HE LYS 202 34.363 24.930 7.254 2086 2HE LYS 202 2HE LYS 202 35.799 24.416 8.159 2087 1HZ LYS 202 1HZ LYS 202 35.385 24.457 5.225 2088 2HZ LYS 202 2HZ LYS 202 36.590 23.494 5.935 2089 3HZ LYS 202 3HZ LYS 202 36.633 25.182 6.120 2090 H ALA 203 H ALA 203 29.655 23.560 9.141 2091 HA ALA 203 HA ALA 203 29.538 25.010 11.767 2092 1HB ALA 203 1HB ALA 203 30.171 26.365 9.744 2093 2HB ALA 203 2HB ALA 203 28.662 26.903 10.481 2094 3HB ALA 203 3HB ALA 203 28.627 25.924 9.014 2095 HA PRO 204 HA PRO 204 25.527 23.284 12.280 2096 1HB PRO 204 1HB PRO 204 24.241 25.409 13.523 2097 2HB PRO 204 2HB PRO 204 25.325 24.278 14.352 2098 1HG PRO 204 1HG PRO 204 25.854 27.024 13.343 2099 2HG PRO 204 2HG PRO 204 26.456 26.222 14.801 2100 1HD PRO 204 1HD PRO 204 27.957 26.561 12.563 2101 2HD PRO 204 2HD PRO 204 28.174 25.195 13.677 2102 H ARG 205 H ARG 205 23.984 23.078 10.709 2103 HA ARG 205 HA ARG 205 23.426 25.377 8.916 2104 1HB ARG 205 1HB ARG 205 23.088 22.391 8.914 2105 2HB ARG 205 2HB ARG 205 22.082 23.351 7.829 2106 1HG ARG 205 1HG ARG 205 23.891 24.083 6.578 2107 2HG ARG 205 2HG ARG 205 25.017 23.931 7.927 2108 1HD ARG 205 1HD ARG 205 24.988 21.490 7.727 2109 2HD ARG 205 2HD ARG 205 23.766 21.588 6.444 2110 HE ARG 205 HE ARG 205 25.472 22.286 4.954 2111 1HH1 ARG 205 1HH1 ARG 205 26.501 22.610 8.264 2112 2HH1 ARG 205 2HH1 ARG 205 28.122 23.034 7.833 2113 1HH2 ARG 205 1HH2 ARG 205 27.582 22.838 4.421 2114 2HH2 ARG 205 2HH2 ARG 205 28.732 23.162 5.675 2115 H LYS 206 H LYS 206 21.189 25.975 8.441 2116 HA LYS 206 HA LYS 206 19.308 25.359 10.698 2117 1HB LYS 206 1HB LYS 206 20.462 27.757 9.931 2118 2HB LYS 206 2HB LYS 206 18.894 27.820 9.127 2119 1HG LYS 206 1HG LYS 206 18.382 28.715 11.224 2120 2HG LYS 206 2HG LYS 206 17.985 27.013 11.460 2121 1HD LYS 206 1HD LYS 206 19.312 27.650 13.349 2122 2HD LYS 206 2HD LYS 206 20.376 26.709 12.302 2123 1HE LYS 206 1HE LYS 206 21.800 28.480 12.339 2124 2HE LYS 206 2HE LYS 206 20.597 29.372 11.388 2125 1HZ LYS 206 1HZ LYS 206 20.873 29.228 14.337 2126 2HZ LYS 206 2HZ LYS 206 19.427 29.727 13.600 2127 3HZ LYS 206 3HZ LYS 206 20.856 30.612 13.353 2128 H GLN 207 H GLN 207 19.554 26.087 7.213 2129 HA GLN 207 HA GLN 207 16.740 25.546 6.686 2130 1HB GLN 207 1HB GLN 207 19.199 25.704 4.900 2131 2HB GLN 207 2HB GLN 207 17.530 25.757 4.333 2132 1HG GLN 207 1HG GLN 207 17.435 27.966 4.751 2133 2HG GLN 207 2HG GLN 207 17.855 27.682 6.440 2134 1HE2 GLN 207 1HE2 GLN 207 18.868 29.499 3.928 2135 2HE2 GLN 207 2HE2 GLN 207 20.542 29.515 4.205 2136 H LEU 208 H LEU 208 16.092 23.743 5.168 2137 HA LEU 208 HA LEU 208 17.841 21.340 5.255 2138 1HB LEU 208 1HB LEU 208 15.482 21.902 6.909 2139 2HB LEU 208 2HB LEU 208 15.336 20.386 6.021 2140 HG LEU 208 HG LEU 208 17.803 21.117 7.615 2141 1HD1 LEU 208 1HD1 LEU 208 15.363 19.522 8.453 2142 2HD1 LEU 208 2HD1 LEU 208 15.927 21.033 9.168 2143 3HD1 LEU 208 3HD1 LEU 208 16.883 19.561 9.347 2144 1HD2 LEU 208 1HD2 LEU 208 18.166 18.657 7.496 2145 2HD2 LEU 208 2HD2 LEU 208 18.108 19.398 5.896 2146 3HD2 LEU 208 3HD2 LEU 208 16.712 18.511 6.508 2147 H ALA 209 H ALA 209 16.891 19.567 3.880 2148 HA ALA 209 HA ALA 209 15.292 20.736 1.631 2149 1HB ALA 209 1HB ALA 209 16.584 19.341 0.220 2150 2HB ALA 209 2HB ALA 209 17.001 18.246 1.538 2151 3HB ALA 209 3HB ALA 209 17.745 19.842 1.449 2152 H THR 210 H THR 210 13.192 20.035 1.670 2153 HA THR 210 HA THR 210 12.588 17.362 2.863 2154 HB THR 210 HB THR 210 10.216 18.403 2.736 2155 HG1 THR 210 HG1 THR 210 10.164 20.205 1.693 2156 1HG2 THR 210 1HG2 THR 210 12.505 19.140 4.471 2157 2HG2 THR 210 2HG2 THR 210 10.931 18.472 4.906 2158 3HG2 THR 210 3HG2 THR 210 11.097 20.197 4.579 2159 H LYS 211 H LYS 211 12.265 19.291 -0.085 2160 HA LYS 211 HA LYS 211 10.712 17.183 -1.453 2161 1HB LYS 211 1HB LYS 211 10.921 19.935 -1.603 2162 2HB LYS 211 2HB LYS 211 11.876 19.418 -2.993 2163 1HG LYS 211 1HG LYS 211 9.964 17.974 -3.712 2164 2HG LYS 211 2HG LYS 211 9.012 18.629 -2.380 2165 1HD LYS 211 1HD LYS 211 8.413 20.315 -3.754 2166 2HD LYS 211 2HD LYS 211 10.084 20.876 -3.679 2167 1HE LYS 211 1HE LYS 211 9.599 18.625 -5.553 2168 2HE LYS 211 2HE LYS 211 8.863 20.173 -6.010 2169 1HZ LYS 211 1HZ LYS 211 11.682 19.844 -5.115 2170 2HZ LYS 211 2HZ LYS 211 10.962 21.268 -5.696 2171 3HZ LYS 211 3HZ LYS 211 11.209 19.953 -6.742 2172 H ALA 212 H ALA 212 11.619 16.714 -3.808 2173 HA ALA 212 HA ALA 212 13.268 15.563 -5.048 2174 1HB ALA 212 1HB ALA 212 14.901 17.085 -5.510 2175 2HB ALA 212 2HB ALA 212 15.477 17.080 -3.843 2176 3HB ALA 212 3HB ALA 212 14.119 18.107 -4.304 2177 H ALA 213 H ALA 213 15.817 14.764 -4.533 2178 HA ALA 213 HA ALA 213 17.017 13.082 -3.389 2179 1HB ALA 213 1HB ALA 213 16.151 15.188 -1.589 2180 2HB ALA 213 2HB ALA 213 17.669 14.291 -1.583 2181 3HB ALA 213 3HB ALA 213 16.268 13.658 -0.720 2182 H ARG 214 H ARG 214 15.017 11.774 -4.401 2183 HA ARG 214 HA ARG 214 13.427 10.522 -2.198 2184 1HB ARG 214 1HB ARG 214 13.137 10.900 -5.174 2185 2HB ARG 214 2HB ARG 214 12.238 9.612 -4.372 2186 1HG ARG 214 1HG ARG 214 12.185 12.518 -3.507 2187 2HG ARG 214 2HG ARG 214 10.961 11.769 -4.531 2188 1HD ARG 214 1HD ARG 214 9.907 11.097 -2.635 2189 2HD ARG 214 2HD ARG 214 11.291 10.037 -2.308 2190 HE ARG 214 HE ARG 214 12.022 11.619 -0.713 2191 1HH1 ARG 214 1HH1 ARG 214 9.847 13.098 -2.993 2192 2HH1 ARG 214 2HH1 ARG 214 9.841 14.618 -2.168 2193 1HH2 ARG 214 1HH2 ARG 214 11.998 13.602 0.339 2194 2HH2 ARG 214 2HH2 ARG 214 11.049 14.904 -0.296 2195 1HN MLZ 215 1HN MLZ 215 12.875 8.072 -3.210 2196 HA MLZ 215 HA MLZ 215 15.389 6.632 -2.883 2197 1HB MLZ 215 1HB MLZ 215 12.480 6.129 -3.042 2198 2HB MLZ 215 2HB MLZ 215 13.472 4.814 -3.673 2199 1HG MLZ 215 1HG MLZ 215 14.285 6.046 -1.075 2200 2HG MLZ 215 2HG MLZ 215 14.438 4.376 -1.621 2201 1HD MLZ 215 1HD MLZ 215 11.949 5.784 -0.630 2202 2HD MLZ 215 2HD MLZ 215 11.890 4.243 -1.487 2203 1HE MLZ 215 1HE MLZ 215 13.899 4.160 0.612 2204 2HE MLZ 215 2HE MLZ 215 12.471 3.129 0.400 2205 HZ MLZ 215 HZ MLZ 215 11.098 4.839 1.358 2206 1HCM MLZ 215 1HCM MLZ 215 12.014 3.367 2.946 2207 2HCM MLZ 215 2HCM MLZ 215 12.121 4.994 3.617 2208 3HCM MLZ 215 3HCM MLZ 215 13.548 4.235 2.914 2209 H SER 216 H SER 216 16.745 6.032 -4.525 2210 HA SER 216 HA SER 216 17.517 5.540 -6.702 2211 1HB SER 216 1HB SER 216 16.935 7.230 -8.253 2212 2HB SER 216 2HB SER 216 15.287 7.350 -7.637 2213 HG SER 216 HG SER 216 16.005 8.426 -5.879 2214 H ALA 217 H ALA 217 16.384 5.078 -9.084 2215 HA ALA 217 HA ALA 217 14.542 2.815 -8.537 2216 1HB ALA 217 1HB ALA 217 13.715 5.388 -9.413 2217 2HB ALA 217 2HB ALA 217 12.734 3.924 -9.341 2218 3HB ALA 217 3HB ALA 217 13.606 4.330 -10.819 2219 HA PRO 218 HA PRO 218 16.706 0.833 -11.799 2220 1HB PRO 218 1HB PRO 218 14.628 -0.204 -13.351 2221 2HB PRO 218 2HB PRO 218 15.269 -0.963 -11.883 2222 1HG PRO 218 1HG PRO 218 12.826 0.682 -12.261 2223 2HG PRO 218 2HG PRO 218 13.105 -0.696 -11.188 2224 1HD PRO 218 1HD PRO 218 13.048 1.871 -10.315 2225 2HD PRO 218 2HD PRO 218 14.036 0.612 -9.544 2226 H ALA 219 H ALA 219 16.553 0.635 -14.408 2227 HA ALA 219 HA ALA 219 16.765 1.858 -16.420 2228 1HB ALA 219 1HB ALA 219 14.269 1.665 -16.014 2229 2HB ALA 219 2HB ALA 219 14.729 3.070 -16.976 2230 3HB ALA 219 3HB ALA 219 14.327 3.263 -15.269 2231 H THR 220 H THR 220 18.750 2.902 -15.460 2232 HA THR 220 HA THR 220 18.374 5.850 -15.317 2233 HB THR 220 HB THR 220 20.043 5.652 -13.287 2234 HG1 THR 220 HG1 THR 220 19.880 3.729 -12.207 2235 1HG2 THR 220 1HG2 THR 220 17.216 4.700 -12.806 2236 2HG2 THR 220 2HG2 THR 220 17.563 6.350 -13.324 2237 3HG2 THR 220 3HG2 THR 220 18.200 5.755 -11.791 2238 H GLY 221 H GLY 221 19.410 4.886 -17.547 2239 1HA GLY 221 1HA GLY 221 21.304 5.011 -18.927 2240 2HA GLY 221 2HA GLY 221 22.119 5.836 -17.598 2241 1HN SAH 301 1HN SAH 301 -11.595 -1.328 -7.283 2242 2HN SAH 301 2HN SAH 301 -10.550 -0.894 -8.555 2243 HA SAH 301 HA SAH 301 -10.912 1.516 -7.741 2244 1HB SAH 301 1HB SAH 301 -11.944 -0.302 -5.553 2245 2HB SAH 301 2HB SAH 301 -11.330 1.309 -5.180 2246 1HG SAH 301 1HG SAH 301 -13.926 0.769 -5.917 2247 2HG SAH 301 2HG SAH 301 -13.204 1.256 -7.451 2248 1H5* SAH 301 1H5* SAH 301 -15.398 2.180 -5.698 2249 2H5* SAH 301 2H5* SAH 301 -15.176 3.592 -4.664 2250 H4* SAH 301 H4* SAH 301 -14.809 4.802 -6.917 2251 H3* SAH 301 H3* SAH 301 -17.079 4.239 -5.205 2252 *HO3 SAH 301 *HO3 SAH 301 -17.597 6.415 -6.270 2253 H2* SAH 301 H2* SAH 301 -18.652 3.640 -6.678 2254 *HO2 SAH 301 *HO2 SAH 301 -17.807 5.748 -8.384 2255 H1* SAH 301 H1* SAH 301 -17.256 3.805 -9.194 2256 H8 SAH 301 H8 SAH 301 -16.676 0.855 -6.870 2257 1HN6 SAH 301 1HN6 SAH 301 -21.471 -1.847 -9.130 2258 2HN6 SAH 301 2HN6 SAH 301 -21.216 -1.406 -7.457 2259 H2 SAH 301 H2 SAH 301 -21.446 2.473 -10.812 2260 1HN SAH 302 1HN SAH 302 11.712 -1.392 7.304 2261 2HN SAH 302 2HN SAH 302 10.701 -0.950 8.595 2262 HA SAH 302 HA SAH 302 11.079 1.457 7.785 2263 1HB SAH 302 1HB SAH 302 12.057 -0.365 5.576 2264 2HB SAH 302 2HB SAH 302 11.453 1.252 5.214 2265 1HG SAH 302 1HG SAH 302 14.053 0.676 5.905 2266 2HG SAH 302 2HG SAH 302 13.364 1.166 7.453 2267 1H5* SAH 302 1H5* SAH 302 15.540 2.067 5.669 2268 2H5* SAH 302 2H5* SAH 302 15.319 3.485 4.643 2269 H4* SAH 302 H4* SAH 302 15.006 4.693 6.905 2270 H3* SAH 302 H3* SAH 302 17.239 4.107 5.154 2271 *HO3 SAH 302 *HO3 SAH 302 17.804 6.272 6.217 2272 H2* SAH 302 H2* SAH 302 18.829 3.482 6.598 2273 *HO2 SAH 302 *HO2 SAH 302 18.041 5.594 8.326 2274 H1* SAH 302 H1* SAH 302 17.477 3.654 9.138 2275 H8 SAH 302 H8 SAH 302 16.819 0.720 6.813 2276 1HN6 SAH 302 1HN6 SAH 302 21.616 -2.051 8.981 2277 2HN6 SAH 302 2HN6 SAH 302 21.340 -1.600 7.314 2278 H2 SAH 302 H2 SAH 302 21.677 2.262 10.680 Start of MODEL 10 1 1H MET 1 1H MET 1 -0.212 -12.177 -8.125 2 2H MET 1 2H MET 1 0.270 -11.688 -6.572 3 3H MET 1 3H MET 1 0.617 -10.710 -7.916 4 HA MET 1 HA MET 1 -1.306 -9.939 -6.507 5 1HB MET 1 1HB MET 1 -1.057 -10.421 -9.427 6 2HB MET 1 2HB MET 1 -2.666 -9.949 -8.881 7 1HG MET 1 1HG MET 1 -0.221 -8.440 -7.966 8 2HG MET 1 2HG MET 1 -0.990 -8.064 -9.509 9 1HE MET 1 1HE MET 1 -1.546 -7.521 -5.422 10 2HE MET 1 2HE MET 1 -1.581 -5.891 -6.093 11 3HE MET 1 3HE MET 1 -0.320 -7.020 -6.586 12 H PHE 2 H PHE 2 -1.226 -12.984 -6.292 13 HA PHE 2 HA PHE 2 -4.078 -13.356 -5.775 14 1HB PHE 2 1HB PHE 2 -4.285 -15.210 -7.453 15 2HB PHE 2 2HB PHE 2 -3.984 -13.648 -8.214 16 HD1 PHE 2 HD1 PHE 2 -1.703 -13.076 -9.045 17 HD2 PHE 2 HD2 PHE 2 -2.665 -16.985 -7.547 18 HE1 PHE 2 HE1 PHE 2 0.346 -13.986 -10.104 19 HE2 PHE 2 HE2 PHE 2 -0.616 -17.896 -8.606 20 HZ PHE 2 HZ PHE 2 0.890 -16.396 -9.885 21 H ASN 3 H ASN 3 -4.177 -14.720 -4.033 22 HA ASN 3 HA ASN 3 -1.893 -16.622 -3.610 23 1HB ASN 3 1HB ASN 3 -2.355 -16.224 -1.193 24 2HB ASN 3 2HB ASN 3 -1.993 -14.717 -2.035 25 1HD2 ASN 3 1HD2 ASN 3 -3.621 -13.103 -2.058 26 2HD2 ASN 3 2HD2 ASN 3 -5.170 -13.317 -1.399 27 H ASP 4 H ASP 4 -2.560 -18.562 -2.258 28 HA ASP 4 HA ASP 4 -4.837 -19.895 -3.420 29 1HB ASP 4 1HB ASP 4 -3.074 -20.478 -1.011 30 2HB ASP 4 2HB ASP 4 -4.181 -21.644 -1.737 31 H ARG 5 H ARG 5 -6.231 -17.873 -2.646 32 HA ARG 5 HA ARG 5 -8.125 -18.759 -0.705 33 1HB ARG 5 1HB ARG 5 -5.707 -17.609 0.335 34 2HB ARG 5 2HB ARG 5 -7.026 -16.482 0.657 35 1HG ARG 5 1HG ARG 5 -8.239 -18.812 1.321 36 2HG ARG 5 2HG ARG 5 -6.570 -19.220 1.719 37 1HD ARG 5 1HD ARG 5 -6.518 -16.941 2.964 38 2HD ARG 5 2HD ARG 5 -8.287 -17.013 2.862 39 HE ARG 5 HE ARG 5 -8.241 -18.799 4.415 40 1HH1 ARG 5 1HH1 ARG 5 -5.101 -18.314 2.993 41 2HH1 ARG 5 2HH1 ARG 5 -4.334 -19.470 4.025 42 1HH2 ARG 5 1HH2 ARG 5 -7.222 -20.296 5.743 43 2HH2 ARG 5 2HH2 ARG 5 -5.523 -20.585 5.570 44 H VAL 6 H VAL 6 -6.551 -16.012 -2.287 45 HA VAL 6 HA VAL 6 -9.205 -14.953 -3.060 46 HB VAL 6 HB VAL 6 -7.152 -13.451 -1.392 47 1HG1 VAL 6 1HG1 VAL 6 -8.237 -12.055 -3.162 48 2HG1 VAL 6 2HG1 VAL 6 -8.672 -11.551 -1.529 49 3HG1 VAL 6 3HG1 VAL 6 -9.810 -12.492 -2.493 50 1HG2 VAL 6 1HG2 VAL 6 -9.213 -13.252 0.133 51 2HG2 VAL 6 2HG2 VAL 6 -8.443 -14.836 0.050 52 3HG2 VAL 6 3HG2 VAL 6 -9.925 -14.527 -0.855 53 H ILE 7 H ILE 7 -8.985 -13.297 -4.767 54 HA ILE 7 HA ILE 7 -6.255 -13.182 -6.003 55 HB ILE 7 HB ILE 7 -7.613 -14.955 -7.055 56 1HG1 ILE 7 1HG1 ILE 7 -7.779 -12.733 -9.047 57 2HG1 ILE 7 2HG1 ILE 7 -6.195 -13.115 -8.372 58 1HG2 ILE 7 1HG2 ILE 7 -9.599 -13.260 -8.306 59 2HG2 ILE 7 2HG2 ILE 7 -9.719 -13.156 -6.551 60 3HG2 ILE 7 3HG2 ILE 7 -9.834 -14.723 -7.349 61 1HD1 ILE 7 1HD1 ILE 7 -7.220 -15.616 -8.930 62 2HD1 ILE 7 2HD1 ILE 7 -6.107 -14.726 -9.969 63 3HD1 ILE 7 3HD1 ILE 7 -7.843 -14.647 -10.265 64 H VAL 8 H VAL 8 -6.003 -11.331 -7.484 65 HA VAL 8 HA VAL 8 -7.701 -9.034 -6.642 66 HB VAL 8 HB VAL 8 -5.045 -9.230 -8.111 67 1HG1 VAL 8 1HG1 VAL 8 -4.952 -6.923 -8.143 68 2HG1 VAL 8 2HG1 VAL 8 -5.957 -6.759 -6.704 69 3HG1 VAL 8 3HG1 VAL 8 -6.701 -7.118 -8.263 70 1HG2 VAL 8 1HG2 VAL 8 -4.614 -8.065 -5.644 71 2HG2 VAL 8 2HG2 VAL 8 -4.303 -9.757 -6.033 72 3HG2 VAL 8 3HG2 VAL 8 -5.828 -9.292 -5.279 73 H LYS 9 H LYS 9 -9.369 -8.589 -7.987 74 HA LYS 9 HA LYS 9 -8.897 -8.734 -10.939 75 1HB LYS 9 1HB LYS 9 -11.386 -9.404 -9.340 76 2HB LYS 9 2HB LYS 9 -11.270 -9.458 -11.098 77 1HG LYS 9 1HG LYS 9 -9.129 -10.986 -10.441 78 2HG LYS 9 2HG LYS 9 -10.183 -11.334 -9.071 79 1HD LYS 9 1HD LYS 9 -12.004 -11.929 -10.629 80 2HD LYS 9 2HD LYS 9 -10.945 -11.591 -11.995 81 1HE LYS 9 1HE LYS 9 -9.548 -13.360 -10.246 82 2HE LYS 9 2HE LYS 9 -11.168 -14.026 -10.512 83 1HZ LYS 9 1HZ LYS 9 -9.195 -13.158 -12.558 84 2HZ LYS 9 2HZ LYS 9 -10.828 -13.454 -12.921 85 3HZ LYS 9 3HZ LYS 9 -9.844 -14.713 -12.344 86 H LYS 10 H LYS 10 -10.379 -5.473 -11.193 87 HA LYS 10 HA LYS 10 -9.717 -6.182 -13.312 88 1HB LYS 10 1HB LYS 10 -7.769 -8.163 -12.405 89 2HB LYS 10 2HB LYS 10 -7.510 -6.636 -13.235 90 1HG LYS 10 1HG LYS 10 -7.988 -5.581 -10.876 91 2HG LYS 10 2HG LYS 10 -7.548 -7.186 -10.291 92 1HD LYS 10 1HD LYS 10 -5.784 -5.903 -12.332 93 2HD LYS 10 2HD LYS 10 -5.726 -5.294 -10.679 94 1HE LYS 10 1HE LYS 10 -5.514 -7.803 -9.996 95 2HE LYS 10 2HE LYS 10 -5.061 -8.060 -11.692 96 1HZ LYS 10 1HZ LYS 10 -3.826 -6.086 -9.835 97 2HZ LYS 10 2HZ LYS 10 -3.407 -6.297 -11.467 98 3HZ LYS 10 3HZ LYS 10 -3.110 -7.539 -10.347 99 H SER 11 H SER 11 -12.004 -7.363 -12.826 100 HA SER 11 HA SER 11 -11.640 -10.298 -13.249 101 1HB SER 11 1HB SER 11 -13.272 -10.375 -11.676 102 2HB SER 11 2HB SER 11 -13.326 -8.616 -11.644 103 HG SER 11 HG SER 11 -15.295 -9.060 -12.320 104 HA PRO 12 HA PRO 12 -13.315 -10.157 -17.299 105 1HB PRO 12 1HB PRO 12 -15.467 -11.904 -17.249 106 2HB PRO 12 2HB PRO 12 -13.773 -12.419 -17.331 107 1HG PRO 12 1HG PRO 12 -15.625 -12.338 -15.012 108 2HG PRO 12 2HG PRO 12 -14.342 -13.493 -15.393 109 1HD PRO 12 1HD PRO 12 -14.104 -11.515 -13.525 110 2HD PRO 12 2HD PRO 12 -12.729 -12.213 -14.398 111 H LEU 13 H LEU 13 -15.500 -9.509 -14.664 112 HA LEU 13 HA LEU 13 -16.916 -7.513 -16.325 113 1HB LEU 13 1HB LEU 13 -17.880 -10.139 -15.954 114 2HB LEU 13 2HB LEU 13 -18.831 -9.140 -14.855 115 HG LEU 13 HG LEU 13 -18.363 -8.219 -17.679 116 1HD1 LEU 13 1HD1 LEU 13 -20.763 -9.880 -16.943 117 2HD1 LEU 13 2HD1 LEU 13 -19.285 -10.664 -17.500 118 3HD1 LEU 13 3HD1 LEU 13 -20.119 -9.512 -18.543 119 1HD2 LEU 13 1HD2 LEU 13 -19.689 -6.567 -16.919 120 2HD2 LEU 13 2HD2 LEU 13 -19.883 -7.395 -15.374 121 3HD2 LEU 13 3HD2 LEU 13 -20.984 -7.744 -16.707 122 H GLY 14 H GLY 14 -15.272 -6.788 -14.316 123 1HA GLY 14 1HA GLY 14 -17.129 -5.701 -12.314 124 2HA GLY 14 2HA GLY 14 -15.883 -6.767 -11.665 125 H GLY 15 H GLY 15 -14.738 -5.129 -10.558 126 1HA GLY 15 1HA GLY 15 -13.263 -3.251 -12.348 127 2HA GLY 15 2HA GLY 15 -13.993 -2.651 -10.859 128 H TYR 16 H TYR 16 -11.708 -2.074 -10.304 129 HA TYR 16 HA TYR 16 -9.778 -4.217 -9.832 130 1HB TYR 16 1HB TYR 16 -9.928 -1.342 -9.911 131 2HB TYR 16 2HB TYR 16 -9.177 -1.815 -8.390 132 HD1 TYR 16 HD1 TYR 16 -6.952 -2.612 -8.324 133 HD2 TYR 16 HD2 TYR 16 -9.011 -2.322 -12.083 134 HE1 TYR 16 HE1 TYR 16 -4.838 -3.108 -9.521 135 HE2 TYR 16 HE2 TYR 16 -6.896 -2.817 -13.279 136 HH TYR 16 HH TYR 16 -3.987 -3.767 -11.549 137 H GLY 17 H GLY 17 -11.831 -5.219 -8.487 138 1HA GLY 17 1HA GLY 17 -11.550 -4.386 -5.631 139 2HA GLY 17 2HA GLY 17 -12.923 -5.286 -6.272 140 H VAL 18 H VAL 18 -12.301 -6.828 -4.436 141 HA VAL 18 HA VAL 18 -10.028 -8.584 -5.330 142 HB VAL 18 HB VAL 18 -9.542 -7.657 -3.174 143 1HG1 VAL 18 1HG1 VAL 18 -11.531 -8.362 -1.400 144 2HG1 VAL 18 2HG1 VAL 18 -12.439 -7.880 -2.828 145 3HG1 VAL 18 3HG1 VAL 18 -11.306 -6.751 -2.089 146 1HG2 VAL 18 1HG2 VAL 18 -9.329 -10.187 -3.447 147 2HG2 VAL 18 2HG2 VAL 18 -10.819 -10.313 -2.512 148 3HG2 VAL 18 3HG2 VAL 18 -9.383 -9.588 -1.789 149 H PHE 19 H PHE 19 -10.578 -10.631 -5.942 150 HA PHE 19 HA PHE 19 -13.426 -11.384 -5.911 151 1HB PHE 19 1HB PHE 19 -10.986 -11.923 -7.400 152 2HB PHE 19 2HB PHE 19 -11.813 -13.427 -7.001 153 HD1 PHE 19 HD1 PHE 19 -12.999 -14.141 -8.880 154 HD2 PHE 19 HD2 PHE 19 -13.096 -9.989 -7.785 155 HE1 PHE 19 HE1 PHE 19 -14.650 -13.706 -10.677 156 HE2 PHE 19 HE2 PHE 19 -14.748 -9.554 -9.583 157 HZ PHE 19 HZ PHE 19 -15.523 -11.413 -11.032 158 H ALA 20 H ALA 20 -14.284 -13.087 -4.740 159 HA ALA 20 HA ALA 20 -12.632 -14.158 -2.529 160 1HB ALA 20 1HB ALA 20 -14.632 -13.851 -1.504 161 2HB ALA 20 2HB ALA 20 -15.326 -15.110 -2.527 162 3HB ALA 20 3HB ALA 20 -15.370 -13.426 -3.049 163 H ARG 21 H ARG 21 -11.353 -15.776 -3.590 164 HA ARG 21 HA ARG 21 -12.419 -17.778 -5.372 165 1HB ARG 21 1HB ARG 21 -9.957 -16.939 -4.409 166 2HB ARG 21 2HB ARG 21 -10.140 -18.536 -3.682 167 1HG ARG 21 1HG ARG 21 -9.228 -19.124 -5.729 168 2HG ARG 21 2HG ARG 21 -10.941 -19.184 -6.130 169 1HD ARG 21 1HD ARG 21 -10.866 -17.050 -7.203 170 2HD ARG 21 2HD ARG 21 -9.281 -16.672 -6.502 171 HE ARG 21 HE ARG 21 -8.795 -19.011 -7.867 172 1HH1 ARG 21 1HH1 ARG 21 -10.309 -16.000 -8.743 173 2HH1 ARG 21 2HH1 ARG 21 -9.844 -16.124 -10.405 174 1HH2 ARG 21 1HH2 ARG 21 -8.204 -19.148 -10.028 175 2HH2 ARG 21 2HH2 ARG 21 -8.662 -17.892 -11.129 176 H LYS 22 H LYS 22 -12.675 -17.304 -1.967 177 HA LYS 22 HA LYS 22 -13.483 -20.156 -1.539 178 1HB LYS 22 1HB LYS 22 -12.836 -17.960 0.470 179 2HB LYS 22 2HB LYS 22 -12.980 -19.682 0.804 180 1HG LYS 22 1HG LYS 22 -11.080 -19.461 -1.270 181 2HG LYS 22 2HG LYS 22 -10.668 -18.213 -0.094 182 1HD LYS 22 1HD LYS 22 -10.323 -19.758 1.623 183 2HD LYS 22 2HD LYS 22 -11.348 -20.976 0.865 184 1HE LYS 22 1HE LYS 22 -9.238 -20.439 -0.961 185 2HE LYS 22 2HE LYS 22 -8.500 -20.671 0.634 186 1HZ LYS 22 1HZ LYS 22 -8.885 -22.801 -0.471 187 2HZ LYS 22 2HZ LYS 22 -10.539 -22.445 -0.619 188 3HZ LYS 22 3HZ LYS 22 -9.851 -22.664 0.918 189 H SER 23 H SER 23 -16.669 -19.020 -0.023 190 HA SER 23 HA SER 23 -14.364 -20.908 0.198 191 1HB SER 23 1HB SER 23 -16.533 -21.857 -0.410 192 2HB SER 23 2HB SER 23 -16.160 -22.342 1.244 193 HG SER 23 HG SER 23 -17.824 -21.274 1.903 194 H PHE 24 H PHE 24 -16.183 -18.475 1.912 195 HA PHE 24 HA PHE 24 -14.544 -19.047 4.360 196 1HB PHE 24 1HB PHE 24 -15.600 -16.518 3.059 197 2HB PHE 24 2HB PHE 24 -14.927 -16.526 4.688 198 HD1 PHE 24 HD1 PHE 24 -14.021 -15.427 1.707 199 HD2 PHE 24 HD2 PHE 24 -12.710 -18.439 4.477 200 HE1 PHE 24 HE1 PHE 24 -11.731 -15.298 0.765 201 HE2 PHE 24 HE2 PHE 24 -10.422 -18.310 3.533 202 HZ PHE 24 HZ PHE 24 -9.932 -16.739 1.678 203 H GLU 25 H GLU 25 -15.592 -18.451 6.425 204 HA GLU 25 HA GLU 25 -18.515 -19.033 6.372 205 1HB GLU 25 1HB GLU 25 -16.211 -19.362 8.241 206 2HB GLU 25 2HB GLU 25 -17.792 -19.109 8.974 207 1HG GLU 25 1HG GLU 25 -18.414 -21.210 8.478 208 2HG GLU 25 2HG GLU 25 -17.977 -20.997 6.786 209 H LYS 26 H LYS 26 -19.775 -17.791 8.143 210 HA LYS 26 HA LYS 26 -19.512 -14.942 7.667 211 1HB LYS 26 1HB LYS 26 -21.610 -16.330 8.079 212 2HB LYS 26 2HB LYS 26 -21.133 -16.400 9.773 213 1HG LYS 26 1HG LYS 26 -21.478 -14.124 10.108 214 2HG LYS 26 2HG LYS 26 -21.251 -13.737 8.405 215 1HD LYS 26 1HD LYS 26 -23.428 -14.217 7.867 216 2HD LYS 26 2HD LYS 26 -23.539 -15.520 9.049 217 1HE LYS 26 1HE LYS 26 -23.316 -12.661 9.984 218 2HE LYS 26 2HE LYS 26 -24.889 -13.329 9.507 219 1HZ LYS 26 1HZ LYS 26 -24.700 -15.050 11.073 220 2HZ LYS 26 2HZ LYS 26 -24.189 -13.667 11.916 221 3HZ LYS 26 3HZ LYS 26 -23.044 -14.773 11.324 222 H GLY 27 H GLY 27 -17.373 -14.427 8.509 223 1HA GLY 27 1HA GLY 27 -16.713 -13.097 10.568 224 2HA GLY 27 2HA GLY 27 -17.218 -14.509 11.497 225 H GLU 28 H GLU 28 -15.218 -14.106 8.550 226 HA GLU 28 HA GLU 28 -13.047 -15.611 9.973 227 1HB GLU 28 1HB GLU 28 -14.525 -16.077 7.462 228 2HB GLU 28 2HB GLU 28 -12.774 -16.190 7.282 229 1HG GLU 28 1HG GLU 28 -12.851 -17.672 9.402 230 2HG GLU 28 2HG GLU 28 -14.582 -17.793 9.091 231 H LEU 29 H LEU 29 -11.015 -14.686 9.793 232 HA LEU 29 HA LEU 29 -10.725 -12.014 8.768 233 1HB LEU 29 1HB LEU 29 -9.453 -13.291 10.621 234 2HB LEU 29 2HB LEU 29 -8.529 -14.035 9.319 235 HG LEU 29 HG LEU 29 -7.417 -12.011 10.303 236 1HD1 LEU 29 1HD1 LEU 29 -6.653 -11.199 8.229 237 2HD1 LEU 29 2HD1 LEU 29 -8.226 -11.418 7.462 238 3HD1 LEU 29 3HD1 LEU 29 -7.230 -12.821 7.847 239 1HD2 LEU 29 1HD2 LEU 29 -9.106 -10.099 8.885 240 2HD2 LEU 29 2HD2 LEU 29 -8.496 -10.042 10.538 241 3HD2 LEU 29 3HD2 LEU 29 -9.978 -10.924 10.177 242 H VAL 30 H VAL 30 -10.630 -11.509 6.630 243 HA VAL 30 HA VAL 30 -9.630 -13.539 4.688 244 HB VAL 30 HB VAL 30 -11.006 -10.855 4.283 245 1HG1 VAL 30 1HG1 VAL 30 -10.430 -13.206 2.459 246 2HG1 VAL 30 2HG1 VAL 30 -9.853 -11.549 2.282 247 3HG1 VAL 30 3HG1 VAL 30 -11.562 -11.916 2.051 248 1HG2 VAL 30 1HG2 VAL 30 -12.050 -13.648 4.699 249 2HG2 VAL 30 2HG2 VAL 30 -12.961 -12.498 3.720 250 3HG2 VAL 30 3HG2 VAL 30 -12.616 -12.137 5.412 251 H GLU 31 H GLU 31 -7.376 -13.217 5.289 252 HA GLU 31 HA GLU 31 -5.242 -12.259 4.996 253 1HB GLU 31 1HB GLU 31 -6.761 -10.574 2.970 254 2HB GLU 31 2HB GLU 31 -5.024 -10.864 2.992 255 1HG GLU 31 1HG GLU 31 -6.266 -13.410 3.086 256 2HG GLU 31 2HG GLU 31 -7.102 -12.488 1.836 257 H GLU 32 H GLU 32 -4.223 -9.840 4.838 258 HA GLU 32 HA GLU 32 -5.805 -7.883 6.385 259 1HB GLU 32 1HB GLU 32 -4.918 -9.424 8.070 260 2HB GLU 32 2HB GLU 32 -3.298 -9.287 7.383 261 1HG GLU 32 1HG GLU 32 -2.973 -7.155 8.225 262 2HG GLU 32 2HG GLU 32 -4.694 -6.780 8.207 263 H CYS 33 H CYS 33 -4.626 -5.789 6.533 264 HA CYS 33 HA CYS 33 -2.207 -5.541 4.825 265 1HB CYS 33 1HB CYS 33 -3.407 -3.875 3.410 266 2HB CYS 33 2HB CYS 33 -4.168 -5.462 3.328 267 HG CYS 33 HG CYS 33 -6.132 -3.899 3.822 268 H LEU 34 H LEU 34 -1.250 -3.355 4.981 269 HA LEU 34 HA LEU 34 -1.799 -2.095 7.624 270 1HB LEU 34 1HB LEU 34 0.432 -1.687 5.594 271 2HB LEU 34 2HB LEU 34 0.427 -1.116 7.262 272 HG LEU 34 HG LEU 34 0.177 -4.044 6.533 273 1HD1 LEU 34 1HD1 LEU 34 2.703 -2.706 7.498 274 2HD1 LEU 34 2HD1 LEU 34 2.351 -2.856 5.777 275 3HD1 LEU 34 3HD1 LEU 34 2.514 -4.303 6.773 276 1HD2 LEU 34 1HD2 LEU 34 0.786 -4.382 8.871 277 2HD2 LEU 34 2HD2 LEU 34 -0.599 -3.293 8.787 278 3HD2 LEU 34 3HD2 LEU 34 1.013 -2.646 9.092 279 H CYS 35 H CYS 35 -1.399 0.450 7.498 280 HA CYS 35 HA CYS 35 -2.525 1.616 5.002 281 1HB CYS 35 1HB CYS 35 -3.751 1.679 7.775 282 2HB CYS 35 2HB CYS 35 -4.238 2.788 6.497 283 HG CYS 35 HG CYS 35 -4.439 -0.286 5.993 284 H ILE 36 H ILE 36 -2.528 4.033 5.115 285 HA ILE 36 HA ILE 36 -0.203 5.030 6.713 286 HB ILE 36 HB ILE 36 -1.666 6.241 4.333 287 1HG1 ILE 36 1HG1 ILE 36 0.978 4.773 4.262 288 2HG1 ILE 36 2HG1 ILE 36 -0.555 3.967 3.927 289 1HG2 ILE 36 1HG2 ILE 36 1.175 6.792 5.146 290 2HG2 ILE 36 2HG2 ILE 36 -0.147 7.618 5.971 291 3HG2 ILE 36 3HG2 ILE 36 0.065 7.811 4.230 292 1HD1 ILE 36 1HD1 ILE 36 0.925 5.174 2.007 293 2HD1 ILE 36 2HD1 ILE 36 -0.086 6.530 2.500 294 3HD1 ILE 36 3HD1 ILE 36 -0.830 5.040 1.920 295 H VAL 37 H VAL 37 -0.504 7.082 7.863 296 HA VAL 37 HA VAL 37 -3.375 7.850 8.263 297 HB VAL 37 HB VAL 37 -1.194 7.571 10.364 298 1HG1 VAL 37 1HG1 VAL 37 -2.751 9.206 11.116 299 2HG1 VAL 37 2HG1 VAL 37 -3.267 7.703 11.884 300 3HG1 VAL 37 3HG1 VAL 37 -4.123 8.308 10.467 301 1HG2 VAL 37 1HG2 VAL 37 -3.639 5.828 10.010 302 2HG2 VAL 37 2HG2 VAL 37 -2.234 5.535 11.034 303 3HG2 VAL 37 3HG2 VAL 37 -2.085 5.422 9.283 304 H ARG 38 H ARG 38 -3.595 9.955 7.667 305 HA ARG 38 HA ARG 38 -1.434 11.889 8.404 306 1HB ARG 38 1HB ARG 38 -2.723 11.291 5.769 307 2HB ARG 38 2HB ARG 38 -2.107 12.906 6.075 308 1HG ARG 38 1HG ARG 38 -0.469 10.385 6.441 309 2HG ARG 38 2HG ARG 38 -0.464 11.337 4.957 310 1HD ARG 38 1HD ARG 38 0.253 13.330 6.266 311 2HD ARG 38 2HD ARG 38 0.313 12.322 7.717 312 HE ARG 38 HE ARG 38 1.789 11.012 5.658 313 1HH1 ARG 38 1HH1 ARG 38 1.939 13.846 7.674 314 2HH1 ARG 38 2HH1 ARG 38 3.668 13.900 7.658 315 1HH2 ARG 38 1HH2 ARG 38 4.032 11.104 5.652 316 2HH2 ARG 38 2HH2 ARG 38 4.846 12.360 6.522 317 H HIS 39 H HIS 39 -2.235 13.971 8.945 318 HA HIS 39 HA HIS 39 -5.028 14.098 9.758 319 1HB HIS 39 1HB HIS 39 -2.803 15.076 10.776 320 2HB HIS 39 2HB HIS 39 -3.113 16.422 9.678 321 HD1 HIS 39 HD1 HIS 39 -5.108 17.957 10.197 322 HD2 HIS 39 HD2 HIS 39 -4.770 14.760 12.851 323 HE1 HIS 39 HE1 HIS 39 -6.710 18.433 12.101 324 H ASN 40 H ASN 40 -5.381 13.778 7.126 325 HA ASN 40 HA ASN 40 -6.270 14.763 5.167 326 1HB ASN 40 1HB ASN 40 -7.570 15.536 7.421 327 2HB ASN 40 2HB ASN 40 -7.089 17.116 6.803 328 1HD2 ASN 40 1HD2 ASN 40 -9.697 15.175 6.754 329 2HD2 ASN 40 2HD2 ASN 40 -10.289 15.473 5.192 330 H ASP 41 H ASP 41 -6.585 17.819 5.055 331 HA ASP 41 HA ASP 41 -5.371 19.690 4.308 332 1HB ASP 41 1HB ASP 41 -4.032 18.827 6.440 333 2HB ASP 41 2HB ASP 41 -2.832 18.386 5.230 334 H ASP 42 H ASP 42 -2.488 19.336 3.365 335 HA ASP 42 HA ASP 42 -2.858 18.950 0.625 336 1HB ASP 42 1HB ASP 42 -0.579 18.549 2.559 337 2HB ASP 42 2HB ASP 42 -0.343 18.172 0.853 338 H TRP 43 H TRP 43 -2.301 16.498 3.122 339 HA TRP 43 HA TRP 43 -1.959 14.234 1.386 340 1HB TRP 43 1HB TRP 43 -1.334 14.046 3.674 341 2HB TRP 43 2HB TRP 43 -2.845 14.755 4.233 342 HD1 TRP 43 HD1 TRP 43 -4.869 13.189 4.626 343 HE1 TRP 43 HE1 TRP 43 -5.189 10.632 4.558 344 HE3 TRP 43 HE3 TRP 43 -0.501 11.813 2.375 345 HZ2 TRP 43 HZ2 TRP 43 -3.777 8.317 3.676 346 HZ3 TRP 43 HZ3 TRP 43 -0.015 9.425 1.927 347 HH2 TRP 43 HH2 TRP 43 -1.650 7.674 2.572 348 H GLY 44 H GLY 44 -4.794 15.908 2.694 349 1HA GLY 44 1HA GLY 44 -6.756 13.960 1.979 350 2HA GLY 44 2HA GLY 44 -7.073 15.678 2.197 351 H THR 45 H THR 45 -5.947 17.008 0.262 352 HA THR 45 HA THR 45 -7.422 16.286 -2.105 353 HB THR 45 HB THR 45 -5.106 18.201 -1.568 354 HG1 THR 45 HG1 THR 45 -6.742 19.690 -1.336 355 1HG2 THR 45 1HG2 THR 45 -6.463 19.296 -3.652 356 2HG2 THR 45 2HG2 THR 45 -6.642 17.582 -4.027 357 3HG2 THR 45 3HG2 THR 45 -5.033 18.283 -3.849 358 H ALA 46 H ALA 46 -3.913 16.060 -1.351 359 HA ALA 46 HA ALA 46 -3.057 15.031 -3.869 360 1HB ALA 46 1HB ALA 46 -1.614 15.803 -1.975 361 2HB ALA 46 2HB ALA 46 -1.155 14.192 -2.531 362 3HB ALA 46 3HB ALA 46 -2.099 14.379 -1.053 363 H LEU 47 H LEU 47 -3.720 13.170 -0.883 364 HA LEU 47 HA LEU 47 -4.209 10.743 -2.516 365 1HB LEU 47 1HB LEU 47 -3.729 11.417 0.385 366 2HB LEU 47 2HB LEU 47 -4.392 9.842 -0.050 367 HG LEU 47 HG LEU 47 -1.939 9.726 0.100 368 1HD1 LEU 47 1HD1 LEU 47 -1.739 8.396 -1.750 369 2HD1 LEU 47 2HD1 LEU 47 -2.315 9.655 -2.842 370 3HD1 LEU 47 3HD1 LEU 47 -3.467 8.712 -1.898 371 1HD2 LEU 47 1HD2 LEU 47 -0.513 11.196 -0.950 372 2HD2 LEU 47 2HD2 LEU 47 -1.896 12.271 -0.742 373 3HD2 LEU 47 3HD2 LEU 47 -1.623 11.475 -2.292 374 H GLU 48 H GLU 48 -6.200 12.919 -2.614 375 HA GLU 48 HA GLU 48 -8.430 12.327 -0.881 376 1HB GLU 48 1HB GLU 48 -7.667 14.202 -2.842 377 2HB GLU 48 2HB GLU 48 -9.120 13.453 -3.472 378 1HG GLU 48 1HG GLU 48 -9.669 13.852 -0.786 379 2HG GLU 48 2HG GLU 48 -8.844 15.318 -1.275 380 H ASP 49 H ASP 49 -7.896 9.844 -1.443 381 HA ASP 49 HA ASP 49 -10.160 8.731 -2.770 382 1HB ASP 49 1HB ASP 49 -8.249 9.733 -4.535 383 2HB ASP 49 2HB ASP 49 -7.843 8.020 -4.443 384 H TYR 50 H TYR 50 -10.214 6.467 -2.332 385 HA TYR 50 HA TYR 50 -9.551 4.461 -1.250 386 1HB TYR 50 1HB TYR 50 -6.708 5.316 -1.849 387 2HB TYR 50 2HB TYR 50 -7.382 3.691 -1.859 388 HD1 TYR 50 HD1 TYR 50 -6.283 6.313 -3.898 389 HD2 TYR 50 HD2 TYR 50 -9.422 3.389 -3.607 390 HE1 TYR 50 HE1 TYR 50 -6.689 6.503 -6.337 391 HE2 TYR 50 HE2 TYR 50 -9.827 3.583 -6.046 392 HH TYR 50 HH TYR 50 -8.291 4.320 -8.111 393 H LEU 51 H LEU 51 -9.582 7.138 0.184 394 HA LEU 51 HA LEU 51 -7.515 6.644 2.282 395 1HB LEU 51 1HB LEU 51 -8.331 8.875 0.816 396 2HB LEU 51 2HB LEU 51 -9.100 9.118 2.383 397 HG LEU 51 HG LEU 51 -6.951 8.907 3.518 398 1HD1 LEU 51 1HD1 LEU 51 -6.159 7.817 0.903 399 2HD1 LEU 51 2HD1 LEU 51 -5.457 7.534 2.496 400 3HD1 LEU 51 3HD1 LEU 51 -4.997 8.963 1.572 401 1HD2 LEU 51 1HD2 LEU 51 -5.844 10.708 1.607 402 2HD2 LEU 51 2HD2 LEU 51 -6.684 11.100 3.109 403 3HD2 LEU 51 3HD2 LEU 51 -7.594 10.939 1.606 404 H PHE 52 H PHE 52 -8.314 5.468 3.969 405 HA PHE 52 HA PHE 52 -11.164 5.662 4.757 406 1HB PHE 52 1HB PHE 52 -8.755 4.016 5.593 407 2HB PHE 52 2HB PHE 52 -10.305 3.898 6.426 408 HD1 PHE 52 HD1 PHE 52 -8.426 3.063 3.412 409 HD2 PHE 52 HD2 PHE 52 -12.333 3.120 5.197 410 HE1 PHE 52 HE1 PHE 52 -9.251 1.518 1.656 411 HE2 PHE 52 HE2 PHE 52 -13.158 1.576 3.441 412 HZ PHE 52 HZ PHE 52 -11.617 0.775 1.670 413 H SER 53 H SER 53 -11.567 7.522 5.956 414 HA SER 53 HA SER 53 -9.487 8.391 7.913 415 1HB SER 53 1HB SER 53 -10.305 9.906 6.074 416 2HB SER 53 2HB SER 53 -11.913 9.840 6.793 417 HG SER 53 HG SER 53 -10.856 11.640 7.574 418 H ARG 54 H ARG 54 -9.991 8.676 10.077 419 HA ARG 54 HA ARG 54 -12.718 7.785 10.950 420 1HB ARG 54 1HB ARG 54 -11.499 6.939 12.967 421 2HB ARG 54 2HB ARG 54 -10.919 6.191 11.480 422 1HG ARG 54 1HG ARG 54 -8.905 7.338 11.527 423 2HG ARG 54 2HG ARG 54 -9.581 8.698 12.425 424 1HD ARG 54 1HD ARG 54 -9.902 6.653 14.231 425 2HD ARG 54 2HD ARG 54 -8.383 6.195 13.439 426 HE ARG 54 HE ARG 54 -8.061 8.897 13.836 427 1HH1 ARG 54 1HH1 ARG 54 -9.014 6.273 15.918 428 2HH1 ARG 54 2HH1 ARG 54 -8.366 7.018 17.336 429 1HH2 ARG 54 1HH2 ARG 54 -7.228 9.842 15.692 430 2HH2 ARG 54 2HH2 ARG 54 -7.362 9.024 17.212 431 H LYS 55 H LYS 55 -12.652 8.572 13.568 432 HA LYS 55 HA LYS 55 -12.885 11.454 13.365 433 1HB LYS 55 1HB LYS 55 -14.106 9.528 14.786 434 2HB LYS 55 2HB LYS 55 -12.889 9.981 15.979 435 1HG LYS 55 1HG LYS 55 -14.778 11.372 16.428 436 2HG LYS 55 2HG LYS 55 -13.618 12.403 15.591 437 1HD LYS 55 1HD LYS 55 -15.397 12.888 14.247 438 2HD LYS 55 2HD LYS 55 -14.985 11.356 13.476 439 1HE LYS 55 1HE LYS 55 -16.546 10.627 15.695 440 2HE LYS 55 2HE LYS 55 -17.363 12.042 15.006 441 1HZ LYS 55 1HZ LYS 55 -17.931 9.860 13.927 442 2HZ LYS 55 2HZ LYS 55 -16.330 9.791 13.365 443 3HZ LYS 55 3HZ LYS 55 -17.352 11.051 12.864 444 H ASN 56 H ASN 56 -10.540 11.728 12.781 445 HA ASN 56 HA ASN 56 -8.447 11.285 14.721 446 1HB ASN 56 1HB ASN 56 -8.606 14.110 14.733 447 2HB ASN 56 2HB ASN 56 -10.247 13.539 15.028 448 1HD2 ASN 56 1HD2 ASN 56 -6.868 12.940 16.146 449 2HD2 ASN 56 2HD2 ASN 56 -7.304 12.587 17.748 450 H MET 57 H MET 57 -8.952 11.067 11.818 451 HA MET 57 HA MET 57 -7.699 13.174 10.337 452 1HB MET 57 1HB MET 57 -5.425 12.158 10.103 453 2HB MET 57 2HB MET 57 -5.759 12.643 11.761 454 1HG MET 57 1HG MET 57 -6.588 9.903 11.071 455 2HG MET 57 2HG MET 57 -4.855 10.174 11.044 456 1HE MET 57 1HE MET 57 -3.597 11.034 12.429 457 2HE MET 57 2HE MET 57 -3.508 10.179 13.970 458 3HE MET 57 3HE MET 57 -3.967 11.882 13.931 459 H SER 58 H SER 58 -6.510 12.001 8.270 460 HA SER 58 HA SER 58 -8.458 9.913 7.368 461 1HB SER 58 1HB SER 58 -8.260 10.910 5.213 462 2HB SER 58 2HB SER 58 -8.278 12.278 6.325 463 HG SER 58 HG SER 58 -6.573 12.250 4.681 464 H ALA 59 H ALA 59 -7.632 7.942 6.706 465 HA ALA 59 HA ALA 59 -4.646 7.698 6.562 466 1HB ALA 59 1HB ALA 59 -5.814 5.177 7.017 467 2HB ALA 59 2HB ALA 59 -6.773 6.299 7.983 468 3HB ALA 59 3HB ALA 59 -5.029 6.196 8.224 469 H MET 60 H MET 60 -4.042 5.640 5.200 470 HA MET 60 HA MET 60 -5.746 5.620 2.728 471 1HB MET 60 1HB MET 60 -3.177 6.550 3.105 472 2HB MET 60 2HB MET 60 -2.884 4.908 2.533 473 1HG MET 60 1HG MET 60 -4.997 6.151 0.991 474 2HG MET 60 2HG MET 60 -3.551 7.159 0.968 475 1HE MET 60 1HE MET 60 -3.581 5.575 -2.347 476 2HE MET 60 2HE MET 60 -2.254 6.529 -1.685 477 3HE MET 60 3HE MET 60 -3.921 6.938 -1.279 478 H ALA 61 H ALA 61 -5.694 3.585 1.499 479 HA ALA 61 HA ALA 61 -5.610 1.220 3.271 480 1HB ALA 61 1HB ALA 61 -6.179 0.673 0.497 481 2HB ALA 61 2HB ALA 61 -7.030 2.141 0.978 482 3HB ALA 61 3HB ALA 61 -7.290 0.639 1.866 483 H LEU 62 H LEU 62 -3.431 0.673 3.581 484 HA LEU 62 HA LEU 62 -1.315 -0.218 3.055 485 1HB LEU 62 1HB LEU 62 -0.958 0.853 0.435 486 2HB LEU 62 2HB LEU 62 -1.880 2.038 1.361 487 HG LEU 62 HG LEU 62 -0.189 1.896 3.178 488 1HD1 LEU 62 1HD1 LEU 62 2.030 0.766 1.986 489 2HD1 LEU 62 2HD1 LEU 62 0.733 -0.316 1.477 490 3HD1 LEU 62 3HD1 LEU 62 1.017 -0.026 3.193 491 1HD2 LEU 62 1HD2 LEU 62 1.377 3.295 2.125 492 2HD2 LEU 62 2HD2 LEU 62 -0.044 3.455 1.092 493 3HD2 LEU 62 3HD2 LEU 62 1.288 2.408 0.605 494 H GLY 63 H GLY 63 -2.387 -2.352 2.837 495 1HA GLY 63 1HA GLY 63 -1.626 -3.692 0.440 496 2HA GLY 63 2HA GLY 63 -2.640 -4.388 1.701 497 H PHE 64 H PHE 64 -4.440 -5.180 0.708 498 HA PHE 64 HA PHE 64 -5.551 -3.817 -1.669 499 1HB PHE 64 1HB PHE 64 -6.360 -6.324 -0.149 500 2HB PHE 64 2HB PHE 64 -6.945 -5.859 -1.746 501 HD1 PHE 64 HD1 PHE 64 -4.445 -7.661 0.038 502 HD2 PHE 64 HD2 PHE 64 -5.113 -5.423 -3.568 503 HE1 PHE 64 HE1 PHE 64 -2.472 -8.746 -1.002 504 HE2 PHE 64 HE2 PHE 64 -3.141 -6.508 -4.607 505 HZ PHE 64 HZ PHE 64 -1.820 -8.169 -3.324 506 H GLY 65 H GLY 65 -5.820 -2.200 0.618 507 1HA GLY 65 1HA GLY 65 -8.577 -2.594 1.619 508 2HA GLY 65 2HA GLY 65 -7.446 -1.359 2.173 509 H ALA 66 H ALA 66 -6.874 -0.814 -0.816 510 HA ALA 66 HA ALA 66 -9.011 1.208 -1.106 511 1HB ALA 66 1HB ALA 66 -6.690 1.867 -1.372 512 2HB ALA 66 2HB ALA 66 -7.454 1.948 -2.960 513 3HB ALA 66 3HB ALA 66 -6.415 0.583 -2.549 514 H ILE 67 H ILE 67 -7.640 -1.524 -2.975 515 HA ILE 67 HA ILE 67 -9.128 -1.356 -5.332 516 HB ILE 67 HB ILE 67 -8.893 -3.871 -5.318 517 1HG1 ILE 67 1HG1 ILE 67 -7.300 -4.227 -3.026 518 2HG1 ILE 67 2HG1 ILE 67 -8.730 -3.360 -2.470 519 1HG2 ILE 67 1HG2 ILE 67 -6.982 -2.002 -5.619 520 2HG2 ILE 67 2HG2 ILE 67 -6.636 -3.729 -5.718 521 3HG2 ILE 67 3HG2 ILE 67 -6.320 -2.849 -4.221 522 1HD1 ILE 67 1HD1 ILE 67 -10.152 -5.036 -3.659 523 2HD1 ILE 67 2HD1 ILE 67 -9.181 -5.744 -2.368 524 3HD1 ILE 67 3HD1 ILE 67 -8.691 -5.941 -4.051 525 H PHE 68 H PHE 68 -10.237 -2.218 -2.129 526 HA PHE 68 HA PHE 68 -12.596 -3.629 -2.567 527 1HB PHE 68 1HB PHE 68 -11.704 -1.464 -0.670 528 2HB PHE 68 2HB PHE 68 -13.336 -2.109 -0.543 529 HD1 PHE 68 HD1 PHE 68 -10.434 -2.374 1.071 530 HD2 PHE 68 HD2 PHE 68 -13.039 -4.931 -1.192 531 HE1 PHE 68 HE1 PHE 68 -9.540 -4.347 2.275 532 HE2 PHE 68 HE2 PHE 68 -12.145 -6.906 0.014 533 HZ PHE 68 HZ PHE 68 -10.394 -6.613 1.747 534 H ASN 69 H ASN 69 -14.723 -3.060 -3.175 535 HA ASN 69 HA ASN 69 -15.043 -0.314 -4.345 536 1HB ASN 69 1HB ASN 69 -16.101 -3.042 -5.162 537 2HB ASN 69 2HB ASN 69 -16.622 -1.534 -5.914 538 1HD2 ASN 69 1HD2 ASN 69 -14.398 -4.034 -6.246 539 2HD2 ASN 69 2HD2 ASN 69 -13.229 -3.227 -7.181 540 H HIS 70 H HIS 70 -17.517 0.194 -4.558 541 HA HIS 70 HA HIS 70 -18.767 -0.355 -1.904 542 1HB HIS 70 1HB HIS 70 -18.261 1.959 -3.213 543 2HB HIS 70 2HB HIS 70 -19.867 1.617 -3.858 544 HD1 HIS 70 HD1 HIS 70 -19.301 3.970 -1.842 545 HD2 HIS 70 HD2 HIS 70 -20.741 0.208 -0.771 546 HE1 HIS 70 HE1 HIS 70 -20.489 4.263 0.376 547 H SER 71 H SER 71 -20.100 -2.142 -2.040 548 HA SER 71 HA SER 71 -21.945 -2.303 -4.403 549 1HB SER 71 1HB SER 71 -19.953 -4.000 -3.948 550 2HB SER 71 2HB SER 71 -21.083 -4.687 -2.781 551 HG SER 71 HG SER 71 -21.532 -4.269 -5.549 552 H LYS 72 H LYS 72 -24.116 -2.855 -3.933 553 HA LYS 72 HA LYS 72 -25.227 -2.055 -1.444 554 1HB LYS 72 1HB LYS 72 -26.244 -3.928 -3.614 555 2HB LYS 72 2HB LYS 72 -27.260 -3.190 -2.377 556 1HG LYS 72 1HG LYS 72 -25.590 -1.679 -4.411 557 2HG LYS 72 2HG LYS 72 -27.338 -1.898 -4.485 558 1HD LYS 72 1HD LYS 72 -27.269 -0.873 -2.056 559 2HD LYS 72 2HD LYS 72 -25.714 -0.233 -2.586 560 1HE LYS 72 1HE LYS 72 -26.850 1.443 -3.609 561 2HE LYS 72 2HE LYS 72 -27.518 0.235 -4.722 562 1HZ LYS 72 1HZ LYS 72 -29.247 -0.254 -3.120 563 2HZ LYS 72 2HZ LYS 72 -29.268 1.406 -3.477 564 3HZ LYS 72 3HZ LYS 72 -28.593 0.860 -2.017 565 H ASP 73 H ASP 73 -25.303 -3.120 0.498 566 HA ASP 73 HA ASP 73 -25.067 -4.860 2.081 567 1HB ASP 73 1HB ASP 73 -26.502 -5.964 -0.314 568 2HB ASP 73 2HB ASP 73 -26.037 -7.085 0.965 569 HA PRO 74 HA PRO 74 -21.155 -6.174 -0.155 570 1HB PRO 74 1HB PRO 74 -19.567 -5.543 2.064 571 2HB PRO 74 2HB PRO 74 -19.814 -4.495 0.658 572 1HG PRO 74 1HG PRO 74 -21.086 -4.410 3.338 573 2HG PRO 74 2HG PRO 74 -20.655 -3.085 2.249 574 1HD PRO 74 1HD PRO 74 -23.201 -3.952 2.583 575 2HD PRO 74 2HD PRO 74 -22.611 -3.261 1.056 576 H ASN 75 H ASN 75 -19.485 -7.792 0.847 577 HA ASN 75 HA ASN 75 -20.947 -9.612 2.724 578 1HB ASN 75 1HB ASN 75 -19.693 -11.404 1.472 579 2HB ASN 75 2HB ASN 75 -20.777 -10.472 0.440 580 1HD2 ASN 75 1HD2 ASN 75 -19.830 -9.630 -1.424 581 2HD2 ASN 75 2HD2 ASN 75 -18.164 -9.398 -1.650 582 H ALA 76 H ALA 76 -18.107 -7.732 2.247 583 HA ALA 76 HA ALA 76 -16.804 -9.126 4.560 584 1HB ALA 76 1HB ALA 76 -15.110 -7.707 2.579 585 2HB ALA 76 2HB ALA 76 -15.939 -9.135 1.960 586 3HB ALA 76 3HB ALA 76 -14.858 -9.274 3.347 587 H ARG 77 H ARG 77 -15.908 -7.734 6.116 588 HA ARG 77 HA ARG 77 -16.330 -4.797 5.646 589 1HB ARG 77 1HB ARG 77 -17.939 -5.723 7.222 590 2HB ARG 77 2HB ARG 77 -16.659 -6.539 8.116 591 1HG ARG 77 1HG ARG 77 -15.760 -4.460 8.899 592 2HG ARG 77 2HG ARG 77 -16.747 -3.532 7.769 593 1HD ARG 77 1HD ARG 77 -18.736 -4.786 9.057 594 2HD ARG 77 2HD ARG 77 -17.529 -4.815 10.356 595 HE ARG 77 HE ARG 77 -18.835 -2.432 9.289 596 1HH1 ARG 77 1HH1 ARG 77 -15.949 -3.702 10.766 597 2HH1 ARG 77 2HH1 ARG 77 -15.487 -2.175 11.433 598 1HH2 ARG 77 1HH2 ARG 77 -18.213 -0.461 10.165 599 2HH2 ARG 77 2HH2 ARG 77 -16.757 -0.352 11.097 600 H HIS 78 H HIS 78 -14.837 -3.440 7.070 601 HA HIS 78 HA HIS 78 -12.140 -4.737 7.182 602 1HB HIS 78 1HB HIS 78 -11.348 -2.393 6.877 603 2HB HIS 78 2HB HIS 78 -12.456 -2.873 5.592 604 HD1 HIS 78 HD1 HIS 78 -14.495 -1.445 5.270 605 HD2 HIS 78 HD2 HIS 78 -12.705 -0.785 8.977 606 HE1 HIS 78 HE1 HIS 78 -15.734 0.493 6.329 607 H GLU 79 H GLU 79 -10.726 -4.070 8.964 608 HA GLU 79 HA GLU 79 -12.177 -3.035 11.376 609 1HB GLU 79 1HB GLU 79 -11.728 -5.623 11.078 610 2HB GLU 79 2HB GLU 79 -10.075 -5.194 11.496 611 1HG GLU 79 1HG GLU 79 -10.910 -4.089 13.561 612 2HG GLU 79 2HG GLU 79 -12.544 -4.618 13.159 613 H LEU 80 H LEU 80 -10.972 -1.504 12.519 614 HA LEU 80 HA LEU 80 -8.137 -1.096 11.625 615 1HB LEU 80 1HB LEU 80 -10.415 0.709 12.391 616 2HB LEU 80 2HB LEU 80 -8.766 1.274 12.650 617 HG LEU 80 HG LEU 80 -9.444 0.048 10.006 618 1HD1 LEU 80 1HD1 LEU 80 -9.800 2.867 9.814 619 2HD1 LEU 80 2HD1 LEU 80 -10.849 2.293 11.112 620 3HD1 LEU 80 3HD1 LEU 80 -10.989 1.603 9.495 621 1HD2 LEU 80 1HD2 LEU 80 -7.839 1.902 9.313 622 2HD2 LEU 80 2HD2 LEU 80 -7.152 0.662 10.361 623 3HD2 LEU 80 3HD2 LEU 80 -7.609 2.228 11.031 624 H THR 81 H THR 81 -6.550 -0.830 13.231 625 HA THR 81 HA THR 81 -6.800 -2.158 15.699 626 HB THR 81 HB THR 81 -4.732 -0.707 16.235 627 HG1 THR 81 HG1 THR 81 -4.008 0.481 14.399 628 1HG2 THR 81 1HG2 THR 81 -3.534 -1.675 14.093 629 2HG2 THR 81 2HG2 THR 81 -5.095 -2.449 13.816 630 3HG2 THR 81 3HG2 THR 81 -4.199 -2.776 15.300 631 H ALA 82 H ALA 82 -6.165 1.344 15.685 632 HA ALA 82 HA ALA 82 -8.570 1.944 17.258 633 1HB ALA 82 1HB ALA 82 -6.688 2.771 19.068 634 2HB ALA 82 2HB ALA 82 -5.915 1.322 18.427 635 3HB ALA 82 3HB ALA 82 -7.514 1.216 19.163 636 H GLY 83 H GLY 83 -5.226 3.216 16.909 637 1HA GLY 83 1HA GLY 83 -6.408 5.883 16.321 638 2HA GLY 83 2HA GLY 83 -4.743 5.597 16.824 639 H LEU 84 H LEU 84 -6.594 3.965 14.253 640 HA LEU 84 HA LEU 84 -6.162 3.774 11.941 641 1HB LEU 84 1HB LEU 84 -6.063 6.456 12.666 642 2HB LEU 84 2HB LEU 84 -4.524 6.230 11.845 643 HG LEU 84 HG LEU 84 -5.655 5.353 9.869 644 1HD1 LEU 84 1HD1 LEU 84 -7.864 5.098 11.758 645 2HD1 LEU 84 2HD1 LEU 84 -7.630 4.303 10.201 646 3HD1 LEU 84 3HD1 LEU 84 -8.362 5.907 10.272 647 1HD2 LEU 84 1HD2 LEU 84 -7.355 7.493 9.697 648 2HD2 LEU 84 2HD2 LEU 84 -5.613 7.595 9.448 649 3HD2 LEU 84 3HD2 LEU 84 -6.304 8.000 11.018 650 H LYS 85 H LYS 85 -4.690 2.237 11.365 651 HA LYS 85 HA LYS 85 -1.911 2.804 10.971 652 1HB LYS 85 1HB LYS 85 -2.834 1.861 13.601 653 2HB LYS 85 2HB LYS 85 -1.567 0.842 12.916 654 1HG LYS 85 1HG LYS 85 0.009 2.442 13.194 655 2HG LYS 85 2HG LYS 85 -1.055 3.696 12.554 656 1HD LYS 85 1HD LYS 85 -2.266 3.210 14.937 657 2HD LYS 85 2HD LYS 85 -0.592 2.854 15.364 658 1HE LYS 85 1HE LYS 85 -0.827 5.291 13.750 659 2HE LYS 85 2HE LYS 85 -1.714 5.396 15.283 660 1HZ LYS 85 1HZ LYS 85 1.116 4.548 14.916 661 2HZ LYS 85 2HZ LYS 85 0.276 4.473 16.390 662 3HZ LYS 85 3HZ LYS 85 0.582 5.977 15.662 663 H ARG 86 H ARG 86 -3.149 -0.239 12.309 664 HA ARG 86 HA ARG 86 -2.800 -1.475 9.599 665 1HB ARG 86 1HB ARG 86 -2.469 -2.491 12.442 666 2HB ARG 86 2HB ARG 86 -2.446 -3.561 11.040 667 1HG ARG 86 1HG ARG 86 -0.202 -3.123 11.080 668 2HG ARG 86 2HG ARG 86 -0.684 -1.657 10.225 669 1HD ARG 86 1HD ARG 86 -0.166 -0.330 12.008 670 2HD ARG 86 2HD ARG 86 -0.915 -1.450 13.162 671 HE ARG 86 HE ARG 86 1.468 -2.621 12.044 672 1HH1 ARG 86 1HH1 ARG 86 0.377 -0.204 14.299 673 2HH1 ARG 86 2HH1 ARG 86 1.801 -0.314 15.274 674 1HH2 ARG 86 1HH2 ARG 86 3.306 -2.746 13.326 675 2HH2 ARG 86 2HH2 ARG 86 3.448 -1.741 14.730 676 H MET 87 H MET 87 -4.546 -2.678 8.789 677 HA MET 87 HA MET 87 -6.875 -3.083 10.598 678 1HB MET 87 1HB MET 87 -8.299 -2.290 8.630 679 2HB MET 87 2HB MET 87 -7.359 -1.040 9.432 680 1HG MET 87 1HG MET 87 -6.973 -0.618 7.157 681 2HG MET 87 2HG MET 87 -5.557 -1.555 7.617 682 1HE MET 87 1HE MET 87 -9.254 -2.939 5.308 683 2HE MET 87 2HE MET 87 -9.016 -1.460 6.238 684 3HE MET 87 3HE MET 87 -9.295 -2.989 7.071 685 H ARG 88 H ARG 88 -8.530 -4.580 9.497 686 HA ARG 88 HA ARG 88 -7.129 -6.580 7.747 687 1HB ARG 88 1HB ARG 88 -9.040 -7.182 10.031 688 2HB ARG 88 2HB ARG 88 -8.019 -8.327 9.166 689 1HG ARG 88 1HG ARG 88 -6.587 -8.018 10.908 690 2HG ARG 88 2HG ARG 88 -6.160 -6.527 10.068 691 1HD ARG 88 1HD ARG 88 -7.249 -5.211 11.603 692 2HD ARG 88 2HD ARG 88 -8.578 -6.373 11.798 693 HE ARG 88 HE ARG 88 -6.160 -6.283 13.402 694 1HH1 ARG 88 1HH1 ARG 88 -8.480 -8.425 11.936 695 2HH1 ARG 88 2HH1 ARG 88 -8.212 -9.684 13.091 696 1HH2 ARG 88 1HH2 ARG 88 -5.830 -7.932 14.889 697 2HH2 ARG 88 2HH2 ARG 88 -6.724 -9.409 14.751 698 H ILE 89 H ILE 89 -8.950 -8.265 7.030 699 HA ILE 89 HA ILE 89 -11.436 -6.761 6.288 700 HB ILE 89 HB ILE 89 -9.656 -8.558 4.596 701 1HG1 ILE 89 1HG1 ILE 89 -10.345 -5.841 3.688 702 2HG1 ILE 89 2HG1 ILE 89 -9.374 -5.882 5.159 703 1HG2 ILE 89 1HG2 ILE 89 -12.124 -8.826 4.172 704 2HG2 ILE 89 2HG2 ILE 89 -11.229 -8.193 2.790 705 3HG2 ILE 89 3HG2 ILE 89 -12.191 -7.105 3.790 706 1HD1 ILE 89 1HD1 ILE 89 -8.263 -5.982 2.715 707 2HD1 ILE 89 2HD1 ILE 89 -8.558 -7.705 2.946 708 3HD1 ILE 89 3HD1 ILE 89 -7.558 -6.820 4.098 709 H PHE 90 H PHE 90 -12.977 -7.868 7.488 710 HA PHE 90 HA PHE 90 -12.726 -10.819 7.800 711 1HB PHE 90 1HB PHE 90 -14.344 -8.583 9.052 712 2HB PHE 90 2HB PHE 90 -14.761 -10.270 9.345 713 HD1 PHE 90 HD1 PHE 90 -13.451 -11.648 10.796 714 HD2 PHE 90 HD2 PHE 90 -12.097 -7.714 9.725 715 HE1 PHE 90 HE1 PHE 90 -11.695 -11.777 12.542 716 HE2 PHE 90 HE2 PHE 90 -10.341 -7.843 11.472 717 HZ PHE 90 HZ PHE 90 -10.140 -9.875 12.880 718 H THR 91 H THR 91 -15.276 -11.662 7.986 719 HA THR 91 HA THR 91 -16.601 -10.878 5.411 720 HB THR 91 HB THR 91 -17.163 -13.371 5.306 721 HG1 THR 91 HG1 THR 91 -15.801 -14.679 6.604 722 1HG2 THR 91 1HG2 THR 91 -14.710 -11.984 4.726 723 2HG2 THR 91 2HG2 THR 91 -15.453 -13.319 3.845 724 3HG2 THR 91 3HG2 THR 91 -14.342 -13.650 5.173 725 H ILE 92 H ILE 92 -18.284 -9.673 6.375 726 HA ILE 92 HA ILE 92 -19.668 -10.314 8.775 727 HB ILE 92 HB ILE 92 -21.353 -8.750 7.830 728 1HG1 ILE 92 1HG1 ILE 92 -19.723 -8.927 5.283 729 2HG1 ILE 92 2HG1 ILE 92 -21.258 -9.762 5.521 730 1HG2 ILE 92 1HG2 ILE 92 -18.700 -7.714 6.879 731 2HG2 ILE 92 2HG2 ILE 92 -18.910 -8.092 8.590 732 3HG2 ILE 92 3HG2 ILE 92 -19.946 -6.891 7.818 733 1HD1 ILE 92 1HD1 ILE 92 -22.484 -7.799 5.496 734 2HD1 ILE 92 2HD1 ILE 92 -21.165 -7.339 4.418 735 3HD1 ILE 92 3HD1 ILE 92 -21.141 -6.831 6.107 736 H LYS 93 H LYS 93 -19.812 -11.819 5.660 737 HA LYS 93 HA LYS 93 -22.004 -13.581 6.619 738 1HB LYS 93 1HB LYS 93 -23.236 -13.181 4.498 739 2HB LYS 93 2HB LYS 93 -23.032 -11.679 5.397 740 1HG LYS 93 1HG LYS 93 -21.151 -11.041 4.002 741 2HG LYS 93 2HG LYS 93 -21.185 -12.598 3.176 742 1HD LYS 93 1HD LYS 93 -22.289 -10.846 1.822 743 2HD LYS 93 2HD LYS 93 -23.434 -12.097 2.303 744 1HE LYS 93 1HE LYS 93 -23.208 -9.897 4.254 745 2HE LYS 93 2HE LYS 93 -23.846 -9.400 2.675 746 1HZ LYS 93 1HZ LYS 93 -25.530 -10.991 2.773 747 2HZ LYS 93 2HZ LYS 93 -25.483 -10.393 4.362 748 3HZ LYS 93 3HZ LYS 93 -24.761 -11.886 3.995 749 HA PRO 94 HA PRO 94 -19.647 -16.767 4.726 750 1HB PRO 94 1HB PRO 94 -22.135 -17.773 3.432 751 2HB PRO 94 2HB PRO 94 -21.040 -18.601 4.553 752 1HG PRO 94 1HG PRO 94 -23.463 -17.727 5.302 753 2HG PRO 94 2HG PRO 94 -22.082 -17.745 6.405 754 1HD PRO 94 1HD PRO 94 -23.363 -15.452 5.012 755 2HD PRO 94 2HD PRO 94 -22.575 -15.516 6.602 756 H ILE 95 H ILE 95 -18.586 -17.063 2.736 757 HA ILE 95 HA ILE 95 -19.783 -15.641 0.377 758 HB ILE 95 HB ILE 95 -16.875 -15.875 1.239 759 1HG1 ILE 95 1HG1 ILE 95 -18.805 -13.536 1.359 760 2HG1 ILE 95 2HG1 ILE 95 -18.192 -14.435 2.747 761 1HG2 ILE 95 1HG2 ILE 95 -18.057 -14.042 -0.854 762 2HG2 ILE 95 2HG2 ILE 95 -17.464 -15.652 -1.257 763 3HG2 ILE 95 3HG2 ILE 95 -16.359 -14.446 -0.592 764 1HD1 ILE 95 1HD1 ILE 95 -16.802 -12.509 2.597 765 2HD1 ILE 95 2HD1 ILE 95 -16.655 -12.657 0.846 766 3HD1 ILE 95 3HD1 ILE 95 -15.845 -13.816 1.900 767 H ALA 96 H ALA 96 -19.665 -16.726 -1.587 768 HA ALA 96 HA ALA 96 -18.929 -19.581 -1.503 769 1HB ALA 96 1HB ALA 96 -21.002 -19.068 -2.541 770 2HB ALA 96 2HB ALA 96 -19.912 -19.325 -3.904 771 3HB ALA 96 3HB ALA 96 -20.323 -17.685 -3.400 772 H ILE 97 H ILE 97 -17.438 -20.532 -2.999 773 HA ILE 97 HA ILE 97 -14.956 -19.362 -3.382 774 HB ILE 97 HB ILE 97 -16.477 -21.382 -5.071 775 1HG1 ILE 97 1HG1 ILE 97 -14.532 -22.640 -3.505 776 2HG1 ILE 97 2HG1 ILE 97 -15.231 -21.421 -2.440 777 1HG2 ILE 97 1HG2 ILE 97 -13.972 -20.176 -5.607 778 2HG2 ILE 97 2HG2 ILE 97 -14.671 -21.588 -6.399 779 3HG2 ILE 97 3HG2 ILE 97 -13.624 -21.793 -4.996 780 1HD1 ILE 97 1HD1 ILE 97 -17.448 -22.478 -3.731 781 2HD1 ILE 97 2HD1 ILE 97 -16.913 -22.899 -2.104 782 3HD1 ILE 97 3HD1 ILE 97 -16.420 -23.889 -3.478 783 H GLY 98 H GLY 98 -17.832 -18.817 -5.306 784 1HA GLY 98 1HA GLY 98 -16.187 -17.229 -7.233 785 2HA GLY 98 2HA GLY 98 -17.755 -17.933 -7.628 786 H GLU 99 H GLU 99 -16.419 -15.813 -5.054 787 HA GLU 99 HA GLU 99 -18.907 -14.150 -5.341 788 1HB GLU 99 1HB GLU 99 -17.372 -15.306 -3.137 789 2HB GLU 99 2HB GLU 99 -17.640 -13.582 -2.907 790 1HG GLU 99 1HG GLU 99 -19.763 -15.679 -3.422 791 2HG GLU 99 2HG GLU 99 -19.490 -14.820 -1.912 792 H GLU 100 H GLU 100 -18.587 -11.814 -4.817 793 HA GLU 100 HA GLU 100 -15.903 -10.827 -5.725 794 1HB GLU 100 1HB GLU 100 -18.169 -10.446 -7.020 795 2HB GLU 100 2HB GLU 100 -18.473 -9.245 -5.765 796 1HG GLU 100 1HG GLU 100 -15.773 -9.123 -6.958 797 2HG GLU 100 2HG GLU 100 -17.086 -8.736 -8.069 798 H ILE 101 H ILE 101 -14.774 -10.099 -3.951 799 HA ILE 101 HA ILE 101 -16.223 -9.306 -1.518 800 HB ILE 101 HB ILE 101 -13.274 -9.497 -2.218 801 1HG1 ILE 101 1HG1 ILE 101 -15.140 -11.431 -0.804 802 2HG1 ILE 101 2HG1 ILE 101 -14.467 -11.641 -2.421 803 1HG2 ILE 101 1HG2 ILE 101 -14.216 -8.095 -0.146 804 2HG2 ILE 101 2HG2 ILE 101 -12.773 -9.097 0.003 805 3HG2 ILE 101 3HG2 ILE 101 -14.329 -9.703 0.570 806 1HD1 ILE 101 1HD1 ILE 101 -12.403 -11.058 -0.436 807 2HD1 ILE 101 2HD1 ILE 101 -12.491 -12.375 -1.605 808 3HD1 ILE 101 3HD1 ILE 101 -13.307 -12.521 -0.048 809 H THR 102 H THR 102 -16.675 -7.266 -0.982 810 HA THR 102 HA THR 102 -14.964 -5.003 -1.792 811 HB THR 102 HB THR 102 -17.077 -3.889 -2.763 812 HG1 THR 102 HG1 THR 102 -18.807 -5.034 -2.630 813 1HG2 THR 102 1HG2 THR 102 -16.099 -6.350 -4.235 814 2HG2 THR 102 2HG2 THR 102 -15.174 -4.853 -4.114 815 3HG2 THR 102 3HG2 THR 102 -16.730 -4.864 -4.944 816 H ILE 103 H ILE 103 -15.337 -3.183 -0.383 817 HA ILE 103 HA ILE 103 -17.244 -3.750 1.864 818 HB ILE 103 HB ILE 103 -15.620 -2.524 3.249 819 1HG1 ILE 103 1HG1 ILE 103 -13.397 -2.246 1.536 820 2HG1 ILE 103 2HG1 ILE 103 -14.764 -1.563 0.657 821 1HG2 ILE 103 1HG2 ILE 103 -13.527 -4.050 2.193 822 2HG2 ILE 103 2HG2 ILE 103 -14.986 -4.913 1.709 823 3HG2 ILE 103 3HG2 ILE 103 -14.688 -4.573 3.413 824 1HD1 ILE 103 1HD1 ILE 103 -15.175 -0.588 3.197 825 2HD1 ILE 103 2HD1 ILE 103 -14.380 0.300 1.897 826 3HD1 ILE 103 3HD1 ILE 103 -13.415 -0.581 3.082 827 H SER 104 H SER 104 -18.361 -1.897 2.774 828 HA SER 104 HA SER 104 -18.948 0.200 0.766 829 1HB SER 104 1HB SER 104 -20.228 -1.137 3.036 830 2HB SER 104 2HB SER 104 -20.454 0.611 3.091 831 HG SER 104 HG SER 104 -21.909 -0.903 1.742 832 H TYR 105 H TYR 105 -19.495 2.426 2.151 833 HA TYR 105 HA TYR 105 -16.994 3.029 3.702 834 1HB TYR 105 1HB TYR 105 -18.550 4.916 1.897 835 2HB TYR 105 2HB TYR 105 -16.946 5.173 2.577 836 HD1 TYR 105 HD1 TYR 105 -18.082 5.021 -0.429 837 HD2 TYR 105 HD2 TYR 105 -15.797 2.405 2.098 838 HE1 TYR 105 HE1 TYR 105 -17.076 3.964 -2.433 839 HE2 TYR 105 HE2 TYR 105 -14.791 1.346 0.092 840 HH TYR 105 HH TYR 105 -14.363 1.943 -2.277 841 H GLY 106 H GLY 106 -20.109 4.676 3.017 842 1HA GLY 106 1HA GLY 106 -21.301 4.428 5.538 843 2HA GLY 106 2HA GLY 106 -20.234 5.827 5.662 844 H ASP 107 H ASP 107 -22.612 6.705 5.997 845 HA ASP 107 HA ASP 107 -24.273 7.051 3.650 846 1HB ASP 107 1HB ASP 107 -24.117 7.909 6.478 847 2HB ASP 107 2HB ASP 107 -24.933 9.056 5.416 848 H ASP 108 H ASP 108 -21.672 8.932 5.150 849 HA ASP 108 HA ASP 108 -22.086 11.321 3.560 850 1HB ASP 108 1HB ASP 108 -20.352 10.279 5.639 851 2HB ASP 108 2HB ASP 108 -19.395 11.118 4.417 852 H TYR 109 H TYR 109 -19.294 9.069 3.484 853 HA TYR 109 HA TYR 109 -18.482 9.881 0.842 854 1HB TYR 109 1HB TYR 109 -17.477 8.443 2.992 855 2HB TYR 109 2HB TYR 109 -17.692 7.197 1.763 856 HD1 TYR 109 HD1 TYR 109 -16.724 10.822 1.611 857 HD2 TYR 109 HD2 TYR 109 -15.673 6.762 0.683 858 HE1 TYR 109 HE1 TYR 109 -14.684 11.617 0.445 859 HE2 TYR 109 HE2 TYR 109 -13.634 7.556 -0.483 860 HH TYR 109 HH TYR 109 -12.131 9.683 -0.313 861 H TRP 110 H TRP 110 -20.808 9.576 -0.071 862 HA TRP 110 HA TRP 110 -20.875 6.980 -1.486 863 1HB TRP 110 1HB TRP 110 -22.248 7.293 0.879 864 2HB TRP 110 2HB TRP 110 -23.471 7.760 -0.301 865 HD1 TRP 110 HD1 TRP 110 -23.597 5.046 1.394 866 HE1 TRP 110 HE1 TRP 110 -23.712 2.800 0.137 867 HE3 TRP 110 HE3 TRP 110 -21.720 6.463 -3.149 868 HZ2 TRP 110 HZ2 TRP 110 -23.093 1.743 -2.444 869 HZ3 TRP 110 HZ3 TRP 110 -21.496 4.817 -4.981 870 HH2 TRP 110 HH2 TRP 110 -22.177 2.461 -4.637 871 H LEU 111 H LEU 111 -23.573 7.340 -2.419 872 HA LEU 111 HA LEU 111 -23.101 9.335 -4.500 873 1HB LEU 111 1HB LEU 111 -24.177 7.150 -4.898 874 2HB LEU 111 2HB LEU 111 -25.473 7.571 -3.780 875 HG LEU 111 HG LEU 111 -25.738 9.673 -5.352 876 1HD1 LEU 111 1HD1 LEU 111 -23.622 8.790 -6.626 877 2HD1 LEU 111 2HD1 LEU 111 -24.974 9.441 -7.553 878 3HD1 LEU 111 3HD1 LEU 111 -24.768 7.696 -7.400 879 1HD2 LEU 111 1HD2 LEU 111 -26.666 6.846 -5.794 880 2HD2 LEU 111 2HD2 LEU 111 -27.163 8.120 -6.907 881 3HD2 LEU 111 3HD2 LEU 111 -27.579 8.232 -5.197 882 H SER 112 H SER 112 -26.033 8.906 -2.483 883 HA SER 112 HA SER 112 -25.951 11.735 -1.648 884 1HB SER 112 1HB SER 112 -27.337 10.748 -4.005 885 2HB SER 112 2HB SER 112 -28.485 11.440 -2.859 886 HG SER 112 HG SER 112 -26.177 12.659 -3.957 887 H ARG 113 H ARG 113 -28.787 9.646 -2.138 888 HA ARG 113 HA ARG 113 -28.922 9.164 0.808 889 1HB ARG 113 1HB ARG 113 -30.221 11.233 -0.369 890 2HB ARG 113 2HB ARG 113 -31.417 9.960 -0.618 891 1HG ARG 113 1HG ARG 113 -31.997 9.972 1.563 892 2HG ARG 113 2HG ARG 113 -30.312 9.873 2.075 893 1HD ARG 113 1HD ARG 113 -30.927 12.504 0.971 894 2HD ARG 113 2HD ARG 113 -31.973 12.108 2.348 895 HE ARG 113 HE ARG 113 -29.097 12.539 2.467 896 1HH1 ARG 113 1HH1 ARG 113 -31.758 10.755 3.828 897 2HH1 ARG 113 2HH1 ARG 113 -30.967 10.521 5.347 898 1HH2 ARG 113 1HH2 ARG 113 -28.090 12.221 4.449 899 2HH2 ARG 113 2HH2 ARG 113 -28.906 11.343 5.699 900 HA PRO 114 HA PRO 114 -30.257 5.613 -1.969 901 1HB PRO 114 1HB PRO 114 -28.321 3.823 -1.165 902 2HB PRO 114 2HB PRO 114 -28.136 4.899 -2.563 903 1HG PRO 114 1HG PRO 114 -27.031 5.146 0.186 904 2HG PRO 114 2HG PRO 114 -26.305 5.583 -1.365 905 1HD PRO 114 1HD PRO 114 -27.412 7.386 0.375 906 2HD PRO 114 2HD PRO 114 -27.283 7.648 -1.376 907 H ARG 115 H ARG 115 -28.941 5.566 1.347 908 HA ARG 115 HA ARG 115 -29.753 4.543 3.311 909 1HB ARG 115 1HB ARG 115 -32.120 5.228 1.598 910 2HB ARG 115 2HB ARG 115 -32.400 4.283 3.061 911 1HG ARG 115 1HG ARG 115 -31.960 6.048 4.424 912 2HG ARG 115 2HG ARG 115 -30.597 6.584 3.440 913 1HD ARG 115 1HD ARG 115 -32.122 8.323 3.067 914 2HD ARG 115 2HD ARG 115 -32.539 7.236 1.728 915 HE ARG 115 HE ARG 115 -33.997 6.388 4.015 916 1HH1 ARG 115 1HH1 ARG 115 -33.801 9.112 1.856 917 2HH1 ARG 115 2HH1 ARG 115 -35.465 9.534 2.060 918 1HH2 ARG 115 1HH2 ARG 115 -36.155 6.956 4.263 919 2HH2 ARG 115 2HH2 ARG 115 -36.790 8.324 3.412 920 H LEU 116 H LEU 116 -29.104 2.850 0.774 921 HA LEU 116 HA LEU 116 -29.249 0.588 0.112 922 1HB LEU 116 1HB LEU 116 -28.554 0.953 2.766 923 2HB LEU 116 2HB LEU 116 -29.847 -0.237 2.872 924 HG LEU 116 HG LEU 116 -27.663 -1.351 2.610 925 1HD1 LEU 116 1HD1 LEU 116 -29.732 -2.316 1.562 926 2HD1 LEU 116 2HD1 LEU 116 -28.245 -2.778 0.732 927 3HD1 LEU 116 3HD1 LEU 116 -29.282 -1.524 0.052 928 1HD2 LEU 116 1HD2 LEU 116 -27.381 -0.333 -0.176 929 2HD2 LEU 116 2HD2 LEU 116 -26.134 -0.797 0.982 930 3HD2 LEU 116 3HD2 LEU 116 -26.932 0.770 1.125 931 H THR 117 H THR 117 -31.796 1.973 -0.083 932 HA THR 117 HA THR 117 -33.638 -0.323 0.486 933 HB THR 117 HB THR 117 -34.144 2.662 0.788 934 HG1 THR 117 HG1 THR 117 -34.432 1.882 3.031 935 1HG2 THR 117 1HG2 THR 117 -36.074 0.902 2.033 936 2HG2 THR 117 2HG2 THR 117 -35.951 0.550 0.309 937 3HG2 THR 117 3HG2 THR 117 -36.344 2.182 0.850 938 H GLN 118 H GLN 118 -33.940 2.856 -1.137 939 HA GLN 118 HA GLN 118 -34.293 1.522 -3.757 940 1HB GLN 118 1HB GLN 118 -36.447 1.918 -2.070 941 2HB GLN 118 2HB GLN 118 -36.490 3.371 -3.069 942 1HG GLN 118 1HG GLN 118 -36.115 1.637 -5.037 943 2HG GLN 118 2HG GLN 118 -36.805 0.501 -3.877 944 1HE2 GLN 118 1HE2 GLN 118 -39.010 0.292 -4.285 945 2HE2 GLN 118 2HE2 GLN 118 -40.054 1.569 -4.685 946 H ASN 119 H ASN 119 -32.206 3.142 -3.326 947 HA ASN 119 HA ASN 119 -31.164 5.153 -3.998 948 1HB ASN 119 1HB ASN 119 -33.495 4.626 -5.798 949 2HB ASN 119 2HB ASN 119 -32.709 6.198 -5.942 950 1HD2 ASN 119 1HD2 ASN 119 -31.693 2.739 -5.614 951 2HD2 ASN 119 2HD2 ASN 119 -30.447 2.849 -6.761 952 1H GLY 201 1H GLY 201 -35.761 16.927 -8.831 953 2H GLY 201 2H GLY 201 -34.368 16.036 -9.218 954 3H GLY 201 3H GLY 201 -35.904 15.419 -9.600 955 1HA GLY 201 1HA GLY 201 -36.217 16.837 -11.361 956 2HA GLY 201 2HA GLY 201 -35.063 18.006 -10.718 957 H LYS 202 H LYS 202 -33.346 18.090 -12.087 958 HA LYS 202 HA LYS 202 -31.754 15.691 -12.592 959 1HB LYS 202 1HB LYS 202 -33.767 16.726 -14.491 960 2HB LYS 202 2HB LYS 202 -32.175 16.475 -15.206 961 1HG LYS 202 1HG LYS 202 -32.817 14.254 -13.485 962 2HG LYS 202 2HG LYS 202 -34.131 14.509 -14.633 963 1HD LYS 202 1HD LYS 202 -31.334 14.635 -15.676 964 2HD LYS 202 2HD LYS 202 -31.986 13.047 -15.271 965 1HE LYS 202 1HE LYS 202 -34.037 13.691 -16.679 966 2HE LYS 202 2HE LYS 202 -33.061 15.046 -17.279 967 1HZ LYS 202 1HZ LYS 202 -32.058 12.254 -17.222 968 2HZ LYS 202 2HZ LYS 202 -31.414 13.579 -18.068 969 3HZ LYS 202 3HZ LYS 202 -32.882 12.885 -18.566 970 H ALA 203 H ALA 203 -30.747 17.788 -11.329 971 HA ALA 203 HA ALA 203 -29.618 19.744 -13.248 972 1HB ALA 203 1HB ALA 203 -30.062 19.445 -10.338 973 2HB ALA 203 2HB ALA 203 -30.102 20.901 -11.332 974 3HB ALA 203 3HB ALA 203 -28.559 20.265 -10.761 975 HA PRO 204 HA PRO 204 -25.845 17.533 -13.825 976 1HB PRO 204 1HB PRO 204 -24.477 20.170 -13.781 977 2HB PRO 204 2HB PRO 204 -24.539 18.962 -15.075 978 1HG PRO 204 1HG PRO 204 -25.894 21.283 -15.191 979 2HG PRO 204 2HG PRO 204 -26.488 19.792 -15.933 980 1HD PRO 204 1HD PRO 204 -27.381 21.158 -13.448 981 2HD PRO 204 2HD PRO 204 -28.314 20.198 -14.614 982 H ARG 205 H ARG 205 -26.012 20.140 -11.424 983 HA ARG 205 HA ARG 205 -24.981 20.355 -9.309 984 1HB ARG 205 1HB ARG 205 -25.759 17.599 -9.827 985 2HB ARG 205 2HB ARG 205 -24.371 17.659 -8.742 986 1HG ARG 205 1HG ARG 205 -25.544 18.747 -7.080 987 2HG ARG 205 2HG ARG 205 -26.608 19.567 -8.223 988 1HD ARG 205 1HD ARG 205 -27.857 17.504 -8.613 989 2HD ARG 205 2HD ARG 205 -26.726 16.593 -7.594 990 HE ARG 205 HE ARG 205 -27.574 18.714 -5.992 991 1HH1 ARG 205 1HH1 ARG 205 -29.114 16.133 -7.748 992 2HH1 ARG 205 2HH1 ARG 205 -30.447 16.034 -6.650 993 1HH2 ARG 205 1HH2 ARG 205 -29.315 18.567 -4.582 994 2HH2 ARG 205 2HH2 ARG 205 -30.562 17.400 -4.872 995 H LYS 206 H LYS 206 -23.049 21.365 -10.284 996 HA LYS 206 HA LYS 206 -20.774 19.788 -11.137 997 1HB LYS 206 1HB LYS 206 -21.645 22.439 -11.193 998 2HB LYS 206 2HB LYS 206 -20.247 22.489 -10.119 999 1HG LYS 206 1HG LYS 206 -19.102 22.659 -12.097 1000 2HG LYS 206 2HG LYS 206 -19.261 20.903 -12.079 1001 1HD LYS 206 1HD LYS 206 -19.976 21.773 -14.254 1002 2HD LYS 206 2HD LYS 206 -21.365 21.110 -13.394 1003 1HE LYS 206 1HE LYS 206 -21.099 23.855 -12.625 1004 2HE LYS 206 2HE LYS 206 -21.038 23.770 -14.395 1005 1HZ LYS 206 1HZ LYS 206 -22.995 22.379 -14.383 1006 2HZ LYS 206 2HZ LYS 206 -23.335 23.811 -13.535 1007 3HZ LYS 206 3HZ LYS 206 -23.034 22.372 -12.685 1008 H GLN 207 H GLN 207 -19.725 18.484 -9.674 1009 HA GLN 207 HA GLN 207 -18.634 17.810 -7.690 1010 1HB GLN 207 1HB GLN 207 -18.022 20.566 -8.347 1011 2HB GLN 207 2HB GLN 207 -17.978 20.344 -6.598 1012 1HG GLN 207 1HG GLN 207 -15.815 19.709 -7.150 1013 2HG GLN 207 2HG GLN 207 -16.634 18.150 -7.244 1014 1HE2 GLN 207 1HE2 GLN 207 -15.872 17.066 -9.070 1015 2HE2 GLN 207 2HE2 GLN 207 -15.616 17.778 -10.590 1016 H LEU 208 H LEU 208 -18.632 18.309 -5.190 1017 HA LEU 208 HA LEU 208 -21.360 19.240 -4.360 1018 1HB LEU 208 1HB LEU 208 -19.894 16.672 -3.987 1019 2HB LEU 208 2HB LEU 208 -20.784 17.263 -2.584 1020 HG LEU 208 HG LEU 208 -22.177 17.329 -5.224 1021 1HD1 LEU 208 1HD1 LEU 208 -22.654 15.030 -5.288 1022 2HD1 LEU 208 2HD1 LEU 208 -22.150 14.783 -3.616 1023 3HD1 LEU 208 3HD1 LEU 208 -20.941 15.054 -4.871 1024 1HD2 LEU 208 1HD2 LEU 208 -22.863 16.946 -2.317 1025 2HD2 LEU 208 2HD2 LEU 208 -24.010 16.472 -3.571 1026 3HD2 LEU 208 3HD2 LEU 208 -23.478 18.149 -3.450 1027 H ALA 209 H ALA 209 -21.291 19.406 -1.781 1028 HA ALA 209 HA ALA 209 -19.542 21.501 -1.050 1029 1HB ALA 209 1HB ALA 209 -21.727 20.348 -0.010 1030 2HB ALA 209 2HB ALA 209 -20.635 21.301 0.995 1031 3HB ALA 209 3HB ALA 209 -20.523 19.541 0.995 1032 H THR 210 H THR 210 -19.310 18.046 -0.099 1033 HA THR 210 HA THR 210 -17.443 16.793 0.624 1034 HB THR 210 HB THR 210 -15.932 18.787 -1.091 1035 HG1 THR 210 HG1 THR 210 -17.453 16.543 -1.921 1036 1HG2 THR 210 1HG2 THR 210 -15.529 15.827 -1.141 1037 2HG2 THR 210 2HG2 THR 210 -14.950 16.706 0.274 1038 3HG2 THR 210 3HG2 THR 210 -14.348 17.123 -1.331 1039 H LYS 211 H LYS 211 -18.143 18.577 2.573 1040 HA LYS 211 HA LYS 211 -16.217 20.527 3.347 1041 1HB LYS 211 1HB LYS 211 -18.220 18.763 4.770 1042 2HB LYS 211 2HB LYS 211 -17.228 19.911 5.669 1043 1HG LYS 211 1HG LYS 211 -18.232 21.760 4.680 1044 2HG LYS 211 2HG LYS 211 -18.685 20.866 3.228 1045 1HD LYS 211 1HD LYS 211 -20.609 20.042 4.174 1046 2HD LYS 211 2HD LYS 211 -19.904 19.959 5.788 1047 1HE LYS 211 1HE LYS 211 -21.111 21.842 6.235 1048 2HE LYS 211 2HE LYS 211 -19.936 22.696 5.217 1049 1HZ LYS 211 1HZ LYS 211 -22.508 21.457 4.401 1050 2HZ LYS 211 2HZ LYS 211 -21.309 21.884 3.276 1051 3HZ LYS 211 3HZ LYS 211 -22.037 23.080 4.236 1052 H ALA 212 H ALA 212 -16.618 17.313 4.884 1053 HA ALA 212 HA ALA 212 -13.840 16.570 4.627 1054 1HB ALA 212 1HB ALA 212 -14.404 18.587 6.483 1055 2HB ALA 212 2HB ALA 212 -12.936 17.611 6.437 1056 3HB ALA 212 3HB ALA 212 -14.284 17.128 7.467 1057 H ALA 213 H ALA 213 -15.257 14.664 4.074 1058 HA ALA 213 HA ALA 213 -15.688 12.992 6.492 1059 1HB ALA 213 1HB ALA 213 -17.825 13.217 4.369 1060 2HB ALA 213 2HB ALA 213 -17.770 14.369 5.703 1061 3HB ALA 213 3HB ALA 213 -17.985 12.650 6.031 1062 H ARG 214 H ARG 214 -13.938 11.686 5.677 1063 HA ARG 214 HA ARG 214 -13.967 10.619 2.962 1064 1HB ARG 214 1HB ARG 214 -12.158 10.958 5.043 1065 2HB ARG 214 2HB ARG 214 -12.408 9.212 5.025 1066 1HG ARG 214 1HG ARG 214 -10.602 9.656 3.508 1067 2HG ARG 214 2HG ARG 214 -12.015 9.300 2.514 1068 1HD ARG 214 1HD ARG 214 -11.301 11.257 1.479 1069 2HD ARG 214 2HD ARG 214 -12.334 11.967 2.732 1070 HE ARG 214 HE ARG 214 -9.657 11.451 3.723 1071 1HH1 ARG 214 1HH1 ARG 214 -11.582 13.649 1.829 1072 2HH1 ARG 214 2HH1 ARG 214 -10.551 15.000 2.148 1073 1HH2 ARG 214 1HH2 ARG 214 -8.335 13.222 4.122 1074 2HH2 ARG 214 2HH2 ARG 214 -8.726 14.763 3.436 1075 1HN MLZ 215 1HN MLZ 215 -13.196 7.878 3.842 1076 HA MLZ 215 HA MLZ 215 -15.839 6.668 3.786 1077 1HB MLZ 215 1HB MLZ 215 -13.014 5.634 4.196 1078 2HB MLZ 215 2HB MLZ 215 -14.414 4.577 4.024 1079 1HG MLZ 215 1HG MLZ 215 -13.689 6.692 1.983 1080 2HG MLZ 215 2HG MLZ 215 -14.847 5.375 1.803 1081 1HD MLZ 215 1HD MLZ 215 -11.873 4.984 2.246 1082 2HD MLZ 215 2HD MLZ 215 -13.060 3.727 1.898 1083 1HE MLZ 215 1HE MLZ 215 -11.845 5.747 0.058 1084 2HE MLZ 215 2HE MLZ 215 -13.534 5.287 -0.230 1085 HZ MLZ 215 HZ MLZ 215 -12.739 2.921 0.093 1086 1HCM MLZ 215 1HCM MLZ 215 -11.801 4.550 -2.205 1087 2HCM MLZ 215 2HCM MLZ 215 -13.332 3.693 -2.064 1088 3HCM MLZ 215 3HCM MLZ 215 -11.828 2.791 -2.202 1089 H SER 216 H SER 216 -17.058 6.008 5.527 1090 HA SER 216 HA SER 216 -17.656 5.541 7.765 1091 1HB SER 216 1HB SER 216 -16.979 7.280 9.238 1092 2HB SER 216 2HB SER 216 -15.413 7.454 8.444 1093 HG SER 216 HG SER 216 -16.664 9.112 7.723 1094 H ALA 217 H ALA 217 -16.425 5.091 10.054 1095 HA ALA 217 HA ALA 217 -14.624 2.836 9.491 1096 1HB ALA 217 1HB ALA 217 -13.753 5.515 10.460 1097 2HB ALA 217 2HB ALA 217 -12.850 4.308 9.544 1098 3HB ALA 217 3HB ALA 217 -13.045 4.127 11.288 1099 HA PRO 218 HA PRO 218 -16.227 1.202 13.232 1100 1HB PRO 218 1HB PRO 218 -13.914 0.486 14.620 1101 2HB PRO 218 2HB PRO 218 -14.675 -0.497 13.368 1102 1HG PRO 218 1HG PRO 218 -12.343 1.347 13.201 1103 2HG PRO 218 2HG PRO 218 -12.606 -0.215 12.411 1104 1HD PRO 218 1HD PRO 218 -12.880 2.099 11.083 1105 2HD PRO 218 2HD PRO 218 -13.924 0.698 10.766 1106 H ALA 219 H ALA 219 -13.365 3.272 13.805 1107 HA ALA 219 HA ALA 219 -12.978 4.921 15.452 1108 1HB ALA 219 1HB ALA 219 -15.911 4.970 14.775 1109 2HB ALA 219 2HB ALA 219 -14.667 6.163 14.399 1110 3HB ALA 219 3HB ALA 219 -15.306 6.042 16.039 1111 H THR 220 H THR 220 -12.333 3.219 17.030 1112 HA THR 220 HA THR 220 -14.428 2.518 19.036 1113 HB THR 220 HB THR 220 -13.067 0.720 18.038 1114 HG1 THR 220 HG1 THR 220 -12.223 1.262 20.689 1115 1HG2 THR 220 1HG2 THR 220 -11.049 1.682 17.367 1116 2HG2 THR 220 2HG2 THR 220 -10.551 0.803 18.812 1117 3HG2 THR 220 3HG2 THR 220 -10.835 2.541 18.892 1118 H GLY 221 H GLY 221 -13.841 2.755 21.345 1119 1HA GLY 221 1HA GLY 221 -12.821 3.850 23.174 1120 2HA GLY 221 2HA GLY 221 -11.559 4.416 22.079 1121 1H MET 1 1H MET 1 0.125 -12.155 8.045 1122 2H MET 1 2H MET 1 -0.346 -11.665 6.488 1123 3H MET 1 3H MET 1 -0.701 -10.686 7.830 1124 HA MET 1 HA MET 1 1.233 -9.920 6.433 1125 1HB MET 1 1HB MET 1 0.964 -10.399 9.351 1126 2HB MET 1 2HB MET 1 2.578 -9.931 8.817 1127 1HG MET 1 1HG MET 1 0.143 -8.417 7.884 1128 2HG MET 1 2HG MET 1 0.901 -8.042 9.431 1129 1HE MET 1 1HE MET 1 1.486 -7.503 5.348 1130 2HE MET 1 2HE MET 1 1.520 -5.872 6.017 1131 3HE MET 1 3HE MET 1 0.253 -6.999 6.504 1132 H PHE 2 H PHE 2 1.149 -12.965 6.219 1133 HA PHE 2 HA PHE 2 4.004 -13.343 5.722 1134 1HB PHE 2 1HB PHE 2 4.196 -15.196 7.402 1135 2HB PHE 2 2HB PHE 2 3.893 -13.633 8.160 1136 HD1 PHE 2 HD1 PHE 2 1.608 -13.056 8.976 1137 HD2 PHE 2 HD2 PHE 2 2.572 -16.968 7.487 1138 HE1 PHE 2 HE1 PHE 2 -0.450 -13.961 10.022 1139 HE2 PHE 2 HE2 PHE 2 0.514 -17.874 8.533 1140 HZ PHE 2 HZ PHE 2 -0.998 -16.370 9.801 1141 H ASN 3 H ASN 3 4.111 -14.709 3.981 1142 HA ASN 3 HA ASN 3 1.826 -16.606 3.545 1143 1HB ASN 3 1HB ASN 3 2.305 -16.211 1.130 1144 2HB ASN 3 2HB ASN 3 1.941 -14.703 1.969 1145 1HD2 ASN 3 1HD2 ASN 3 3.572 -13.092 2.002 1146 2HD2 ASN 3 2HD2 ASN 3 5.125 -13.310 1.353 1147 H ASP 4 H ASP 4 2.498 -18.548 2.196 1148 HA ASP 4 HA ASP 4 4.765 -19.886 3.377 1149 1HB ASP 4 1HB ASP 4 3.017 -20.467 0.957 1150 2HB ASP 4 2HB ASP 4 4.116 -21.635 1.691 1151 H ARG 5 H ARG 5 6.169 -17.866 2.610 1152 HA ARG 5 HA ARG 5 8.073 -18.758 0.683 1153 1HB ARG 5 1HB ARG 5 5.665 -17.604 -0.374 1154 2HB ARG 5 2HB ARG 5 6.989 -16.480 -0.687 1155 1HG ARG 5 1HG ARG 5 8.201 -18.812 -1.342 1156 2HG ARG 5 2HG ARG 5 6.534 -19.218 -1.750 1157 1HD ARG 5 1HD ARG 5 6.494 -16.940 -2.998 1158 2HD ARG 5 2HD ARG 5 8.263 -17.014 -2.885 1159 HE ARG 5 HE ARG 5 8.224 -18.803 -4.436 1160 1HH1 ARG 5 1HH1 ARG 5 5.075 -18.310 -3.036 1161 2HH1 ARG 5 2HH1 ARG 5 4.313 -19.465 -4.071 1162 1HH2 ARG 5 1HH2 ARG 5 7.211 -20.298 -5.769 1163 2HH2 ARG 5 2HH2 ARG 5 5.510 -20.584 -5.608 1164 H VAL 6 H VAL 6 6.497 -16.003 2.247 1165 HA VAL 6 HA VAL 6 9.146 -14.952 3.042 1166 HB VAL 6 HB VAL 6 7.107 -13.447 1.360 1167 1HG1 VAL 6 1HG1 VAL 6 8.183 -12.053 3.136 1168 2HG1 VAL 6 2HG1 VAL 6 8.630 -11.550 1.506 1169 3HG1 VAL 6 3HG1 VAL 6 9.759 -12.493 2.478 1170 1HG2 VAL 6 1HG2 VAL 6 9.179 -13.254 -0.152 1171 2HG2 VAL 6 2HG2 VAL 6 8.404 -14.836 -0.073 1172 3HG2 VAL 6 3HG2 VAL 6 9.881 -14.531 0.841 1173 H ILE 7 H ILE 7 8.914 -13.295 4.748 1174 HA ILE 7 HA ILE 7 6.179 -13.173 5.965 1175 HB ILE 7 HB ILE 7 7.526 -14.949 7.027 1176 1HG1 ILE 7 1HG1 ILE 7 7.685 -12.725 9.018 1177 2HG1 ILE 7 2HG1 ILE 7 6.104 -13.105 8.333 1178 1HG2 ILE 7 1HG2 ILE 7 9.507 -13.257 8.289 1179 2HG2 ILE 7 2HG2 ILE 7 9.639 -13.154 6.535 1180 3HG2 ILE 7 3HG2 ILE 7 9.746 -14.721 7.336 1181 1HD1 ILE 7 1HD1 ILE 7 7.120 -15.607 8.900 1182 2HD1 ILE 7 2HD1 ILE 7 6.002 -14.714 9.930 1183 3HD1 ILE 7 3HD1 ILE 7 7.736 -14.638 10.238 1184 H VAL 8 H VAL 8 5.921 -11.320 7.442 1185 HA VAL 8 HA VAL 8 7.629 -9.028 6.609 1186 HB VAL 8 HB VAL 8 4.964 -9.217 8.061 1187 1HG1 VAL 8 1HG1 VAL 8 4.875 -6.911 8.091 1188 2HG1 VAL 8 2HG1 VAL 8 5.890 -6.749 6.659 1189 3HG1 VAL 8 3HG1 VAL 8 6.623 -7.109 8.223 1190 1HG2 VAL 8 1HG2 VAL 8 4.552 -8.054 5.591 1191 2HG2 VAL 8 2HG2 VAL 8 4.234 -9.745 5.979 1192 3HG2 VAL 8 3HG2 VAL 8 5.765 -9.283 5.235 1193 H LYS 9 H LYS 9 9.289 -8.586 7.965 1194 HA LYS 9 HA LYS 9 8.797 -8.724 10.913 1195 1HB LYS 9 1HB LYS 9 11.298 -9.404 9.332 1196 2HB LYS 9 2HB LYS 9 11.167 -9.454 11.089 1197 1HG LYS 9 1HG LYS 9 9.028 -10.979 10.420 1198 2HG LYS 9 2HG LYS 9 10.090 -11.330 9.056 1199 1HD LYS 9 1HD LYS 9 11.903 -11.927 10.628 1200 2HD LYS 9 2HD LYS 9 10.833 -11.587 11.986 1201 1HE LYS 9 1HE LYS 9 9.441 -13.357 10.229 1202 2HE LYS 9 2HE LYS 9 11.060 -14.025 10.507 1203 1HZ LYS 9 1HZ LYS 9 9.076 -13.150 12.539 1204 2HZ LYS 9 2HZ LYS 9 10.706 -13.449 12.912 1205 3HZ LYS 9 3HZ LYS 9 9.723 -14.707 12.330 1206 H LYS 10 H LYS 10 10.304 -5.469 11.181 1207 HA LYS 10 HA LYS 10 9.607 -6.175 13.292 1208 1HB LYS 10 1HB LYS 10 7.662 -8.154 12.370 1209 2HB LYS 10 2HB LYS 10 7.395 -6.632 13.206 1210 1HG LYS 10 1HG LYS 10 7.894 -5.571 10.844 1211 2HG LYS 10 2HG LYS 10 7.456 -7.175 10.257 1212 1HD LYS 10 1HD LYS 10 5.678 -5.889 12.284 1213 2HD LYS 10 2HD LYS 10 5.622 -5.281 10.630 1214 1HE LYS 10 1HE LYS 10 5.421 -7.791 9.949 1215 2HE LYS 10 2HE LYS 10 4.957 -8.045 11.642 1216 1HZ LYS 10 1HZ LYS 10 3.739 -6.070 9.775 1217 2HZ LYS 10 2HZ LYS 10 3.309 -6.279 11.404 1218 3HZ LYS 10 3HZ LYS 10 3.017 -7.521 10.283 1219 H SER 11 H SER 11 11.895 -7.361 12.821 1220 HA SER 11 HA SER 11 11.522 -10.295 13.244 1221 1HB SER 11 1HB SER 11 13.164 -10.377 11.682 1222 2HB SER 11 2HB SER 11 13.222 -8.618 11.649 1223 HG SER 11 HG SER 11 15.185 -9.065 12.339 1224 HA PRO 12 HA PRO 12 13.170 -10.155 17.306 1225 1HB PRO 12 1HB PRO 12 15.319 -11.906 17.270 1226 2HB PRO 12 2HB PRO 12 13.623 -12.417 17.341 1227 1HG PRO 12 1HG PRO 12 15.491 -12.341 15.035 1228 2HG PRO 12 2HG PRO 12 14.203 -13.494 15.409 1229 1HD PRO 12 1HD PRO 12 13.980 -11.517 13.537 1230 2HD PRO 12 2HD PRO 12 12.597 -12.211 14.406 1231 H LEU 13 H LEU 13 15.374 -9.512 14.685 1232 HA LEU 13 HA LEU 13 16.783 -7.519 16.353 1233 1HB LEU 13 1HB LEU 13 17.744 -10.146 15.990 1234 2HB LEU 13 2HB LEU 13 18.704 -9.150 14.897 1235 HG LEU 13 HG LEU 13 18.220 -8.227 17.717 1236 1HD1 LEU 13 1HD1 LEU 13 20.621 -9.893 16.999 1237 2HD1 LEU 13 2HD1 LEU 13 19.137 -10.673 17.546 1238 3HD1 LEU 13 3HD1 LEU 13 19.967 -9.522 18.594 1239 1HD2 LEU 13 1HD2 LEU 13 19.553 -6.577 16.965 1240 2HD2 LEU 13 2HD2 LEU 13 19.756 -7.407 15.422 1241 3HD2 LEU 13 3HD2 LEU 13 20.848 -7.758 16.762 1242 H GLY 14 H GLY 14 15.154 -6.792 14.333 1243 1HA GLY 14 1HA GLY 14 17.027 -5.709 12.342 1244 2HA GLY 14 2HA GLY 14 15.783 -6.774 11.686 1245 H GLY 15 H GLY 15 14.648 -5.134 10.570 1246 1HA GLY 15 1HA GLY 15 13.165 -3.252 12.348 1247 2HA GLY 15 2HA GLY 15 13.907 -2.654 10.865 1248 H TYR 16 H TYR 16 11.627 -2.073 10.293 1249 HA TYR 16 HA TYR 16 9.699 -4.209 9.805 1250 1HB TYR 16 1HB TYR 16 9.850 -1.337 9.888 1251 2HB TYR 16 2HB TYR 16 9.109 -1.810 8.362 1252 HD1 TYR 16 HD1 TYR 16 6.883 -2.603 8.282 1253 HD2 TYR 16 HD2 TYR 16 8.918 -2.314 12.054 1254 HE1 TYR 16 HE1 TYR 16 4.759 -3.094 9.465 1255 HE2 TYR 16 HE2 TYR 16 6.794 -2.804 13.237 1256 HH TYR 16 HH TYR 16 3.893 -3.750 11.488 1257 H GLY 17 H GLY 17 11.756 -5.222 8.484 1258 1HA GLY 17 1HA GLY 17 11.492 -4.390 5.624 1259 2HA GLY 17 2HA GLY 17 12.859 -5.294 6.275 1260 H VAL 18 H VAL 18 12.234 -6.830 4.440 1261 HA VAL 18 HA VAL 18 9.964 -8.587 5.312 1262 HB VAL 18 HB VAL 18 9.497 -7.656 3.152 1263 1HG1 VAL 18 1HG1 VAL 18 11.498 -8.369 1.395 1264 2HG1 VAL 18 2HG1 VAL 18 12.398 -7.887 2.829 1265 3HG1 VAL 18 3HG1 VAL 18 11.273 -6.759 2.079 1266 1HG2 VAL 18 1HG2 VAL 18 9.276 -10.186 3.426 1267 2HG2 VAL 18 2HG2 VAL 18 10.772 -10.316 2.502 1268 3HG2 VAL 18 3HG2 VAL 18 9.342 -9.589 1.768 1269 H PHE 19 H PHE 19 10.510 -10.629 5.932 1270 HA PHE 19 HA PHE 19 13.355 -11.391 5.922 1271 1HB PHE 19 1HB PHE 19 10.903 -11.923 7.392 1272 2HB PHE 19 2HB PHE 19 11.730 -13.429 7.000 1273 HD1 PHE 19 HD1 PHE 19 12.902 -14.144 8.887 1274 HD2 PHE 19 HD2 PHE 19 13.015 -9.993 7.789 1275 HE1 PHE 19 HE1 PHE 19 14.543 -13.711 10.695 1276 HE2 PHE 19 HE2 PHE 19 14.657 -9.560 9.597 1277 HZ PHE 19 HZ PHE 19 15.420 -11.419 11.051 1278 H ALA 20 H ALA 20 14.219 -13.097 4.757 1279 HA ALA 20 HA ALA 20 12.579 -14.163 2.533 1280 1HB ALA 20 1HB ALA 20 14.586 -13.863 1.522 1281 2HB ALA 20 2HB ALA 20 15.270 -15.123 2.551 1282 3HB ALA 20 3HB ALA 20 15.314 -13.438 3.071 1283 H ARG 21 H ARG 21 11.287 -15.779 3.588 1284 HA ARG 21 HA ARG 21 12.344 -17.779 5.377 1285 1HB ARG 21 1HB ARG 21 9.884 -16.939 4.398 1286 2HB ARG 21 2HB ARG 21 10.070 -18.537 3.673 1287 1HG ARG 21 1HG ARG 21 9.137 -19.123 5.715 1288 2HG ARG 21 2HG ARG 21 10.850 -19.186 6.128 1289 1HD ARG 21 1HD ARG 21 10.775 -17.050 7.198 1290 2HD ARG 21 2HD ARG 21 9.195 -16.669 6.487 1291 HE ARG 21 HE ARG 21 8.695 -19.006 7.850 1292 1HH1 ARG 21 1HH1 ARG 21 10.209 -15.998 8.734 1293 2HH1 ARG 21 2HH1 ARG 21 9.734 -16.119 10.392 1294 1HH2 ARG 21 1HH2 ARG 21 8.090 -19.140 10.007 1295 2HH2 ARG 21 2HH2 ARG 21 8.542 -17.884 11.110 1296 H LYS 22 H LYS 22 12.618 -17.312 1.974 1297 HA LYS 22 HA LYS 22 13.423 -20.166 1.554 1298 1HB LYS 22 1HB LYS 22 12.794 -17.970 -0.461 1299 2HB LYS 22 2HB LYS 22 12.936 -19.693 -0.793 1300 1HG LYS 22 1HG LYS 22 11.023 -19.466 1.268 1301 2HG LYS 22 2HG LYS 22 10.621 -18.218 0.089 1302 1HD LYS 22 1HD LYS 22 10.284 -19.763 -1.629 1303 2HD LYS 22 2HD LYS 22 11.303 -20.983 -0.865 1304 1HE LYS 22 1HE LYS 22 9.179 -20.441 0.950 1305 2HE LYS 22 2HE LYS 22 8.454 -20.673 -0.652 1306 1HZ LYS 22 1HZ LYS 22 8.827 -22.803 0.458 1307 2HZ LYS 22 2HZ LYS 22 10.480 -22.449 0.616 1308 3HZ LYS 22 3HZ LYS 22 9.803 -22.668 -0.926 1309 H SER 23 H SER 23 16.621 -19.037 0.059 1310 HA SER 23 HA SER 23 14.314 -20.921 -0.176 1311 1HB SER 23 1HB SER 23 16.476 -21.873 0.447 1312 2HB SER 23 2HB SER 23 16.113 -22.359 -1.210 1313 HG SER 23 HG SER 23 17.785 -21.295 -1.858 1314 H PHE 24 H PHE 24 16.145 -18.492 -1.882 1315 HA PHE 24 HA PHE 24 14.525 -19.064 -4.340 1316 1HB PHE 24 1HB PHE 24 15.578 -16.536 -3.032 1317 2HB PHE 24 2HB PHE 24 14.916 -16.543 -4.666 1318 HD1 PHE 24 HD1 PHE 24 13.992 -15.440 -1.693 1319 HD2 PHE 24 HD2 PHE 24 12.694 -18.452 -4.468 1320 HE1 PHE 24 HE1 PHE 24 11.696 -15.306 -0.766 1321 HE2 PHE 24 HE2 PHE 24 10.399 -18.317 -3.540 1322 HZ PHE 24 HZ PHE 24 9.900 -16.744 -1.689 1323 H GLU 25 H GLU 25 15.589 -18.470 -6.398 1324 HA GLU 25 HA GLU 25 18.510 -19.057 -6.322 1325 1HB GLU 25 1HB GLU 25 16.215 -19.381 -8.208 1326 2HB GLU 25 2HB GLU 25 17.804 -19.135 -8.931 1327 1HG GLU 25 1HG GLU 25 18.421 -21.242 -8.430 1328 2HG GLU 25 2HG GLU 25 17.970 -21.023 -6.740 1329 H LYS 26 H LYS 26 19.784 -17.820 -8.088 1330 HA LYS 26 HA LYS 26 19.523 -14.972 -7.613 1331 1HB LYS 26 1HB LYS 26 21.621 -16.363 -8.013 1332 2HB LYS 26 2HB LYS 26 21.155 -16.433 -9.710 1333 1HG LYS 26 1HG LYS 26 21.509 -14.158 -10.045 1334 2HG LYS 26 2HG LYS 26 21.270 -13.769 -8.343 1335 1HD LYS 26 1HD LYS 26 23.442 -14.254 -7.789 1336 2HD LYS 26 2HD LYS 26 23.559 -15.559 -8.970 1337 1HE LYS 26 1HE LYS 26 23.349 -12.699 -9.909 1338 2HE LYS 26 2HE LYS 26 24.917 -13.370 -9.421 1339 1HZ LYS 26 1HZ LYS 26 24.735 -15.092 -10.987 1340 2HZ LYS 26 2HZ LYS 26 24.232 -13.709 -11.834 1341 3HZ LYS 26 3HZ LYS 26 23.080 -14.811 -11.248 1342 H GLY 27 H GLY 27 17.392 -14.452 -8.472 1343 1HA GLY 27 1HA GLY 27 16.748 -13.123 -10.536 1344 2HA GLY 27 2HA GLY 27 17.257 -14.535 -11.461 1345 H GLU 28 H GLU 28 15.238 -14.127 -8.528 1346 HA GLU 28 HA GLU 28 13.072 -15.628 -9.965 1347 1HB GLU 28 1HB GLU 28 14.533 -16.096 -7.443 1348 2HB GLU 28 2HB GLU 28 12.781 -16.205 -7.275 1349 1HG GLU 28 1HG GLU 28 12.869 -17.688 -9.393 1350 2HG GLU 28 2HG GLU 28 14.598 -17.813 -9.070 1351 H LEU 29 H LEU 29 11.043 -14.700 -9.798 1352 HA LEU 29 HA LEU 29 10.751 -12.026 -8.778 1353 1HB LEU 29 1HB LEU 29 9.488 -13.302 -10.638 1354 2HB LEU 29 2HB LEU 29 8.555 -14.043 -9.342 1355 HG LEU 29 HG LEU 29 7.453 -12.017 -10.335 1356 1HD1 LEU 29 1HD1 LEU 29 6.677 -11.202 -8.266 1357 2HD1 LEU 29 2HD1 LEU 29 8.244 -11.424 -7.489 1358 3HD1 LEU 29 3HD1 LEU 29 7.247 -12.825 -7.879 1359 1HD2 LEU 29 1HD2 LEU 29 9.137 -10.109 -8.907 1360 2HD2 LEU 29 2HD2 LEU 29 8.537 -10.051 -10.564 1361 3HD2 LEU 29 3HD2 LEU 29 10.015 -10.936 -10.192 1362 H VAL 30 H VAL 30 10.642 -11.518 -6.640 1363 HA VAL 30 HA VAL 30 9.625 -13.545 -4.703 1364 HB VAL 30 HB VAL 30 11.004 -10.864 -4.291 1365 1HG1 VAL 30 1HG1 VAL 30 10.411 -13.213 -2.470 1366 2HG1 VAL 30 2HG1 VAL 30 9.836 -11.554 -2.298 1367 3HG1 VAL 30 3HG1 VAL 30 11.543 -11.925 -2.054 1368 1HG2 VAL 30 1HG2 VAL 30 12.045 -13.659 -4.699 1369 2HG2 VAL 30 2HG2 VAL 30 12.951 -12.510 -3.714 1370 3HG2 VAL 30 3HG2 VAL 30 12.619 -12.150 -5.409 1371 H GLU 31 H GLU 31 7.376 -13.219 -5.320 1372 HA GLU 31 HA GLU 31 5.242 -12.257 -5.042 1373 1HB GLU 31 1HB GLU 31 6.751 -10.573 -3.007 1374 2HB GLU 31 2HB GLU 31 5.014 -10.859 -3.041 1375 1HG GLU 31 1HG GLU 31 6.250 -13.408 -3.124 1376 2HG GLU 31 2HG GLU 31 7.080 -12.488 -1.869 1377 H GLU 32 H GLU 32 4.227 -9.839 -4.889 1378 HA GLU 32 HA GLU 32 5.824 -7.884 -6.430 1379 1HB GLU 32 1HB GLU 32 4.944 -9.423 -8.120 1380 2HB GLU 32 2HB GLU 32 3.320 -9.282 -7.444 1381 1HG GLU 32 1HG GLU 32 3.005 -7.150 -8.290 1382 2HG GLU 32 2HG GLU 32 4.727 -6.776 -8.265 1383 H CYS 33 H CYS 33 4.648 -5.787 -6.589 1384 HA CYS 33 HA CYS 33 2.219 -5.532 -4.897 1385 1HB CYS 33 1HB CYS 33 3.413 -3.868 -3.474 1386 2HB CYS 33 2HB CYS 33 4.170 -5.456 -3.386 1387 HG CYS 33 HG CYS 33 6.141 -3.898 -3.868 1388 H LEU 34 H LEU 34 1.268 -3.345 -5.060 1389 HA LEU 34 HA LEU 34 1.837 -2.088 -7.700 1390 1HB LEU 34 1HB LEU 34 -0.406 -1.673 -5.685 1391 2HB LEU 34 2HB LEU 34 -0.389 -1.104 -7.354 1392 HG LEU 34 HG LEU 34 -0.150 -4.032 -6.621 1393 1HD1 LEU 34 1HD1 LEU 34 -2.667 -2.690 -7.605 1394 2HD1 LEU 34 2HD1 LEU 34 -2.326 -2.839 -5.881 1395 3HD1 LEU 34 3HD1 LEU 34 -2.486 -4.286 -6.876 1396 1HD2 LEU 34 1HD2 LEU 34 -0.744 -4.370 -8.963 1397 2HD2 LEU 34 2HD2 LEU 34 0.643 -3.284 -8.871 1398 3HD2 LEU 34 3HD2 LEU 34 -0.966 -2.635 -9.187 1399 H CYS 35 H CYS 35 1.442 0.458 -7.578 1400 HA CYS 35 HA CYS 35 2.553 1.624 -5.076 1401 1HB CYS 35 1HB CYS 35 3.799 1.683 -7.841 1402 2HB CYS 35 2HB CYS 35 4.280 2.791 -6.557 1403 HG CYS 35 HG CYS 35 4.470 -0.283 -6.053 1404 H ILE 36 H ILE 36 2.561 4.041 -5.191 1405 HA ILE 36 HA ILE 36 0.250 5.041 -6.806 1406 HB ILE 36 HB ILE 36 1.699 6.251 -4.416 1407 1HG1 ILE 36 1HG1 ILE 36 -0.948 4.788 -4.362 1408 2HG1 ILE 36 2HG1 ILE 36 0.581 3.980 -4.016 1409 1HG2 ILE 36 1HG2 ILE 36 -1.136 6.807 -5.250 1410 2HG2 ILE 36 2HG2 ILE 36 0.194 7.630 -6.066 1411 3HG2 ILE 36 3HG2 ILE 36 -0.029 7.824 -4.327 1412 1HD1 ILE 36 1HD1 ILE 36 -0.910 5.190 -2.107 1413 2HD1 ILE 36 2HD1 ILE 36 0.108 6.544 -2.594 1414 3HD1 ILE 36 3HD1 ILE 36 0.845 5.054 -2.008 1415 H VAL 37 H VAL 37 0.563 7.091 -7.955 1416 HA VAL 37 HA VAL 37 3.439 7.853 -8.338 1417 HB VAL 37 HB VAL 37 1.269 7.578 -10.451 1418 1HG1 VAL 37 1HG1 VAL 37 2.834 9.209 -11.193 1419 2HG1 VAL 37 2HG1 VAL 37 3.350 7.706 -11.957 1420 3HG1 VAL 37 3HG1 VAL 37 4.200 8.310 -10.535 1421 1HG2 VAL 37 1HG2 VAL 37 3.710 5.830 -10.080 1422 2HG2 VAL 37 2HG2 VAL 37 2.311 5.539 -11.113 1423 3HG2 VAL 37 3HG2 VAL 37 2.150 5.428 -9.362 1424 H ARG 38 H ARG 38 3.660 9.958 -7.740 1425 HA ARG 38 HA ARG 38 1.510 11.894 -8.496 1426 1HB ARG 38 1HB ARG 38 2.781 11.296 -5.846 1427 2HB ARG 38 2HB ARG 38 2.166 12.914 -6.161 1428 1HG ARG 38 1HG ARG 38 0.525 10.396 -6.537 1429 2HG ARG 38 2HG ARG 38 0.512 11.348 -5.053 1430 1HD ARG 38 1HD ARG 38 -0.197 13.345 -6.363 1431 2HD ARG 38 2HD ARG 38 -0.254 12.340 -7.820 1432 HE ARG 38 HE ARG 38 -1.737 11.029 -5.768 1433 1HH1 ARG 38 1HH1 ARG 38 -1.869 13.862 -7.787 1434 2HH1 ARG 38 2HH1 ARG 38 -3.597 13.919 -7.783 1435 1HH2 ARG 38 1HH2 ARG 38 -3.979 11.124 -5.777 1436 2HH2 ARG 38 2HH2 ARG 38 -4.786 12.382 -6.654 1437 H HIS 39 H HIS 39 2.316 13.976 -9.031 1438 HA HIS 39 HA HIS 39 5.114 14.097 -9.825 1439 1HB HIS 39 1HB HIS 39 2.898 15.079 -10.859 1440 2HB HIS 39 2HB HIS 39 3.202 16.425 -9.760 1441 HD1 HIS 39 HD1 HIS 39 5.205 17.956 -10.266 1442 HD2 HIS 39 HD2 HIS 39 4.878 14.757 -12.920 1443 HE1 HIS 39 HE1 HIS 39 6.820 18.427 -12.159 1444 H ASN 40 H ASN 40 5.449 13.778 -7.190 1445 HA ASN 40 HA ASN 40 6.327 14.763 -5.226 1446 1HB ASN 40 1HB ASN 40 7.643 15.531 -7.472 1447 2HB ASN 40 2HB ASN 40 7.161 17.113 -6.858 1448 1HD2 ASN 40 1HD2 ASN 40 9.765 15.167 -6.791 1449 2HD2 ASN 40 2HD2 ASN 40 10.347 15.465 -5.225 1450 H ASP 41 H ASP 41 6.652 17.817 -5.113 1451 HA ASP 41 HA ASP 41 5.431 19.693 -4.377 1452 1HB ASP 41 1HB ASP 41 4.103 18.831 -6.518 1453 2HB ASP 41 2HB ASP 41 2.890 18.395 -5.315 1454 H ASP 42 H ASP 42 2.541 19.346 -3.453 1455 HA ASP 42 HA ASP 42 2.892 18.961 -0.713 1456 1HB ASP 42 1HB ASP 42 0.626 18.562 -2.659 1457 2HB ASP 42 2HB ASP 42 0.377 18.187 -0.954 1458 H TRP 43 H TRP 43 2.347 16.508 -3.209 1459 HA TRP 43 HA TRP 43 1.989 14.246 -1.474 1460 1HB TRP 43 1HB TRP 43 1.378 14.057 -3.765 1461 2HB TRP 43 2HB TRP 43 2.894 14.762 -4.316 1462 HD1 TRP 43 HD1 TRP 43 4.919 13.192 -4.693 1463 HE1 TRP 43 HE1 TRP 43 5.233 10.635 -4.621 1464 HE3 TRP 43 HE3 TRP 43 0.530 11.827 -2.470 1465 HZ2 TRP 43 HZ2 TRP 43 3.811 8.323 -3.745 1466 HZ3 TRP 43 HZ3 TRP 43 0.038 9.439 -2.025 1467 HH2 TRP 43 HH2 TRP 43 1.674 7.686 -2.657 1468 H GLY 44 H GLY 44 4.836 15.912 -2.764 1469 1HA GLY 44 1HA GLY 44 6.790 13.963 -2.036 1470 2HA GLY 44 2HA GLY 44 7.112 15.682 -2.258 1471 H THR 45 H THR 45 5.979 17.014 -0.320 1472 HA THR 45 HA THR 45 7.424 16.306 2.054 1473 HB THR 45 HB THR 45 5.121 18.210 1.499 1474 HG1 THR 45 HG1 THR 45 6.765 19.694 1.276 1475 1HG2 THR 45 1HG2 THR 45 6.470 19.303 3.592 1476 2HG2 THR 45 2HG2 THR 45 6.643 17.588 3.967 1477 3HG2 THR 45 3HG2 THR 45 5.037 18.292 3.781 1478 H ALA 46 H ALA 46 3.928 16.070 1.275 1479 HA ALA 46 HA ALA 46 3.053 15.046 3.786 1480 1HB ALA 46 1HB ALA 46 1.625 15.819 1.884 1481 2HB ALA 46 2HB ALA 46 1.158 14.210 2.438 1482 3HB ALA 46 3HB ALA 46 2.112 14.394 0.965 1483 H LEU 47 H LEU 47 3.738 13.180 0.805 1484 HA LEU 47 HA LEU 47 4.207 10.755 2.450 1485 1HB LEU 47 1HB LEU 47 3.746 11.426 -0.457 1486 2HB LEU 47 2HB LEU 47 4.403 9.851 -0.017 1487 HG LEU 47 HG LEU 47 1.952 9.739 -0.184 1488 1HD1 LEU 47 1HD1 LEU 47 1.736 8.411 1.665 1489 2HD1 LEU 47 2HD1 LEU 47 2.307 9.669 2.760 1490 3HD1 LEU 47 3HD1 LEU 47 3.464 8.723 1.825 1491 1HD2 LEU 47 1HD2 LEU 47 0.524 11.213 0.853 1492 2HD2 LEU 47 2HD2 LEU 47 1.911 12.285 0.656 1493 3HD2 LEU 47 3HD2 LEU 47 1.623 11.490 2.205 1494 H GLU 48 H GLU 48 6.200 12.917 2.566 1495 HA GLU 48 HA GLU 48 8.441 12.327 0.839 1496 1HB GLU 48 1HB GLU 48 7.670 14.203 2.793 1497 2HB GLU 48 2HB GLU 48 9.119 13.442 3.443 1498 1HG GLU 48 1HG GLU 48 9.693 13.844 0.739 1499 2HG GLU 48 2HG GLU 48 8.860 15.315 1.233 1500 H ASP 49 H ASP 49 7.898 9.846 1.398 1501 HA ASP 49 HA ASP 49 10.151 8.729 2.741 1502 1HB ASP 49 1HB ASP 49 8.230 9.736 4.492 1503 2HB ASP 49 2HB ASP 49 7.822 8.024 4.400 1504 H TYR 50 H TYR 50 10.203 6.464 2.306 1505 HA TYR 50 HA TYR 50 9.544 4.460 1.221 1506 1HB TYR 50 1HB TYR 50 6.698 5.321 1.799 1507 2HB TYR 50 2HB TYR 50 7.368 3.694 1.815 1508 HD1 TYR 50 HD1 TYR 50 6.261 6.320 3.846 1509 HD2 TYR 50 HD2 TYR 50 9.396 3.390 3.576 1510 HE1 TYR 50 HE1 TYR 50 6.653 6.511 6.287 1511 HE2 TYR 50 HE2 TYR 50 9.785 3.584 6.018 1512 HH TYR 50 HH TYR 50 8.237 4.326 8.073 1513 H LEU 51 H LEU 51 9.589 7.137 -0.216 1514 HA LEU 51 HA LEU 51 7.534 6.644 -2.326 1515 1HB LEU 51 1HB LEU 51 8.346 8.875 -0.857 1516 2HB LEU 51 2HB LEU 51 9.126 9.114 -2.419 1517 HG LEU 51 HG LEU 51 6.984 8.906 -3.569 1518 1HD1 LEU 51 1HD1 LEU 51 6.173 7.821 -0.958 1519 2HD1 LEU 51 2HD1 LEU 51 5.481 7.537 -2.555 1520 3HD1 LEU 51 3HD1 LEU 51 5.019 8.968 -1.635 1521 1HD2 LEU 51 1HD2 LEU 51 5.870 10.714 -1.668 1522 2HD2 LEU 51 2HD2 LEU 51 6.721 11.101 -3.163 1523 3HD2 LEU 51 3HD2 LEU 51 7.619 10.940 -1.655 1524 H PHE 52 H PHE 52 8.341 5.464 -4.007 1525 HA PHE 52 HA PHE 52 11.197 5.653 -4.776 1526 1HB PHE 52 1HB PHE 52 8.792 4.010 -5.628 1527 2HB PHE 52 2HB PHE 52 10.347 3.890 -6.450 1528 HD1 PHE 52 HD1 PHE 52 8.447 3.060 -3.448 1529 HD2 PHE 52 HD2 PHE 52 12.365 3.108 -5.207 1530 HE1 PHE 52 HE1 PHE 52 9.257 1.515 -1.685 1531 HE2 PHE 52 HE2 PHE 52 13.175 1.563 -3.444 1532 HZ PHE 52 HZ PHE 52 11.621 0.767 -1.683 1533 H SER 53 H SER 53 11.612 7.512 -5.974 1534 HA SER 53 HA SER 53 9.548 8.383 -7.947 1535 1HB SER 53 1HB SER 53 10.359 9.897 -6.102 1536 2HB SER 53 2HB SER 53 11.971 9.826 -6.814 1537 HG SER 53 HG SER 53 10.922 11.629 -7.601 1538 H ARG 54 H ARG 54 10.066 8.665 -10.107 1539 HA ARG 54 HA ARG 54 12.798 7.772 -10.965 1540 1HB ARG 54 1HB ARG 54 11.590 6.921 -12.985 1541 2HB ARG 54 2HB ARG 54 10.999 6.176 -11.500 1542 1HG ARG 54 1HG ARG 54 8.987 7.327 -11.563 1543 2HG ARG 54 2HG ARG 54 9.672 8.684 -12.457 1544 1HD ARG 54 1HD ARG 54 10.002 6.639 -14.260 1545 2HD ARG 54 2HD ARG 54 8.476 6.184 -13.478 1546 HE ARG 54 HE ARG 54 8.163 8.886 -13.879 1547 1HH1 ARG 54 1HH1 ARG 54 9.125 6.259 -15.952 1548 2HH1 ARG 54 2HH1 ARG 54 8.488 7.005 -17.376 1549 1HH2 ARG 54 1HH2 ARG 54 7.344 9.833 -15.741 1550 2HH2 ARG 54 2HH2 ARG 54 7.486 9.012 -17.260 1551 H LYS 55 H LYS 55 12.755 8.549 -13.578 1552 HA LYS 55 HA LYS 55 12.996 11.437 -13.389 1553 1HB LYS 55 1HB LYS 55 14.217 9.504 -14.793 1554 2HB LYS 55 2HB LYS 55 13.008 9.959 -15.994 1555 1HG LYS 55 1HG LYS 55 14.903 11.348 -16.429 1556 2HG LYS 55 2HG LYS 55 13.739 12.380 -15.599 1557 1HD LYS 55 1HD LYS 55 15.510 12.862 -14.243 1558 2HD LYS 55 2HD LYS 55 15.090 11.331 -13.475 1559 1HE LYS 55 1HE LYS 55 16.664 10.598 -15.682 1560 2HE LYS 55 2HE LYS 55 17.479 12.012 -14.988 1561 1HZ LYS 55 1HZ LYS 55 18.035 9.829 -13.905 1562 2HZ LYS 55 2HZ LYS 55 16.430 9.764 -13.354 1563 3HZ LYS 55 3HZ LYS 55 17.452 11.023 -12.847 1564 H ASN 56 H ASN 56 10.640 11.714 -12.805 1565 HA ASN 56 HA ASN 56 8.560 11.270 -14.761 1566 1HB ASN 56 1HB ASN 56 8.726 14.100 -14.776 1567 2HB ASN 56 2HB ASN 56 10.367 13.522 -15.060 1568 1HD2 ASN 56 1HD2 ASN 56 6.994 12.930 -16.200 1569 2HD2 ASN 56 2HD2 ASN 56 7.441 12.575 -17.799 1570 H MET 57 H MET 57 9.024 11.057 -11.859 1571 HA MET 57 HA MET 57 7.786 13.175 -10.386 1572 1HB MET 57 1HB MET 57 5.509 12.160 -10.164 1573 2HB MET 57 2HB MET 57 5.854 12.639 -11.822 1574 1HG MET 57 1HG MET 57 6.683 9.897 -11.118 1575 2HG MET 57 2HG MET 57 4.944 10.171 -11.105 1576 1HE MET 57 1HE MET 57 3.682 11.037 -12.510 1577 2HE MET 57 2HE MET 57 3.612 10.179 -14.049 1578 3HE MET 57 3HE MET 57 4.074 11.881 -14.008 1579 H SER 58 H SER 58 6.580 11.999 -8.325 1580 HA SER 58 HA SER 58 8.518 9.908 -7.410 1581 1HB SER 58 1HB SER 58 8.308 10.906 -5.257 1582 2HB SER 58 2HB SER 58 8.337 12.274 -6.369 1583 HG SER 58 HG SER 58 6.621 12.250 -4.736 1584 H ALA 59 H ALA 59 7.685 7.939 -6.751 1585 HA ALA 59 HA ALA 59 4.698 7.701 -6.627 1586 1HB ALA 59 1HB ALA 59 5.864 5.177 -7.072 1587 2HB ALA 59 2HB ALA 59 6.831 6.295 -8.033 1588 3HB ALA 59 3HB ALA 59 5.088 6.196 -8.285 1589 H MET 60 H MET 60 4.079 5.647 -5.268 1590 HA MET 60 HA MET 60 5.767 5.622 -2.784 1591 1HB MET 60 1HB MET 60 3.203 6.559 -3.178 1592 2HB MET 60 2HB MET 60 2.902 4.917 -2.608 1593 1HG MET 60 1HG MET 60 5.008 6.157 -1.052 1594 2HG MET 60 2HG MET 60 3.563 7.168 -1.040 1595 1HE MET 60 1HE MET 60 3.568 5.585 2.277 1596 2HE MET 60 2HE MET 60 2.247 6.541 1.605 1597 3HE MET 60 3HE MET 60 3.917 6.946 1.211 1598 H ALA 61 H ALA 61 5.698 3.586 -1.555 1599 HA ALA 61 HA ALA 61 5.626 1.222 -3.324 1600 1HB ALA 61 1HB ALA 61 6.175 0.676 -0.546 1601 2HB ALA 61 2HB ALA 61 7.032 2.142 -1.023 1602 3HB ALA 61 3HB ALA 61 7.296 0.640 -1.908 1603 H LEU 62 H LEU 62 3.447 0.681 -3.649 1604 HA LEU 62 HA LEU 62 1.326 -0.207 -3.137 1605 1HB LEU 62 1HB LEU 62 0.954 0.866 -0.520 1606 2HB LEU 62 2HB LEU 62 1.885 2.049 -1.439 1607 HG LEU 62 HG LEU 62 0.206 1.910 -3.269 1608 1HD1 LEU 62 1HD1 LEU 62 -2.023 0.786 -2.090 1609 2HD1 LEU 62 2HD1 LEU 62 -0.732 -0.299 -1.572 1610 3HD1 LEU 62 3HD1 LEU 62 -1.004 -0.009 -3.290 1611 1HD2 LEU 62 1HD2 LEU 62 -1.365 3.312 -2.226 1612 2HD2 LEU 62 2HD2 LEU 62 0.050 3.470 -1.184 1613 3HD2 LEU 62 3HD2 LEU 62 -1.287 2.425 -0.705 1614 H GLY 63 H GLY 63 2.393 -2.343 -2.910 1615 1HA GLY 63 1HA GLY 63 1.613 -3.679 -0.517 1616 2HA GLY 63 2HA GLY 63 2.634 -4.378 -1.770 1617 H PHE 64 H PHE 64 4.426 -5.173 -0.764 1618 HA PHE 64 HA PHE 64 5.524 -3.810 1.619 1619 1HB PHE 64 1HB PHE 64 6.338 -6.320 0.106 1620 2HB PHE 64 2HB PHE 64 6.913 -5.855 1.707 1621 HD1 PHE 64 HD1 PHE 64 4.421 -7.653 -0.092 1622 HD2 PHE 64 HD2 PHE 64 5.070 -5.414 3.516 1623 HE1 PHE 64 HE1 PHE 64 2.439 -8.733 0.935 1624 HE2 PHE 64 HE2 PHE 64 3.088 -6.494 4.543 1625 HZ PHE 64 HZ PHE 64 1.773 -8.154 3.252 1626 H GLY 65 H GLY 65 5.812 -2.195 -0.667 1627 1HA GLY 65 1HA GLY 65 8.574 -2.596 -1.649 1628 2HA GLY 65 2HA GLY 65 7.449 -1.361 -2.212 1629 H ALA 66 H ALA 66 6.859 -0.811 0.773 1630 HA ALA 66 HA ALA 66 8.998 1.206 1.075 1631 1HB ALA 66 1HB ALA 66 6.676 1.872 1.325 1632 2HB ALA 66 2HB ALA 66 7.430 1.952 2.918 1633 3HB ALA 66 3HB ALA 66 6.391 0.589 2.501 1634 H ILE 67 H ILE 67 7.608 -1.520 2.937 1635 HA ILE 67 HA ILE 67 9.081 -1.352 5.304 1636 HB ILE 67 HB ILE 67 8.840 -3.868 5.290 1637 1HG1 ILE 67 1HG1 ILE 67 7.262 -4.222 2.989 1638 2HG1 ILE 67 2HG1 ILE 67 8.694 -3.354 2.442 1639 1HG2 ILE 67 1HG2 ILE 67 6.932 -1.995 5.578 1640 2HG2 ILE 67 2HG2 ILE 67 6.582 -3.721 5.675 1641 3HG2 ILE 67 3HG2 ILE 67 6.277 -2.842 4.176 1642 1HD1 ILE 67 1HD1 ILE 67 10.110 -5.037 3.640 1643 2HD1 ILE 67 2HD1 ILE 67 9.145 -5.743 2.343 1644 3HD1 ILE 67 3HD1 ILE 67 8.643 -5.939 4.023 1645 H PHE 68 H PHE 68 10.210 -2.220 2.109 1646 HA PHE 68 HA PHE 68 12.562 -3.636 2.564 1647 1HB PHE 68 1HB PHE 68 11.688 -1.470 0.659 1648 2HB PHE 68 2HB PHE 68 13.320 -2.119 0.543 1649 HD1 PHE 68 HD1 PHE 68 10.427 -2.379 -1.089 1650 HD2 PHE 68 HD2 PHE 68 13.012 -4.940 1.192 1651 HE1 PHE 68 HE1 PHE 68 9.538 -4.351 -2.298 1652 HE2 PHE 68 HE2 PHE 68 12.122 -6.914 -0.018 1653 HZ PHE 68 HZ PHE 68 10.384 -6.619 -1.763 1654 H ASN 69 H ASN 69 14.687 -3.070 3.185 1655 HA ASN 69 HA ASN 69 15.004 -0.323 4.355 1656 1HB ASN 69 1HB ASN 69 16.051 -3.053 5.181 1657 2HB ASN 69 2HB ASN 69 16.570 -1.546 5.936 1658 1HD2 ASN 69 1HD2 ASN 69 14.339 -4.039 6.254 1659 2HD2 ASN 69 2HD2 ASN 69 13.169 -3.232 7.182 1660 H HIS 70 H HIS 70 17.478 0.179 4.585 1661 HA HIS 70 HA HIS 70 18.745 -0.376 1.940 1662 1HB HIS 70 1HB HIS 70 18.235 1.941 3.243 1663 2HB HIS 70 2HB HIS 70 19.836 1.596 3.899 1664 HD1 HIS 70 HD1 HIS 70 19.289 3.949 1.878 1665 HD2 HIS 70 HD2 HIS 70 20.728 0.183 0.819 1666 HE1 HIS 70 HE1 HIS 70 20.491 4.237 -0.333 1667 H SER 71 H SER 71 20.074 -2.165 2.086 1668 HA SER 71 HA SER 71 21.903 -2.328 4.461 1669 1HB SER 71 1HB SER 71 19.911 -4.021 3.994 1670 2HB SER 71 2HB SER 71 21.047 -4.710 2.835 1671 HG SER 71 HG SER 71 21.478 -4.293 5.605 1672 H LYS 72 H LYS 72 24.075 -2.885 4.005 1673 HA LYS 72 HA LYS 72 25.204 -2.089 1.523 1674 1HB LYS 72 1HB LYS 72 26.203 -3.962 3.702 1675 2HB LYS 72 2HB LYS 72 27.229 -3.227 2.471 1676 1HG LYS 72 1HG LYS 72 25.548 -1.711 4.493 1677 2HG LYS 72 2HG LYS 72 27.295 -1.934 4.579 1678 1HD LYS 72 1HD LYS 72 27.245 -0.911 2.148 1679 2HD LYS 72 2HD LYS 72 25.687 -0.267 2.667 1680 1HE LYS 72 1HE LYS 72 26.821 1.409 3.697 1681 2HE LYS 72 2HE LYS 72 27.478 0.199 4.816 1682 1HZ LYS 72 1HZ LYS 72 29.217 -0.294 3.225 1683 2HZ LYS 72 2HZ LYS 72 29.239 1.366 3.582 1684 3HZ LYS 72 3HZ LYS 72 28.573 0.820 2.117 1685 H ASP 73 H ASP 73 25.291 -3.155 -0.417 1686 HA ASP 73 HA ASP 73 25.062 -4.896 -2.000 1687 1HB ASP 73 1HB ASP 73 26.478 -6.001 0.406 1688 2HB ASP 73 2HB ASP 73 26.020 -7.122 -0.876 1689 HA PRO 74 HA PRO 74 21.132 -6.200 0.211 1690 1HB PRO 74 1HB PRO 74 19.561 -5.568 -2.020 1691 2HB PRO 74 2HB PRO 74 19.801 -4.519 -0.612 1692 1HG PRO 74 1HG PRO 74 21.090 -4.439 -3.284 1693 2HG PRO 74 2HG PRO 74 20.655 -3.112 -2.198 1694 1HD PRO 74 1HD PRO 74 23.201 -3.984 -2.515 1695 2HD PRO 74 2HD PRO 74 22.603 -3.291 -0.993 1696 H ASN 75 H ASN 75 19.466 -7.815 -0.801 1697 HA ASN 75 HA ASN 75 20.936 -9.640 -2.667 1698 1HB ASN 75 1HB ASN 75 19.671 -11.429 -1.422 1699 2HB ASN 75 2HB ASN 75 20.750 -10.498 -0.384 1700 1HD2 ASN 75 1HD2 ASN 75 19.792 -9.653 1.474 1701 2HD2 ASN 75 2HD2 ASN 75 18.125 -9.416 1.688 1702 H ALA 76 H ALA 76 18.097 -7.754 -2.211 1703 HA ALA 76 HA ALA 76 16.807 -9.147 -4.531 1704 1HB ALA 76 1HB ALA 76 15.102 -7.723 -2.562 1705 2HB ALA 76 2HB ALA 76 15.925 -9.152 -1.937 1706 3HB ALA 76 3HB ALA 76 14.853 -9.290 -3.331 1707 H ARG 77 H ARG 77 15.926 -7.752 -6.095 1708 HA ARG 77 HA ARG 77 16.349 -4.817 -5.624 1709 1HB ARG 77 1HB ARG 77 17.966 -5.749 -7.188 1710 2HB ARG 77 2HB ARG 77 16.691 -6.562 -8.090 1711 1HG ARG 77 1HG ARG 77 15.801 -4.482 -8.881 1712 2HG ARG 77 2HG ARG 77 16.783 -3.556 -7.745 1713 1HD ARG 77 1HD ARG 77 18.778 -4.814 -9.018 1714 2HD ARG 77 2HD ARG 77 17.579 -4.842 -10.325 1715 HE ARG 77 HE ARG 77 18.883 -2.461 -9.251 1716 1HH1 ARG 77 1HH1 ARG 77 16.005 -3.725 -10.746 1717 2HH1 ARG 77 2HH1 ARG 77 15.550 -2.198 -11.418 1718 1HH2 ARG 77 1HH2 ARG 77 18.271 -0.489 -10.133 1719 2HH2 ARG 77 2HH2 ARG 77 16.822 -0.378 -11.074 1720 H HIS 78 H HIS 78 14.869 -3.459 -7.058 1721 HA HIS 78 HA HIS 78 12.169 -4.750 -7.188 1722 1HB HIS 78 1HB HIS 78 11.381 -2.404 -6.890 1723 2HB HIS 78 2HB HIS 78 12.478 -2.886 -5.596 1724 HD1 HIS 78 HD1 HIS 78 14.518 -1.462 -5.262 1725 HD2 HIS 78 HD2 HIS 78 12.755 -0.801 -8.981 1726 HE1 HIS 78 HE1 HIS 78 15.769 0.473 -6.314 1727 H GLU 79 H GLU 79 10.769 -4.082 -8.980 1728 HA GLU 79 HA GLU 79 12.239 -3.051 -11.382 1729 1HB GLU 79 1HB GLU 79 11.792 -5.635 -11.084 1730 2HB GLU 79 2HB GLU 79 10.136 -5.209 -11.513 1731 1HG GLU 79 1HG GLU 79 10.984 -4.105 -13.575 1732 2HG GLU 79 2HG GLU 79 12.615 -4.637 -13.162 1733 H LEU 80 H LEU 80 11.044 -1.519 -12.535 1734 HA LEU 80 HA LEU 80 8.203 -1.104 -11.659 1735 1HB LEU 80 1HB LEU 80 10.490 0.695 -12.413 1736 2HB LEU 80 2HB LEU 80 8.844 1.263 -12.683 1737 HG LEU 80 HG LEU 80 9.502 0.038 -10.033 1738 1HD1 LEU 80 1HD1 LEU 80 9.864 2.856 -9.841 1739 2HD1 LEU 80 2HD1 LEU 80 10.920 2.280 -11.130 1740 3HD1 LEU 80 3HD1 LEU 80 11.047 1.589 -9.513 1741 1HD2 LEU 80 1HD2 LEU 80 7.897 1.896 -9.352 1742 2HD2 LEU 80 2HD2 LEU 80 7.214 0.656 -10.404 1743 3HD2 LEU 80 3HD2 LEU 80 7.679 2.221 -11.072 1744 H THR 81 H THR 81 6.628 -0.836 -13.276 1745 HA THR 81 HA THR 81 6.892 -2.168 -15.742 1746 HB THR 81 HB THR 81 4.830 -0.712 -16.292 1747 HG1 THR 81 HG1 THR 81 4.097 0.478 -14.462 1748 1HG2 THR 81 1HG2 THR 81 3.617 -1.676 -14.158 1749 2HG2 THR 81 2HG2 THR 81 5.174 -2.453 -13.870 1750 3HG2 THR 81 3HG2 THR 81 4.288 -2.779 -15.360 1751 H ALA 82 H ALA 82 6.264 1.336 -15.735 1752 HA ALA 82 HA ALA 82 8.680 1.930 -17.292 1753 1HB ALA 82 1HB ALA 82 6.813 2.760 -19.115 1754 2HB ALA 82 2HB ALA 82 6.032 1.313 -18.479 1755 3HB ALA 82 3HB ALA 82 7.636 1.203 -19.203 1756 H GLY 83 H GLY 83 5.337 3.209 -16.966 1757 1HA GLY 83 1HA GLY 83 6.520 5.874 -16.372 1758 2HA GLY 83 2HA GLY 83 4.858 5.591 -16.886 1759 H LEU 84 H LEU 84 6.689 3.958 -14.302 1760 HA LEU 84 HA LEU 84 6.242 3.769 -11.993 1761 1HB LEU 84 1HB LEU 84 6.159 6.446 -12.722 1762 2HB LEU 84 2HB LEU 84 4.610 6.230 -11.912 1763 HG LEU 84 HG LEU 84 5.723 5.349 -9.926 1764 1HD1 LEU 84 1HD1 LEU 84 7.945 5.090 -11.800 1765 2HD1 LEU 84 2HD1 LEU 84 7.698 4.297 -10.243 1766 3HD1 LEU 84 3HD1 LEU 84 8.434 5.899 -10.311 1767 1HD2 LEU 84 1HD2 LEU 84 7.426 7.484 -9.743 1768 2HD2 LEU 84 2HD2 LEU 84 5.682 7.590 -9.507 1769 3HD2 LEU 84 3HD2 LEU 84 6.385 7.990 -11.073 1770 H LYS 85 H LYS 85 4.772 2.231 -11.422 1771 HA LYS 85 HA LYS 85 1.982 2.809 -11.052 1772 1HB LYS 85 1HB LYS 85 2.920 1.864 -13.673 1773 2HB LYS 85 2HB LYS 85 1.648 0.846 -12.996 1774 1HG LYS 85 1HG LYS 85 0.074 2.446 -13.290 1775 2HG LYS 85 2HG LYS 85 1.125 3.705 -12.644 1776 1HD LYS 85 1HD LYS 85 2.363 3.210 -15.013 1777 2HD LYS 85 2HD LYS 85 0.692 2.858 -15.453 1778 1HE LYS 85 1HE LYS 85 0.921 5.295 -13.839 1779 2HE LYS 85 2HE LYS 85 1.819 5.397 -15.366 1780 1HZ LYS 85 1HZ LYS 85 -1.016 4.556 -15.017 1781 2HZ LYS 85 2HZ LYS 85 -0.166 4.479 -16.486 1782 3HZ LYS 85 3HZ LYS 85 -0.473 5.983 -15.761 1783 H ARG 86 H ARG 86 3.222 -0.238 -12.377 1784 HA ARG 86 HA ARG 86 2.852 -1.471 -9.669 1785 1HB ARG 86 1HB ARG 86 2.539 -2.489 -12.513 1786 2HB ARG 86 2HB ARG 86 2.504 -3.557 -11.111 1787 1HG ARG 86 1HG ARG 86 0.262 -3.115 -11.167 1788 2HG ARG 86 2HG ARG 86 0.741 -1.650 -10.310 1789 1HD ARG 86 1HD ARG 86 0.237 -0.323 -12.096 1790 2HD ARG 86 2HD ARG 86 0.992 -1.445 -13.244 1791 HE ARG 86 HE ARG 86 -1.401 -2.611 -12.141 1792 1HH1 ARG 86 1HH1 ARG 86 -0.290 -0.197 -14.391 1793 2HH1 ARG 86 2HH1 ARG 86 -1.707 -0.305 -15.376 1794 1HH2 ARG 86 1HH2 ARG 86 -3.231 -2.732 -13.436 1795 2HH2 ARG 86 2HH2 ARG 86 -3.361 -1.729 -14.841 1796 H MET 87 H MET 87 4.586 -2.679 -8.847 1797 HA MET 87 HA MET 87 6.931 -3.089 -10.640 1798 1HB MET 87 1HB MET 87 8.348 -2.296 -8.663 1799 2HB MET 87 2HB MET 87 7.411 -1.045 -9.472 1800 1HG MET 87 1HG MET 87 7.011 -0.621 -7.200 1801 2HG MET 87 2HG MET 87 5.596 -1.555 -7.669 1802 1HE MET 87 1HE MET 87 9.275 -2.946 -5.334 1803 2HE MET 87 2HE MET 87 9.046 -1.466 -6.267 1804 3HE MET 87 3HE MET 87 9.327 -2.997 -7.096 1805 H ARG 88 H ARG 88 8.576 -4.588 -9.527 1806 HA ARG 88 HA ARG 88 7.158 -6.582 -7.784 1807 1HB ARG 88 1HB ARG 88 9.083 -7.191 -10.055 1808 2HB ARG 88 2HB ARG 88 8.054 -8.334 -9.196 1809 1HG ARG 88 1HG ARG 88 6.634 -8.023 -10.948 1810 2HG ARG 88 2HG ARG 88 6.205 -6.531 -10.111 1811 1HD ARG 88 1HD ARG 88 7.306 -5.218 -11.641 1812 2HD ARG 88 2HD ARG 88 8.629 -6.385 -11.827 1813 HE ARG 88 HE ARG 88 6.227 -6.290 -13.447 1814 1HH1 ARG 88 1HH1 ARG 88 8.533 -8.434 -11.963 1815 2HH1 ARG 88 2HH1 ARG 88 8.271 -9.693 -13.119 1816 1HH2 ARG 88 1HH2 ARG 88 5.905 -7.938 -14.934 1817 2HH2 ARG 88 2HH2 ARG 88 6.795 -9.417 -14.789 1818 H ILE 89 H ILE 89 8.971 -8.272 -7.054 1819 HA ILE 89 HA ILE 89 11.455 -6.772 -6.296 1820 HB ILE 89 HB ILE 89 9.660 -8.564 -4.616 1821 1HG1 ILE 89 1HG1 ILE 89 10.349 -5.848 -3.704 1822 2HG1 ILE 89 2HG1 ILE 89 9.388 -5.888 -5.182 1823 1HG2 ILE 89 1HG2 ILE 89 12.126 -8.837 -4.174 1824 2HG2 ILE 89 2HG2 ILE 89 11.222 -8.202 -2.800 1825 3HG2 ILE 89 3HG2 ILE 89 12.194 -7.116 -3.793 1826 1HD1 ILE 89 1HD1 ILE 89 8.260 -5.984 -2.746 1827 2HD1 ILE 89 2HD1 ILE 89 8.553 -7.708 -2.974 1828 3HD1 ILE 89 3HD1 ILE 89 7.563 -6.822 -4.133 1829 H PHE 90 H PHE 90 13.003 -7.884 -7.485 1830 HA PHE 90 HA PHE 90 12.747 -10.833 -7.797 1831 1HB PHE 90 1HB PHE 90 14.378 -8.602 -9.040 1832 2HB PHE 90 2HB PHE 90 14.794 -10.290 -9.328 1833 HD1 PHE 90 HD1 PHE 90 13.490 -11.667 -10.787 1834 HD2 PHE 90 HD2 PHE 90 12.137 -7.730 -9.729 1835 HE1 PHE 90 HE1 PHE 90 11.746 -11.794 -12.545 1836 HE2 PHE 90 HE2 PHE 90 10.393 -7.856 -11.487 1837 HZ PHE 90 HZ PHE 90 10.197 -9.888 -12.895 1838 H THR 91 H THR 91 15.298 -11.682 -7.966 1839 HA THR 91 HA THR 91 16.607 -10.899 -5.382 1840 HB THR 91 HB THR 91 17.163 -13.393 -5.271 1841 HG1 THR 91 HG1 THR 91 15.806 -14.700 -6.577 1842 1HG2 THR 91 1HG2 THR 91 14.708 -12.001 -4.709 1843 2HG2 THR 91 2HG2 THR 91 15.442 -13.336 -3.822 1844 3HG2 THR 91 3HG2 THR 91 14.340 -13.667 -5.157 1845 H ILE 92 H ILE 92 18.297 -9.698 -6.336 1846 HA ILE 92 HA ILE 92 19.697 -10.344 -8.726 1847 HB ILE 92 HB ILE 92 21.378 -8.782 -7.771 1848 1HG1 ILE 92 1HG1 ILE 92 19.731 -8.955 -5.235 1849 2HG1 ILE 92 2HG1 ILE 92 21.266 -9.792 -5.462 1850 1HG2 ILE 92 1HG2 ILE 92 18.722 -7.741 -6.839 1851 2HG2 ILE 92 2HG2 ILE 92 18.942 -8.120 -8.547 1852 3HG2 ILE 92 3HG2 ILE 92 19.975 -6.921 -7.769 1853 1HD1 ILE 92 1HD1 ILE 92 22.496 -7.833 -5.430 1854 2HD1 ILE 92 2HD1 ILE 92 21.171 -7.369 -4.361 1855 3HD1 ILE 92 3HD1 ILE 92 21.159 -6.862 -6.051 1856 H LYS 93 H LYS 93 19.817 -11.847 -5.609 1857 HA LYS 93 HA LYS 93 22.012 -13.614 -6.552 1858 1HB LYS 93 1HB LYS 93 23.230 -13.215 -4.423 1859 2HB LYS 93 2HB LYS 93 23.035 -11.714 -5.325 1860 1HG LYS 93 1HG LYS 93 21.147 -11.070 -3.942 1861 2HG LYS 93 2HG LYS 93 21.171 -12.627 -3.115 1862 1HD LYS 93 1HD LYS 93 22.270 -10.876 -1.755 1863 2HD LYS 93 2HD LYS 93 23.416 -12.130 -2.228 1864 1HE LYS 93 1HE LYS 93 23.208 -9.931 -4.182 1865 2HE LYS 93 2HE LYS 93 23.836 -9.434 -2.599 1866 1HZ LYS 93 1HZ LYS 93 25.517 -11.029 -2.685 1867 2HZ LYS 93 2HZ LYS 93 25.482 -10.432 -4.274 1868 3HZ LYS 93 3HZ LYS 93 24.754 -11.923 -3.911 1869 HA PRO 94 HA PRO 94 19.636 -16.794 -4.672 1870 1HB PRO 94 1HB PRO 94 22.112 -17.804 -3.360 1871 2HB PRO 94 2HB PRO 94 21.024 -18.631 -4.489 1872 1HG PRO 94 1HG PRO 94 23.454 -17.763 -5.221 1873 2HG PRO 94 2HG PRO 94 22.080 -17.779 -6.334 1874 1HD PRO 94 1HD PRO 94 23.355 -15.486 -4.935 1875 2HD PRO 94 2HD PRO 94 22.578 -15.551 -6.530 1876 H ILE 95 H ILE 95 18.561 -17.085 -2.688 1877 HA ILE 95 HA ILE 95 19.744 -15.664 -0.323 1878 HB ILE 95 HB ILE 95 16.843 -15.894 -1.205 1879 1HG1 ILE 95 1HG1 ILE 95 18.778 -13.559 -1.313 1880 2HG1 ILE 95 2HG1 ILE 95 18.172 -14.458 -2.705 1881 1HG2 ILE 95 1HG2 ILE 95 18.013 -14.062 0.894 1882 2HG2 ILE 95 2HG2 ILE 95 17.412 -15.672 1.293 1883 3HG2 ILE 95 3HG2 ILE 95 16.317 -14.464 0.620 1884 1HD1 ILE 95 1HD1 ILE 95 16.784 -12.528 -2.567 1885 2HD1 ILE 95 2HD1 ILE 95 16.625 -12.674 -0.816 1886 3HD1 ILE 95 3HD1 ILE 95 15.820 -13.833 -1.875 1887 H ALA 96 H ALA 96 19.612 -16.747 1.642 1888 HA ALA 96 HA ALA 96 18.871 -19.602 1.554 1889 1HB ALA 96 1HB ALA 96 20.938 -19.094 2.605 1890 2HB ALA 96 2HB ALA 96 19.840 -19.348 3.961 1891 3HB ALA 96 3HB ALA 96 20.258 -17.709 3.460 1892 H ILE 97 H ILE 97 17.367 -20.549 3.040 1893 HA ILE 97 HA ILE 97 14.882 -19.379 3.404 1894 HB ILE 97 HB ILE 97 16.391 -21.395 5.107 1895 1HG1 ILE 97 1HG1 ILE 97 14.453 -22.650 3.529 1896 2HG1 ILE 97 2HG1 ILE 97 15.162 -21.433 2.467 1897 1HG2 ILE 97 1HG2 ILE 97 13.885 -20.184 5.625 1898 2HG2 ILE 97 2HG2 ILE 97 14.576 -21.597 6.423 1899 3HG2 ILE 97 3HG2 ILE 97 13.537 -21.801 5.013 1900 1HD1 ILE 97 1HD1 ILE 97 17.368 -22.494 3.774 1901 2HD1 ILE 97 2HD1 ILE 97 16.844 -22.915 2.144 1902 3HD1 ILE 97 3HD1 ILE 97 16.340 -23.903 3.516 1903 H GLY 98 H GLY 98 17.749 -18.832 5.349 1904 1HA GLY 98 1HA GLY 98 16.094 -17.238 7.263 1905 2HA GLY 98 2HA GLY 98 17.658 -17.946 7.669 1906 H GLU 99 H GLU 99 16.348 -15.819 5.091 1907 HA GLU 99 HA GLU 99 18.835 -14.166 5.388 1908 1HB GLU 99 1HB GLU 99 17.311 -15.322 3.175 1909 2HB GLU 99 2HB GLU 99 17.584 -13.598 2.945 1910 1HG GLU 99 1HG GLU 99 19.704 -15.700 3.481 1911 2HG GLU 99 2HG GLU 99 19.439 -14.843 1.964 1912 H GLU 100 H GLU 100 18.522 -11.831 4.861 1913 HA GLU 100 HA GLU 100 15.833 -10.838 5.750 1914 1HB GLU 100 1HB GLU 100 18.092 -10.461 7.059 1915 2HB GLU 100 2HB GLU 100 18.408 -9.262 5.805 1916 1HG GLU 100 1HG GLU 100 15.699 -9.134 6.980 1917 2HG GLU 100 2HG GLU 100 17.006 -8.748 8.099 1918 H ILE 101 H ILE 101 14.717 -10.111 3.966 1919 HA ILE 101 HA ILE 101 16.185 -9.325 1.542 1920 HB ILE 101 HB ILE 101 13.230 -9.505 2.224 1921 1HG1 ILE 101 1HG1 ILE 101 15.100 -11.440 0.823 1922 2HG1 ILE 101 2HG1 ILE 101 14.419 -11.651 2.436 1923 1HG2 ILE 101 1HG2 ILE 101 14.190 -8.107 0.157 1924 2HG2 ILE 101 2HG2 ILE 101 12.745 -9.106 -0.002 1925 3HG2 ILE 101 3HG2 ILE 101 14.304 -9.715 -0.558 1926 1HD1 ILE 101 1HD1 ILE 101 12.368 -11.066 0.437 1927 2HD1 ILE 101 2HD1 ILE 101 12.446 -12.382 1.607 1928 3HD1 ILE 101 3HD1 ILE 101 13.273 -12.531 0.057 1929 H THR 102 H THR 102 16.648 -7.283 1.005 1930 HA THR 102 HA THR 102 14.933 -5.017 1.804 1931 HB THR 102 HB THR 102 17.042 -3.905 2.790 1932 HG1 THR 102 HG1 THR 102 18.770 -5.053 2.669 1933 1HG2 THR 102 1HG2 THR 102 16.050 -6.362 4.258 1934 2HG2 THR 102 2HG2 THR 102 15.128 -4.864 4.128 1935 3HG2 THR 102 3HG2 THR 102 16.678 -4.877 4.969 1936 H ILE 103 H ILE 103 15.320 -3.198 0.398 1937 HA ILE 103 HA ILE 103 17.240 -3.770 -1.836 1938 HB ILE 103 HB ILE 103 15.628 -2.542 -3.232 1939 1HG1 ILE 103 1HG1 ILE 103 13.394 -2.258 -1.535 1940 2HG1 ILE 103 2HG1 ILE 103 14.757 -1.577 -0.647 1941 1HG2 ILE 103 1HG2 ILE 103 13.524 -4.063 -2.190 1942 2HG2 ILE 103 2HG2 ILE 103 14.979 -4.928 -1.695 1943 3HG2 ILE 103 3HG2 ILE 103 14.693 -4.589 -3.402 1944 1HD1 ILE 103 1HD1 ILE 103 15.186 -0.605 -3.186 1945 2HD1 ILE 103 2HD1 ILE 103 14.384 0.286 -1.892 1946 3HD1 ILE 103 3HD1 ILE 103 13.426 -0.594 -3.082 1947 H SER 104 H SER 104 18.367 -1.920 -2.741 1948 HA SER 104 HA SER 104 18.945 0.178 -0.730 1949 1HB SER 104 1HB SER 104 20.237 -1.164 -2.990 1950 2HB SER 104 2HB SER 104 20.468 0.584 -3.045 1951 HG SER 104 HG SER 104 21.910 -0.932 -1.686 1952 H TYR 105 H TYR 105 19.505 2.402 -2.112 1953 HA TYR 105 HA TYR 105 17.016 3.008 -3.680 1954 1HB TYR 105 1HB TYR 105 18.563 4.893 -1.867 1955 2HB TYR 105 2HB TYR 105 16.965 5.153 -2.558 1956 HD1 TYR 105 HD1 TYR 105 18.080 5.001 0.456 1957 HD2 TYR 105 HD2 TYR 105 15.807 2.387 -2.085 1958 HE1 TYR 105 HE1 TYR 105 17.058 3.947 2.454 1959 HE2 TYR 105 HE2 TYR 105 14.786 1.332 -0.084 1960 HH TYR 105 HH TYR 105 14.342 1.932 2.281 1961 H GLY 106 H GLY 106 20.130 4.648 -2.978 1962 1HA GLY 106 1HA GLY 106 21.338 4.397 -5.489 1963 2HA GLY 106 2HA GLY 106 20.276 5.798 -5.621 1964 H ASP 107 H ASP 107 22.657 6.671 -5.941 1965 HA ASP 107 HA ASP 107 24.303 7.015 -3.583 1966 1HB ASP 107 1HB ASP 107 24.168 7.871 -6.413 1967 2HB ASP 107 2HB ASP 107 24.979 9.018 -5.346 1968 H ASP 108 H ASP 108 21.716 8.900 -5.102 1969 HA ASP 108 HA ASP 108 22.124 11.290 -3.511 1970 1HB ASP 108 1HB ASP 108 20.402 10.250 -5.600 1971 2HB ASP 108 2HB ASP 108 19.439 11.092 -4.386 1972 H TYR 109 H TYR 109 19.330 9.042 -3.451 1973 HA TYR 109 HA TYR 109 18.499 9.860 -0.816 1974 1HB TYR 109 1HB TYR 109 17.505 8.422 -2.971 1975 2HB TYR 109 2HB TYR 109 17.710 7.176 -1.740 1976 HD1 TYR 109 HD1 TYR 109 16.748 10.804 -1.597 1977 HD2 TYR 109 HD2 TYR 109 15.683 6.747 -0.673 1978 HE1 TYR 109 HE1 TYR 109 14.702 11.603 -0.446 1979 HE2 TYR 109 HE2 TYR 109 13.637 7.546 0.478 1980 HH TYR 109 HH TYR 109 12.140 9.676 0.297 1981 H TRP 110 H TRP 110 20.818 9.552 0.113 1982 HA TRP 110 HA TRP 110 20.871 6.956 1.530 1983 1HB TRP 110 1HB TRP 110 22.260 7.263 -0.827 1984 2HB TRP 110 2HB TRP 110 23.476 7.728 0.361 1985 HD1 TRP 110 HD1 TRP 110 23.608 5.013 -1.331 1986 HE1 TRP 110 HE1 TRP 110 23.710 2.768 -0.071 1987 HE3 TRP 110 HE3 TRP 110 21.704 6.438 3.199 1988 HZ2 TRP 110 HZ2 TRP 110 23.071 1.714 2.507 1989 HZ3 TRP 110 HZ3 TRP 110 21.464 4.794 5.030 1990 HH2 TRP 110 HH2 TRP 110 22.144 2.435 4.693 1991 H LEU 111 H LEU 111 23.563 7.310 2.481 1992 HA LEU 111 HA LEU 111 23.082 9.308 4.557 1993 1HB LEU 111 1HB LEU 111 24.150 7.121 4.964 1994 2HB LEU 111 2HB LEU 111 25.454 7.538 3.854 1995 HG LEU 111 HG LEU 111 25.713 9.642 5.427 1996 1HD1 LEU 111 1HD1 LEU 111 23.587 8.764 6.687 1997 2HD1 LEU 111 2HD1 LEU 111 24.933 9.413 7.623 1998 3HD1 LEU 111 3HD1 LEU 111 24.725 7.668 7.470 1999 1HD2 LEU 111 1HD2 LEU 111 26.633 6.813 5.876 2000 2HD2 LEU 111 2HD2 LEU 111 27.124 8.087 6.992 2001 3HD2 LEU 111 3HD2 LEU 111 27.552 8.196 5.285 2002 H SER 112 H SER 112 26.025 8.872 2.560 2003 HA SER 112 HA SER 112 25.955 11.700 1.723 2004 1HB SER 112 1HB SER 112 27.323 10.712 4.089 2005 2HB SER 112 2HB SER 112 28.481 11.401 2.950 2006 HG SER 112 HG SER 112 26.168 12.625 4.032 2007 H ARG 113 H ARG 113 28.784 9.606 2.232 2008 HA ARG 113 HA ARG 113 28.937 9.121 -0.712 2009 1HB ARG 113 1HB ARG 113 30.232 11.188 0.472 2010 2HB ARG 113 2HB ARG 113 31.424 9.914 0.730 2011 1HG ARG 113 1HG ARG 113 32.019 9.922 -1.447 2012 2HG ARG 113 2HG ARG 113 30.337 9.826 -1.970 2013 1HD ARG 113 1HD ARG 113 30.950 12.456 -0.864 2014 2HD ARG 113 2HD ARG 113 32.004 12.058 -2.234 2015 HE ARG 113 HE ARG 113 29.130 12.495 -2.372 2016 1HH1 ARG 113 1HH1 ARG 113 31.797 10.704 -3.714 2017 2HH1 ARG 113 2HH1 ARG 113 31.015 10.470 -5.238 2018 1HH2 ARG 113 1HH2 ARG 113 28.136 12.177 -4.360 2019 2HH2 ARG 113 2HH2 ARG 113 28.959 11.296 -5.604 2020 HA PRO 114 HA PRO 114 30.247 5.569 2.077 2021 1HB PRO 114 1HB PRO 114 28.312 3.783 1.262 2022 2HB PRO 114 2HB PRO 114 28.120 4.860 2.657 2023 1HG PRO 114 1HG PRO 114 27.034 5.107 -0.100 2024 2HG PRO 114 2HG PRO 114 26.299 5.547 1.447 2025 1HD PRO 114 1HD PRO 114 27.420 7.347 -0.287 2026 2HD PRO 114 2HD PRO 114 27.280 7.611 1.463 2027 H ARG 115 H ARG 115 28.952 5.523 -1.247 2028 HA ARG 115 HA ARG 115 29.776 4.497 -3.206 2029 1HB ARG 115 1HB ARG 115 32.132 5.178 -1.478 2030 2HB ARG 115 2HB ARG 115 32.420 4.231 -2.937 2031 1HG ARG 115 1HG ARG 115 31.993 5.996 -4.305 2032 2HG ARG 115 2HG ARG 115 30.625 6.536 -3.331 2033 1HD ARG 115 1HD ARG 115 32.151 8.272 -2.948 2034 2HD ARG 115 2HD ARG 115 32.556 7.185 -1.606 2035 HE ARG 115 HE ARG 115 34.028 6.333 -3.883 2036 1HH1 ARG 115 1HH1 ARG 115 33.823 9.058 -1.728 2037 2HH1 ARG 115 2HH1 ARG 115 35.489 9.477 -1.921 2038 1HH2 ARG 115 1HH2 ARG 115 36.189 6.896 -4.117 2039 2HH2 ARG 115 2HH2 ARG 115 36.821 8.263 -3.263 2040 H LEU 116 H LEU 116 29.106 2.811 -0.668 2041 HA LEU 116 HA LEU 116 29.243 0.544 -0.008 2042 1HB LEU 116 1HB LEU 116 28.566 0.908 -2.668 2043 2HB LEU 116 2HB LEU 116 29.857 -0.289 -2.765 2044 HG LEU 116 HG LEU 116 27.668 -1.393 -2.514 2045 1HD1 LEU 116 1HD1 LEU 116 29.728 -2.362 -1.452 2046 2HD1 LEU 116 2HD1 LEU 116 28.236 -2.820 -0.632 2047 3HD1 LEU 116 3HD1 LEU 116 29.270 -1.567 0.055 2048 1HD2 LEU 116 1HD2 LEU 116 27.370 -0.372 0.269 2049 2HD2 LEU 116 2HD2 LEU 116 26.131 -0.834 -0.897 2050 3HD2 LEU 116 3HD2 LEU 116 26.933 0.731 -1.036 2051 H THR 117 H THR 117 31.790 1.925 0.204 2052 HA THR 117 HA THR 117 33.631 -0.375 -0.352 2053 HB THR 117 HB THR 117 34.145 2.608 -0.652 2054 HG1 THR 117 HG1 THR 117 34.447 1.826 -2.892 2055 1HG2 THR 117 1HG2 THR 117 36.080 0.843 -1.883 2056 2HG2 THR 117 2HG2 THR 117 35.945 0.493 -0.160 2057 3HG2 THR 117 3HG2 THR 117 36.345 2.124 -0.699 2058 H GLN 118 H GLN 118 33.929 2.805 1.271 2059 HA GLN 118 HA GLN 118 34.262 1.472 3.895 2060 1HB GLN 118 1HB GLN 118 36.428 1.863 2.222 2061 2HB GLN 118 2HB GLN 118 36.468 3.316 3.220 2062 1HG GLN 118 1HG GLN 118 36.076 1.584 5.186 2063 2HG GLN 118 2HG GLN 118 36.771 0.446 4.032 2064 1HE2 GLN 118 1HE2 GLN 118 38.973 0.233 4.454 2065 2HE2 GLN 118 2HE2 GLN 118 40.017 1.508 4.862 2066 H ASN 119 H ASN 119 32.181 3.095 3.448 2067 HA ASN 119 HA ASN 119 31.139 5.109 4.112 2068 1HB ASN 119 1HB ASN 119 33.456 4.579 5.928 2069 2HB ASN 119 2HB ASN 119 32.673 6.153 6.066 2070 1HD2 ASN 119 1HD2 ASN 119 31.652 2.695 5.733 2071 2HD2 ASN 119 2HD2 ASN 119 30.398 2.808 6.872 2072 1H GLY 201 1H GLY 201 35.728 16.877 8.967 2073 2H GLY 201 2H GLY 201 34.330 15.990 9.345 2074 3H GLY 201 3H GLY 201 35.862 15.370 9.738 2075 1HA GLY 201 1HA GLY 201 36.166 16.788 11.499 2076 2HA GLY 201 2HA GLY 201 35.020 17.959 10.848 2077 H LYS 202 H LYS 202 33.293 18.048 12.205 2078 HA LYS 202 HA LYS 202 31.693 15.653 12.701 2079 1HB LYS 202 1HB LYS 202 33.695 16.685 14.613 2080 2HB LYS 202 2HB LYS 202 32.098 16.438 15.318 2081 1HG LYS 202 1HG LYS 202 32.747 14.213 13.603 2082 2HG LYS 202 2HG LYS 202 34.054 14.467 14.760 2083 1HD LYS 202 1HD LYS 202 31.250 14.600 15.784 2084 2HD LYS 202 2HD LYS 202 31.902 13.010 15.384 2085 1HE LYS 202 1HE LYS 202 33.945 13.651 16.806 2086 2HE LYS 202 2HE LYS 202 32.968 15.008 17.398 2087 1HZ LYS 202 1HZ LYS 202 31.959 12.219 17.336 2088 2HZ LYS 202 2HZ LYS 202 31.312 13.546 18.177 2089 3HZ LYS 202 3HZ LYS 202 32.776 12.848 18.685 2090 H ALA 203 H ALA 203 30.699 17.751 11.431 2091 HA ALA 203 HA ALA 203 29.561 19.710 13.340 2092 1HB ALA 203 1HB ALA 203 30.024 19.408 10.434 2093 2HB ALA 203 2HB ALA 203 30.060 20.865 11.427 2094 3HB ALA 203 3HB ALA 203 28.520 20.231 10.846 2095 HA PRO 204 HA PRO 204 25.780 17.508 13.894 2096 1HB PRO 204 1HB PRO 204 24.417 20.148 13.839 2097 2HB PRO 204 2HB PRO 204 24.468 18.940 15.135 2098 1HG PRO 204 1HG PRO 204 25.827 21.259 15.257 2099 2HG PRO 204 2HG PRO 204 26.413 19.767 16.004 2100 1HD PRO 204 1HD PRO 204 27.325 21.129 13.524 2101 2HD PRO 204 2HD PRO 204 28.249 20.168 14.698 2102 H ARG 205 H ARG 205 25.969 20.112 11.492 2103 HA ARG 205 HA ARG 205 24.951 20.328 9.370 2104 1HB ARG 205 1HB ARG 205 25.721 17.571 9.896 2105 2HB ARG 205 2HB ARG 205 24.340 17.632 8.801 2106 1HG ARG 205 1HG ARG 205 25.526 18.717 7.146 2107 2HG ARG 205 2HG ARG 205 26.584 19.536 8.296 2108 1HD ARG 205 1HD ARG 205 27.826 17.471 8.696 2109 2HD ARG 205 2HD ARG 205 26.701 16.561 7.669 2110 HE ARG 205 HE ARG 205 27.563 18.679 6.072 2111 1HH1 ARG 205 1HH1 ARG 205 29.086 16.096 7.840 2112 2HH1 ARG 205 2HH1 ARG 205 30.426 15.994 6.751 2113 1HH2 ARG 205 1HH2 ARG 205 29.313 18.527 4.674 2114 2HH2 ARG 205 2HH2 ARG 205 30.556 17.358 4.972 2115 H LYS 206 H LYS 206 23.016 21.343 10.332 2116 HA LYS 206 HA LYS 206 20.731 19.771 11.171 2117 1HB LYS 206 1HB LYS 206 21.607 22.420 11.231 2118 2HB LYS 206 2HB LYS 206 20.216 22.472 10.147 2119 1HG LYS 206 1HG LYS 206 19.059 22.646 12.117 2120 2HG LYS 206 2HG LYS 206 19.214 20.889 12.102 2121 1HD LYS 206 1HD LYS 206 19.916 21.760 14.281 2122 2HD LYS 206 2HD LYS 206 21.310 21.094 13.431 2123 1HE LYS 206 1HE LYS 206 21.055 23.839 12.657 2124 2HE LYS 206 2HE LYS 206 20.982 23.755 14.427 2125 1HZ LYS 206 1HZ LYS 206 22.936 22.360 14.429 2126 2HZ LYS 206 2HZ LYS 206 23.285 23.790 13.582 2127 3HZ LYS 206 3HZ LYS 206 22.986 22.351 12.731 2128 H GLN 207 H GLN 207 19.690 18.468 9.701 2129 HA GLN 207 HA GLN 207 18.611 17.795 7.711 2130 1HB GLN 207 1HB GLN 207 17.999 20.552 8.361 2131 2HB GLN 207 2HB GLN 207 17.967 20.329 6.612 2132 1HG GLN 207 1HG GLN 207 15.799 19.699 7.151 2133 2HG GLN 207 2HG GLN 207 16.614 18.138 7.251 2134 1HE2 GLN 207 1HE2 GLN 207 15.838 17.057 9.073 2135 2HE2 GLN 207 2HE2 GLN 207 15.573 17.771 10.590 2136 H LEU 208 H LEU 208 18.627 18.292 5.210 2137 HA LEU 208 HA LEU 208 21.362 19.216 4.398 2138 1HB LEU 208 1HB LEU 208 19.893 16.651 4.017 2139 2HB LEU 208 2HB LEU 208 20.793 17.240 2.620 2140 HG LEU 208 HG LEU 208 22.169 17.304 5.269 2141 1HD1 LEU 208 1HD1 LEU 208 22.641 15.005 5.337 2142 2HD1 LEU 208 2HD1 LEU 208 22.147 14.757 3.662 2143 3HD1 LEU 208 3HD1 LEU 208 20.930 15.032 4.909 2144 1HD2 LEU 208 1HD2 LEU 208 22.873 16.917 2.367 2145 2HD2 LEU 208 2HD2 LEU 208 24.011 16.442 3.629 2146 3HD2 LEU 208 3HD2 LEU 208 23.483 18.121 3.503 2147 H ALA 209 H ALA 209 21.311 19.381 1.818 2148 HA ALA 209 HA ALA 209 19.570 21.478 1.074 2149 1HB ALA 209 1HB ALA 209 21.760 20.321 0.050 2150 2HB ALA 209 2HB ALA 209 20.676 21.275 -0.963 2151 3HB ALA 209 3HB ALA 209 20.561 19.515 -0.963 2152 H THR 210 H THR 210 19.338 18.023 0.124 2153 HA THR 210 HA THR 210 17.473 16.773 -0.610 2154 HB THR 210 HB THR 210 15.954 18.772 1.093 2155 HG1 THR 210 HG1 THR 210 17.465 16.525 1.935 2156 1HG2 THR 210 1HG2 THR 210 15.545 15.813 1.143 2157 2HG2 THR 210 2HG2 THR 210 14.978 16.692 -0.276 2158 3HG2 THR 210 3HG2 THR 210 14.365 17.111 1.323 2159 H LYS 211 H LYS 211 18.190 18.555 -2.556 2160 HA LYS 211 HA LYS 211 16.272 20.508 -3.344 2161 1HB LYS 211 1HB LYS 211 18.281 18.739 -4.752 2162 2HB LYS 211 2HB LYS 211 17.298 19.889 -5.659 2163 1HG LYS 211 1HG LYS 211 18.299 21.736 -4.664 2164 2HG LYS 211 2HG LYS 211 18.740 20.842 -3.209 2165 1HD LYS 211 1HD LYS 211 20.670 20.013 -4.141 2166 2HD LYS 211 2HD LYS 211 19.975 19.931 -5.760 2167 1HE LYS 211 1HE LYS 211 21.189 21.810 -6.201 2168 2HE LYS 211 2HE LYS 211 20.009 22.668 -5.191 2169 1HZ LYS 211 1HZ LYS 211 22.573 21.424 -4.357 2170 2HZ LYS 211 2HZ LYS 211 21.367 21.854 -3.241 2171 3HZ LYS 211 3HZ LYS 211 22.104 23.049 -4.196 2172 H ALA 212 H ALA 212 16.677 17.292 -4.875 2173 HA ALA 212 HA ALA 212 13.896 16.555 -4.637 2174 1HB ALA 212 1HB ALA 212 14.477 18.569 -6.491 2175 2HB ALA 212 2HB ALA 212 13.007 17.596 -6.454 2176 3HB ALA 212 3HB ALA 212 14.360 17.110 -7.475 2177 H ALA 213 H ALA 213 15.306 14.646 -4.073 2178 HA ALA 213 HA ALA 213 15.750 12.972 -6.487 2179 1HB ALA 213 1HB ALA 213 17.873 13.194 -4.349 2180 2HB ALA 213 2HB ALA 213 17.829 14.345 -5.685 2181 3HB ALA 213 3HB ALA 213 18.043 12.625 -6.010 2182 H ARG 214 H ARG 214 13.992 11.670 -5.683 2183 HA ARG 214 HA ARG 214 14.000 10.605 -2.967 2184 1HB ARG 214 1HB ARG 214 12.205 10.946 -5.060 2185 2HB ARG 214 2HB ARG 214 12.452 9.200 -5.039 2186 1HG ARG 214 1HG ARG 214 10.637 9.649 -3.534 2187 2HG ARG 214 2HG ARG 214 12.042 9.291 -2.530 2188 1HD ARG 214 1HD ARG 214 11.326 11.250 -1.500 2189 2HD ARG 214 2HD ARG 214 12.368 11.957 -2.748 2190 HE ARG 214 HE ARG 214 9.697 11.445 -3.757 2191 1HH1 ARG 214 1HH1 ARG 214 11.613 13.640 -1.852 2192 2HH1 ARG 214 2HH1 ARG 214 10.588 14.994 -2.179 2193 1HH2 ARG 214 1HH2 ARG 214 8.381 13.218 -4.167 2194 2HH2 ARG 214 2HH2 ARG 214 8.771 14.759 -3.479 2195 1HN MLZ 215 1HN MLZ 215 13.233 7.866 -3.851 2196 HA MLZ 215 HA MLZ 215 15.870 6.649 -3.776 2197 1HB MLZ 215 1HB MLZ 215 13.045 5.621 -4.204 2198 2HB MLZ 215 2HB MLZ 215 14.441 4.561 -4.021 2199 1HG MLZ 215 1HG MLZ 215 13.707 6.680 -1.987 2200 2HG MLZ 215 2HG MLZ 215 14.862 5.360 -1.798 2201 1HD MLZ 215 1HD MLZ 215 11.889 4.974 -2.261 2202 2HD MLZ 215 2HD MLZ 215 13.072 3.715 -1.903 2203 1HE MLZ 215 1HE MLZ 215 11.849 5.740 -0.073 2204 2HE MLZ 215 2HE MLZ 215 13.535 5.277 0.226 2205 HZ MLZ 215 HZ MLZ 215 12.737 2.912 -0.099 2206 1HCM MLZ 215 1HCM MLZ 215 11.786 4.546 2.188 2207 2HCM MLZ 215 2HCM MLZ 215 13.319 3.684 2.058 2208 3HCM MLZ 215 3HCM MLZ 215 11.809 2.783 2.186 2209 H SER 216 H SER 216 17.099 5.986 -5.508 2210 HA SER 216 HA SER 216 17.711 5.516 -7.741 2211 1HB SER 216 1HB SER 216 17.047 7.255 -9.220 2212 2HB SER 216 2HB SER 216 15.477 7.433 -8.437 2213 HG SER 216 HG SER 216 16.725 9.088 -7.708 2214 H ALA 217 H ALA 217 16.494 5.066 -10.038 2215 HA ALA 217 HA ALA 217 14.685 2.816 -9.485 2216 1HB ALA 217 1HB ALA 217 13.825 5.495 -10.462 2217 2HB ALA 217 2HB ALA 217 12.914 4.291 -9.552 2218 3HB ALA 217 3HB ALA 217 13.120 4.109 -11.294 2219 HA PRO 218 HA PRO 218 16.309 1.175 -13.215 2220 1HB PRO 218 1HB PRO 218 14.005 0.462 -14.631 2221 2HB PRO 218 2HB PRO 218 14.755 -0.521 -13.362 2222 1HG PRO 218 1HG PRO 218 12.425 1.328 -13.208 2223 2HG PRO 218 2HG PRO 218 12.680 -0.235 -12.416 2224 1HD PRO 218 1HD PRO 218 12.949 2.084 -11.090 2225 2HD PRO 218 2HD PRO 218 13.986 0.682 -10.747 2226 H ALA 219 H ALA 219 13.455 3.251 -13.808 2227 HA ALA 219 HA ALA 219 13.083 4.900 -15.459 2228 1HB ALA 219 1HB ALA 219 16.011 4.943 -14.762 2229 2HB ALA 219 2HB ALA 219 14.767 6.138 -14.396 2230 3HB ALA 219 3HB ALA 219 15.417 6.015 -16.031 2231 H THR 220 H THR 220 12.445 3.197 -17.040 2232 HA THR 220 HA THR 220 14.552 2.491 -19.032 2233 HB THR 220 HB THR 220 13.180 0.696 -18.042 2234 HG1 THR 220 HG1 THR 220 12.355 1.238 -20.698 2235 1HG2 THR 220 1HG2 THR 220 11.160 1.663 -17.384 2236 2HG2 THR 220 2HG2 THR 220 10.670 0.784 -18.832 2237 3HG2 THR 220 3HG2 THR 220 10.958 2.522 -18.911 2238 H GLY 221 H GLY 221 13.981 2.728 -21.344 2239 1HA GLY 221 1HA GLY 221 12.976 3.823 -23.180 2240 2HA GLY 221 2HA GLY 221 11.707 4.392 -22.095 2241 1HN SAH 301 1HN SAH 301 -11.266 -0.988 -6.774 2242 2HN SAH 301 2HN SAH 301 -9.822 -0.219 -7.236 2243 HA SAH 301 HA SAH 301 -12.481 1.042 -7.632 2244 1HB SAH 301 1HB SAH 301 -11.455 0.272 -5.219 2245 2HB SAH 301 2HB SAH 301 -10.705 1.858 -5.398 2246 1HG SAH 301 1HG SAH 301 -13.180 1.524 -4.365 2247 2HG SAH 301 2HG SAH 301 -13.596 1.685 -6.072 2248 1H5* SAH 301 1H5* SAH 301 -14.934 3.259 -4.824 2249 2H5* SAH 301 2H5* SAH 301 -14.445 4.817 -4.157 2250 H4* SAH 301 H4* SAH 301 -13.999 5.306 -6.706 2251 H3* SAH 301 H3* SAH 301 -16.087 5.806 -4.763 2252 *HO3 SAH 301 *HO3 SAH 301 -14.606 7.081 -6.628 2253 H2* SAH 301 H2* SAH 301 -17.934 5.236 -5.892 2254 *HO2 SAH 301 *HO2 SAH 301 -18.470 6.717 -7.258 2255 H1* SAH 301 H1* SAH 301 -16.857 4.449 -8.460 2256 H8 SAH 301 H8 SAH 301 -16.559 1.829 -5.835 2257 1HN6 SAH 301 1HN6 SAH 301 -20.909 -0.799 -8.330 2258 2HN6 SAH 301 2HN6 SAH 301 -21.459 -0.269 -6.757 2259 H2 SAH 301 H2 SAH 301 -21.364 3.844 -9.543 2260 1HN SAH 302 1HN SAH 302 11.213 -0.983 6.757 2261 2HN SAH 302 2HN SAH 302 9.767 -0.216 7.211 2262 HA SAH 302 HA SAH 302 12.425 1.039 7.625 2263 1HB SAH 302 1HB SAH 302 11.413 0.270 5.206 2264 2HB SAH 302 2HB SAH 302 10.664 1.858 5.378 2265 1HG SAH 302 1HG SAH 302 13.145 1.517 4.361 2266 2HG SAH 302 2HG SAH 302 13.551 1.679 6.070 2267 1H5* SAH 302 1H5* SAH 302 14.900 3.248 4.832 2268 2H5* SAH 302 2H5* SAH 302 14.419 4.806 4.160 2269 H4* SAH 302 H4* SAH 302 13.956 5.300 6.705 2270 H3* SAH 302 H3* SAH 302 16.058 5.794 4.776 2271 *HO3 SAH 302 *HO3 SAH 302 14.568 7.073 6.630 2272 H2* SAH 302 H2* SAH 302 17.895 5.222 5.918 2273 *HO2 SAH 302 *HO2 SAH 302 18.426 6.702 7.286 2274 H1* SAH 302 H1* SAH 302 16.801 4.438 8.479 2275 H8 SAH 302 H8 SAH 302 16.514 1.815 5.853 2276 1HN6 SAH 302 1HN6 SAH 302 20.842 -0.818 8.380 2277 2HN6 SAH 302 2HN6 SAH 302 21.404 -0.290 6.810 2278 H2 SAH 302 H2 SAH 302 21.299 3.825 9.593 Start of MODEL 11 1 1H MET 1 1H MET 1 1.295 -9.372 -4.491 2 2H MET 1 2H MET 1 0.753 -10.523 -5.616 3 3H MET 1 3H MET 1 0.783 -10.902 -3.961 4 HA MET 1 HA MET 1 -0.969 -9.363 -3.486 5 1HB MET 1 1HB MET 1 0.188 -8.049 -5.598 6 2HB MET 1 2HB MET 1 -1.296 -8.642 -6.342 7 1HG MET 1 1HG MET 1 -1.848 -6.509 -5.416 8 2HG MET 1 2HG MET 1 -2.527 -7.700 -4.307 9 1HE MET 1 1HE MET 1 -2.683 -5.380 -3.206 10 2HE MET 1 2HE MET 1 -1.360 -4.348 -3.749 11 3HE MET 1 3HE MET 1 -1.494 -4.787 -2.046 12 H PHE 2 H PHE 2 -0.496 -12.157 -4.725 13 HA PHE 2 HA PHE 2 -3.355 -12.702 -5.263 14 1HB PHE 2 1HB PHE 2 -2.595 -13.996 -7.363 15 2HB PHE 2 2HB PHE 2 -2.609 -12.239 -7.484 16 HD1 PHE 2 HD1 PHE 2 -0.499 -10.951 -7.371 17 HD2 PHE 2 HD2 PHE 2 -0.519 -15.246 -7.390 18 HE1 PHE 2 HE1 PHE 2 1.916 -10.958 -7.926 19 HE2 PHE 2 HE2 PHE 2 1.899 -15.253 -7.944 20 HZ PHE 2 HZ PHE 2 3.115 -13.107 -8.212 21 H ASN 3 H ASN 3 -2.747 -13.703 -3.063 22 HA ASN 3 HA ASN 3 -2.066 -16.532 -3.518 23 1HB ASN 3 1HB ASN 3 -0.261 -14.506 -2.309 24 2HB ASN 3 2HB ASN 3 -0.361 -16.043 -1.450 25 1HD2 ASN 3 1HD2 ASN 3 0.509 -17.936 -2.495 26 2HD2 ASN 3 2HD2 ASN 3 1.382 -17.854 -3.948 27 H ASP 4 H ASP 4 -1.734 -14.736 -0.492 28 HA ASP 4 HA ASP 4 -2.995 -16.399 1.252 29 1HB ASP 4 1HB ASP 4 -1.880 -14.077 1.516 30 2HB ASP 4 2HB ASP 4 -3.503 -13.419 1.306 31 H ARG 5 H ARG 5 -4.791 -17.460 0.139 32 HA ARG 5 HA ARG 5 -7.067 -17.751 -0.441 33 1HB ARG 5 1HB ARG 5 -7.065 -15.910 1.975 34 2HB ARG 5 2HB ARG 5 -8.473 -16.820 1.435 35 1HG ARG 5 1HG ARG 5 -6.640 -18.812 1.514 36 2HG ARG 5 2HG ARG 5 -6.008 -17.769 2.789 37 1HD ARG 5 1HD ARG 5 -7.944 -17.984 4.100 38 2HD ARG 5 2HD ARG 5 -8.951 -18.429 2.708 39 HE ARG 5 HE ARG 5 -6.807 -20.333 3.072 40 1HH1 ARG 5 1HH1 ARG 5 -9.890 -19.342 4.350 41 2HH1 ARG 5 2HH1 ARG 5 -10.263 -20.915 4.966 42 1HH2 ARG 5 1HH2 ARG 5 -7.313 -22.363 3.879 43 2HH2 ARG 5 2HH2 ARG 5 -8.815 -22.614 4.702 44 H VAL 6 H VAL 6 -5.721 -15.112 -1.596 45 HA VAL 6 HA VAL 6 -8.266 -14.013 -2.609 46 HB VAL 6 HB VAL 6 -6.371 -12.522 -0.755 47 1HG1 VAL 6 1HG1 VAL 6 -7.688 -10.480 -1.254 48 2HG1 VAL 6 2HG1 VAL 6 -8.565 -11.361 -2.505 49 3HG1 VAL 6 3HG1 VAL 6 -6.836 -11.063 -2.684 50 1HG2 VAL 6 1HG2 VAL 6 -9.328 -13.164 -0.733 51 2HG2 VAL 6 2HG2 VAL 6 -8.613 -11.946 0.327 52 3HG2 VAL 6 3HG2 VAL 6 -8.106 -13.631 0.454 53 H ILE 7 H ILE 7 -7.940 -12.580 -4.414 54 HA ILE 7 HA ILE 7 -5.149 -12.189 -5.357 55 HB ILE 7 HB ILE 7 -5.933 -14.318 -6.303 56 1HG1 ILE 7 1HG1 ILE 7 -6.097 -12.198 -8.452 57 2HG1 ILE 7 2HG1 ILE 7 -4.581 -12.634 -7.666 58 1HG2 ILE 7 1HG2 ILE 7 -8.410 -13.352 -6.158 59 2HG2 ILE 7 2HG2 ILE 7 -7.982 -14.599 -7.329 60 3HG2 ILE 7 3HG2 ILE 7 -8.079 -12.912 -7.833 61 1HD1 ILE 7 1HD1 ILE 7 -5.707 -13.913 -9.871 62 2HD1 ILE 7 2HD1 ILE 7 -6.085 -14.982 -8.521 63 3HD1 ILE 7 3HD1 ILE 7 -4.410 -14.544 -8.855 64 H VAL 8 H VAL 8 -4.921 -10.274 -6.546 65 HA VAL 8 HA VAL 8 -7.220 -8.435 -6.433 66 HB VAL 8 HB VAL 8 -4.929 -7.820 -5.698 67 1HG1 VAL 8 1HG1 VAL 8 -4.169 -9.200 -8.009 68 2HG1 VAL 8 2HG1 VAL 8 -3.105 -8.281 -6.945 69 3HG1 VAL 8 3HG1 VAL 8 -3.806 -7.512 -8.368 70 1HG2 VAL 8 1HG2 VAL 8 -6.060 -6.377 -8.105 71 2HG2 VAL 8 2HG2 VAL 8 -4.698 -5.744 -7.179 72 3HG2 VAL 8 3HG2 VAL 8 -6.266 -5.968 -6.402 73 H LYS 9 H LYS 9 -8.387 -7.757 -8.183 74 HA LYS 9 HA LYS 9 -7.354 -8.316 -10.914 75 1HB LYS 9 1HB LYS 9 -9.936 -9.236 -9.656 76 2HB LYS 9 2HB LYS 9 -9.711 -9.195 -11.404 77 1HG LYS 9 1HG LYS 9 -7.487 -10.482 -10.863 78 2HG LYS 9 2HG LYS 9 -8.294 -10.869 -9.353 79 1HD LYS 9 1HD LYS 9 -9.896 -12.181 -10.395 80 2HD LYS 9 2HD LYS 9 -9.806 -11.271 -11.898 81 1HE LYS 9 1HE LYS 9 -7.809 -12.370 -12.574 82 2HE LYS 9 2HE LYS 9 -7.495 -12.970 -10.935 83 1HZ LYS 9 1HZ LYS 9 -8.477 -14.748 -12.149 84 2HZ LYS 9 2HZ LYS 9 -9.708 -13.750 -12.760 85 3HZ LYS 9 3HZ LYS 9 -9.681 -14.152 -11.110 86 H LYS 10 H LYS 10 -9.081 -5.295 -11.907 87 HA LYS 10 HA LYS 10 -7.971 -6.166 -13.758 88 1HB LYS 10 1HB LYS 10 -6.355 -6.467 -11.412 89 2HB LYS 10 2HB LYS 10 -6.075 -7.859 -12.459 90 1HG LYS 10 1HG LYS 10 -6.046 -5.003 -13.467 91 2HG LYS 10 2HG LYS 10 -4.594 -5.844 -12.923 92 1HD LYS 10 1HD LYS 10 -6.441 -6.765 -15.147 93 2HD LYS 10 2HD LYS 10 -4.849 -6.040 -15.368 94 1HE LYS 10 1HE LYS 10 -4.079 -7.998 -13.750 95 2HE LYS 10 2HE LYS 10 -5.561 -8.771 -14.345 96 1HZ LYS 10 1HZ LYS 10 -3.645 -7.438 -16.171 97 2HZ LYS 10 2HZ LYS 10 -4.857 -8.564 -16.556 98 3HZ LYS 10 3HZ LYS 10 -3.458 -9.069 -15.736 99 H SER 11 H SER 11 -10.253 -7.427 -13.508 100 HA SER 11 HA SER 11 -9.681 -10.367 -13.606 101 1HB SER 11 1HB SER 11 -12.358 -10.209 -13.400 102 2HB SER 11 2HB SER 11 -11.327 -10.085 -11.977 103 HG SER 11 HG SER 11 -11.682 -7.988 -11.865 104 HA PRO 12 HA PRO 12 -10.987 -10.522 -17.793 105 1HB PRO 12 1HB PRO 12 -13.166 -12.440 -17.420 106 2HB PRO 12 2HB PRO 12 -11.565 -12.712 -18.126 107 1HG PRO 12 1HG PRO 12 -12.376 -13.725 -15.725 108 2HG PRO 12 2HG PRO 12 -10.689 -13.425 -16.157 109 1HD PRO 12 1HD PRO 12 -12.503 -11.848 -14.409 110 2HD PRO 12 2HD PRO 12 -10.751 -12.112 -14.282 111 H LEU 13 H LEU 13 -13.524 -10.022 -15.444 112 HA LEU 13 HA LEU 13 -14.918 -8.240 -17.378 113 1HB LEU 13 1HB LEU 13 -15.738 -10.865 -16.669 114 2HB LEU 13 2HB LEU 13 -16.821 -9.765 -15.816 115 HG LEU 13 HG LEU 13 -16.216 -9.145 -18.671 116 1HD1 LEU 13 1HD1 LEU 13 -18.502 -10.813 -18.674 117 2HD1 LEU 13 2HD1 LEU 13 -17.244 -11.702 -17.814 118 3HD1 LEU 13 3HD1 LEU 13 -16.952 -11.124 -19.454 119 1HD2 LEU 13 1HD2 LEU 13 -17.678 -7.746 -17.184 120 2HD2 LEU 13 2HD2 LEU 13 -18.783 -9.115 -17.057 121 3HD2 LEU 13 3HD2 LEU 13 -18.509 -8.344 -18.619 122 H GLY 14 H GLY 14 -13.268 -7.970 -14.843 123 1HA GLY 14 1HA GLY 14 -15.301 -6.414 -13.295 124 2HA GLY 14 2HA GLY 14 -14.135 -7.440 -12.460 125 H GLY 15 H GLY 15 -14.149 -4.780 -11.815 126 1HA GLY 15 1HA GLY 15 -12.053 -3.437 -13.418 127 2HA GLY 15 2HA GLY 15 -12.960 -2.710 -12.092 128 H TYR 16 H TYR 16 -11.133 -2.038 -10.888 129 HA TYR 16 HA TYR 16 -9.118 -4.088 -10.140 130 1HB TYR 16 1HB TYR 16 -9.221 -1.263 -10.573 131 2HB TYR 16 2HB TYR 16 -8.710 -1.531 -8.911 132 HD1 TYR 16 HD1 TYR 16 -7.215 -4.003 -8.995 133 HD2 TYR 16 HD2 TYR 16 -7.313 -0.802 -11.859 134 HE1 TYR 16 HE1 TYR 16 -4.954 -4.642 -9.786 135 HE2 TYR 16 HE2 TYR 16 -5.050 -1.442 -12.650 136 HH TYR 16 HH TYR 16 -3.114 -2.635 -11.909 137 H GLY 17 H GLY 17 -11.070 -5.124 -8.915 138 1HA GLY 17 1HA GLY 17 -11.244 -3.935 -6.174 139 2HA GLY 17 2HA GLY 17 -12.522 -4.925 -6.883 140 H VAL 18 H VAL 18 -12.177 -6.287 -4.876 141 HA VAL 18 HA VAL 18 -9.670 -7.907 -4.966 142 HB VAL 18 HB VAL 18 -11.954 -7.683 -2.970 143 1HG1 VAL 18 1HG1 VAL 18 -10.716 -9.080 -1.521 144 2HG1 VAL 18 2HG1 VAL 18 -9.244 -8.912 -2.478 145 3HG1 VAL 18 3HG1 VAL 18 -10.587 -9.878 -3.089 146 1HG2 VAL 18 1HG2 VAL 18 -10.597 -5.634 -3.164 147 2HG2 VAL 18 2HG2 VAL 18 -9.128 -6.580 -2.925 148 3HG2 VAL 18 3HG2 VAL 18 -10.306 -6.435 -1.620 149 H PHE 19 H PHE 19 -9.733 -10.068 -5.569 150 HA PHE 19 HA PHE 19 -12.381 -11.141 -6.443 151 1HB PHE 19 1HB PHE 19 -9.765 -11.078 -7.533 152 2HB PHE 19 2HB PHE 19 -10.076 -12.758 -7.100 153 HD1 PHE 19 HD1 PHE 19 -11.264 -14.107 -8.583 154 HD2 PHE 19 HD2 PHE 19 -11.767 -9.846 -8.748 155 HE1 PHE 19 HE1 PHE 19 -12.728 -14.358 -10.570 156 HE2 PHE 19 HE2 PHE 19 -13.234 -10.096 -10.733 157 HZ PHE 19 HZ PHE 19 -13.711 -12.352 -11.647 158 H ALA 20 H ALA 20 -13.311 -12.704 -5.210 159 HA ALA 20 HA ALA 20 -11.862 -13.752 -2.868 160 1HB ALA 20 1HB ALA 20 -13.985 -13.778 -2.051 161 2HB ALA 20 2HB ALA 20 -14.548 -14.783 -3.388 162 3HB ALA 20 3HB ALA 20 -14.489 -13.028 -3.566 163 H ARG 21 H ARG 21 -10.413 -15.339 -3.620 164 HA ARG 21 HA ARG 21 -11.208 -17.438 -5.495 165 1HB ARG 21 1HB ARG 21 -8.859 -16.351 -4.650 166 2HB ARG 21 2HB ARG 21 -8.918 -17.779 -3.617 167 1HG ARG 21 1HG ARG 21 -8.977 -19.254 -5.471 168 2HG ARG 21 2HG ARG 21 -9.420 -17.964 -6.589 169 1HD ARG 21 1HD ARG 21 -7.060 -16.981 -5.666 170 2HD ARG 21 2HD ARG 21 -6.741 -18.722 -5.552 171 HE ARG 21 HE ARG 21 -8.048 -18.165 -8.041 172 1HH1 ARG 21 1HH1 ARG 21 -5.008 -17.715 -6.406 173 2HH1 ARG 21 2HH1 ARG 21 -4.095 -17.700 -7.874 174 1HH2 ARG 21 1HH2 ARG 21 -6.839 -18.143 -9.935 175 2HH2 ARG 21 2HH2 ARG 21 -5.121 -17.940 -9.858 176 H LYS 22 H LYS 22 -11.485 -16.869 -2.085 177 HA LYS 22 HA LYS 22 -11.971 -19.737 -1.469 178 1HB LYS 22 1HB LYS 22 -11.086 -17.308 -0.130 179 2HB LYS 22 2HB LYS 22 -12.407 -18.053 0.762 180 1HG LYS 22 1HG LYS 22 -10.656 -19.262 1.655 181 2HG LYS 22 2HG LYS 22 -10.975 -20.265 0.240 182 1HD LYS 22 1HD LYS 22 -9.098 -17.935 -0.001 183 2HD LYS 22 2HD LYS 22 -8.522 -19.435 0.725 184 1HE LYS 22 1HE LYS 22 -10.039 -19.634 -1.846 185 2HE LYS 22 2HE LYS 22 -8.369 -19.044 -1.913 186 1HZ LYS 22 1HZ LYS 22 -8.467 -21.479 -2.009 187 2HZ LYS 22 2HZ LYS 22 -9.277 -21.512 -0.516 188 3HZ LYS 22 3HZ LYS 22 -7.677 -20.950 -0.601 189 H SER 23 H SER 23 -15.475 -19.112 -0.438 190 HA SER 23 HA SER 23 -12.906 -20.471 0.240 191 1HB SER 23 1HB SER 23 -14.988 -21.720 -0.480 192 2HB SER 23 2HB SER 23 -14.396 -22.193 1.114 193 HG SER 23 HG SER 23 -16.773 -21.506 0.644 194 H PHE 24 H PHE 24 -15.379 -18.337 1.497 195 HA PHE 24 HA PHE 24 -13.906 -18.254 4.112 196 1HB PHE 24 1HB PHE 24 -15.387 -16.169 2.472 197 2HB PHE 24 2HB PHE 24 -14.782 -15.865 4.100 198 HD1 PHE 24 HD1 PHE 24 -12.220 -17.192 4.199 199 HD2 PHE 24 HD2 PHE 24 -14.022 -15.036 0.951 200 HE1 PHE 24 HE1 PHE 24 -9.972 -16.706 3.274 201 HE2 PHE 24 HE2 PHE 24 -11.774 -14.549 0.026 202 HZ PHE 24 HZ PHE 24 -9.751 -15.385 1.189 203 H GLU 25 H GLU 25 -15.235 -17.721 6.000 204 HA GLU 25 HA GLU 25 -17.979 -18.879 5.803 205 1HB GLU 25 1HB GLU 25 -15.911 -19.505 7.403 206 2HB GLU 25 2HB GLU 25 -16.599 -18.209 8.374 207 1HG GLU 25 1HG GLU 25 -18.780 -19.789 7.518 208 2HG GLU 25 2HG GLU 25 -17.535 -20.911 8.061 209 H LYS 26 H LYS 26 -18.955 -17.693 8.206 210 HA LYS 26 HA LYS 26 -19.476 -14.928 7.233 211 1HB LYS 26 1HB LYS 26 -21.246 -16.706 7.839 212 2HB LYS 26 2HB LYS 26 -20.788 -16.425 9.514 213 1HG LYS 26 1HG LYS 26 -21.288 -14.007 9.228 214 2HG LYS 26 2HG LYS 26 -21.806 -14.330 7.575 215 1HD LYS 26 1HD LYS 26 -23.590 -15.785 8.365 216 2HD LYS 26 2HD LYS 26 -23.025 -15.629 10.028 217 1HE LYS 26 1HE LYS 26 -23.393 -12.989 8.960 218 2HE LYS 26 2HE LYS 26 -24.864 -13.934 8.657 219 1HZ LYS 26 1HZ LYS 26 -23.414 -13.720 11.248 220 2HZ LYS 26 2HZ LYS 26 -24.776 -14.696 10.970 221 3HZ LYS 26 3HZ LYS 26 -24.911 -13.005 10.887 222 H GLY 27 H GLY 27 -17.420 -14.022 7.981 223 1HA GLY 27 1HA GLY 27 -16.732 -12.455 9.751 224 2HA GLY 27 2HA GLY 27 -17.389 -13.584 10.935 225 H GLU 28 H GLU 28 -14.800 -13.203 8.523 226 HA GLU 28 HA GLU 28 -12.966 -14.706 10.296 227 1HB GLU 28 1HB GLU 28 -14.408 -15.849 8.089 228 2HB GLU 28 2HB GLU 28 -12.699 -15.794 7.658 229 1HG GLU 28 1HG GLU 28 -12.240 -16.810 9.965 230 2HG GLU 28 2HG GLU 28 -13.972 -17.123 10.059 231 H LEU 29 H LEU 29 -10.859 -13.951 10.032 232 HA LEU 29 HA LEU 29 -10.270 -11.573 8.624 233 1HB LEU 29 1HB LEU 29 -9.002 -13.418 10.316 234 2HB LEU 29 2HB LEU 29 -8.025 -13.434 8.863 235 HG LEU 29 HG LEU 29 -8.656 -11.077 10.637 236 1HD1 LEU 29 1HD1 LEU 29 -5.935 -11.537 9.649 237 2HD1 LEU 29 2HD1 LEU 29 -6.572 -12.876 10.604 238 3HD1 LEU 29 3HD1 LEU 29 -6.502 -11.255 11.295 239 1HD2 LEU 29 1HD2 LEU 29 -7.580 -11.102 7.808 240 2HD2 LEU 29 2HD2 LEU 29 -7.293 -9.762 8.918 241 3HD2 LEU 29 3HD2 LEU 29 -8.939 -10.170 8.438 242 H VAL 30 H VAL 30 -9.095 -11.252 6.600 243 HA VAL 30 HA VAL 30 -9.022 -13.633 4.785 244 HB VAL 30 HB VAL 30 -10.276 -10.905 4.285 245 1HG1 VAL 30 1HG1 VAL 30 -10.762 -11.661 2.048 246 2HG1 VAL 30 2HG1 VAL 30 -10.136 -13.272 2.400 247 3HG1 VAL 30 3HG1 VAL 30 -9.034 -11.897 2.313 248 1HG2 VAL 30 1HG2 VAL 30 -12.085 -12.950 3.702 249 2HG2 VAL 30 2HG2 VAL 30 -12.098 -11.926 5.138 250 3HG2 VAL 30 3HG2 VAL 30 -11.284 -13.490 5.177 251 H GLU 31 H GLU 31 -8.220 -10.159 5.065 252 HA GLU 31 HA GLU 31 -5.433 -10.689 4.318 253 1HB GLU 31 1HB GLU 31 -6.732 -10.706 2.168 254 2HB GLU 31 2HB GLU 31 -7.269 -9.063 2.518 255 1HG GLU 31 1HG GLU 31 -5.414 -8.530 1.273 256 2HG GLU 31 2HG GLU 31 -4.611 -8.726 2.831 257 H GLU 32 H GLU 32 -4.427 -9.364 5.783 258 HA GLU 32 HA GLU 32 -5.568 -6.624 6.183 259 1HB GLU 32 1HB GLU 32 -4.966 -6.873 8.523 260 2HB GLU 32 2HB GLU 32 -5.883 -8.295 8.048 261 1HG GLU 32 1HG GLU 32 -3.679 -9.460 7.615 262 2HG GLU 32 2HG GLU 32 -2.877 -8.075 8.354 263 H CYS 33 H CYS 33 -4.032 -4.921 6.237 264 HA CYS 33 HA CYS 33 -1.158 -5.681 5.893 265 1HB CYS 33 1HB CYS 33 -2.808 -3.792 4.174 266 2HB CYS 33 2HB CYS 33 -1.089 -4.118 3.962 267 HG CYS 33 HG CYS 33 -3.288 -6.313 3.569 268 H LEU 34 H LEU 34 -0.234 -3.082 5.370 269 HA LEU 34 HA LEU 34 -0.544 -1.837 8.045 270 1HB LEU 34 1HB LEU 34 1.426 -1.999 5.847 271 2HB LEU 34 2HB LEU 34 1.351 -0.428 6.643 272 HG LEU 34 HG LEU 34 2.986 -1.988 7.708 273 1HD1 LEU 34 1HD1 LEU 34 1.479 -1.874 10.023 274 2HD1 LEU 34 2HD1 LEU 34 0.763 -0.612 9.020 275 3HD1 LEU 34 3HD1 LEU 34 2.486 -0.570 9.393 276 1HD2 LEU 34 1HD2 LEU 34 2.369 -4.017 8.663 277 2HD2 LEU 34 2HD2 LEU 34 1.332 -3.983 7.237 278 3HD2 LEU 34 3HD2 LEU 34 0.677 -3.543 8.814 279 H CYS 35 H CYS 35 -0.335 0.737 7.842 280 HA CYS 35 HA CYS 35 -1.876 1.830 5.558 281 1HB CYS 35 1HB CYS 35 -2.838 1.469 8.373 282 2HB CYS 35 2HB CYS 35 -3.322 2.935 7.526 283 HG CYS 35 HG CYS 35 -4.800 0.527 7.139 284 H ILE 36 H ILE 36 -1.827 4.217 5.559 285 HA ILE 36 HA ILE 36 0.531 5.270 7.084 286 HB ILE 36 HB ILE 36 -0.898 6.393 4.646 287 1HG1 ILE 36 1HG1 ILE 36 1.633 4.724 4.724 288 2HG1 ILE 36 2HG1 ILE 36 0.052 4.101 4.251 289 1HG2 ILE 36 1HG2 ILE 36 1.548 7.359 4.423 290 2HG2 ILE 36 2HG2 ILE 36 1.605 7.055 6.159 291 3HG2 ILE 36 3HG2 ILE 36 0.384 8.139 5.493 292 1HD1 ILE 36 1HD1 ILE 36 1.802 5.103 2.463 293 2HD1 ILE 36 2HD1 ILE 36 0.961 6.590 2.898 294 3HD1 ILE 36 3HD1 ILE 36 0.056 5.224 2.248 295 H VAL 37 H VAL 37 -0.275 6.176 8.980 296 HA VAL 37 HA VAL 37 -2.875 7.569 8.969 297 HB VAL 37 HB VAL 37 -0.754 7.010 11.074 298 1HG1 VAL 37 1HG1 VAL 37 -2.833 8.914 11.146 299 2HG1 VAL 37 2HG1 VAL 37 -1.885 8.325 12.512 300 3HG1 VAL 37 3HG1 VAL 37 -3.410 7.543 12.094 301 1HG2 VAL 37 1HG2 VAL 37 -2.779 5.510 11.849 302 2HG2 VAL 37 2HG2 VAL 37 -1.705 4.941 10.571 303 3HG2 VAL 37 3HG2 VAL 37 -3.268 5.647 10.159 304 H ARG 38 H ARG 38 -3.008 9.717 8.502 305 HA ARG 38 HA ARG 38 -0.746 11.503 9.289 306 1HB ARG 38 1HB ARG 38 -0.645 10.737 6.869 307 2HB ARG 38 2HB ARG 38 -2.186 11.555 6.617 308 1HG ARG 38 1HG ARG 38 -0.534 13.141 5.969 309 2HG ARG 38 2HG ARG 38 -1.044 13.647 7.580 310 1HD ARG 38 1HD ARG 38 0.938 12.859 8.587 311 2HD ARG 38 2HD ARG 38 1.301 11.771 7.234 312 HE ARG 38 HE ARG 38 1.241 14.296 6.076 313 1HH1 ARG 38 1HH1 ARG 38 2.950 12.834 8.733 314 2HH1 ARG 38 2HH1 ARG 38 4.335 13.852 8.546 315 1HH2 ARG 38 1HH2 ARG 38 3.052 15.606 5.854 316 2HH2 ARG 38 2HH2 ARG 38 4.395 15.410 6.930 317 H HIS 39 H HIS 39 -1.424 13.643 9.796 318 HA HIS 39 HA HIS 39 -4.070 13.981 10.817 319 1HB HIS 39 1HB HIS 39 -1.663 15.675 10.234 320 2HB HIS 39 2HB HIS 39 -3.171 16.492 10.645 321 HD1 HIS 39 HD1 HIS 39 -1.171 16.912 12.737 322 HD2 HIS 39 HD2 HIS 39 -3.430 13.409 12.661 323 HE1 HIS 39 HE1 HIS 39 -1.092 15.957 15.082 324 H ASN 40 H ASN 40 -5.144 16.298 10.000 325 HA ASN 40 HA ASN 40 -5.977 15.721 7.205 326 1HB ASN 40 1HB ASN 40 -7.466 16.076 9.327 327 2HB ASN 40 2HB ASN 40 -7.135 17.790 9.075 328 1HD2 ASN 40 1HD2 ASN 40 -8.695 14.935 7.641 329 2HD2 ASN 40 2HD2 ASN 40 -9.594 15.794 6.485 330 H ASP 41 H ASP 41 -4.842 16.814 5.661 331 HA ASP 41 HA ASP 41 -4.711 19.694 5.590 332 1HB ASP 41 1HB ASP 41 -2.957 18.695 7.363 333 2HB ASP 41 2HB ASP 41 -1.987 18.480 5.907 334 H ASP 42 H ASP 42 -1.973 19.416 4.139 335 HA ASP 42 HA ASP 42 -2.813 19.153 1.478 336 1HB ASP 42 1HB ASP 42 -0.398 18.727 1.053 337 2HB ASP 42 2HB ASP 42 -0.615 19.990 2.265 338 H TRP 43 H TRP 43 -2.144 16.675 3.846 339 HA TRP 43 HA TRP 43 -1.964 14.419 2.037 340 1HB TRP 43 1HB TRP 43 -1.049 14.220 4.226 341 2HB TRP 43 2HB TRP 43 -2.477 14.915 4.981 342 HD1 TRP 43 HD1 TRP 43 -4.424 13.335 5.624 343 HE1 TRP 43 HE1 TRP 43 -4.736 10.776 5.576 344 HE3 TRP 43 HE3 TRP 43 -0.384 11.999 2.801 345 HZ2 TRP 43 HZ2 TRP 43 -3.441 8.472 4.488 346 HZ3 TRP 43 HZ3 TRP 43 0.055 9.621 2.276 347 HH2 TRP 43 HH2 TRP 43 -1.469 7.854 3.114 348 H GLY 44 H GLY 44 -4.589 15.888 3.963 349 1HA GLY 44 1HA GLY 44 -6.634 14.036 3.309 350 2HA GLY 44 2HA GLY 44 -6.917 15.723 3.738 351 H THR 45 H THR 45 -5.202 16.646 1.456 352 HA THR 45 HA THR 45 -7.320 16.498 -0.617 353 HB THR 45 HB THR 45 -4.729 18.069 -0.362 354 HG1 THR 45 HG1 THR 45 -5.932 19.168 0.944 355 1HG2 THR 45 1HG2 THR 45 -6.771 19.170 -2.111 356 2HG2 THR 45 2HG2 THR 45 -6.281 17.560 -2.646 357 3HG2 THR 45 3HG2 THR 45 -5.074 18.835 -2.456 358 H ALA 46 H ALA 46 -3.728 16.294 -0.743 359 HA ALA 46 HA ALA 46 -3.460 15.131 -3.276 360 1HB ALA 46 1HB ALA 46 -1.738 15.913 -1.480 361 2HB ALA 46 2HB ALA 46 -1.277 14.570 -2.525 362 3HB ALA 46 3HB ALA 46 -1.832 14.258 -0.881 363 H LEU 47 H LEU 47 -3.534 13.301 -0.192 364 HA LEU 47 HA LEU 47 -4.293 10.849 -1.683 365 1HB LEU 47 1HB LEU 47 -3.410 11.549 1.126 366 2HB LEU 47 2HB LEU 47 -4.085 9.962 0.768 367 HG LEU 47 HG LEU 47 -1.652 9.860 0.596 368 1HD1 LEU 47 1HD1 LEU 47 -3.447 9.115 -1.425 369 2HD1 LEU 47 2HD1 LEU 47 -1.816 8.489 -1.184 370 3HD1 LEU 47 3HD1 LEU 47 -2.088 9.849 -2.275 371 1HD2 LEU 47 1HD2 LEU 47 -0.368 11.298 -0.785 372 2HD2 LEU 47 2HD2 LEU 47 -1.496 12.367 0.048 373 3HD2 LEU 47 3HD2 LEU 47 -1.798 11.898 -1.625 374 H GLU 48 H GLU 48 -6.243 12.962 -1.654 375 HA GLU 48 HA GLU 48 -8.162 12.672 0.456 376 1HB GLU 48 1HB GLU 48 -9.626 13.865 -1.181 377 2HB GLU 48 2HB GLU 48 -8.036 14.607 -1.044 378 1HG GLU 48 1HG GLU 48 -8.125 14.506 -3.324 379 2HG GLU 48 2HG GLU 48 -7.536 12.871 -3.049 380 H ASP 49 H ASP 49 -7.324 10.478 -2.019 381 HA ASP 49 HA ASP 49 -9.999 9.158 -1.830 382 1HB ASP 49 1HB ASP 49 -8.700 10.067 -4.040 383 2HB ASP 49 2HB ASP 49 -8.029 8.440 -3.949 384 H TYR 50 H TYR 50 -9.773 6.714 -2.046 385 HA TYR 50 HA TYR 50 -8.992 4.690 -1.097 386 1HB TYR 50 1HB TYR 50 -6.396 6.096 -1.831 387 2HB TYR 50 2HB TYR 50 -6.552 4.369 -1.516 388 HD1 TYR 50 HD1 TYR 50 -9.161 3.778 -2.836 389 HD2 TYR 50 HD2 TYR 50 -5.854 6.201 -4.125 390 HE1 TYR 50 HE1 TYR 50 -9.804 3.402 -5.197 391 HE2 TYR 50 HE2 TYR 50 -6.500 5.822 -6.488 392 HH TYR 50 HH TYR 50 -8.175 3.527 -7.587 393 H LEU 51 H LEU 51 -9.238 7.182 0.674 394 HA LEU 51 HA LEU 51 -7.268 6.379 2.790 395 1HB LEU 51 1HB LEU 51 -8.085 8.884 1.619 396 2HB LEU 51 2HB LEU 51 -8.504 8.894 3.327 397 HG LEU 51 HG LEU 51 -6.157 8.125 3.828 398 1HD1 LEU 51 1HD1 LEU 51 -5.828 8.703 0.872 399 2HD1 LEU 51 2HD1 LEU 51 -5.578 7.160 1.678 400 3HD1 LEU 51 3HD1 LEU 51 -4.483 8.506 1.996 401 1HD2 LEU 51 1HD2 LEU 51 -5.181 10.447 2.908 402 2HD2 LEU 51 2HD2 LEU 51 -6.324 10.381 4.250 403 3HD2 LEU 51 3HD2 LEU 51 -6.895 10.749 2.622 404 H PHE 52 H PHE 52 -8.145 5.426 4.570 405 HA PHE 52 HA PHE 52 -11.080 5.508 5.009 406 1HB PHE 52 1HB PHE 52 -8.703 4.034 6.182 407 2HB PHE 52 2HB PHE 52 -10.295 3.947 6.935 408 HD1 PHE 52 HD1 PHE 52 -8.452 3.339 3.754 409 HD2 PHE 52 HD2 PHE 52 -12.005 2.562 6.040 410 HE1 PHE 52 HE1 PHE 52 -9.139 1.622 2.104 411 HE2 PHE 52 HE2 PHE 52 -12.692 0.844 4.389 412 HZ PHE 52 HZ PHE 52 -11.258 0.374 2.420 413 H SER 53 H SER 53 -11.607 7.514 5.908 414 HA SER 53 HA SER 53 -9.750 8.789 7.789 415 1HB SER 53 1HB SER 53 -10.872 10.083 6.056 416 2HB SER 53 2HB SER 53 -12.443 9.543 6.633 417 HG SER 53 HG SER 53 -12.014 11.573 7.467 418 H ARG 54 H ARG 54 -9.849 8.390 9.941 419 HA ARG 54 HA ARG 54 -12.345 7.280 11.121 420 1HB ARG 54 1HB ARG 54 -9.902 6.390 11.382 421 2HB ARG 54 2HB ARG 54 -9.688 7.743 12.492 422 1HG ARG 54 1HG ARG 54 -10.925 6.747 14.113 423 2HG ARG 54 2HG ARG 54 -12.159 6.224 12.966 424 1HD ARG 54 1HD ARG 54 -9.934 4.659 12.312 425 2HD ARG 54 2HD ARG 54 -9.934 4.702 14.086 426 HE ARG 54 HE ARG 54 -11.941 3.419 12.427 427 1HH1 ARG 54 1HH1 ARG 54 -11.433 5.193 15.379 428 2HH1 ARG 54 2HH1 ARG 54 -12.821 4.512 16.155 429 1HH2 ARG 54 1HH2 ARG 54 -13.737 2.550 13.456 430 2HH2 ARG 54 2HH2 ARG 54 -14.116 3.028 15.077 431 H LYS 55 H LYS 55 -12.647 8.197 13.517 432 HA LYS 55 HA LYS 55 -13.119 11.059 13.235 433 1HB LYS 55 1HB LYS 55 -14.607 9.358 14.373 434 2HB LYS 55 2HB LYS 55 -13.393 9.220 15.644 435 1HG LYS 55 1HG LYS 55 -13.928 11.247 16.554 436 2HG LYS 55 2HG LYS 55 -14.230 11.984 14.981 437 1HD LYS 55 1HD LYS 55 -16.346 10.516 14.896 438 2HD LYS 55 2HD LYS 55 -16.081 10.246 16.619 439 1HE LYS 55 1HE LYS 55 -15.801 13.041 16.203 440 2HE LYS 55 2HE LYS 55 -17.265 12.541 15.334 441 1HZ LYS 55 1HZ LYS 55 -17.783 11.176 17.381 442 2HZ LYS 55 2HZ LYS 55 -17.924 12.858 17.566 443 3HZ LYS 55 3HZ LYS 55 -16.562 12.048 18.176 444 H ASN 56 H ASN 56 -10.834 11.688 13.008 445 HA ASN 56 HA ASN 56 -9.060 11.385 15.338 446 1HB ASN 56 1HB ASN 56 -10.637 13.194 15.961 447 2HB ASN 56 2HB ASN 56 -9.016 13.844 15.718 448 1HD2 ASN 56 1HD2 ASN 56 -9.139 15.792 14.601 449 2HD2 ASN 56 2HD2 ASN 56 -10.212 16.124 13.328 450 H MET 57 H MET 57 -9.189 10.991 12.269 451 HA MET 57 HA MET 57 -7.383 12.894 11.064 452 1HB MET 57 1HB MET 57 -5.329 11.474 11.186 453 2HB MET 57 2HB MET 57 -5.867 11.986 12.783 454 1HG MET 57 1HG MET 57 -7.124 9.486 11.924 455 2HG MET 57 2HG MET 57 -5.366 9.367 12.004 456 1HE MET 57 1HE MET 57 -4.063 9.128 14.585 457 2HE MET 57 2HE MET 57 -4.447 10.642 15.404 458 3HE MET 57 3HE MET 57 -4.121 10.635 13.671 459 H SER 58 H SER 58 -6.157 11.648 9.131 460 HA SER 58 HA SER 58 -8.112 9.700 7.946 461 1HB SER 58 1HB SER 58 -6.449 11.833 6.559 462 2HB SER 58 2HB SER 58 -7.711 10.843 5.825 463 HG SER 58 HG SER 58 -7.978 13.155 7.057 464 H ALA 59 H ALA 59 -7.170 7.847 7.022 465 HA ALA 59 HA ALA 59 -4.177 7.810 6.833 466 1HB ALA 59 1HB ALA 59 -4.538 5.365 7.683 467 2HB ALA 59 2HB ALA 59 -6.129 5.942 8.183 468 3HB ALA 59 3HB ALA 59 -4.674 6.678 8.853 469 H MET 60 H MET 60 -3.330 6.346 5.232 470 HA MET 60 HA MET 60 -5.190 5.812 2.997 471 1HB MET 60 1HB MET 60 -3.065 6.865 2.509 472 2HB MET 60 2HB MET 60 -2.188 5.645 3.427 473 1HG MET 60 1HG MET 60 -1.941 5.153 1.060 474 2HG MET 60 2HG MET 60 -2.972 3.919 1.784 475 1HE MET 60 1HE MET 60 -3.816 7.687 -0.158 476 2HE MET 60 2HE MET 60 -3.463 6.646 -1.537 477 3HE MET 60 3HE MET 60 -2.325 6.745 -0.193 478 H ALA 61 H ALA 61 -5.390 3.697 2.045 479 HA ALA 61 HA ALA 61 -5.280 1.508 4.016 480 1HB ALA 61 1HB ALA 61 -6.507 2.133 1.366 481 2HB ALA 61 2HB ALA 61 -7.250 1.433 2.804 482 3HB ALA 61 3HB ALA 61 -6.265 0.427 1.742 483 H LEU 62 H LEU 62 -3.023 1.012 4.183 484 HA LEU 62 HA LEU 62 -1.045 -0.120 3.576 485 1HB LEU 62 1HB LEU 62 -0.929 0.527 0.810 486 2HB LEU 62 2HB LEU 62 -1.719 1.885 1.611 487 HG LEU 62 HG LEU 62 0.184 1.723 3.349 488 1HD1 LEU 62 1HD1 LEU 62 2.090 0.730 1.438 489 2HD1 LEU 62 2HD1 LEU 62 0.835 -0.484 1.685 490 3HD1 LEU 62 3HD1 LEU 62 1.748 0.132 3.062 491 1HD2 LEU 62 1HD2 LEU 62 -0.097 3.444 1.476 492 2HD2 LEU 62 2HD2 LEU 62 1.051 2.477 0.552 493 3HD2 LEU 62 3HD2 LEU 62 1.546 3.214 2.075 494 H GLY 63 H GLY 63 -3.613 -1.561 3.297 495 1HA GLY 63 1HA GLY 63 -2.621 -3.724 1.565 496 2HA GLY 63 2HA GLY 63 -4.005 -3.822 2.651 497 H PHE 64 H PHE 64 -5.644 -4.450 1.290 498 HA PHE 64 HA PHE 64 -5.932 -3.198 -1.376 499 1HB PHE 64 1HB PHE 64 -7.497 -5.319 0.144 500 2HB PHE 64 2HB PHE 64 -7.741 -4.910 -1.553 501 HD1 PHE 64 HD1 PHE 64 -6.216 -5.656 -3.256 502 HD2 PHE 64 HD2 PHE 64 -5.346 -6.333 0.895 503 HE1 PHE 64 HE1 PHE 64 -4.380 -7.196 -3.892 504 HE2 PHE 64 HE2 PHE 64 -3.510 -7.873 0.260 505 HZ PHE 64 HZ PHE 64 -3.027 -8.305 -2.134 506 H GLY 65 H GLY 65 -6.497 -1.842 1.396 507 1HA GLY 65 1HA GLY 65 -9.300 -1.404 1.608 508 2HA GLY 65 2HA GLY 65 -8.068 -0.312 2.222 509 H ALA 66 H ALA 66 -6.973 -0.192 -0.658 510 HA ALA 66 HA ALA 66 -8.656 2.100 -1.465 511 1HB ALA 66 1HB ALA 66 -6.155 2.144 -1.338 512 2HB ALA 66 2HB ALA 66 -6.748 2.531 -2.953 513 3HB ALA 66 3HB ALA 66 -6.097 0.927 -2.613 514 H ILE 67 H ILE 67 -7.231 -0.694 -3.207 515 HA ILE 67 HA ILE 67 -8.670 -0.448 -5.598 516 HB ILE 67 HB ILE 67 -8.207 -2.930 -5.771 517 1HG1 ILE 67 1HG1 ILE 67 -6.612 -3.542 -3.674 518 2HG1 ILE 67 2HG1 ILE 67 -7.791 -2.521 -2.856 519 1HG2 ILE 67 1HG2 ILE 67 -6.130 -0.935 -4.911 520 2HG2 ILE 67 2HG2 ILE 67 -6.441 -1.593 -6.520 521 3HG2 ILE 67 3HG2 ILE 67 -5.667 -2.595 -5.289 522 1HD1 ILE 67 1HD1 ILE 67 -9.328 -4.137 -4.536 523 2HD1 ILE 67 2HD1 ILE 67 -9.144 -4.316 -2.790 524 3HD1 ILE 67 3HD1 ILE 67 -8.099 -5.222 -3.884 525 H PHE 68 H PHE 68 -9.903 -1.466 -2.500 526 HA PHE 68 HA PHE 68 -11.975 -3.211 -3.124 527 1HB PHE 68 1HB PHE 68 -11.392 -1.118 -1.127 528 2HB PHE 68 2HB PHE 68 -13.112 -1.439 -1.314 529 HD1 PHE 68 HD1 PHE 68 -12.998 -4.385 -2.018 530 HD2 PHE 68 HD2 PHE 68 -10.943 -2.090 0.967 531 HE1 PHE 68 HE1 PHE 68 -12.746 -6.420 -0.627 532 HE2 PHE 68 HE2 PHE 68 -10.688 -4.119 2.358 533 HZ PHE 68 HZ PHE 68 -11.589 -6.288 1.563 534 H ASN 69 H ASN 69 -14.109 -2.986 -3.911 535 HA ASN 69 HA ASN 69 -14.696 -0.370 -5.257 536 1HB ASN 69 1HB ASN 69 -15.372 -3.242 -5.996 537 2HB ASN 69 2HB ASN 69 -15.880 -1.827 -6.918 538 1HD2 ASN 69 1HD2 ASN 69 -14.242 -3.708 -8.215 539 2HD2 ASN 69 2HD2 ASN 69 -12.685 -3.059 -8.423 540 H HIS 70 H HIS 70 -17.155 -0.135 -5.649 541 HA HIS 70 HA HIS 70 -18.531 -0.634 -3.071 542 1HB HIS 70 1HB HIS 70 -18.452 1.612 -4.134 543 2HB HIS 70 2HB HIS 70 -19.273 0.961 -5.553 544 HD1 HIS 70 HD1 HIS 70 -19.863 2.078 -2.046 545 HD2 HIS 70 HD2 HIS 70 -22.039 0.268 -5.106 546 HE1 HIS 70 HE1 HIS 70 -22.299 2.200 -1.362 547 H SER 71 H SER 71 -20.529 -1.752 -2.945 548 HA SER 71 HA SER 71 -21.755 -2.909 -5.354 549 1HB SER 71 1HB SER 71 -19.922 -4.444 -5.054 550 2HB SER 71 2HB SER 71 -20.181 -4.509 -3.311 551 HG SER 71 HG SER 71 -21.209 -6.081 -5.138 552 H LYS 72 H LYS 72 -23.930 -3.109 -4.940 553 HA LYS 72 HA LYS 72 -25.185 -2.266 -2.574 554 1HB LYS 72 1HB LYS 72 -25.838 -3.746 -5.038 555 2HB LYS 72 2HB LYS 72 -26.919 -4.112 -3.695 556 1HG LYS 72 1HG LYS 72 -27.940 -2.239 -4.675 557 2HG LYS 72 2HG LYS 72 -26.992 -1.520 -3.373 558 1HD LYS 72 1HD LYS 72 -25.464 -0.583 -4.818 559 2HD LYS 72 2HD LYS 72 -25.635 -1.877 -6.004 560 1HE LYS 72 1HE LYS 72 -28.105 -0.319 -5.632 561 2HE LYS 72 2HE LYS 72 -26.751 0.636 -6.264 562 1HZ LYS 72 1HZ LYS 72 -27.604 -2.022 -7.298 563 2HZ LYS 72 2HZ LYS 72 -26.352 -1.060 -7.923 564 3HZ LYS 72 3HZ LYS 72 -27.963 -0.536 -8.038 565 H ASP 73 H ASP 73 -23.846 -5.424 -3.363 566 HA ASP 73 HA ASP 73 -24.820 -6.448 -0.716 567 1HB ASP 73 1HB ASP 73 -25.671 -7.538 -2.825 568 2HB ASP 73 2HB ASP 73 -24.007 -7.973 -3.217 569 HA PRO 74 HA PRO 74 -20.181 -6.040 -0.597 570 1HB PRO 74 1HB PRO 74 -20.169 -5.263 2.074 571 2HB PRO 74 2HB PRO 74 -20.181 -4.137 0.705 572 1HG PRO 74 1HG PRO 74 -22.414 -5.033 2.449 573 2HG PRO 74 2HG PRO 74 -22.122 -3.453 1.711 574 1HD PRO 74 1HD PRO 74 -23.949 -5.229 0.764 575 2HD PRO 74 2HD PRO 74 -23.103 -4.059 -0.271 576 H ASN 75 H ASN 75 -19.709 -8.246 -0.575 577 HA ASN 75 HA ASN 75 -20.751 -10.092 1.394 578 1HB ASN 75 1HB ASN 75 -18.451 -10.188 -0.592 579 2HB ASN 75 2HB ASN 75 -19.052 -11.592 0.290 580 1HD2 ASN 75 1HD2 ASN 75 -19.663 -12.511 -1.877 581 2HD2 ASN 75 2HD2 ASN 75 -21.089 -11.985 -2.631 582 H ALA 76 H ALA 76 -18.237 -7.762 1.527 583 HA ALA 76 HA ALA 76 -17.259 -8.977 4.059 584 1HB ALA 76 1HB ALA 76 -15.602 -9.814 2.652 585 2HB ALA 76 2HB ALA 76 -14.907 -8.236 3.022 586 3HB ALA 76 3HB ALA 76 -15.769 -8.485 1.504 587 H ARG 77 H ARG 77 -16.048 -7.404 5.377 588 HA ARG 77 HA ARG 77 -16.623 -4.552 4.638 589 1HB ARG 77 1HB ARG 77 -18.139 -5.635 6.368 590 2HB ARG 77 2HB ARG 77 -16.719 -5.825 7.396 591 1HG ARG 77 1HG ARG 77 -17.511 -3.781 8.159 592 2HG ARG 77 2HG ARG 77 -16.419 -3.238 6.885 593 1HD ARG 77 1HD ARG 77 -18.419 -3.292 5.302 594 2HD ARG 77 2HD ARG 77 -19.436 -3.523 6.737 595 HE ARG 77 HE ARG 77 -17.763 -1.384 7.384 596 1HH1 ARG 77 1HH1 ARG 77 -20.047 -2.110 4.860 597 2HH1 ARG 77 2HH1 ARG 77 -20.479 -0.452 4.623 598 1HH2 ARG 77 1HH2 ARG 77 -18.339 0.759 7.058 599 2HH2 ARG 77 2HH2 ARG 77 -19.520 1.162 5.857 600 H HIS 78 H HIS 78 -15.065 -3.013 5.509 601 HA HIS 78 HA HIS 78 -12.362 -4.172 5.794 602 1HB HIS 78 1HB HIS 78 -11.704 -1.801 5.509 603 2HB HIS 78 2HB HIS 78 -12.874 -2.271 4.276 604 HD1 HIS 78 HD1 HIS 78 -15.100 -1.050 4.246 605 HD2 HIS 78 HD2 HIS 78 -12.851 -0.178 7.646 606 HE1 HIS 78 HE1 HIS 78 -16.297 0.841 5.430 607 H GLU 79 H GLU 79 -11.218 -4.199 7.705 608 HA GLU 79 HA GLU 79 -12.513 -2.951 10.108 609 1HB GLU 79 1HB GLU 79 -12.277 -5.531 9.752 610 2HB GLU 79 2HB GLU 79 -10.572 -5.266 10.120 611 1HG GLU 79 1HG GLU 79 -11.047 -4.480 12.297 612 2HG GLU 79 2HG GLU 79 -12.745 -4.194 11.919 613 H LEU 80 H LEU 80 -10.886 -2.312 11.818 614 HA LEU 80 HA LEU 80 -8.315 -1.388 10.569 615 1HB LEU 80 1HB LEU 80 -10.369 -0.088 12.340 616 2HB LEU 80 2HB LEU 80 -8.701 0.467 12.416 617 HG LEU 80 HG LEU 80 -10.366 0.280 9.887 618 1HD1 LEU 80 1HD1 LEU 80 -9.846 2.458 11.861 619 2HD1 LEU 80 2HD1 LEU 80 -11.281 2.150 10.883 620 3HD1 LEU 80 3HD1 LEU 80 -9.858 2.894 10.152 621 1HD2 LEU 80 1HD2 LEU 80 -8.284 1.904 9.316 622 2HD2 LEU 80 2HD2 LEU 80 -8.239 0.161 9.049 623 3HD2 LEU 80 3HD2 LEU 80 -7.521 0.849 10.505 624 H THR 81 H THR 81 -6.535 -1.127 12.124 625 HA THR 81 HA THR 81 -6.805 -2.890 14.531 626 HB THR 81 HB THR 81 -4.705 -2.751 12.343 627 HG1 THR 81 HG1 THR 81 -6.197 -4.947 13.310 628 1HG2 THR 81 1HG2 THR 81 -3.429 -3.049 14.312 629 2HG2 THR 81 2HG2 THR 81 -3.672 -4.680 13.688 630 3HG2 THR 81 3HG2 THR 81 -4.646 -4.097 15.039 631 H ALA 82 H ALA 82 -6.319 -1.672 16.317 632 HA ALA 82 HA ALA 82 -5.344 0.002 17.669 633 1HB ALA 82 1HB ALA 82 -2.864 0.351 16.372 634 2HB ALA 82 2HB ALA 82 -3.352 -1.300 15.992 635 3HB ALA 82 3HB ALA 82 -3.214 -0.786 17.673 636 H GLY 83 H GLY 83 -7.068 1.337 16.260 637 1HA GLY 83 1HA GLY 83 -7.494 3.520 15.475 638 2HA GLY 83 2HA GLY 83 -5.764 3.845 15.584 639 H LEU 84 H LEU 84 -4.857 4.252 13.632 640 HA LEU 84 HA LEU 84 -6.041 2.918 11.216 641 1HB LEU 84 1HB LEU 84 -4.747 5.630 11.666 642 2HB LEU 84 2HB LEU 84 -5.149 5.005 10.067 643 HG LEU 84 HG LEU 84 -7.204 5.171 12.273 644 1HD1 LEU 84 1HD1 LEU 84 -6.010 7.411 11.539 645 2HD1 LEU 84 2HD1 LEU 84 -7.766 7.354 11.689 646 3HD1 LEU 84 3HD1 LEU 84 -7.013 7.230 10.099 647 1HD2 LEU 84 1HD2 LEU 84 -8.527 5.483 9.948 648 2HD2 LEU 84 2HD2 LEU 84 -8.170 3.894 10.624 649 3HD2 LEU 84 3HD2 LEU 84 -7.141 4.565 9.358 650 H LYS 85 H LYS 85 -3.770 2.051 13.050 651 HA LYS 85 HA LYS 85 -1.300 2.437 11.553 652 1HB LYS 85 1HB LYS 85 -2.272 0.725 13.847 653 2HB LYS 85 2HB LYS 85 -0.646 0.522 13.197 654 1HG LYS 85 1HG LYS 85 -1.723 3.218 14.051 655 2HG LYS 85 2HG LYS 85 -0.877 2.145 15.166 656 1HD LYS 85 1HD LYS 85 1.150 2.337 14.022 657 2HD LYS 85 2HD LYS 85 0.366 2.789 12.508 658 1HE LYS 85 1HE LYS 85 -0.422 4.871 14.059 659 2HE LYS 85 2HE LYS 85 1.136 4.497 14.819 660 1HZ LYS 85 1HZ LYS 85 0.655 4.873 11.904 661 2HZ LYS 85 2HZ LYS 85 2.147 4.469 12.609 662 3HZ LYS 85 3HZ LYS 85 1.439 5.980 12.926 663 H ARG 86 H ARG 86 -3.317 -0.466 12.171 664 HA ARG 86 HA ARG 86 -2.299 -1.595 9.584 665 1HB ARG 86 1HB ARG 86 -2.325 -2.533 12.304 666 2HB ARG 86 2HB ARG 86 -3.304 -3.612 11.310 667 1HG ARG 86 1HG ARG 86 -0.992 -2.992 9.788 668 2HG ARG 86 2HG ARG 86 -0.434 -3.375 11.415 669 1HD ARG 86 1HD ARG 86 -1.577 -5.497 11.372 670 2HD ARG 86 2HD ARG 86 -2.375 -5.103 9.846 671 HE ARG 86 HE ARG 86 -0.337 -5.583 8.730 672 1HH1 ARG 86 1HH1 ARG 86 0.187 -5.132 12.142 673 2HH1 ARG 86 2HH1 ARG 86 1.849 -5.602 12.060 674 1HH2 ARG 86 1HH2 ARG 86 1.822 -6.189 8.650 675 2HH2 ARG 86 2HH2 ARG 86 2.771 -6.196 10.099 676 H MET 87 H MET 87 -3.862 -2.689 8.267 677 HA MET 87 HA MET 87 -6.712 -2.107 9.007 678 1HB MET 87 1HB MET 87 -5.058 -1.489 6.740 679 2HB MET 87 2HB MET 87 -6.349 -2.564 6.207 680 1HG MET 87 1HG MET 87 -7.981 -1.050 7.410 681 2HG MET 87 2HG MET 87 -6.649 0.075 7.669 682 1HE MET 87 1HE MET 87 -8.862 -1.826 5.220 683 2HE MET 87 2HE MET 87 -9.205 -0.563 4.038 684 3HE MET 87 3HE MET 87 -9.624 -0.320 5.734 685 H ARG 88 H ARG 88 -8.249 -3.761 8.628 686 HA ARG 88 HA ARG 88 -7.122 -6.442 7.880 687 1HB ARG 88 1HB ARG 88 -8.633 -5.430 10.210 688 2HB ARG 88 2HB ARG 88 -9.280 -6.925 9.531 689 1HG ARG 88 1HG ARG 88 -6.973 -7.899 9.629 690 2HG ARG 88 2HG ARG 88 -6.439 -6.440 10.462 691 1HD ARG 88 1HD ARG 88 -8.706 -7.188 11.893 692 2HD ARG 88 2HD ARG 88 -7.916 -8.733 11.526 693 HE ARG 88 HE ARG 88 -5.944 -6.796 12.315 694 1HH1 ARG 88 1HH1 ARG 88 -8.507 -8.776 13.591 695 2HH1 ARG 88 2HH1 ARG 88 -7.794 -8.879 15.163 696 1HH2 ARG 88 1HH2 ARG 88 -5.039 -6.944 14.365 697 2HH2 ARG 88 2HH2 ARG 88 -5.846 -7.851 15.600 698 H ILE 89 H ILE 89 -8.807 -7.928 6.999 699 HA ILE 89 HA ILE 89 -11.175 -6.522 5.834 700 HB ILE 89 HB ILE 89 -9.040 -8.185 4.451 701 1HG1 ILE 89 1HG1 ILE 89 -10.124 -5.556 3.505 702 2HG1 ILE 89 2HG1 ILE 89 -8.997 -5.565 4.857 703 1HG2 ILE 89 1HG2 ILE 89 -11.743 -7.293 3.396 704 2HG2 ILE 89 2HG2 ILE 89 -11.218 -8.958 3.643 705 3HG2 ILE 89 3HG2 ILE 89 -10.451 -7.966 2.403 706 1HD1 ILE 89 1HD1 ILE 89 -8.132 -7.301 2.666 707 2HD1 ILE 89 2HD1 ILE 89 -7.238 -6.042 3.520 708 3HD1 ILE 89 3HD1 ILE 89 -8.295 -5.615 2.172 709 H PHE 90 H PHE 90 -12.876 -7.646 6.706 710 HA PHE 90 HA PHE 90 -12.587 -10.608 7.045 711 1HB PHE 90 1HB PHE 90 -13.828 -8.360 8.554 712 2HB PHE 90 2HB PHE 90 -14.717 -9.884 8.569 713 HD1 PHE 90 HD1 PHE 90 -13.968 -11.736 9.851 714 HD2 PHE 90 HD2 PHE 90 -11.383 -8.358 9.248 715 HE1 PHE 90 HE1 PHE 90 -12.374 -12.659 11.511 716 HE2 PHE 90 HE2 PHE 90 -9.792 -9.280 10.906 717 HZ PHE 90 HZ PHE 90 -10.279 -11.437 12.028 718 H THR 91 H THR 91 -14.935 -11.643 7.031 719 HA THR 91 HA THR 91 -16.379 -10.593 4.620 720 HB THR 91 HB THR 91 -16.877 -13.106 4.323 721 HG1 THR 91 HG1 THR 91 -16.195 -14.296 5.887 722 1HG2 THR 91 1HG2 THR 91 -15.032 -11.637 3.191 723 2HG2 THR 91 2HG2 THR 91 -14.928 -13.393 3.053 724 3HG2 THR 91 3HG2 THR 91 -13.924 -12.540 4.226 725 H ILE 92 H ILE 92 -18.108 -9.550 5.712 726 HA ILE 92 HA ILE 92 -19.452 -10.394 8.039 727 HB ILE 92 HB ILE 92 -21.353 -9.067 7.032 728 1HG1 ILE 92 1HG1 ILE 92 -19.527 -8.690 4.654 729 2HG1 ILE 92 2HG1 ILE 92 -20.782 -9.928 4.669 730 1HG2 ILE 92 1HG2 ILE 92 -19.556 -7.096 6.380 731 2HG2 ILE 92 2HG2 ILE 92 -18.555 -8.189 7.336 732 3HG2 ILE 92 3HG2 ILE 92 -20.029 -7.511 8.028 733 1HD1 ILE 92 1HD1 ILE 92 -21.035 -7.008 4.408 734 2HD1 ILE 92 2HD1 ILE 92 -22.154 -7.723 5.568 735 3HD1 ILE 92 3HD1 ILE 92 -22.140 -8.284 3.896 736 H LYS 93 H LYS 93 -19.691 -11.606 4.746 737 HA LYS 93 HA LYS 93 -21.540 -13.736 5.751 738 1HB LYS 93 1HB LYS 93 -22.719 -13.518 3.543 739 2HB LYS 93 2HB LYS 93 -22.831 -12.056 4.521 740 1HG LYS 93 1HG LYS 93 -21.864 -10.873 2.872 741 2HG LYS 93 2HG LYS 93 -20.433 -11.896 2.975 742 1HD LYS 93 1HD LYS 93 -20.953 -12.646 0.910 743 2HD LYS 93 2HD LYS 93 -22.325 -13.474 1.645 744 1HE LYS 93 1HE LYS 93 -22.691 -10.571 1.066 745 2HE LYS 93 2HE LYS 93 -22.651 -11.667 -0.328 746 1HZ LYS 93 1HZ LYS 93 -24.245 -13.101 0.859 747 2HZ LYS 93 2HZ LYS 93 -24.888 -11.561 0.546 748 3HZ LYS 93 3HZ LYS 93 -24.342 -11.951 2.106 749 HA PRO 94 HA PRO 94 -18.589 -16.573 4.127 750 1HB PRO 94 1HB PRO 94 -20.902 -18.018 3.018 751 2HB PRO 94 2HB PRO 94 -19.620 -18.616 4.068 752 1HG PRO 94 1HG PRO 94 -22.104 -18.114 4.971 753 2HG PRO 94 2HG PRO 94 -20.663 -17.892 5.970 754 1HD PRO 94 1HD PRO 94 -22.424 -15.868 4.729 755 2HD PRO 94 2HD PRO 94 -21.395 -15.746 6.172 756 H ILE 95 H ILE 95 -17.553 -16.911 2.120 757 HA ILE 95 HA ILE 95 -18.955 -15.730 -0.259 758 HB ILE 95 HB ILE 95 -16.057 -15.629 0.655 759 1HG1 ILE 95 1HG1 ILE 95 -18.131 -13.451 0.254 760 2HG1 ILE 95 2HG1 ILE 95 -17.635 -14.103 1.816 761 1HG2 ILE 95 1HG2 ILE 95 -17.353 -15.057 -1.967 762 2HG2 ILE 95 2HG2 ILE 95 -15.710 -15.597 -1.619 763 3HG2 ILE 95 3HG2 ILE 95 -16.144 -13.901 -1.406 764 1HD1 ILE 95 1HD1 ILE 95 -16.131 -12.335 -0.068 765 2HD1 ILE 95 2HD1 ILE 95 -15.209 -13.493 0.890 766 3HD1 ILE 95 3HD1 ILE 95 -16.211 -12.285 1.693 767 H ALA 96 H ALA 96 -18.618 -16.792 -2.258 768 HA ALA 96 HA ALA 96 -17.780 -19.621 -2.053 769 1HB ALA 96 1HB ALA 96 -19.357 -19.825 -3.680 770 2HB ALA 96 2HB ALA 96 -18.551 -18.621 -4.685 771 3HB ALA 96 3HB ALA 96 -19.702 -18.110 -3.450 772 H ILE 97 H ILE 97 -16.139 -20.516 -3.410 773 HA ILE 97 HA ILE 97 -13.732 -19.105 -3.679 774 HB ILE 97 HB ILE 97 -14.898 -21.482 -5.171 775 1HG1 ILE 97 1HG1 ILE 97 -12.837 -21.571 -2.986 776 2HG1 ILE 97 2HG1 ILE 97 -14.537 -21.365 -2.570 777 1HG2 ILE 97 1HG2 ILE 97 -12.469 -20.066 -5.691 778 2HG2 ILE 97 2HG2 ILE 97 -13.029 -21.570 -6.420 779 3HG2 ILE 97 3HG2 ILE 97 -12.050 -21.612 -4.954 780 1HD1 ILE 97 1HD1 ILE 97 -14.656 -23.401 -4.410 781 2HD1 ILE 97 2HD1 ILE 97 -14.623 -23.633 -2.662 782 3HD1 ILE 97 3HD1 ILE 97 -13.129 -23.742 -3.595 783 H GLY 98 H GLY 98 -16.511 -19.006 -5.774 784 1HA GLY 98 1HA GLY 98 -14.880 -17.560 -7.821 785 2HA GLY 98 2HA GLY 98 -16.382 -18.410 -8.184 786 H GLU 99 H GLU 99 -15.326 -15.909 -5.820 787 HA GLU 99 HA GLU 99 -17.705 -14.299 -6.705 788 1HB GLU 99 1HB GLU 99 -16.889 -15.380 -4.054 789 2HB GLU 99 2HB GLU 99 -17.509 -13.729 -4.053 790 1HG GLU 99 1HG GLU 99 -19.053 -15.668 -5.679 791 2HG GLU 99 2HG GLU 99 -19.104 -15.930 -3.936 792 H GLU 100 H GLU 100 -17.450 -11.989 -5.576 793 HA GLU 100 HA GLU 100 -14.587 -11.134 -5.862 794 1HB GLU 100 1HB GLU 100 -16.231 -10.618 -7.770 795 2HB GLU 100 2HB GLU 100 -17.049 -9.539 -6.639 796 1HG GLU 100 1HG GLU 100 -14.548 -8.656 -6.275 797 2HG GLU 100 2HG GLU 100 -14.362 -9.270 -7.918 798 H ILE 101 H ILE 101 -13.850 -10.067 -4.070 799 HA ILE 101 HA ILE 101 -15.750 -9.388 -1.916 800 HB ILE 101 HB ILE 101 -12.721 -9.273 -2.163 801 1HG1 ILE 101 1HG1 ILE 101 -14.564 -11.332 -0.911 802 2HG1 ILE 101 2HG1 ILE 101 -13.652 -11.544 -2.405 803 1HG2 ILE 101 1HG2 ILE 101 -14.053 -9.526 0.474 804 2HG2 ILE 101 2HG2 ILE 101 -14.208 -7.954 -0.310 805 3HG2 ILE 101 3HG2 ILE 101 -12.609 -8.618 0.026 806 1HD1 ILE 101 1HD1 ILE 101 -12.725 -11.642 0.403 807 2HD1 ILE 101 2HD1 ILE 101 -11.667 -10.763 -0.702 808 3HD1 ILE 101 3HD1 ILE 101 -12.077 -12.448 -1.026 809 H THR 102 H THR 102 -16.388 -7.333 -1.451 810 HA THR 102 HA THR 102 -14.800 -5.006 -2.366 811 HB THR 102 HB THR 102 -16.987 -4.115 -3.412 812 HG1 THR 102 HG1 THR 102 -17.609 -6.869 -3.490 813 1HG2 THR 102 1HG2 THR 102 -15.963 -6.577 -4.816 814 2HG2 THR 102 2HG2 THR 102 -14.923 -5.170 -4.594 815 3HG2 THR 102 3HG2 THR 102 -16.423 -5.023 -5.511 816 H ILE 103 H ILE 103 -15.786 -2.948 -1.441 817 HA ILE 103 HA ILE 103 -17.519 -3.478 0.938 818 HB ILE 103 HB ILE 103 -15.942 -2.125 2.281 819 1HG1 ILE 103 1HG1 ILE 103 -13.625 -1.937 0.821 820 2HG1 ILE 103 2HG1 ILE 103 -14.845 -1.591 -0.404 821 1HG2 ILE 103 1HG2 ILE 103 -15.572 -4.708 1.446 822 2HG2 ILE 103 2HG2 ILE 103 -14.588 -3.911 2.675 823 3HG2 ILE 103 3HG2 ILE 103 -14.030 -3.976 1.003 824 1HD1 ILE 103 1HD1 ILE 103 -15.172 0.465 0.454 825 2HD1 ILE 103 2HD1 ILE 103 -13.868 0.161 1.602 826 3HD1 ILE 103 3HD1 ILE 103 -15.533 -0.225 2.036 827 H SER 104 H SER 104 -18.647 -1.553 1.693 828 HA SER 104 HA SER 104 -19.184 0.378 -0.489 829 1HB SER 104 1HB SER 104 -20.993 -0.807 0.747 830 2HB SER 104 2HB SER 104 -20.438 -0.066 2.248 831 HG SER 104 HG SER 104 -21.718 1.494 1.712 832 H TYR 105 H TYR 105 -19.966 2.598 1.010 833 HA TYR 105 HA TYR 105 -17.468 3.429 2.450 834 1HB TYR 105 1HB TYR 105 -19.081 5.080 0.468 835 2HB TYR 105 2HB TYR 105 -17.535 5.518 1.191 836 HD1 TYR 105 HD1 TYR 105 -18.684 4.810 -1.831 837 HD2 TYR 105 HD2 TYR 105 -15.994 3.027 1.004 838 HE1 TYR 105 HE1 TYR 105 -17.505 3.651 -3.679 839 HE2 TYR 105 HE2 TYR 105 -14.814 1.869 -0.846 840 HH TYR 105 HH TYR 105 -14.501 1.965 -3.168 841 H GLY 106 H GLY 106 -20.775 4.566 1.654 842 1HA GLY 106 1HA GLY 106 -22.459 5.416 3.046 843 2HA GLY 106 2HA GLY 106 -21.610 4.674 4.400 844 H ASP 107 H ASP 107 -22.811 7.178 4.666 845 HA ASP 107 HA ASP 107 -22.345 9.361 5.417 846 1HB ASP 107 1HB ASP 107 -20.688 7.602 6.600 847 2HB ASP 107 2HB ASP 107 -19.480 8.571 5.756 848 H ASP 108 H ASP 108 -22.477 10.705 3.638 849 HA ASP 108 HA ASP 108 -21.761 12.148 1.935 850 1HB ASP 108 1HB ASP 108 -19.246 11.545 3.501 851 2HB ASP 108 2HB ASP 108 -19.250 12.695 2.168 852 H TYR 109 H TYR 109 -18.888 10.027 2.067 853 HA TYR 109 HA TYR 109 -18.231 9.905 -0.593 854 1HB TYR 109 1HB TYR 109 -17.909 8.297 1.801 855 2HB TYR 109 2HB TYR 109 -17.957 7.266 0.371 856 HD1 TYR 109 HD1 TYR 109 -15.746 6.689 -0.163 857 HD2 TYR 109 HD2 TYR 109 -16.678 10.754 0.865 858 HE1 TYR 109 HE1 TYR 109 -13.427 7.364 -0.726 859 HE2 TYR 109 HE2 TYR 109 -14.359 11.429 0.302 860 HH TYR 109 HH TYR 109 -11.918 9.731 0.232 861 H TRP 110 H TRP 110 -19.686 9.690 -2.257 862 HA TRP 110 HA TRP 110 -21.405 8.793 -3.596 863 1HB TRP 110 1HB TRP 110 -19.351 7.003 -2.997 864 2HB TRP 110 2HB TRP 110 -20.817 6.055 -2.740 865 HD1 TRP 110 HD1 TRP 110 -22.237 5.413 -4.802 866 HE1 TRP 110 HE1 TRP 110 -21.941 5.702 -7.348 867 HE3 TRP 110 HE3 TRP 110 -18.323 8.684 -4.859 868 HZ2 TRP 110 HZ2 TRP 110 -20.261 7.137 -9.167 869 HZ3 TRP 110 HZ3 TRP 110 -17.394 9.497 -7.008 870 HH2 TRP 110 HH2 TRP 110 -18.357 8.729 -9.160 871 H LEU 111 H LEU 111 -22.734 6.238 -3.115 872 HA LEU 111 HA LEU 111 -25.110 6.974 -1.903 873 1HB LEU 111 1HB LEU 111 -24.692 4.913 -3.194 874 2HB LEU 111 2HB LEU 111 -23.711 4.274 -1.875 875 HG LEU 111 HG LEU 111 -26.520 5.157 -1.299 876 1HD1 LEU 111 1HD1 LEU 111 -26.333 3.564 -3.379 877 2HD1 LEU 111 2HD1 LEU 111 -27.493 3.187 -2.105 878 3HD1 LEU 111 3HD1 LEU 111 -25.950 2.336 -2.172 879 1HD2 LEU 111 1HD2 LEU 111 -24.414 3.411 -0.126 880 2HD2 LEU 111 2HD2 LEU 111 -26.085 2.895 0.100 881 3HD2 LEU 111 3HD2 LEU 111 -25.565 4.478 0.677 882 H SER 112 H SER 112 -25.883 7.141 0.182 883 HA SER 112 HA SER 112 -23.960 6.546 2.407 884 1HB SER 112 1HB SER 112 -26.169 8.605 2.054 885 2HB SER 112 2HB SER 112 -25.289 8.370 3.564 886 HG SER 112 HG SER 112 -23.350 8.742 2.303 887 H ARG 113 H ARG 113 -27.139 5.972 1.102 888 HA ARG 113 HA ARG 113 -28.666 5.204 3.321 889 1HB ARG 113 1HB ARG 113 -28.479 4.658 0.439 890 2HB ARG 113 2HB ARG 113 -29.217 3.330 1.334 891 1HG ARG 113 1HG ARG 113 -30.830 4.879 2.346 892 2HG ARG 113 2HG ARG 113 -30.068 6.237 1.517 893 1HD ARG 113 1HD ARG 113 -30.549 4.892 -0.666 894 2HD ARG 113 2HD ARG 113 -31.698 3.986 0.337 895 HE ARG 113 HE ARG 113 -31.980 6.771 -0.495 896 1HH1 ARG 113 1HH1 ARG 113 -32.720 4.424 1.966 897 2HH1 ARG 113 2HH1 ARG 113 -34.115 5.282 2.520 898 1HH2 ARG 113 1HH2 ARG 113 -33.794 7.867 0.240 899 2HH2 ARG 113 2HH2 ARG 113 -34.721 7.217 1.552 900 HA PRO 114 HA PRO 114 -27.121 1.514 5.111 901 1HB PRO 114 1HB PRO 114 -29.042 -0.435 4.422 902 2HB PRO 114 2HB PRO 114 -29.097 0.620 5.845 903 1HG PRO 114 1HG PRO 114 -30.492 0.871 3.240 904 2HG PRO 114 2HG PRO 114 -31.026 1.343 4.859 905 1HD PRO 114 1HD PRO 114 -30.203 3.146 3.039 906 2HD PRO 114 2HD PRO 114 -29.907 3.358 4.778 907 H ARG 115 H ARG 115 -27.194 -1.165 4.330 908 HA ARG 115 HA ARG 115 -25.661 -1.053 1.766 909 1HB ARG 115 1HB ARG 115 -25.644 -3.000 4.094 910 2HB ARG 115 2HB ARG 115 -24.544 -3.046 2.714 911 1HG ARG 115 1HG ARG 115 -23.268 -1.838 4.227 912 2HG ARG 115 2HG ARG 115 -24.099 -0.527 3.399 913 1HD ARG 115 1HD ARG 115 -25.516 -0.101 5.206 914 2HD ARG 115 2HD ARG 115 -25.397 -1.767 5.813 915 HE ARG 115 HE ARG 115 -22.787 -0.681 5.894 916 1HH1 ARG 115 1HH1 ARG 115 -25.900 -0.113 7.345 917 2HH1 ARG 115 2HH1 ARG 115 -25.226 0.527 8.803 918 1HH2 ARG 115 1HH2 ARG 115 -21.936 0.154 7.797 919 2HH2 ARG 115 2HH2 ARG 115 -23.000 0.679 9.060 920 H LEU 116 H LEU 116 -28.497 -1.227 1.565 921 HA LEU 116 HA LEU 116 -30.205 -2.557 0.631 922 1HB LEU 116 1HB LEU 116 -27.551 -3.354 -0.491 923 2HB LEU 116 2HB LEU 116 -28.933 -4.366 -0.899 924 HG LEU 116 HG LEU 116 -28.619 -2.574 -2.572 925 1HD1 LEU 116 1HD1 LEU 116 -30.875 -2.149 -2.776 926 2HD1 LEU 116 2HD1 LEU 116 -31.049 -1.694 -1.081 927 3HD1 LEU 116 3HD1 LEU 116 -30.951 -3.396 -1.531 928 1HD2 LEU 116 1HD2 LEU 116 -27.603 -0.964 -0.907 929 2HD2 LEU 116 2HD2 LEU 116 -29.232 -0.667 -0.298 930 3HD2 LEU 116 3HD2 LEU 116 -28.822 -0.248 -1.962 931 H THR 117 H THR 117 -31.069 -3.616 2.491 932 HA THR 117 HA THR 117 -29.805 -6.127 3.422 933 HB THR 117 HB THR 117 -32.437 -4.965 4.335 934 HG1 THR 117 HG1 THR 117 -31.366 -3.177 4.618 935 1HG2 THR 117 1HG2 THR 117 -30.173 -6.071 5.993 936 2HG2 THR 117 2HG2 THR 117 -31.328 -7.144 5.203 937 3HG2 THR 117 3HG2 THR 117 -31.887 -5.974 6.399 938 H GLN 118 H GLN 118 -30.440 -8.088 2.620 939 HA GLN 118 HA GLN 118 -31.696 -9.695 1.429 940 1HB GLN 118 1HB GLN 118 -33.451 -8.096 3.174 941 2HB GLN 118 2HB GLN 118 -34.316 -8.899 1.863 942 1HG GLN 118 1HG GLN 118 -33.449 -11.054 2.519 943 2HG GLN 118 2HG GLN 118 -32.354 -10.316 3.688 944 1HE2 GLN 118 1HE2 GLN 118 -33.435 -9.146 5.563 945 2HE2 GLN 118 2HE2 GLN 118 -34.948 -9.699 6.097 946 H ASN 119 H ASN 119 -30.794 -8.458 -0.554 947 HA ASN 119 HA ASN 119 -32.636 -6.684 -1.976 948 1HB ASN 119 1HB ASN 119 -30.105 -6.646 -2.039 949 2HB ASN 119 2HB ASN 119 -30.160 -8.166 -2.933 950 1HD2 ASN 119 1HD2 ASN 119 -30.873 -4.698 -3.136 951 2HD2 ASN 119 2HD2 ASN 119 -31.120 -4.668 -4.815 952 1H GLY 201 1H GLY 201 -24.225 35.039 -13.518 953 2H GLY 201 2H GLY 201 -25.671 35.643 -14.174 954 3H GLY 201 3H GLY 201 -24.365 35.272 -15.195 955 1HA GLY 201 1HA GLY 201 -25.961 33.336 -13.607 956 2HA GLY 201 2HA GLY 201 -26.012 33.543 -15.358 957 H LYS 202 H LYS 202 -24.662 32.255 -16.523 958 HA LYS 202 HA LYS 202 -22.965 30.677 -16.983 959 1HB LYS 202 1HB LYS 202 -21.902 33.009 -15.987 960 2HB LYS 202 2HB LYS 202 -21.216 31.817 -14.883 961 1HG LYS 202 1HG LYS 202 -20.256 30.570 -16.710 962 2HG LYS 202 2HG LYS 202 -21.120 31.544 -17.899 963 1HD LYS 202 1HD LYS 202 -19.578 33.238 -16.122 964 2HD LYS 202 2HD LYS 202 -18.543 32.026 -16.875 965 1HE LYS 202 1HE LYS 202 -18.717 33.017 -18.919 966 2HE LYS 202 2HE LYS 202 -20.470 33.230 -18.749 967 1HZ LYS 202 1HZ LYS 202 -18.303 34.905 -17.600 968 2HZ LYS 202 2HZ LYS 202 -19.908 34.988 -17.050 969 3HZ LYS 202 3HZ LYS 202 -19.539 35.389 -18.659 970 H ALA 203 H ALA 203 -21.388 29.080 -15.749 971 HA ALA 203 HA ALA 203 -21.266 27.240 -14.272 972 1HB ALA 203 1HB ALA 203 -20.898 28.066 -12.170 973 2HB ALA 203 2HB ALA 203 -22.509 28.776 -12.076 974 3HB ALA 203 3HB ALA 203 -21.213 29.638 -12.903 975 HA PRO 204 HA PRO 204 -25.921 26.714 -14.860 976 1HB PRO 204 1HB PRO 204 -24.957 24.218 -16.160 977 2HB PRO 204 2HB PRO 204 -26.164 25.384 -16.728 978 1HG PRO 204 1HG PRO 204 -23.711 25.203 -17.809 979 2HG PRO 204 2HG PRO 204 -24.593 26.732 -17.700 980 1HD PRO 204 1HD PRO 204 -22.288 25.758 -16.096 981 2HD PRO 204 2HD PRO 204 -22.718 27.413 -16.578 982 H ARG 205 H ARG 205 -25.901 26.351 -12.529 983 HA ARG 205 HA ARG 205 -26.041 25.014 -10.586 984 1HB ARG 205 1HB ARG 205 -26.901 23.414 -12.953 985 2HB ARG 205 2HB ARG 205 -26.636 22.517 -11.458 986 1HG ARG 205 1HG ARG 205 -28.964 23.240 -11.547 987 2HG ARG 205 2HG ARG 205 -28.133 24.137 -10.277 988 1HD ARG 205 1HD ARG 205 -28.389 26.129 -11.370 989 2HD ARG 205 2HD ARG 205 -28.020 25.410 -12.948 990 HE ARG 205 HE ARG 205 -30.519 24.370 -12.041 991 1HH1 ARG 205 1HH1 ARG 205 -29.088 27.346 -13.142 992 2HH1 ARG 205 2HH1 ARG 205 -30.574 27.951 -13.785 993 1HH2 ARG 205 1HH2 ARG 205 -32.437 25.176 -12.884 994 2HH2 ARG 205 2HH2 ARG 205 -32.457 26.734 -13.642 995 H LYS 206 H LYS 206 -23.448 25.441 -10.971 996 HA LYS 206 HA LYS 206 -22.163 22.732 -10.828 997 1HB LYS 206 1HB LYS 206 -21.804 24.640 -12.755 998 2HB LYS 206 2HB LYS 206 -20.548 25.099 -11.605 999 1HG LYS 206 1HG LYS 206 -19.285 23.291 -12.115 1000 2HG LYS 206 2HG LYS 206 -20.673 22.206 -12.038 1001 1HD LYS 206 1HD LYS 206 -20.019 22.109 -14.305 1002 2HD LYS 206 2HD LYS 206 -21.355 23.260 -14.309 1003 1HE LYS 206 1HE LYS 206 -19.824 24.550 -15.465 1004 2HE LYS 206 2HE LYS 206 -19.272 24.949 -13.827 1005 1HZ LYS 206 1HZ LYS 206 -17.751 23.083 -13.910 1006 2HZ LYS 206 2HZ LYS 206 -17.452 24.111 -15.229 1007 3HZ LYS 206 3HZ LYS 206 -18.300 22.658 -15.461 1008 H GLN 207 H GLN 207 -23.015 23.521 -8.445 1009 HA GLN 207 HA GLN 207 -20.596 24.060 -6.933 1010 1HB GLN 207 1HB GLN 207 -21.270 26.303 -7.908 1011 2HB GLN 207 2HB GLN 207 -22.758 26.194 -6.968 1012 1HG GLN 207 1HG GLN 207 -21.428 27.372 -5.478 1013 2HG GLN 207 2HG GLN 207 -21.056 25.722 -4.979 1014 1HE2 GLN 207 1HE2 GLN 207 -19.748 28.602 -6.496 1015 2HE2 GLN 207 2HE2 GLN 207 -18.167 28.016 -6.693 1016 H LEU 208 H LEU 208 -21.325 22.157 -5.809 1017 HA LEU 208 HA LEU 208 -23.743 22.592 -4.084 1018 1HB LEU 208 1HB LEU 208 -23.703 20.822 -6.008 1019 2HB LEU 208 2HB LEU 208 -22.644 19.907 -4.933 1020 HG LEU 208 HG LEU 208 -24.558 20.478 -3.163 1021 1HD1 LEU 208 1HD1 LEU 208 -26.731 20.658 -4.105 1022 2HD1 LEU 208 2HD1 LEU 208 -26.153 20.235 -5.717 1023 3HD1 LEU 208 3HD1 LEU 208 -25.753 21.806 -5.021 1024 1HD2 LEU 208 1HD2 LEU 208 -24.038 18.215 -3.529 1025 2HD2 LEU 208 2HD2 LEU 208 -24.429 18.307 -5.247 1026 3HD2 LEU 208 3HD2 LEU 208 -25.721 18.314 -4.047 1027 H ALA 209 H ALA 209 -20.515 21.092 -4.312 1028 HA ALA 209 HA ALA 209 -20.080 21.614 -1.437 1029 1HB ALA 209 1HB ALA 209 -20.727 18.992 -2.657 1030 2HB ALA 209 2HB ALA 209 -20.905 19.522 -0.984 1031 3HB ALA 209 3HB ALA 209 -19.335 18.975 -1.574 1032 H THR 210 H THR 210 -17.767 20.964 -0.845 1033 HA THR 210 HA THR 210 -15.981 21.076 -3.255 1034 HB THR 210 HB THR 210 -14.548 22.552 -1.759 1035 HG1 THR 210 HG1 THR 210 -15.306 23.136 0.153 1036 1HG2 THR 210 1HG2 THR 210 -17.367 23.396 -2.476 1037 2HG2 THR 210 2HG2 THR 210 -15.904 23.618 -3.435 1038 3HG2 THR 210 3HG2 THR 210 -16.127 24.531 -1.943 1039 H LYS 211 H LYS 211 -16.233 20.192 0.195 1040 HA LYS 211 HA LYS 211 -13.988 18.248 -0.229 1041 1HB LYS 211 1HB LYS 211 -13.685 18.521 2.237 1042 2HB LYS 211 2HB LYS 211 -13.564 20.062 1.390 1043 1HG LYS 211 1HG LYS 211 -15.425 20.884 2.393 1044 2HG LYS 211 2HG LYS 211 -16.311 19.375 2.172 1045 1HD LYS 211 1HD LYS 211 -15.417 18.428 4.148 1046 2HD LYS 211 2HD LYS 211 -14.112 19.612 4.226 1047 1HE LYS 211 1HE LYS 211 -15.713 21.392 4.761 1048 2HE LYS 211 2HE LYS 211 -17.064 20.255 4.587 1049 1HZ LYS 211 1HZ LYS 211 -14.792 19.997 6.494 1050 2HZ LYS 211 2HZ LYS 211 -16.049 18.870 6.307 1051 3HZ LYS 211 3HZ LYS 211 -16.383 20.424 6.905 1052 H ALA 212 H ALA 212 -14.221 16.224 1.114 1053 HA ALA 212 HA ALA 212 -17.105 15.453 1.434 1054 1HB ALA 212 1HB ALA 212 -16.695 13.711 0.025 1055 2HB ALA 212 2HB ALA 212 -15.204 13.295 0.870 1056 3HB ALA 212 3HB ALA 212 -15.190 14.534 -0.385 1057 H ALA 213 H ALA 213 -16.845 13.048 2.657 1058 HA ALA 213 HA ALA 213 -15.329 13.687 5.166 1059 1HB ALA 213 1HB ALA 213 -17.289 11.791 5.744 1060 2HB ALA 213 2HB ALA 213 -18.054 12.803 4.518 1061 3HB ALA 213 3HB ALA 213 -17.442 13.529 6.004 1062 H ARG 214 H ARG 214 -14.397 12.182 2.710 1063 HA ARG 214 HA ARG 214 -13.278 10.169 2.189 1064 1HB ARG 214 1HB ARG 214 -12.795 11.017 4.962 1065 2HB ARG 214 2HB ARG 214 -12.461 9.305 4.699 1066 1HG ARG 214 1HG ARG 214 -10.433 10.510 4.209 1067 2HG ARG 214 2HG ARG 214 -11.107 9.985 2.668 1068 1HD ARG 214 1HD ARG 214 -10.421 12.335 2.490 1069 2HD ARG 214 2HD ARG 214 -12.193 12.256 2.454 1070 HE ARG 214 HE ARG 214 -11.252 12.446 5.174 1071 1HH1 ARG 214 1HH1 ARG 214 -11.711 14.309 2.269 1072 2HH1 ARG 214 2HH1 ARG 214 -11.906 15.800 3.125 1073 1HH2 ARG 214 1HH2 ARG 214 -11.508 14.393 6.262 1074 2HH2 ARG 214 2HH2 ARG 214 -11.792 15.850 5.368 1075 1HN MLZ 215 1HN MLZ 215 -13.009 7.786 3.604 1076 HA MLZ 215 HA MLZ 215 -15.665 6.596 3.244 1077 1HB MLZ 215 1HB MLZ 215 -12.835 5.768 3.685 1078 2HB MLZ 215 2HB MLZ 215 -14.069 4.625 4.215 1079 1HG MLZ 215 1HG MLZ 215 -14.233 5.887 1.485 1080 2HG MLZ 215 2HG MLZ 215 -14.945 4.374 2.049 1081 1HD MLZ 215 1HD MLZ 215 -11.993 4.917 1.604 1082 2HD MLZ 215 2HD MLZ 215 -12.648 3.426 2.279 1083 1HE MLZ 215 1HE MLZ 215 -13.825 4.344 -0.305 1084 2HE MLZ 215 2HE MLZ 215 -13.436 2.701 0.241 1085 HZ MLZ 215 HZ MLZ 215 -11.163 3.042 -0.144 1086 1HCM MLZ 215 1HCM MLZ 215 -11.140 3.147 -2.383 1087 2HCM MLZ 215 2HCM MLZ 215 -12.016 4.674 -2.396 1088 3HCM MLZ 215 3HCM MLZ 215 -12.885 3.162 -2.159 1089 H SER 216 H SER 216 -17.127 6.319 4.879 1090 HA SER 216 HA SER 216 -18.010 6.084 7.055 1091 1HB SER 216 1HB SER 216 -16.844 8.457 6.817 1092 2HB SER 216 2HB SER 216 -17.425 7.914 8.391 1093 HG SER 216 HG SER 216 -15.126 8.732 8.086 1094 H ALA 217 H ALA 217 -16.948 5.849 9.535 1095 HA ALA 217 HA ALA 217 -15.007 3.574 9.275 1096 1HB ALA 217 1HB ALA 217 -14.606 6.066 10.430 1097 2HB ALA 217 2HB ALA 217 -13.668 4.619 10.801 1098 3HB ALA 217 3HB ALA 217 -15.041 5.064 11.815 1099 HA PRO 218 HA PRO 218 -18.150 1.324 11.409 1100 1HB PRO 218 1HB PRO 218 -16.615 -0.738 12.383 1101 2HB PRO 218 2HB PRO 218 -17.086 -0.599 10.682 1102 1HG PRO 218 1HG PRO 218 -14.512 0.114 11.971 1103 2HG PRO 218 2HG PRO 218 -14.813 -0.685 10.426 1104 1HD PRO 218 1HD PRO 218 -14.184 1.934 10.656 1105 2HD PRO 218 2HD PRO 218 -15.179 1.295 9.347 1106 H ALA 219 H ALA 219 -17.849 -0.120 13.774 1107 HA ALA 219 HA ALA 219 -17.076 2.020 15.729 1108 1HB ALA 219 1HB ALA 219 -19.008 -0.171 16.382 1109 2HB ALA 219 2HB ALA 219 -19.540 1.060 15.237 1110 3HB ALA 219 3HB ALA 219 -19.040 1.525 16.863 1111 H THR 220 H THR 220 -15.069 1.367 16.489 1112 HA THR 220 HA THR 220 -14.939 -1.204 17.939 1113 HB THR 220 HB THR 220 -14.341 -1.748 15.605 1114 HG1 THR 220 HG1 THR 220 -12.836 -2.965 16.377 1115 1HG2 THR 220 1HG2 THR 220 -13.382 -0.110 14.386 1116 2HG2 THR 220 2HG2 THR 220 -11.878 -0.457 15.239 1117 3HG2 THR 220 3HG2 THR 220 -12.961 0.800 15.837 1118 H GLY 221 H GLY 221 -12.076 -1.165 18.184 1119 1HA GLY 221 1HA GLY 221 -11.766 0.770 20.285 1120 2HA GLY 221 2HA GLY 221 -10.466 -0.205 19.599 1121 1H MET 1 1H MET 1 -1.203 -9.331 4.853 1122 2H MET 1 2H MET 1 -0.639 -10.489 5.959 1123 3H MET 1 3H MET 1 -0.719 -10.863 4.305 1124 HA MET 1 HA MET 1 1.032 -9.337 3.783 1125 1HB MET 1 1HB MET 1 -0.058 -8.021 5.930 1126 2HB MET 1 2HB MET 1 1.442 -8.627 6.632 1127 1HG MET 1 1HG MET 1 1.984 -6.495 5.698 1128 2HG MET 1 2HG MET 1 2.623 -7.687 4.567 1129 1HE MET 1 1HE MET 1 2.767 -5.364 3.469 1130 2HE MET 1 2HE MET 1 1.466 -4.325 4.051 1131 3HE MET 1 3HE MET 1 1.550 -4.760 2.344 1132 H PHE 2 H PHE 2 0.572 -12.129 5.028 1133 HA PHE 2 HA PHE 2 3.437 -12.699 5.481 1134 1HB PHE 2 1HB PHE 2 2.731 -13.993 7.601 1135 2HB PHE 2 2HB PHE 2 2.760 -12.236 7.726 1136 HD1 PHE 2 HD1 PHE 2 0.657 -10.932 7.677 1137 HD2 PHE 2 HD2 PHE 2 0.647 -15.228 7.683 1138 HE1 PHE 2 HE1 PHE 2 -1.742 -10.924 8.297 1139 HE2 PHE 2 HE2 PHE 2 -1.755 -15.219 8.303 1140 HZ PHE 2 HZ PHE 2 -2.948 -13.065 8.610 1141 H ASN 3 H ASN 3 2.754 -13.688 3.298 1142 HA ASN 3 HA ASN 3 2.079 -16.519 3.766 1143 1HB ASN 3 1HB ASN 3 0.258 -14.471 2.615 1144 2HB ASN 3 2HB ASN 3 0.321 -16.006 1.749 1145 1HD2 ASN 3 1HD2 ASN 3 -0.534 -17.896 2.811 1146 2HD2 ASN 3 2HD2 ASN 3 -1.367 -17.812 4.287 1147 H ASP 4 H ASP 4 1.677 -14.702 0.756 1148 HA ASP 4 HA ASP 4 2.876 -16.372 -1.026 1149 1HB ASP 4 1HB ASP 4 1.772 -14.041 -1.254 1150 2HB ASP 4 2HB ASP 4 3.405 -13.396 -1.086 1151 H ARG 5 H ARG 5 4.695 -17.449 0.033 1152 HA ARG 5 HA ARG 5 6.983 -17.757 0.551 1153 1HB ARG 5 1HB ARG 5 6.929 -15.910 -1.860 1154 2HB ARG 5 2HB ARG 5 8.345 -16.832 -1.361 1155 1HG ARG 5 1HG ARG 5 6.497 -18.811 -1.396 1156 2HG ARG 5 2HG ARG 5 5.837 -17.759 -2.649 1157 1HD ARG 5 1HD ARG 5 7.734 -17.984 -4.015 1158 2HD ARG 5 2HD ARG 5 8.776 -18.440 -2.654 1159 HE ARG 5 HE ARG 5 6.610 -20.327 -2.962 1160 1HH1 ARG 5 1HH1 ARG 5 9.664 -19.355 -4.321 1161 2HH1 ARG 5 2HH1 ARG 5 10.008 -20.928 -4.951 1162 1HH2 ARG 5 1HH2 ARG 5 7.079 -22.358 -3.788 1163 2HH2 ARG 5 2HH2 ARG 5 8.557 -22.618 -4.652 1164 H VAL 6 H VAL 6 5.695 -15.107 1.748 1165 HA VAL 6 HA VAL 6 8.272 -14.034 2.694 1166 HB VAL 6 HB VAL 6 6.335 -12.526 0.899 1167 1HG1 VAL 6 1HG1 VAL 6 7.679 -10.494 1.366 1168 2HG1 VAL 6 2HG1 VAL 6 8.584 -11.385 2.590 1169 3HG1 VAL 6 3HG1 VAL 6 6.862 -11.075 2.817 1170 1HG2 VAL 6 1HG2 VAL 6 9.282 -13.187 0.790 1171 2HG2 VAL 6 2HG2 VAL 6 8.549 -11.961 -0.245 1172 3HG2 VAL 6 3HG2 VAL 6 8.026 -13.642 -0.362 1173 H ILE 7 H ILE 7 7.998 -12.602 4.513 1174 HA ILE 7 HA ILE 7 5.240 -12.194 5.528 1175 HB ILE 7 HB ILE 7 6.035 -14.335 6.450 1176 1HG1 ILE 7 1HG1 ILE 7 6.275 -12.223 8.602 1177 2HG1 ILE 7 2HG1 ILE 7 4.734 -12.646 7.856 1178 1HG2 ILE 7 1HG2 ILE 7 8.515 -13.387 6.240 1179 2HG2 ILE 7 2HG2 ILE 7 8.110 -14.634 7.420 1180 3HG2 ILE 7 3HG2 ILE 7 8.233 -12.949 7.925 1181 1HD1 ILE 7 1HD1 ILE 7 5.910 -13.940 10.026 1182 2HD1 ILE 7 2HD1 ILE 7 6.244 -15.009 8.664 1183 3HD1 ILE 7 3HD1 ILE 7 4.582 -14.560 9.045 1184 H VAL 8 H VAL 8 5.059 -10.285 6.731 1185 HA VAL 8 HA VAL 8 7.367 -8.460 6.563 1186 HB VAL 8 HB VAL 8 5.061 -7.828 5.892 1187 1HG1 VAL 8 1HG1 VAL 8 4.355 -9.210 8.219 1188 2HG1 VAL 8 2HG1 VAL 8 3.269 -8.280 7.187 1189 3HG1 VAL 8 3HG1 VAL 8 4.015 -7.521 8.593 1190 1HG2 VAL 8 1HG2 VAL 8 6.269 -6.400 8.271 1191 2HG2 VAL 8 2HG2 VAL 8 4.887 -5.755 7.384 1192 3HG2 VAL 8 3HG2 VAL 8 6.431 -5.988 6.564 1193 H LYS 9 H LYS 9 8.584 -7.799 8.283 1194 HA LYS 9 HA LYS 9 7.624 -8.350 11.042 1195 1HB LYS 9 1HB LYS 9 10.164 -9.290 9.705 1196 2HB LYS 9 2HB LYS 9 9.988 -9.254 11.460 1197 1HG LYS 9 1HG LYS 9 7.738 -10.526 10.976 1198 2HG LYS 9 2HG LYS 9 8.507 -10.919 9.441 1199 1HD LYS 9 1HD LYS 9 10.125 -12.239 10.440 1200 2HD LYS 9 2HD LYS 9 10.082 -11.333 11.949 1201 1HE LYS 9 1HE LYS 9 8.096 -12.420 12.674 1202 2HE LYS 9 2HE LYS 9 7.733 -13.013 11.042 1203 1HZ LYS 9 1HZ LYS 9 8.736 -14.801 12.223 1204 2HZ LYS 9 2HZ LYS 9 9.990 -13.814 12.804 1205 3HZ LYS 9 3HZ LYS 9 9.915 -14.210 11.154 1206 H LYS 10 H LYS 10 9.402 -5.350 11.991 1207 HA LYS 10 HA LYS 10 8.336 -6.220 13.870 1208 1HB LYS 10 1HB LYS 10 6.654 -6.503 11.568 1209 2HB LYS 10 2HB LYS 10 6.393 -7.895 12.619 1210 1HG LYS 10 1HG LYS 10 6.411 -5.043 13.635 1211 2HG LYS 10 2HG LYS 10 4.939 -5.872 13.129 1212 1HD LYS 10 1HD LYS 10 6.840 -6.813 15.299 1213 2HD LYS 10 2HD LYS 10 5.260 -6.077 15.566 1214 1HE LYS 10 1HE LYS 10 4.432 -8.024 13.963 1215 2HE LYS 10 2HE LYS 10 5.923 -8.810 14.515 1216 1HZ LYS 10 1HZ LYS 10 4.068 -7.469 16.397 1217 2HZ LYS 10 2HZ LYS 10 5.282 -8.604 16.746 1218 3HZ LYS 10 3HZ LYS 10 3.858 -9.098 15.963 1219 H SER 11 H SER 11 10.600 -7.496 13.554 1220 HA SER 11 HA SER 11 10.010 -10.433 13.660 1221 1HB SER 11 1HB SER 11 12.681 -10.293 13.380 1222 2HB SER 11 2HB SER 11 11.613 -10.158 11.987 1223 HG SER 11 HG SER 11 11.980 -8.063 11.871 1224 HA PRO 12 HA PRO 12 11.429 -10.610 17.809 1225 1HB PRO 12 1HB PRO 12 13.584 -12.542 17.371 1226 2HB PRO 12 2HB PRO 12 12.001 -12.805 18.120 1227 1HG PRO 12 1HG PRO 12 12.737 -13.817 15.695 1228 2HG PRO 12 2HG PRO 12 11.065 -13.506 16.176 1229 1HD PRO 12 1HD PRO 12 12.843 -11.937 14.380 1230 2HD PRO 12 2HD PRO 12 11.085 -12.187 14.301 1231 H LEU 13 H LEU 13 13.905 -10.121 15.392 1232 HA LEU 13 HA LEU 13 15.364 -8.354 17.293 1233 1HB LEU 13 1HB LEU 13 16.146 -10.983 16.554 1234 2HB LEU 13 2HB LEU 13 17.213 -9.888 15.674 1235 HG LEU 13 HG LEU 13 16.690 -9.273 18.547 1236 1HD1 LEU 13 1HD1 LEU 13 18.963 -10.957 18.482 1237 2HD1 LEU 13 2HD1 LEU 13 17.676 -11.835 17.655 1238 3HD1 LEU 13 3HD1 LEU 13 17.433 -11.259 19.304 1239 1HD2 LEU 13 1HD2 LEU 13 18.121 -7.879 17.024 1240 2HD2 LEU 13 2HD2 LEU 13 19.212 -9.255 16.863 1241 3HD2 LEU 13 3HD2 LEU 13 18.987 -8.488 18.435 1242 H GLY 14 H GLY 14 13.647 -8.065 14.805 1243 1HA GLY 14 1HA GLY 14 15.648 -6.519 13.206 1244 2HA GLY 14 2HA GLY 14 14.452 -7.534 12.400 1245 H GLY 15 H GLY 15 14.468 -4.872 11.763 1246 1HA GLY 15 1HA GLY 15 12.426 -3.519 13.426 1247 2HA GLY 15 2HA GLY 15 13.302 -2.795 12.078 1248 H TYR 16 H TYR 16 11.448 -2.106 10.927 1249 HA TYR 16 HA TYR 16 9.397 -4.139 10.229 1250 1HB TYR 16 1HB TYR 16 9.532 -1.312 10.671 1251 2HB TYR 16 2HB TYR 16 8.975 -1.575 9.019 1252 HD1 TYR 16 HD1 TYR 16 7.465 -4.037 9.136 1253 HD2 TYR 16 HD2 TYR 16 7.663 -0.846 12.005 1254 HE1 TYR 16 HE1 TYR 16 5.222 -4.663 9.987 1255 HE2 TYR 16 HE2 TYR 16 5.419 -1.472 12.856 1256 HH TYR 16 HH TYR 16 3.455 -2.649 12.165 1257 H GLY 17 H GLY 17 11.310 -5.192 8.946 1258 1HA GLY 17 1HA GLY 17 11.414 -3.990 6.207 1259 2HA GLY 17 2HA GLY 17 12.704 -4.991 6.877 1260 H VAL 18 H VAL 18 12.289 -6.340 4.882 1261 HA VAL 18 HA VAL 18 9.781 -7.948 5.030 1262 HB VAL 18 HB VAL 18 12.011 -7.732 2.973 1263 1HG1 VAL 18 1HG1 VAL 18 10.723 -9.117 1.554 1264 2HG1 VAL 18 2HG1 VAL 18 9.280 -8.941 2.552 1265 3HG1 VAL 18 3HG1 VAL 18 10.632 -9.918 3.123 1266 1HG2 VAL 18 1HG2 VAL 18 10.675 -5.675 3.208 1267 2HG2 VAL 18 2HG2 VAL 18 9.195 -6.612 3.007 1268 3HG2 VAL 18 3HG2 VAL 18 10.337 -6.470 1.671 1269 H PHE 19 H PHE 19 9.846 -10.110 5.627 1270 HA PHE 19 HA PHE 19 12.509 -11.204 6.424 1271 1HB PHE 19 1HB PHE 19 9.923 -11.125 7.584 1272 2HB PHE 19 2HB PHE 19 10.210 -12.807 7.138 1273 HD1 PHE 19 HD1 PHE 19 11.429 -14.169 8.585 1274 HD2 PHE 19 HD2 PHE 19 11.970 -9.911 8.745 1275 HE1 PHE 19 HE1 PHE 19 12.944 -14.436 10.529 1276 HE2 PHE 19 HE2 PHE 19 13.486 -10.178 10.690 1277 HZ PHE 19 HZ PHE 19 13.973 -12.440 11.583 1278 H ALA 20 H ALA 20 13.396 -12.770 5.161 1279 HA ALA 20 HA ALA 20 11.877 -13.799 2.859 1280 1HB ALA 20 1HB ALA 20 13.972 -13.840 1.982 1281 2HB ALA 20 2HB ALA 20 14.565 -14.853 3.299 1282 3HB ALA 20 3HB ALA 20 14.524 -13.099 3.484 1283 H ARG 21 H ARG 21 10.432 -15.379 3.643 1284 HA ARG 21 HA ARG 21 11.263 -17.489 5.489 1285 1HB ARG 21 1HB ARG 21 8.901 -16.383 4.712 1286 2HB ARG 21 2HB ARG 21 8.921 -17.809 3.674 1287 1HG ARG 21 1HG ARG 21 9.020 -19.290 5.522 1288 2HG ARG 21 2HG ARG 21 9.503 -18.007 6.630 1289 1HD ARG 21 1HD ARG 21 7.126 -17.004 5.776 1290 2HD ARG 21 2HD ARG 21 6.791 -18.743 5.665 1291 HE ARG 21 HE ARG 21 8.170 -18.203 8.119 1292 1HH1 ARG 21 1HH1 ARG 21 5.090 -17.725 6.569 1293 2HH1 ARG 21 2HH1 ARG 21 4.217 -17.708 8.062 1294 1HH2 ARG 21 1HH2 ARG 21 7.014 -18.177 10.046 1295 2HH2 ARG 21 2HH2 ARG 21 5.295 -17.962 10.016 1296 H LYS 22 H LYS 22 11.452 -16.912 2.075 1297 HA LYS 22 HA LYS 22 11.900 -19.782 1.437 1298 1HB LYS 22 1HB LYS 22 10.997 -17.342 0.130 1299 2HB LYS 22 2HB LYS 22 12.288 -18.095 -0.799 1300 1HG LYS 22 1HG LYS 22 10.505 -19.289 -1.648 1301 2HG LYS 22 2HG LYS 22 10.855 -20.298 -0.244 1302 1HD LYS 22 1HD LYS 22 9.002 -17.955 0.055 1303 2HD LYS 22 2HD LYS 22 8.396 -19.449 -0.659 1304 1HE LYS 22 1HE LYS 22 9.980 -19.669 1.871 1305 2HE LYS 22 2HE LYS 22 8.316 -19.066 1.983 1306 1HZ LYS 22 1HZ LYS 22 8.399 -21.502 2.068 1307 2HZ LYS 22 2HZ LYS 22 9.168 -21.536 0.554 1308 3HZ LYS 22 3HZ LYS 22 7.575 -20.962 0.685 1309 H SER 23 H SER 23 15.379 -19.179 0.313 1310 HA SER 23 HA SER 23 12.782 -20.519 -0.299 1311 1HB SER 23 1HB SER 23 14.873 -21.786 0.359 1312 2HB SER 23 2HB SER 23 14.236 -22.248 -1.219 1313 HG SER 23 HG SER 23 16.630 -21.579 -0.811 1314 H PHE 24 H PHE 24 15.234 -18.396 -1.617 1315 HA PHE 24 HA PHE 24 13.691 -18.296 -4.188 1316 1HB PHE 24 1HB PHE 24 15.233 -16.227 -2.585 1317 2HB PHE 24 2HB PHE 24 14.585 -15.914 -4.195 1318 HD1 PHE 24 HD1 PHE 24 12.013 -17.222 -4.228 1319 HD2 PHE 24 HD2 PHE 24 13.918 -15.088 -1.024 1320 HE1 PHE 24 HE1 PHE 24 9.794 -16.721 -3.241 1321 HE2 PHE 24 HE2 PHE 24 11.700 -14.588 -0.037 1322 HZ PHE 24 HZ PHE 24 9.639 -15.404 -1.147 1323 H GLU 25 H GLU 25 14.973 -17.766 -6.113 1324 HA GLU 25 HA GLU 25 17.713 -18.945 -5.993 1325 1HB GLU 25 1HB GLU 25 15.598 -19.551 -7.538 1326 2HB GLU 25 2HB GLU 25 16.268 -18.254 -8.526 1327 1HG GLU 25 1HG GLU 25 18.461 -19.854 -7.733 1328 2HG GLU 25 2HG GLU 25 17.195 -20.970 -8.243 1329 H LYS 26 H LYS 26 18.631 -17.758 -8.420 1330 HA LYS 26 HA LYS 26 19.199 -15.000 -7.453 1331 1HB LYS 26 1HB LYS 26 20.939 -16.790 -8.114 1332 2HB LYS 26 2HB LYS 26 20.435 -16.499 -9.778 1333 1HG LYS 26 1HG LYS 26 20.962 -14.087 -9.496 1334 2HG LYS 26 2HG LYS 26 21.522 -14.418 -7.857 1335 1HD LYS 26 1HD LYS 26 23.273 -15.883 -8.699 1336 2HD LYS 26 2HD LYS 26 22.665 -15.718 -10.346 1337 1HE LYS 26 1HE LYS 26 23.081 -13.084 -9.281 1338 2HE LYS 26 2HE LYS 26 24.553 -14.041 -9.021 1339 1HZ LYS 26 1HZ LYS 26 23.034 -13.808 -11.571 1340 2HZ LYS 26 2HZ LYS 26 24.396 -14.794 -11.334 1341 3HZ LYS 26 3HZ LYS 26 24.545 -13.104 -11.249 1342 H GLY 27 H GLY 27 17.129 -14.077 -8.141 1343 1HA GLY 27 1HA GLY 27 16.404 -12.499 -9.888 1344 2HA GLY 27 2HA GLY 27 17.021 -13.630 -11.093 1345 H GLU 28 H GLU 28 14.501 -13.238 -8.610 1346 HA GLU 28 HA GLU 28 12.608 -14.722 -10.336 1347 1HB GLU 28 1HB GLU 28 14.102 -15.883 -8.172 1348 2HB GLU 28 2HB GLU 28 12.405 -15.817 -7.696 1349 1HG GLU 28 1HG GLU 28 11.876 -16.822 -9.992 1350 2HG GLU 28 2HG GLU 28 13.604 -17.147 -10.134 1351 H LEU 29 H LEU 29 10.515 -13.953 -10.012 1352 HA LEU 29 HA LEU 29 9.981 -11.575 -8.582 1353 1HB LEU 29 1HB LEU 29 8.653 -13.409 -10.243 1354 2HB LEU 29 2HB LEU 29 7.714 -13.424 -8.757 1355 HG LEU 29 HG LEU 29 8.318 -11.064 -10.547 1356 1HD1 LEU 29 1HD1 LEU 29 5.620 -11.507 -9.488 1357 2HD1 LEU 29 2HD1 LEU 29 6.222 -12.847 -10.465 1358 3HD1 LEU 29 3HD1 LEU 29 6.145 -11.223 -11.148 1359 1HD2 LEU 29 1HD2 LEU 29 7.319 -11.090 -7.690 1360 2HD2 LEU 29 2HD2 LEU 29 7.010 -9.745 -8.789 1361 3HD2 LEU 29 3HD2 LEU 29 8.666 -10.166 -8.355 1362 H VAL 30 H VAL 30 8.865 -11.253 -6.525 1363 HA VAL 30 HA VAL 30 8.825 -13.638 -4.713 1364 HB VAL 30 HB VAL 30 10.112 -10.921 -4.243 1365 1HG1 VAL 30 1HG1 VAL 30 10.653 -11.687 -2.022 1366 2HG1 VAL 30 2HG1 VAL 30 10.006 -13.292 -2.361 1367 3HG1 VAL 30 3HG1 VAL 30 8.917 -11.910 -2.241 1368 1HG2 VAL 30 1HG2 VAL 30 11.921 -12.980 -3.715 1369 2HG2 VAL 30 2HG2 VAL 30 11.903 -11.952 -5.148 1370 3HG2 VAL 30 3HG2 VAL 30 11.076 -13.510 -5.169 1371 H GLU 31 H GLU 31 8.040 -10.158 -4.964 1372 HA GLU 31 HA GLU 31 5.271 -10.671 -4.142 1373 1HB GLU 31 1HB GLU 31 6.629 -10.703 -2.028 1374 2HB GLU 31 2HB GLU 31 7.167 -9.063 -2.389 1375 1HG GLU 31 1HG GLU 31 5.351 -8.521 -1.092 1376 2HG GLU 31 2HG GLU 31 4.505 -8.706 -2.628 1377 H GLU 32 H GLU 32 4.235 -9.335 -5.573 1378 HA GLU 32 HA GLU 32 5.384 -6.599 -5.998 1379 1HB GLU 32 1HB GLU 32 4.717 -6.837 -8.324 1380 2HB GLU 32 2HB GLU 32 5.637 -8.267 -7.877 1381 1HG GLU 32 1HG GLU 32 3.437 -9.419 -7.387 1382 2HG GLU 32 2HG GLU 32 2.624 -8.026 -8.099 1383 H CYS 33 H CYS 33 3.859 -4.887 -6.006 1384 HA CYS 33 HA CYS 33 0.990 -5.628 -5.585 1385 1HB CYS 33 1HB CYS 33 2.700 -3.756 -3.907 1386 2HB CYS 33 2HB CYS 33 0.986 -4.070 -3.649 1387 HG CYS 33 HG CYS 33 3.179 -6.282 -3.322 1388 H LEU 34 H LEU 34 0.100 -3.023 -5.030 1389 HA LEU 34 HA LEU 34 0.355 -1.771 -7.708 1390 1HB LEU 34 1HB LEU 34 -1.564 -1.926 -5.458 1391 2HB LEU 34 2HB LEU 34 -1.501 -0.354 -6.252 1392 HG LEU 34 HG LEU 34 -3.182 -1.900 -7.275 1393 1HD1 LEU 34 1HD1 LEU 34 -1.732 -1.790 -9.631 1394 2HD1 LEU 34 2HD1 LEU 34 -0.980 -0.536 -8.644 1395 3HD1 LEU 34 3HD1 LEU 34 -2.712 -0.480 -8.970 1396 1HD2 LEU 34 1HD2 LEU 34 -2.599 -3.930 -8.254 1397 2HD2 LEU 34 2HD2 LEU 34 -1.524 -3.908 -6.856 1398 3HD2 LEU 34 3HD2 LEU 34 -0.908 -3.468 -8.449 1399 H CYS 35 H CYS 35 0.160 0.802 -7.491 1400 HA CYS 35 HA CYS 35 1.770 1.879 -5.248 1401 1HB CYS 35 1HB CYS 35 2.651 1.513 -8.090 1402 2HB CYS 35 2HB CYS 35 3.170 2.976 -7.254 1403 HG CYS 35 HG CYS 35 4.642 0.559 -6.913 1404 H ILE 36 H ILE 36 1.734 4.266 -5.243 1405 HA ILE 36 HA ILE 36 -0.653 5.340 -6.699 1406 HB ILE 36 HB ILE 36 0.851 6.444 -4.299 1407 1HG1 ILE 36 1HG1 ILE 36 -1.693 4.793 -4.311 1408 2HG1 ILE 36 2HG1 ILE 36 -0.103 4.158 -3.883 1409 1HG2 ILE 36 1HG2 ILE 36 -1.581 7.426 -4.005 1410 2HG2 ILE 36 2HG2 ILE 36 -1.688 7.128 -5.740 1411 3HG2 ILE 36 3HG2 ILE 36 -0.441 8.201 -5.105 1412 1HD1 ILE 36 1HD1 ILE 36 -1.797 5.167 -2.045 1413 2HD1 ILE 36 2HD1 ILE 36 -0.957 6.649 -2.499 1414 3HD1 ILE 36 3HD1 ILE 36 -0.045 5.274 -1.878 1415 H VAL 37 H VAL 37 0.110 6.243 -8.614 1416 HA VAL 37 HA VAL 37 2.718 7.620 -8.672 1417 HB VAL 37 HB VAL 37 0.535 7.081 -10.719 1418 1HG1 VAL 37 1HG1 VAL 37 2.625 8.971 -10.841 1419 2HG1 VAL 37 2HG1 VAL 37 1.637 8.393 -12.183 1420 3HG1 VAL 37 3HG1 VAL 37 3.167 7.599 -11.809 1421 1HG2 VAL 37 1HG2 VAL 37 2.528 5.569 -11.552 1422 2HG2 VAL 37 2HG2 VAL 37 1.485 5.004 -10.246 1423 3HG2 VAL 37 3HG2 VAL 37 3.064 5.698 -9.877 1424 H ARG 38 H ARG 38 2.880 9.765 -8.201 1425 HA ARG 38 HA ARG 38 0.609 11.568 -8.921 1426 1HB ARG 38 1HB ARG 38 0.569 10.795 -6.502 1427 2HB ARG 38 2HB ARG 38 2.122 11.603 -6.288 1428 1HG ARG 38 1HG ARG 38 0.500 13.198 -5.591 1429 2HG ARG 38 2HG ARG 38 0.969 13.706 -7.213 1430 1HD ARG 38 1HD ARG 38 -1.045 12.935 -8.169 1431 2HD ARG 38 2HD ARG 38 -1.379 11.846 -6.809 1432 HE ARG 38 HE ARG 38 -1.270 14.367 -5.646 1433 1HH1 ARG 38 1HH1 ARG 38 -3.061 12.925 -8.260 1434 2HH1 ARG 38 2HH1 ARG 38 -4.433 13.952 -8.032 1435 1HH2 ARG 38 1HH2 ARG 38 -3.064 15.689 -5.371 1436 2HH2 ARG 38 2HH2 ARG 38 -4.437 15.505 -6.410 1437 H HIS 39 H HIS 39 1.288 13.705 -9.439 1438 HA HIS 39 HA HIS 39 3.908 14.028 -10.531 1439 1HB HIS 39 1HB HIS 39 1.530 15.738 -9.878 1440 2HB HIS 39 2HB HIS 39 3.032 16.545 -10.328 1441 HD1 HIS 39 HD1 HIS 39 0.978 16.986 -12.364 1442 HD2 HIS 39 HD2 HIS 39 3.214 13.466 -12.359 1443 HE1 HIS 39 HE1 HIS 39 0.829 16.038 -14.708 1444 H ASN 40 H ASN 40 5.021 16.335 -9.738 1445 HA ASN 40 HA ASN 40 5.925 15.744 -6.968 1446 1HB ASN 40 1HB ASN 40 7.359 16.096 -9.131 1447 2HB ASN 40 2HB ASN 40 7.046 17.811 -8.863 1448 1HD2 ASN 40 1HD2 ASN 40 8.624 14.940 -7.481 1449 2HD2 ASN 40 2HD2 ASN 40 9.560 15.789 -6.348 1450 H ASP 41 H ASP 41 4.840 16.840 -5.391 1451 HA ASP 41 HA ASP 41 4.732 19.720 -5.308 1452 1HB ASP 41 1HB ASP 41 2.923 18.739 -7.036 1453 2HB ASP 41 2HB ASP 41 1.992 18.527 -5.554 1454 H ASP 42 H ASP 42 2.033 19.458 -3.783 1455 HA ASP 42 HA ASP 42 2.944 19.181 -1.148 1456 1HB ASP 42 1HB ASP 42 0.538 18.771 -0.658 1457 2HB ASP 42 2HB ASP 42 0.731 20.036 -1.872 1458 H TRP 43 H TRP 43 2.192 16.715 -3.503 1459 HA TRP 43 HA TRP 43 2.046 14.454 -1.696 1460 1HB TRP 43 1HB TRP 43 1.068 14.267 -3.861 1461 2HB TRP 43 2HB TRP 43 2.482 14.956 -4.652 1462 HD1 TRP 43 HD1 TRP 43 4.399 13.363 -5.351 1463 HE1 TRP 43 HE1 TRP 43 4.694 10.803 -5.319 1464 HE3 TRP 43 HE3 TRP 43 0.423 12.051 -2.425 1465 HZ2 TRP 43 HZ2 TRP 43 3.413 8.504 -4.203 1466 HZ3 TRP 43 HZ3 TRP 43 -0.015 9.671 -1.895 1467 HH2 TRP 43 HH2 TRP 43 1.474 7.897 -2.778 1468 H GLY 44 H GLY 44 4.628 15.911 -3.689 1469 1HA GLY 44 1HA GLY 44 6.677 14.042 -3.096 1470 2HA GLY 44 2HA GLY 44 6.960 15.729 -3.529 1471 H THR 45 H THR 45 5.316 16.655 -1.194 1472 HA THR 45 HA THR 45 7.488 16.489 0.813 1473 HB THR 45 HB THR 45 4.902 18.077 0.635 1474 HG1 THR 45 HG1 THR 45 6.077 19.172 -0.699 1475 1HG2 THR 45 1HG2 THR 45 6.998 19.162 2.331 1476 2HG2 THR 45 2HG2 THR 45 6.511 17.557 2.877 1477 3HG2 THR 45 3HG2 THR 45 5.309 18.838 2.721 1478 H ALA 46 H ALA 46 3.899 16.308 1.040 1479 HA ALA 46 HA ALA 46 3.691 15.140 3.576 1480 1HB ALA 46 1HB ALA 46 1.926 15.939 1.831 1481 2HB ALA 46 2HB ALA 46 1.484 14.594 2.885 1482 3HB ALA 46 3HB ALA 46 1.992 14.284 1.225 1483 H LEU 47 H LEU 47 3.671 13.319 0.484 1484 HA LEU 47 HA LEU 47 4.451 10.858 1.950 1485 1HB LEU 47 1HB LEU 47 3.496 11.572 -0.832 1486 2HB LEU 47 2HB LEU 47 4.168 9.978 -0.498 1487 HG LEU 47 HG LEU 47 1.740 9.894 -0.260 1488 1HD1 LEU 47 1HD1 LEU 47 3.586 9.130 1.708 1489 2HD1 LEU 47 2HD1 LEU 47 1.944 8.517 1.511 1490 3HD1 LEU 47 3HD1 LEU 47 2.255 9.871 2.597 1491 1HD2 LEU 47 1HD2 LEU 47 0.506 11.337 1.161 1492 2HD2 LEU 47 2HD2 LEU 47 1.618 12.401 0.300 1493 3HD2 LEU 47 3HD2 LEU 47 1.963 11.924 1.963 1494 H GLU 48 H GLU 48 6.412 12.955 1.872 1495 HA GLU 48 HA GLU 48 8.273 12.660 -0.291 1496 1HB GLU 48 1HB GLU 48 9.790 13.837 1.310 1497 2HB GLU 48 2HB GLU 48 8.201 14.591 1.220 1498 1HG GLU 48 1HG GLU 48 8.350 14.475 3.499 1499 2HG GLU 48 2HG GLU 48 7.748 12.842 3.231 1500 H ASP 49 H ASP 49 7.483 10.474 2.203 1501 HA ASP 49 HA ASP 49 10.145 9.126 1.936 1502 1HB ASP 49 1HB ASP 49 8.914 10.036 4.183 1503 2HB ASP 49 2HB ASP 49 8.229 8.415 4.105 1504 H TYR 50 H TYR 50 9.915 6.672 2.149 1505 HA TYR 50 HA TYR 50 9.086 4.665 1.215 1506 1HB TYR 50 1HB TYR 50 6.523 6.089 2.025 1507 2HB TYR 50 2HB TYR 50 6.657 4.362 1.701 1508 HD1 TYR 50 HD1 TYR 50 9.295 3.750 2.944 1509 HD2 TYR 50 HD2 TYR 50 6.044 6.191 4.333 1510 HE1 TYR 50 HE1 TYR 50 10.003 3.361 5.288 1511 HE2 TYR 50 HE2 TYR 50 6.753 5.801 6.676 1512 HH TYR 50 HH TYR 50 8.436 3.504 7.725 1513 H LEU 51 H LEU 51 9.304 7.163 -0.554 1514 HA LEU 51 HA LEU 51 7.270 6.380 -2.617 1515 1HB LEU 51 1HB LEU 51 8.136 8.875 -1.462 1516 2HB LEU 51 2HB LEU 51 8.508 8.888 -3.181 1517 HG LEU 51 HG LEU 51 6.143 8.136 -3.619 1518 1HD1 LEU 51 1HD1 LEU 51 5.900 8.706 -0.653 1519 2HD1 LEU 51 2HD1 LEU 51 5.619 7.167 -1.457 1520 3HD1 LEU 51 3HD1 LEU 51 4.525 8.520 -1.740 1521 1HD2 LEU 51 1HD2 LEU 51 5.209 10.462 -2.666 1522 2HD2 LEU 51 2HD2 LEU 51 6.315 10.393 -4.039 1523 3HD2 LEU 51 3HD2 LEU 51 6.933 10.752 -2.426 1524 H PHE 52 H PHE 52 8.091 5.425 -4.423 1525 HA PHE 52 HA PHE 52 11.013 5.486 -4.943 1526 1HB PHE 52 1HB PHE 52 8.594 4.035 -6.055 1527 2HB PHE 52 2HB PHE 52 10.165 3.937 -6.851 1528 HD1 PHE 52 HD1 PHE 52 8.405 3.334 -3.622 1529 HD2 PHE 52 HD2 PHE 52 11.888 2.539 -6.006 1530 HE1 PHE 52 HE1 PHE 52 9.124 1.608 -1.996 1531 HE2 PHE 52 HE2 PHE 52 12.608 0.811 -4.379 1532 HZ PHE 52 HZ PHE 52 11.226 0.345 -2.374 1533 H SER 53 H SER 53 11.525 7.496 -5.845 1534 HA SER 53 HA SER 53 9.633 8.790 -7.674 1535 1HB SER 53 1HB SER 53 10.812 10.068 -5.969 1536 2HB SER 53 2HB SER 53 12.369 9.518 -6.590 1537 HG SER 53 HG SER 53 11.924 11.555 -7.407 1538 H ARG 54 H ARG 54 9.668 8.395 -9.829 1539 HA ARG 54 HA ARG 54 12.123 7.272 -11.084 1540 1HB ARG 54 1HB ARG 54 9.668 6.396 -11.277 1541 2HB ARG 54 2HB ARG 54 9.432 7.753 -12.378 1542 1HG ARG 54 1HG ARG 54 10.618 6.756 -14.034 1543 2HG ARG 54 2HG ARG 54 11.879 6.220 -12.923 1544 1HD ARG 54 1HD ARG 54 9.662 4.669 -12.214 1545 2HD ARG 54 2HD ARG 54 9.613 4.718 -13.986 1546 HE ARG 54 HE ARG 54 11.656 3.415 -12.386 1547 1HH1 ARG 54 1HH1 ARG 54 11.080 5.202 -15.318 1548 2HH1 ARG 54 2HH1 ARG 54 12.441 4.514 -16.134 1549 1HH2 ARG 54 1HH2 ARG 54 13.417 2.537 -13.467 1550 2HH2 ARG 54 2HH2 ARG 54 13.755 3.017 -15.096 1551 H LYS 55 H LYS 55 12.368 8.190 -13.479 1552 HA LYS 55 HA LYS 55 12.873 11.051 -13.214 1553 1HB LYS 55 1HB LYS 55 14.311 9.340 -14.391 1554 2HB LYS 55 2HB LYS 55 13.061 9.215 -15.629 1555 1HG LYS 55 1HG LYS 55 13.585 11.242 -16.545 1556 2HG LYS 55 2HG LYS 55 13.935 11.971 -14.978 1557 1HD LYS 55 1HD LYS 55 16.042 10.489 -14.956 1558 2HD LYS 55 2HD LYS 55 15.729 10.226 -16.671 1559 1HE LYS 55 1HE LYS 55 15.480 13.022 -16.240 1560 2HE LYS 55 2HE LYS 55 16.963 12.508 -15.413 1561 1HZ LYS 55 1HZ LYS 55 17.415 11.146 -17.476 1562 2HZ LYS 55 2HZ LYS 55 17.563 12.827 -17.661 1563 3HZ LYS 55 3HZ LYS 55 16.179 12.029 -18.236 1564 H ASN 56 H ASN 56 10.592 11.695 -12.910 1565 HA ASN 56 HA ASN 56 8.754 11.410 -15.194 1566 1HB ASN 56 1HB ASN 56 10.326 13.210 -15.855 1567 2HB ASN 56 2HB ASN 56 8.717 13.871 -15.567 1568 1HD2 ASN 56 1HD2 ASN 56 8.884 15.815 -14.448 1569 2HD2 ASN 56 2HD2 ASN 56 9.994 16.136 -13.204 1570 H MET 57 H MET 57 8.951 11.008 -12.136 1571 HA MET 57 HA MET 57 7.203 12.920 -10.873 1572 1HB MET 57 1HB MET 57 5.137 11.513 -10.942 1573 2HB MET 57 2HB MET 57 5.635 12.027 -12.552 1574 1HG MET 57 1HG MET 57 6.898 9.516 -11.734 1575 2HG MET 57 2HG MET 57 5.138 9.408 -11.767 1576 1HE MET 57 1HE MET 57 3.763 9.187 -14.312 1577 2HE MET 57 2HE MET 57 4.135 10.700 -15.137 1578 3HE MET 57 3HE MET 57 3.856 10.691 -13.396 1579 H SER 58 H SER 58 6.022 11.676 -8.911 1580 HA SER 58 HA SER 58 7.988 9.709 -7.788 1581 1HB SER 58 1HB SER 58 6.387 11.851 -6.346 1582 2HB SER 58 2HB SER 58 7.661 10.849 -5.651 1583 HG SER 58 HG SER 58 7.912 13.163 -6.883 1584 H ALA 59 H ALA 59 7.064 7.864 -6.839 1585 HA ALA 59 HA ALA 59 4.080 7.844 -6.568 1586 1HB ALA 59 1HB ALA 59 4.400 5.401 -7.436 1587 2HB ALA 59 2HB ALA 59 5.980 5.967 -7.978 1588 3HB ALA 59 3HB ALA 59 4.513 6.717 -8.606 1589 H MET 60 H MET 60 3.266 6.382 -4.950 1590 HA MET 60 HA MET 60 5.181 5.827 -2.768 1591 1HB MET 60 1HB MET 60 3.080 6.894 -2.219 1592 2HB MET 60 2HB MET 60 2.168 5.683 -3.116 1593 1HG MET 60 1HG MET 60 1.983 5.185 -0.745 1594 2HG MET 60 2HG MET 60 2.985 3.947 -1.501 1595 1HE MET 60 1HE MET 60 3.909 7.703 0.428 1596 2HE MET 60 2HE MET 60 3.586 6.660 1.814 1597 3HE MET 60 3HE MET 60 2.413 6.772 0.502 1598 H ALA 61 H ALA 61 5.389 3.706 -1.829 1599 HA ALA 61 HA ALA 61 5.216 1.524 -3.801 1600 1HB ALA 61 1HB ALA 61 6.517 2.135 -1.184 1601 2HB ALA 61 2HB ALA 61 7.216 1.433 -2.644 1602 3HB ALA 61 3HB ALA 61 6.253 0.431 -1.558 1603 H LEU 62 H LEU 62 2.950 1.046 -3.909 1604 HA LEU 62 HA LEU 62 0.980 -0.073 -3.251 1605 1HB LEU 62 1HB LEU 62 0.946 0.566 -0.480 1606 2HB LEU 62 2HB LEU 62 1.723 1.921 -1.300 1607 HG LEU 62 HG LEU 62 -0.228 1.778 -2.985 1608 1HD1 LEU 62 1HD1 LEU 62 -2.088 0.793 -1.025 1609 2HD1 LEU 62 2HD1 LEU 62 -0.849 -0.430 -1.309 1610 3HD1 LEU 62 3HD1 LEU 62 -1.795 0.197 -2.659 1611 1HD2 LEU 62 1HD2 LEU 62 0.117 3.491 -1.115 1612 2HD2 LEU 62 2HD2 LEU 62 -1.012 2.529 -0.162 1613 3HD2 LEU 62 3HD2 LEU 62 -1.544 3.274 -1.669 1614 H GLY 63 H GLY 63 3.546 -1.533 -3.046 1615 1HA GLY 63 1HA GLY 63 2.585 -3.694 -1.294 1616 2HA GLY 63 2HA GLY 63 3.939 -3.799 -2.417 1617 H PHE 64 H PHE 64 5.610 -4.442 -1.104 1618 HA PHE 64 HA PHE 64 5.980 -3.200 1.556 1619 1HB PHE 64 1HB PHE 64 7.487 -5.328 -0.011 1620 2HB PHE 64 2HB PHE 64 7.780 -4.926 1.680 1621 HD1 PHE 64 HD1 PHE 64 6.298 -5.666 3.422 1622 HD2 PHE 64 HD2 PHE 64 5.309 -6.323 -0.706 1623 HE1 PHE 64 HE1 PHE 64 4.469 -7.195 4.104 1624 HE2 PHE 64 HE2 PHE 64 3.480 -7.853 -0.025 1625 HZ PHE 64 HZ PHE 64 3.060 -8.289 2.380 1626 H GLY 65 H GLY 65 6.479 -1.840 -1.225 1627 1HA GLY 65 1HA GLY 65 9.278 -1.420 -1.512 1628 2HA GLY 65 2HA GLY 65 8.037 -0.320 -2.091 1629 H ALA 66 H ALA 66 7.022 -0.200 0.820 1630 HA ALA 66 HA ALA 66 8.744 2.077 1.586 1631 1HB ALA 66 1HB ALA 66 6.240 2.141 1.527 1632 2HB ALA 66 2HB ALA 66 6.880 2.518 3.127 1633 3HB ALA 66 3HB ALA 66 6.208 0.921 2.801 1634 H ILE 67 H ILE 67 7.346 -0.712 3.359 1635 HA ILE 67 HA ILE 67 8.852 -0.482 5.711 1636 HB ILE 67 HB ILE 67 8.375 -2.961 5.889 1637 1HG1 ILE 67 1HG1 ILE 67 6.719 -3.556 3.834 1638 2HG1 ILE 67 2HG1 ILE 67 7.883 -2.541 2.988 1639 1HG2 ILE 67 1HG2 ILE 67 6.289 -0.948 5.091 1640 2HG2 ILE 67 2HG2 ILE 67 6.637 -1.613 6.688 1641 3HG2 ILE 67 3HG2 ILE 67 5.823 -2.605 5.477 1642 1HD1 ILE 67 1HD1 ILE 67 9.454 -4.173 4.621 1643 2HD1 ILE 67 2HD1 ILE 67 9.223 -4.345 2.882 1644 3HD1 ILE 67 3HD1 ILE 67 8.201 -5.248 4.000 1645 H PHE 68 H PHE 68 9.992 -1.500 2.577 1646 HA PHE 68 HA PHE 68 12.068 -3.262 3.139 1647 1HB PHE 68 1HB PHE 68 11.446 -1.158 1.165 1648 2HB PHE 68 2HB PHE 68 13.168 -1.493 1.303 1649 HD1 PHE 68 HD1 PHE 68 13.052 -4.439 2.002 1650 HD2 PHE 68 HD2 PHE 68 10.932 -2.121 -0.919 1651 HE1 PHE 68 HE1 PHE 68 12.747 -6.468 0.613 1652 HE2 PHE 68 HE2 PHE 68 10.625 -4.144 -2.308 1653 HZ PHE 68 HZ PHE 68 11.532 -6.322 -1.545 1654 H ASN 69 H ASN 69 14.224 -3.054 3.867 1655 HA ASN 69 HA ASN 69 14.867 -0.446 5.204 1656 1HB ASN 69 1HB ASN 69 15.542 -3.325 5.916 1657 2HB ASN 69 2HB ASN 69 16.085 -1.916 6.828 1658 1HD2 ASN 69 1HD2 ASN 69 14.472 -3.787 8.165 1659 2HD2 ASN 69 2HD2 ASN 69 12.926 -3.133 8.417 1660 H HIS 70 H HIS 70 17.337 -0.230 5.529 1661 HA HIS 70 HA HIS 70 18.639 -0.730 2.914 1662 1HB HIS 70 1HB HIS 70 18.604 1.512 3.985 1663 2HB HIS 70 2HB HIS 70 19.459 0.852 5.379 1664 HD1 HIS 70 HD1 HIS 70 19.961 1.975 1.860 1665 HD2 HIS 70 HD2 HIS 70 22.207 0.140 4.854 1666 HE1 HIS 70 HE1 HIS 70 22.378 2.081 1.110 1667 H SER 71 H SER 71 20.624 -1.863 2.729 1668 HA SER 71 HA SER 71 21.907 -3.036 5.100 1669 1HB SER 71 1HB SER 71 20.056 -4.557 4.847 1670 2HB SER 71 2HB SER 71 20.266 -4.618 3.097 1671 HG SER 71 HG SER 71 21.333 -6.203 4.891 1672 H LYS 72 H LYS 72 24.068 -3.250 4.627 1673 HA LYS 72 HA LYS 72 25.264 -2.409 2.230 1674 1HB LYS 72 1HB LYS 72 25.973 -3.901 4.671 1675 2HB LYS 72 2HB LYS 72 27.016 -4.270 3.297 1676 1HG LYS 72 1HG LYS 72 28.076 -2.407 4.255 1677 2HG LYS 72 2HG LYS 72 27.098 -1.678 2.981 1678 1HD LYS 72 1HD LYS 72 25.616 -0.735 4.470 1679 2HD LYS 72 2HD LYS 72 25.811 -2.033 5.648 1680 1HE LYS 72 1HE LYS 72 28.281 -0.492 5.213 1681 2HE LYS 72 2HE LYS 72 26.951 0.472 5.883 1682 1HZ LYS 72 1HZ LYS 72 27.814 -2.196 6.886 1683 2HZ LYS 72 2HZ LYS 72 26.586 -1.227 7.548 1684 3HZ LYS 72 3HZ LYS 72 28.204 -0.715 7.621 1685 H ASP 73 H ASP 73 23.925 -5.559 3.046 1686 HA ASP 73 HA ASP 73 24.819 -6.583 0.370 1687 1HB ASP 73 1HB ASP 73 25.719 -7.685 2.453 1688 2HB ASP 73 2HB ASP 73 24.064 -8.109 2.889 1689 HA PRO 74 HA PRO 74 20.181 -6.141 0.380 1690 1HB PRO 74 1HB PRO 74 20.102 -5.356 -2.288 1691 2HB PRO 74 2HB PRO 74 20.160 -4.235 -0.917 1692 1HG PRO 74 1HG PRO 74 22.337 -5.141 -2.723 1693 2HG PRO 74 2HG PRO 74 22.077 -3.561 -1.973 1694 1HD PRO 74 1HD PRO 74 23.916 -5.352 -1.081 1695 2HD PRO 74 2HD PRO 74 23.108 -4.180 -0.020 1696 H ASN 75 H ASN 75 19.693 -8.343 0.364 1697 HA ASN 75 HA ASN 75 20.667 -10.190 -1.638 1698 1HB ASN 75 1HB ASN 75 18.422 -10.276 0.410 1699 2HB ASN 75 2HB ASN 75 18.989 -11.682 -0.492 1700 1HD2 ASN 75 1HD2 ASN 75 19.652 -12.612 1.655 1701 2HD2 ASN 75 2HD2 ASN 75 21.102 -12.098 2.372 1702 H ALA 76 H ALA 76 18.168 -7.843 -1.695 1703 HA ALA 76 HA ALA 76 17.112 -9.043 -4.202 1704 1HB ALA 76 1HB ALA 76 15.488 -9.872 -2.753 1705 2HB ALA 76 2HB ALA 76 14.794 -8.288 -3.100 1706 3HB ALA 76 3HB ALA 76 15.696 -8.549 -1.606 1707 H ARG 77 H ARG 77 15.877 -7.457 -5.483 1708 HA ARG 77 HA ARG 77 16.492 -4.612 -4.751 1709 1HB ARG 77 1HB ARG 77 17.952 -5.701 -6.525 1710 2HB ARG 77 2HB ARG 77 16.503 -5.877 -7.515 1711 1HG ARG 77 1HG ARG 77 17.289 -3.837 -8.293 1712 2HG ARG 77 2HG ARG 77 16.237 -3.289 -6.989 1713 1HD ARG 77 1HD ARG 77 18.278 -3.362 -5.461 1714 2HD ARG 77 2HD ARG 77 19.254 -3.597 -6.924 1715 HE ARG 77 HE ARG 77 17.579 -1.444 -7.519 1716 1HH1 ARG 77 1HH1 ARG 77 19.926 -2.194 -5.060 1717 2HH1 ARG 77 2HH1 ARG 77 20.376 -0.540 -4.830 1718 1HH2 ARG 77 1HH2 ARG 77 18.179 0.695 -7.203 1719 2HH2 ARG 77 2HH2 ARG 77 19.395 1.085 -6.033 1720 H HIS 78 H HIS 78 14.921 -3.059 -5.575 1721 HA HIS 78 HA HIS 78 12.204 -4.198 -5.789 1722 1HB HIS 78 1HB HIS 78 11.570 -1.824 -5.478 1723 2HB HIS 78 2HB HIS 78 12.771 -2.306 -4.280 1724 HD1 HIS 78 HD1 HIS 78 15.005 -1.101 -4.308 1725 HD2 HIS 78 HD2 HIS 78 12.671 -0.202 -7.643 1726 HE1 HIS 78 HE1 HIS 78 16.183 0.786 -5.520 1727 H GLU 79 H GLU 79 11.007 -4.212 -7.668 1728 HA GLU 79 HA GLU 79 12.247 -2.964 -10.100 1729 1HB GLU 79 1HB GLU 79 12.001 -5.545 -9.747 1730 2HB GLU 79 2HB GLU 79 10.289 -5.265 -10.067 1731 1HG GLU 79 1HG GLU 79 10.708 -4.480 -12.256 1732 2HG GLU 79 2HG GLU 79 12.418 -4.205 -11.924 1733 H LEU 80 H LEU 80 10.578 -2.310 -11.765 1734 HA LEU 80 HA LEU 80 8.055 -1.367 -10.439 1735 1HB LEU 80 1HB LEU 80 10.067 -0.083 -12.272 1736 2HB LEU 80 2HB LEU 80 8.398 0.485 -12.297 1737 HG LEU 80 HG LEU 80 10.129 0.280 -9.814 1738 1HD1 LEU 80 1HD1 LEU 80 9.571 2.469 -11.767 1739 2HD1 LEU 80 2HD1 LEU 80 11.029 2.147 -10.829 1740 3HD1 LEU 80 3HD1 LEU 80 9.633 2.899 -10.058 1741 1HD2 LEU 80 1HD2 LEU 80 8.074 1.918 -9.178 1742 2HD2 LEU 80 2HD2 LEU 80 8.023 0.175 -8.916 1743 3HD2 LEU 80 3HD2 LEU 80 7.267 0.873 -10.348 1744 H THR 81 H THR 81 6.230 -1.090 -11.948 1745 HA THR 81 HA THR 81 6.419 -2.850 -14.366 1746 HB THR 81 HB THR 81 4.379 -2.704 -12.123 1747 HG1 THR 81 HG1 THR 81 5.830 -4.907 -13.136 1748 1HG2 THR 81 1HG2 THR 81 3.045 -2.988 -14.061 1749 2HG2 THR 81 2HG2 THR 81 3.296 -4.623 -13.450 1750 3HG2 THR 81 3HG2 THR 81 4.236 -4.042 -14.824 1751 H ALA 82 H ALA 82 5.893 -1.624 -16.136 1752 HA ALA 82 HA ALA 82 4.893 0.062 -17.456 1753 1HB ALA 82 1HB ALA 82 2.452 0.424 -16.090 1754 2HB ALA 82 2HB ALA 82 2.939 -1.232 -15.728 1755 3HB ALA 82 3HB ALA 82 2.759 -0.712 -17.404 1756 H GLY 83 H GLY 83 6.665 1.380 -16.091 1757 1HA GLY 83 1HA GLY 83 7.128 3.557 -15.311 1758 2HA GLY 83 2HA GLY 83 5.398 3.895 -15.372 1759 H LEU 84 H LEU 84 4.547 4.302 -13.394 1760 HA LEU 84 HA LEU 84 5.788 2.953 -11.016 1761 1HB LEU 84 1HB LEU 84 4.501 5.675 -11.422 1762 2HB LEU 84 2HB LEU 84 4.942 5.042 -9.837 1763 HG LEU 84 HG LEU 84 6.938 5.201 -12.098 1764 1HD1 LEU 84 1HD1 LEU 84 5.780 7.447 -11.325 1765 2HD1 LEU 84 2HD1 LEU 84 7.531 7.378 -11.524 1766 3HD1 LEU 84 3HD1 LEU 84 6.820 7.254 -9.914 1767 1HD2 LEU 84 1HD2 LEU 84 8.325 5.496 -9.809 1768 2HD2 LEU 84 2HD2 LEU 84 7.939 3.911 -10.480 1769 3HD2 LEU 84 3HD2 LEU 84 6.950 4.586 -9.185 1770 H LYS 85 H LYS 85 3.461 2.107 -12.790 1771 HA LYS 85 HA LYS 85 1.036 2.507 -11.224 1772 1HB LYS 85 1HB LYS 85 1.932 0.795 -13.549 1773 2HB LYS 85 2HB LYS 85 0.323 0.601 -12.856 1774 1HG LYS 85 1HG LYS 85 1.396 3.291 -13.730 1775 2HG LYS 85 2HG LYS 85 0.513 2.229 -14.826 1776 1HD LYS 85 1HD LYS 85 -1.481 2.431 -13.626 1777 2HD LYS 85 2HD LYS 85 -0.653 2.874 -12.133 1778 1HE LYS 85 1HE LYS 85 0.107 4.955 -13.698 1779 2HE LYS 85 2HE LYS 85 -1.474 4.594 -14.416 1780 1HZ LYS 85 1HZ LYS 85 -0.911 4.957 -11.515 1781 2HZ LYS 85 2HZ LYS 85 -2.424 4.566 -12.179 1782 3HZ LYS 85 3HZ LYS 85 -1.714 6.072 -12.512 1783 H ARG 86 H ARG 86 3.015 -0.409 -11.906 1784 HA ARG 86 HA ARG 86 2.061 -1.528 -9.290 1785 1HB ARG 86 1HB ARG 86 2.003 -2.469 -12.016 1786 2HB ARG 86 2HB ARG 86 3.002 -3.557 -11.052 1787 1HG ARG 86 1HG ARG 86 0.737 -2.925 -9.466 1788 2HG ARG 86 2HG ARG 86 0.132 -3.300 -11.080 1789 1HD ARG 86 1HD ARG 86 1.260 -5.442 -11.077 1790 2HD ARG 86 2HD ARG 86 2.102 -5.050 -9.567 1791 HE ARG 86 HE ARG 86 0.093 -5.516 -8.399 1792 1HH1 ARG 86 1HH1 ARG 86 -0.521 -5.051 -11.794 1793 2HH1 ARG 86 2HH1 ARG 86 -2.184 -5.508 -11.668 1794 1HH2 ARG 86 1HH2 ARG 86 -2.068 -6.106 -8.261 1795 2HH2 ARG 86 2HH2 ARG 86 -3.056 -6.102 -9.684 1796 H MET 87 H MET 87 3.650 -2.646 -8.024 1797 HA MET 87 HA MET 87 6.484 -2.084 -8.841 1798 1HB MET 87 1HB MET 87 4.896 -1.461 -6.527 1799 2HB MET 87 2HB MET 87 6.194 -2.546 -6.033 1800 1HG MET 87 1HG MET 87 7.803 -1.040 -7.275 1801 2HG MET 87 2HG MET 87 6.470 0.095 -7.494 1802 1HE MET 87 1HE MET 87 8.738 -1.829 -5.114 1803 2HE MET 87 2HE MET 87 9.122 -0.572 -3.937 1804 3HE MET 87 3HE MET 87 9.495 -0.327 -5.643 1805 H ARG 88 H ARG 88 8.018 -3.749 -8.508 1806 HA ARG 88 HA ARG 88 6.893 -6.425 -7.738 1807 1HB ARG 88 1HB ARG 88 8.346 -5.415 -10.106 1808 2HB ARG 88 2HB ARG 88 9.003 -6.914 -9.450 1809 1HG ARG 88 1HG ARG 88 6.686 -7.875 -9.486 1810 2HG ARG 88 2HG ARG 88 6.139 -6.410 -10.299 1811 1HD ARG 88 1HD ARG 88 8.361 -7.170 -11.795 1812 2HD ARG 88 2HD ARG 88 7.570 -8.711 -11.410 1813 HE ARG 88 HE ARG 88 5.591 -6.757 -12.140 1814 1HH1 ARG 88 1HH1 ARG 88 8.104 -8.752 -13.491 1815 2HH1 ARG 88 2HH1 ARG 88 7.348 -8.844 -15.043 1816 1HH2 ARG 88 1HH2 ARG 88 4.629 -6.893 -14.164 1817 2HH2 ARG 88 2HH2 ARG 88 5.396 -7.801 -15.424 1818 H ILE 89 H ILE 89 8.590 -7.925 -6.907 1819 HA ILE 89 HA ILE 89 10.999 -6.540 -5.804 1820 HB ILE 89 HB ILE 89 8.891 -8.192 -4.368 1821 1HG1 ILE 89 1HG1 ILE 89 10.019 -5.574 -3.443 1822 2HG1 ILE 89 2HG1 ILE 89 8.857 -5.571 -4.765 1823 1HG2 ILE 89 1HG2 ILE 89 11.629 -7.322 -3.384 1824 2HG2 ILE 89 2HG2 ILE 89 11.085 -8.982 -3.621 1825 3HG2 ILE 89 3HG2 ILE 89 10.359 -7.989 -2.358 1826 1HD1 ILE 89 1HD1 ILE 89 8.039 -7.307 -2.557 1827 2HD1 ILE 89 2HD1 ILE 89 7.131 -6.039 -3.383 1828 3HD1 ILE 89 3HD1 ILE 89 8.227 -5.624 -2.063 1829 H PHE 90 H PHE 90 12.668 -7.673 -6.725 1830 HA PHE 90 HA PHE 90 12.348 -10.632 -7.064 1831 1HB PHE 90 1HB PHE 90 13.563 -8.389 -8.600 1832 2HB PHE 90 2HB PHE 90 14.440 -9.919 -8.643 1833 HD1 PHE 90 HD1 PHE 90 13.643 -11.761 -9.910 1834 HD2 PHE 90 HD2 PHE 90 11.101 -8.366 -9.226 1835 HE1 PHE 90 HE1 PHE 90 12.000 -12.666 -11.531 1836 HE2 PHE 90 HE2 PHE 90 9.460 -9.271 -10.846 1837 HZ PHE 90 HZ PHE 90 9.907 -11.422 -11.996 1838 H THR 91 H THR 91 14.688 -11.684 -7.117 1839 HA THR 91 HA THR 91 16.205 -10.651 -4.744 1840 HB THR 91 HB THR 91 16.693 -13.168 -4.468 1841 HG1 THR 91 HG1 THR 91 15.961 -14.349 -6.016 1842 1HG2 THR 91 1HG2 THR 91 14.891 -11.690 -3.281 1843 2HG2 THR 91 2HG2 THR 91 14.778 -13.445 -3.145 1844 3HG2 THR 91 3HG2 THR 91 13.749 -12.581 -4.287 1845 H ILE 92 H ILE 92 17.911 -9.617 -5.879 1846 HA ILE 92 HA ILE 92 19.183 -10.461 -8.244 1847 HB ILE 92 HB ILE 92 21.122 -9.153 -7.286 1848 1HG1 ILE 92 1HG1 ILE 92 19.365 -8.770 -4.859 1849 2HG1 ILE 92 2HG1 ILE 92 20.610 -10.017 -4.911 1850 1HG2 ILE 92 1HG2 ILE 92 19.358 -7.172 -6.580 1851 2HG2 ILE 92 2HG2 ILE 92 18.323 -8.254 -7.511 1852 3HG2 ILE 92 3HG2 ILE 92 19.782 -7.585 -8.241 1853 1HD1 ILE 92 1HD1 ILE 92 20.891 -7.099 -4.650 1854 2HD1 ILE 92 2HD1 ILE 92 21.973 -7.818 -5.843 1855 3HD1 ILE 92 3HD1 ILE 92 22.001 -8.384 -4.172 1856 H LYS 93 H LYS 93 19.505 -11.688 -4.964 1857 HA LYS 93 HA LYS 93 21.311 -13.827 -6.024 1858 1HB LYS 93 1HB LYS 93 22.551 -13.624 -3.849 1859 2HB LYS 93 2HB LYS 93 22.647 -12.160 -4.825 1860 1HG LYS 93 1HG LYS 93 21.733 -10.976 -3.148 1861 2HG LYS 93 2HG LYS 93 20.292 -11.990 -3.213 1862 1HD LYS 93 1HD LYS 93 20.865 -12.748 -1.166 1863 2HD LYS 93 2HD LYS 93 22.210 -13.584 -1.941 1864 1HE LYS 93 1HE LYS 93 22.612 -10.685 -1.364 1865 2HE LYS 93 2HE LYS 93 22.603 -11.785 0.027 1866 1HZ LYS 93 1HZ LYS 93 24.153 -13.226 -1.207 1867 2HZ LYS 93 2HZ LYS 93 24.816 -11.691 -0.907 1868 3HZ LYS 93 3HZ LYS 93 24.225 -12.074 -2.453 1869 HA PRO 94 HA PRO 94 18.373 -16.636 -4.335 1870 1HB PRO 94 1HB PRO 94 20.732 -18.122 -3.282 1871 2HB PRO 94 2HB PRO 94 19.405 -18.701 -4.303 1872 1HG PRO 94 1HG PRO 94 21.865 -18.212 -5.272 1873 2HG PRO 94 2HG PRO 94 20.397 -17.977 -6.230 1874 1HD PRO 94 1HD PRO 94 22.208 -15.970 -5.031 1875 2HD PRO 94 2HD PRO 94 21.141 -15.834 -6.443 1876 H ILE 95 H ILE 95 17.401 -16.983 -2.293 1877 HA ILE 95 HA ILE 95 18.877 -15.820 0.048 1878 HB ILE 95 HB ILE 95 15.956 -15.697 -0.786 1879 1HG1 ILE 95 1HG1 ILE 95 18.055 -13.535 -0.436 1880 2HG1 ILE 95 2HG1 ILE 95 17.513 -14.179 -1.986 1881 1HG2 ILE 95 1HG2 ILE 95 17.327 -15.141 1.801 1882 2HG2 ILE 95 2HG2 ILE 95 15.672 -15.668 1.497 1883 3HG2 ILE 95 3HG2 ILE 95 16.112 -13.975 1.277 1884 1HD1 ILE 95 1HD1 ILE 95 16.073 -12.406 -0.056 1885 2HD1 ILE 95 2HD1 ILE 95 15.117 -13.555 -0.992 1886 3HD1 ILE 95 3HD1 ILE 95 16.105 -12.351 -1.818 1887 H ALA 96 H ALA 96 18.587 -16.886 2.053 1888 HA ALA 96 HA ALA 96 17.726 -19.708 1.864 1889 1HB ALA 96 1HB ALA 96 19.343 -19.929 3.445 1890 2HB ALA 96 2HB ALA 96 18.574 -18.722 4.476 1891 3HB ALA 96 3HB ALA 96 19.694 -18.216 3.212 1892 H ILE 97 H ILE 97 16.114 -20.597 3.261 1893 HA ILE 97 HA ILE 97 13.724 -19.173 3.598 1894 HB ILE 97 HB ILE 97 14.914 -21.559 5.053 1895 1HG1 ILE 97 1HG1 ILE 97 12.794 -21.627 2.926 1896 2HG1 ILE 97 2HG1 ILE 97 14.484 -21.432 2.463 1897 1HG2 ILE 97 1HG2 ILE 97 12.510 -20.127 5.643 1898 2HG2 ILE 97 2HG2 ILE 97 13.080 -21.637 6.353 1899 3HG2 ILE 97 3HG2 ILE 97 12.061 -21.668 4.913 1900 1HD1 ILE 97 1HD1 ILE 97 14.638 -23.475 4.294 1901 2HD1 ILE 97 2HD1 ILE 97 14.555 -23.700 2.547 1902 3HD1 ILE 97 3HD1 ILE 97 13.088 -23.802 3.519 1903 H GLY 98 H GLY 98 16.562 -19.095 5.619 1904 1HA GLY 98 1HA GLY 98 14.998 -17.644 7.714 1905 2HA GLY 98 2HA GLY 98 16.503 -18.507 8.033 1906 H GLU 99 H GLU 99 15.408 -15.987 5.712 1907 HA GLU 99 HA GLU 99 17.816 -14.398 6.530 1908 1HB GLU 99 1HB GLU 99 16.918 -15.468 3.900 1909 2HB GLU 99 2HB GLU 99 17.549 -13.821 3.887 1910 1HG GLU 99 1HG GLU 99 19.124 -15.776 5.463 1911 2HG GLU 99 2HG GLU 99 19.125 -16.033 3.719 1912 H GLU 100 H GLU 100 17.545 -12.085 5.417 1913 HA GLU 100 HA GLU 100 14.697 -11.211 5.782 1914 1HB GLU 100 1HB GLU 100 16.397 -10.713 7.646 1915 2HB GLU 100 2HB GLU 100 17.191 -9.636 6.496 1916 1HG GLU 100 1HG GLU 100 14.687 -8.734 6.203 1917 2HG GLU 100 2HG GLU 100 14.542 -9.352 7.848 1918 H ILE 101 H ILE 101 13.918 -10.134 4.014 1919 HA ILE 101 HA ILE 101 15.763 -9.464 1.811 1920 HB ILE 101 HB ILE 101 12.743 -9.325 2.141 1921 1HG1 ILE 101 1HG1 ILE 101 14.537 -11.394 0.833 1922 2HG1 ILE 101 2HG1 ILE 101 13.665 -11.604 2.351 1923 1HG2 ILE 101 1HG2 ILE 101 14.001 -9.580 -0.533 1924 2HG2 ILE 101 2HG2 ILE 101 14.189 -8.011 0.251 1925 3HG2 ILE 101 3HG2 ILE 101 12.577 -8.663 -0.043 1926 1HD1 ILE 101 1HD1 ILE 101 12.660 -11.687 -0.431 1927 2HD1 ILE 101 2HD1 ILE 101 11.640 -10.804 0.705 1928 3HD1 ILE 101 3HD1 ILE 101 12.046 -12.493 1.012 1929 H THR 102 H THR 102 16.406 -7.410 1.333 1930 HA THR 102 HA THR 102 14.859 -5.076 2.298 1931 HB THR 102 HB THR 102 17.079 -4.202 3.287 1932 HG1 THR 102 HG1 THR 102 17.684 -6.960 3.340 1933 1HG2 THR 102 1HG2 THR 102 16.076 -6.661 4.711 1934 2HG2 THR 102 2HG2 THR 102 15.041 -5.246 4.522 1935 3HG2 THR 102 3HG2 THR 102 16.566 -5.112 5.398 1936 H ILE 103 H ILE 103 15.833 -3.020 1.353 1937 HA ILE 103 HA ILE 103 17.497 -3.555 -1.075 1938 HB ILE 103 HB ILE 103 15.894 -2.187 -2.369 1939 1HG1 ILE 103 1HG1 ILE 103 13.618 -1.987 -0.846 1940 2HG1 ILE 103 2HG1 ILE 103 14.874 -1.653 0.346 1941 1HG2 ILE 103 1HG2 ILE 103 15.528 -4.770 -1.533 1942 2HG2 ILE 103 2HG2 ILE 103 14.517 -3.963 -2.731 1943 3HG2 ILE 103 3HG2 ILE 103 14.004 -4.028 -1.045 1944 1HD1 ILE 103 1HD1 ILE 103 15.192 0.402 -0.515 1945 2HD1 ILE 103 2HD1 ILE 103 13.855 0.111 -1.627 1946 3HD1 ILE 103 3HD1 ILE 103 15.504 -0.285 -2.109 1947 H SER 104 H SER 104 18.618 -1.636 -1.855 1948 HA SER 104 HA SER 104 19.228 0.284 0.317 1949 1HB SER 104 1HB SER 104 20.993 -0.909 -0.971 1950 2HB SER 104 2HB SER 104 20.403 -0.161 -2.454 1951 HG SER 104 HG SER 104 21.709 1.390 -1.949 1952 H TYR 105 H TYR 105 19.984 2.503 -1.196 1953 HA TYR 105 HA TYR 105 17.454 3.356 -2.565 1954 1HB TYR 105 1HB TYR 105 19.132 4.989 -0.623 1955 2HB TYR 105 2HB TYR 105 17.570 5.441 -1.302 1956 HD1 TYR 105 HD1 TYR 105 18.797 4.715 1.685 1957 HD2 TYR 105 HD2 TYR 105 16.017 2.961 -1.080 1958 HE1 TYR 105 HE1 TYR 105 17.660 3.559 3.561 1959 HE2 TYR 105 HE2 TYR 105 14.880 1.805 0.798 1960 HH TYR 105 HH TYR 105 14.631 1.896 3.128 1961 H GLY 106 H GLY 106 20.789 4.468 -1.856 1962 1HA GLY 106 1HA GLY 106 22.441 5.310 -3.291 1963 2HA GLY 106 2HA GLY 106 21.549 4.578 -4.624 1964 H ASP 107 H ASP 107 22.760 7.074 -4.915 1965 HA ASP 107 HA ASP 107 22.290 9.263 -5.648 1966 1HB ASP 107 1HB ASP 107 20.589 7.519 -6.789 1967 2HB ASP 107 2HB ASP 107 19.411 8.494 -5.910 1968 H ASP 108 H ASP 108 22.483 10.599 -3.868 1969 HA ASP 108 HA ASP 108 21.821 12.042 -2.143 1970 1HB ASP 108 1HB ASP 108 19.258 11.464 -3.641 1971 2HB ASP 108 2HB ASP 108 19.309 12.609 -2.305 1972 H TYR 109 H TYR 109 18.932 9.943 -2.202 1973 HA TYR 109 HA TYR 109 18.347 9.817 0.476 1974 1HB TYR 109 1HB TYR 109 17.947 8.219 -1.914 1975 2HB TYR 109 2HB TYR 109 18.027 7.183 -0.489 1976 HD1 TYR 109 HD1 TYR 109 15.828 6.621 0.104 1977 HD2 TYR 109 HD2 TYR 109 16.760 10.682 -0.938 1978 HE1 TYR 109 HE1 TYR 109 13.529 7.309 0.732 1979 HE2 TYR 109 HE2 TYR 109 14.462 11.371 -0.310 1980 HH TYR 109 HH TYR 109 12.012 9.690 -0.178 1981 H TRP 110 H TRP 110 19.843 9.591 2.094 1982 HA TRP 110 HA TRP 110 21.593 8.674 3.386 1983 1HB TRP 110 1HB TRP 110 19.510 6.900 2.839 1984 2HB TRP 110 2HB TRP 110 20.962 5.943 2.538 1985 HD1 TRP 110 HD1 TRP 110 22.436 5.280 4.563 1986 HE1 TRP 110 HE1 TRP 110 22.208 5.568 7.115 1987 HE3 TRP 110 HE3 TRP 110 18.546 8.583 4.733 1988 HZ2 TRP 110 HZ2 TRP 110 20.590 7.009 8.981 1989 HZ3 TRP 110 HZ3 TRP 110 17.682 9.397 6.909 1990 HH2 TRP 110 HH2 TRP 110 18.698 8.615 9.031 1991 H LEU 111 H LEU 111 22.890 6.111 2.862 1992 HA LEU 111 HA LEU 111 25.238 6.834 1.587 1993 1HB LEU 111 1HB LEU 111 24.840 4.772 2.883 1994 2HB LEU 111 2HB LEU 111 23.818 4.144 1.590 1995 HG LEU 111 HG LEU 111 26.617 5.008 0.940 1996 1HD1 LEU 111 1HD1 LEU 111 26.476 3.411 3.019 1997 2HD1 LEU 111 2HD1 LEU 111 27.598 3.029 1.713 1998 3HD1 LEU 111 3HD1 LEU 111 26.051 2.189 1.821 1999 1HD2 LEU 111 1HD2 LEU 111 24.467 3.281 -0.180 2000 2HD2 LEU 111 2HD2 LEU 111 26.128 2.754 -0.453 2001 3HD2 LEU 111 3HD2 LEU 111 25.603 4.343 -1.012 2002 H SER 112 H SER 112 25.953 7.002 -0.517 2003 HA SER 112 HA SER 112 23.967 6.427 -2.690 2004 1HB SER 112 1HB SER 112 26.199 8.469 -2.392 2005 2HB SER 112 2HB SER 112 25.276 8.245 -3.878 2006 HG SER 112 HG SER 112 23.376 8.627 -2.564 2007 H ARG 113 H ARG 113 27.175 5.826 -1.475 2008 HA ARG 113 HA ARG 113 28.636 5.055 -3.738 2009 1HB ARG 113 1HB ARG 113 28.525 4.501 -0.852 2010 2HB ARG 113 2HB ARG 113 29.227 3.171 -1.772 2011 1HG ARG 113 1HG ARG 113 30.824 4.711 -2.822 2012 2HG ARG 113 2HG ARG 113 30.095 6.072 -1.970 2013 1HD ARG 113 1HD ARG 113 30.626 4.717 0.196 2014 2HD ARG 113 2HD ARG 113 31.741 3.806 -0.841 2015 HE ARG 113 HE ARG 113 32.064 6.587 -0.008 2016 1HH1 ARG 113 1HH1 ARG 113 32.719 4.241 -2.496 2017 2HH1 ARG 113 2HH1 ARG 113 34.105 5.091 -3.086 2018 1HH2 ARG 113 1HH2 ARG 113 33.865 7.671 -0.790 2019 2HH2 ARG 113 2HH2 ARG 113 34.751 7.020 -2.129 2020 HA PRO 114 HA PRO 114 27.016 1.381 -5.495 2021 1HB PRO 114 1HB PRO 114 28.942 -0.583 -4.864 2022 2HB PRO 114 2HB PRO 114 28.965 0.475 -6.285 2023 1HG PRO 114 1HG PRO 114 30.432 0.709 -3.718 2024 2HG PRO 114 2HG PRO 114 30.926 1.182 -5.350 2025 1HD PRO 114 1HD PRO 114 30.165 2.984 -3.501 2026 2HD PRO 114 2HD PRO 114 29.830 3.209 -5.231 2027 H ARG 115 H ARG 115 27.091 -1.301 -4.723 2028 HA ARG 115 HA ARG 115 25.636 -1.183 -2.114 2029 1HB ARG 115 1HB ARG 115 25.534 -3.126 -4.449 2030 2HB ARG 115 2HB ARG 115 24.473 -3.168 -3.040 2031 1HG ARG 115 1HG ARG 115 23.159 -1.949 -4.520 2032 2HG ARG 115 2HG ARG 115 24.024 -0.645 -3.708 2033 1HD ARG 115 1HD ARG 115 25.393 -0.226 -5.550 2034 2HD ARG 115 2HD ARG 115 25.250 -1.886 -6.159 2035 HE ARG 115 HE ARG 115 22.646 -0.781 -6.166 2036 1HH1 ARG 115 1HH1 ARG 115 25.723 -0.231 -7.699 2037 2HH1 ARG 115 2HH1 ARG 115 25.014 0.419 -9.136 2038 1HH2 ARG 115 1HH2 ARG 115 21.750 0.066 -8.042 2039 2HH2 ARG 115 2HH2 ARG 115 22.783 0.587 -9.331 2040 H LEU 116 H LEU 116 28.469 -1.377 -2.001 2041 HA LEU 116 HA LEU 116 30.193 -2.725 -1.112 2042 1HB LEU 116 1HB LEU 116 27.565 -3.509 0.081 2043 2HB LEU 116 2HB LEU 116 28.950 -4.535 0.451 2044 HG LEU 116 HG LEU 116 28.695 -2.741 2.133 2045 1HD1 LEU 116 1HD1 LEU 116 30.958 -2.333 2.277 2046 2HD1 LEU 116 2HD1 LEU 116 31.089 -1.873 0.579 2047 3HD1 LEU 116 3HD1 LEU 116 30.992 -3.576 1.027 2048 1HD2 LEU 116 1HD2 LEU 116 27.646 -1.118 0.501 2049 2HD2 LEU 116 2HD2 LEU 116 29.259 -0.832 -0.152 2050 3HD2 LEU 116 3HD2 LEU 116 28.898 -0.415 1.524 2051 H THR 117 H THR 117 30.998 -3.785 -2.998 2052 HA THR 117 HA THR 117 29.691 -6.285 -3.901 2053 HB THR 117 HB THR 117 32.305 -5.138 -4.882 2054 HG1 THR 117 HG1 THR 117 31.240 -3.341 -5.131 2055 1HG2 THR 117 1HG2 THR 117 29.988 -6.222 -6.482 2056 2HG2 THR 117 2HG2 THR 117 31.157 -7.306 -5.726 2057 3HG2 THR 117 3HG2 THR 117 31.691 -6.136 -6.934 2058 H GLN 118 H GLN 118 30.333 -8.252 -3.123 2059 HA GLN 118 HA GLN 118 31.610 -9.871 -1.971 2060 1HB GLN 118 1HB GLN 118 33.328 -8.279 -3.759 2061 2HB GLN 118 2HB GLN 118 34.222 -9.092 -2.474 2062 1HG GLN 118 1HG GLN 118 33.323 -11.240 -3.113 2063 2HG GLN 118 2HG GLN 118 32.202 -10.490 -4.249 2064 1HE2 GLN 118 1HE2 GLN 118 33.239 -9.322 -6.149 2065 2HE2 GLN 118 2HE2 GLN 118 34.733 -9.884 -6.727 2066 H ASN 119 H ASN 119 30.772 -8.634 0.039 2067 HA ASN 119 HA ASN 119 32.664 -6.877 1.415 2068 1HB ASN 119 1HB ASN 119 30.136 -6.822 1.547 2069 2HB ASN 119 2HB ASN 119 30.205 -8.344 2.436 2070 1HD2 ASN 119 1HD2 ASN 119 30.948 -4.883 2.629 2071 2HD2 ASN 119 2HD2 ASN 119 31.242 -4.860 4.300 2072 1H GLY 201 1H GLY 201 24.872 34.869 13.302 2073 2H GLY 201 2H GLY 201 26.339 35.461 13.920 2074 3H GLY 201 3H GLY 201 25.059 35.096 14.975 2075 1HA GLY 201 1HA GLY 201 26.598 33.153 13.339 2076 2HA GLY 201 2HA GLY 201 26.697 33.355 15.088 2077 H LYS 202 H LYS 202 25.371 32.073 16.285 2078 HA LYS 202 HA LYS 202 23.676 30.506 16.788 2079 1HB LYS 202 1HB LYS 202 22.602 32.848 15.827 2080 2HB LYS 202 2HB LYS 202 21.878 31.664 14.739 2081 1HG LYS 202 1HG LYS 202 20.959 30.419 16.588 2082 2HG LYS 202 2HG LYS 202 21.863 31.383 17.756 2083 1HD LYS 202 1HD LYS 202 20.285 33.094 16.027 2084 2HD LYS 202 2HD LYS 202 19.262 31.886 16.805 2085 1HE LYS 202 1HE LYS 202 19.499 32.870 18.846 2086 2HE LYS 202 2HE LYS 202 21.248 33.071 18.629 2087 1HZ LYS 202 1HZ LYS 202 19.063 34.764 17.544 2088 2HZ LYS 202 2HZ LYS 202 20.652 34.838 16.951 2089 3HZ LYS 202 3HZ LYS 202 20.331 35.236 18.570 2090 H ALA 203 H ALA 203 22.054 28.923 15.592 2091 HA ALA 203 HA ALA 203 21.879 27.088 14.114 2092 1HB ALA 203 1HB ALA 203 21.459 27.924 12.026 2093 2HB ALA 203 2HB ALA 203 23.072 28.623 11.889 2094 3HB ALA 203 3HB ALA 203 21.805 29.492 12.754 2095 HA PRO 204 HA PRO 204 26.543 26.529 14.573 2096 1HB PRO 204 1HB PRO 204 25.597 24.035 15.891 2097 2HB PRO 204 2HB PRO 204 26.828 25.191 16.430 2098 1HG PRO 204 1HG PRO 204 24.404 25.024 17.578 2099 2HG PRO 204 2HG PRO 204 25.294 26.547 17.449 2100 1HD PRO 204 1HD PRO 204 22.940 25.594 15.905 2101 2HD PRO 204 2HD PRO 204 23.394 27.244 16.380 2102 H ARG 205 H ARG 205 26.458 26.173 12.243 2103 HA ARG 205 HA ARG 205 26.535 24.840 10.293 2104 1HB ARG 205 1HB ARG 205 27.448 23.227 12.631 2105 2HB ARG 205 2HB ARG 205 27.136 22.336 11.141 2106 1HG ARG 205 1HG ARG 205 29.470 23.043 11.168 2107 2HG ARG 205 2HG ARG 205 28.611 23.950 9.924 2108 1HD ARG 205 1HD ARG 205 28.911 25.937 11.015 2109 2HD ARG 205 2HD ARG 205 28.580 25.215 12.601 2110 HE ARG 205 HE ARG 205 31.046 24.160 11.623 2111 1HH1 ARG 205 1HH1 ARG 205 29.667 27.143 12.771 2112 2HH1 ARG 205 2HH1 ARG 205 31.175 27.735 13.375 2113 1HH2 ARG 205 1HH2 ARG 205 32.992 24.951 12.415 2114 2HH2 ARG 205 2HH2 ARG 205 33.045 26.506 13.176 2115 H LYS 206 H LYS 206 23.957 25.285 10.750 2116 HA LYS 206 HA LYS 206 22.649 22.585 10.634 2117 1HB LYS 206 1HB LYS 206 22.356 24.490 12.576 2118 2HB LYS 206 2HB LYS 206 21.072 24.961 11.462 2119 1HG LYS 206 1HG LYS 206 19.811 23.161 12.001 2120 2HG LYS 206 2HG LYS 206 21.189 22.066 11.883 2121 1HD LYS 206 1HD LYS 206 20.596 21.967 14.167 2122 2HD LYS 206 2HD LYS 206 21.940 23.108 14.138 2123 1HE LYS 206 1HE LYS 206 20.451 24.406 15.339 2124 2HE LYS 206 2HE LYS 206 19.856 24.814 13.718 2125 1HZ LYS 206 1HZ LYS 206 18.325 22.958 13.837 2126 2HZ LYS 206 2HZ LYS 206 18.070 23.984 15.166 2127 3HZ LYS 206 3HZ LYS 206 18.913 22.524 15.371 2128 H GLN 207 H GLN 207 23.440 23.375 8.231 2129 HA GLN 207 HA GLN 207 20.985 23.936 6.787 2130 1HB GLN 207 1HB GLN 207 21.702 26.171 7.750 2131 2HB GLN 207 2HB GLN 207 23.162 26.055 6.769 2132 1HG GLN 207 1HG GLN 207 21.801 27.246 5.319 2133 2HG GLN 207 2HG GLN 207 21.403 25.600 4.826 2134 1HE2 GLN 207 1HE2 GLN 207 20.158 28.485 6.387 2135 2HE2 GLN 207 2HE2 GLN 207 18.579 27.909 6.625 2136 H LEU 208 H LEU 208 21.670 22.031 5.638 2137 HA LEU 208 HA LEU 208 24.042 22.455 3.849 2138 1HB LEU 208 1HB LEU 208 24.042 20.679 5.769 2139 2HB LEU 208 2HB LEU 208 22.948 19.775 4.721 2140 HG LEU 208 HG LEU 208 24.817 20.337 2.901 2141 1HD1 LEU 208 1HD1 LEU 208 27.016 20.499 3.783 2142 2HD1 LEU 208 2HD1 LEU 208 26.480 20.076 5.409 2143 3HD1 LEU 208 3HD1 LEU 208 26.072 21.651 4.728 2144 1HD2 LEU 208 1HD2 LEU 208 24.291 18.077 3.274 2145 2HD2 LEU 208 2HD2 LEU 208 24.728 18.161 4.980 2146 3HD2 LEU 208 3HD2 LEU 208 25.988 18.163 3.746 2147 H ALA 209 H ALA 209 20.811 20.977 4.161 2148 HA ALA 209 HA ALA 209 20.301 21.511 1.300 2149 1HB ALA 209 1HB ALA 209 20.963 18.880 2.495 2150 2HB ALA 209 2HB ALA 209 21.099 19.414 0.819 2151 3HB ALA 209 3HB ALA 209 19.542 18.876 1.450 2152 H THR 210 H THR 210 17.968 20.879 0.771 2153 HA THR 210 HA THR 210 16.250 20.996 3.229 2154 HB THR 210 HB THR 210 14.787 22.486 1.777 2155 HG1 THR 210 HG1 THR 210 15.497 23.071 -0.153 2156 1HG2 THR 210 1HG2 THR 210 17.630 23.309 2.418 2157 2HG2 THR 210 2HG2 THR 210 16.196 23.538 3.418 2158 3HG2 THR 210 3HG2 THR 210 16.384 24.454 1.923 2159 H LYS 211 H LYS 211 16.401 20.120 -0.229 2160 HA LYS 211 HA LYS 211 14.155 18.191 0.250 2161 1HB LYS 211 1HB LYS 211 13.786 18.473 -2.206 2162 2HB LYS 211 2HB LYS 211 13.699 20.014 -1.351 2163 1HG LYS 211 1HG LYS 211 15.538 20.825 -2.402 2164 2HG LYS 211 2HG LYS 211 16.419 19.309 -2.210 2165 1HD LYS 211 1HD LYS 211 15.464 18.374 -4.163 2166 2HD LYS 211 2HD LYS 211 14.167 19.568 -4.203 2167 1HE LYS 211 1HE LYS 211 15.765 21.338 -4.776 2168 2HE LYS 211 2HE LYS 211 17.112 20.192 -4.642 2169 1HZ LYS 211 1HZ LYS 211 14.787 19.955 -6.487 2170 2HZ LYS 211 2HZ LYS 211 16.040 18.819 -6.338 2171 3HZ LYS 211 3HZ LYS 211 16.369 20.372 -6.940 2172 H ALA 212 H ALA 212 14.336 16.170 -1.105 2173 HA ALA 212 HA ALA 212 17.204 15.380 -1.505 2174 1HB ALA 212 1HB ALA 212 16.821 13.636 -0.091 2175 2HB ALA 212 2HB ALA 212 15.305 13.233 -0.895 2176 3HB ALA 212 3HB ALA 212 15.334 14.468 0.363 2177 H ALA 213 H ALA 213 16.894 12.980 -2.727 2178 HA ALA 213 HA ALA 213 15.315 13.637 -5.192 2179 1HB ALA 213 1HB ALA 213 17.245 11.729 -5.829 2180 2HB ALA 213 2HB ALA 213 18.050 12.732 -4.622 2181 3HB ALA 213 3HB ALA 213 17.403 13.467 -6.089 2182 H ARG 214 H ARG 214 14.444 12.132 -2.714 2183 HA ARG 214 HA ARG 214 13.321 10.125 -2.170 2184 1HB ARG 214 1HB ARG 214 12.768 10.985 -4.926 2185 2HB ARG 214 2HB ARG 214 12.429 9.275 -4.659 2186 1HG ARG 214 1HG ARG 214 10.421 10.490 -4.110 2187 2HG ARG 214 2HG ARG 214 11.136 9.958 -2.589 2188 1HD ARG 214 1HD ARG 214 10.473 12.314 -2.386 2189 2HD ARG 214 2HD ARG 214 12.244 12.220 -2.400 2190 HE ARG 214 HE ARG 214 11.231 12.425 -5.092 2191 1HH1 ARG 214 1HH1 ARG 214 11.782 14.277 -2.196 2192 2HH1 ARG 214 2HH1 ARG 214 11.964 15.768 -3.052 2193 1HH2 ARG 214 1HH2 ARG 214 11.470 14.374 -6.181 2194 2HH2 ARG 214 2HH2 ARG 214 11.789 15.825 -5.291 2195 1HN MLZ 215 1HN MLZ 215 12.997 7.748 -3.584 2196 HA MLZ 215 HA MLZ 215 15.652 6.539 -3.300 2197 1HB MLZ 215 1HB MLZ 215 12.806 5.732 -3.666 2198 2HB MLZ 215 2HB MLZ 215 14.016 4.581 -4.232 2199 1HG MLZ 215 1HG MLZ 215 14.264 5.835 -1.505 2200 2HG MLZ 215 2HG MLZ 215 14.949 4.319 -2.092 2201 1HD MLZ 215 1HD MLZ 215 12.015 4.881 -1.565 2202 2HD MLZ 215 2HD MLZ 215 12.640 3.387 -2.262 2203 1HE MLZ 215 1HE MLZ 215 13.894 4.288 0.292 2204 2HE MLZ 215 2HE MLZ 215 13.478 2.650 -0.248 2205 HZ MLZ 215 HZ MLZ 215 11.220 3.006 0.201 2206 1HCM MLZ 215 1HCM MLZ 215 11.256 3.104 2.437 2207 2HCM MLZ 215 2HCM MLZ 215 12.145 4.627 2.430 2208 3HCM MLZ 215 3HCM MLZ 215 12.998 3.107 2.165 2209 H SER 216 H SER 216 17.067 6.257 -4.976 2210 HA SER 216 HA SER 216 17.888 6.021 -7.176 2211 1HB SER 216 1HB SER 216 16.747 8.402 -6.899 2212 2HB SER 216 2HB SER 216 17.281 7.860 -8.489 2213 HG SER 216 HG SER 216 14.997 8.692 -8.120 2214 H ALA 217 H ALA 217 16.757 5.801 -9.626 2215 HA ALA 217 HA ALA 217 14.808 3.540 -9.319 2216 1HB ALA 217 1HB ALA 217 14.394 6.038 -10.456 2217 2HB ALA 217 2HB ALA 217 13.436 4.599 -10.805 2218 3HB ALA 217 3HB ALA 217 14.783 5.037 -11.855 2219 HA PRO 218 HA PRO 218 17.876 1.274 -11.545 2220 1HB PRO 218 1HB PRO 218 16.299 -0.773 -12.486 2221 2HB PRO 218 2HB PRO 218 16.829 -0.655 -10.798 2222 1HG PRO 218 1HG PRO 218 14.214 0.086 -12.017 2223 2HG PRO 218 2HG PRO 218 14.551 -0.716 -10.476 2224 1HD PRO 218 1HD PRO 218 13.926 1.918 -10.680 2225 2HD PRO 218 2HD PRO 218 14.962 1.265 -9.396 2226 H ALA 219 H ALA 219 17.500 -0.161 -13.905 2227 HA ALA 219 HA ALA 219 16.689 1.991 -15.832 2228 1HB ALA 219 1HB ALA 219 18.586 -0.213 -16.544 2229 2HB ALA 219 2HB ALA 219 19.158 1.011 -15.411 2230 3HB ALA 219 3HB ALA 219 18.617 1.485 -17.021 2231 H THR 220 H THR 220 14.657 1.354 -16.539 2232 HA THR 220 HA THR 220 14.469 -1.212 -17.991 2233 HB THR 220 HB THR 220 13.930 -1.759 -15.644 2234 HG1 THR 220 HG1 THR 220 12.397 -2.962 -16.378 2235 1HG2 THR 220 1HG2 THR 220 13.017 -0.117 -14.394 2236 2HG2 THR 220 2HG2 THR 220 11.488 -0.452 -15.207 2237 3HG2 THR 220 3HG2 THR 220 12.563 0.799 -15.831 2238 H GLY 221 H GLY 221 11.600 -1.151 -18.158 2239 1HA GLY 221 1HA GLY 221 11.246 0.791 -20.245 2240 2HA GLY 221 2HA GLY 221 9.959 -0.176 -19.526 2241 1HN SAH 301 1HN SAH 301 -10.942 -0.551 -8.146 2242 2HN SAH 301 2HN SAH 301 -9.951 0.087 -9.374 2243 HA SAH 301 HA SAH 301 -10.410 2.362 -8.273 2244 1HB SAH 301 1HB SAH 301 -11.562 0.283 -6.490 2245 2HB SAH 301 2HB SAH 301 -10.639 1.548 -5.685 2246 1HG SAH 301 1HG SAH 301 -13.299 1.690 -6.755 2247 2HG SAH 301 2HG SAH 301 -12.273 2.803 -7.659 2248 1H5* SAH 301 1H5* SAH 301 -14.680 2.649 -5.502 2249 2H5* SAH 301 2H5* SAH 301 -14.491 3.859 -4.233 2250 H4* SAH 301 H4* SAH 301 -13.895 5.401 -6.220 2251 H3* SAH 301 H3* SAH 301 -16.299 4.704 -4.778 2252 *HO3 SAH 301 *HO3 SAH 301 -14.969 6.734 -4.977 2253 H2* SAH 301 H2* SAH 301 -17.786 4.373 -6.417 2254 *HO2 SAH 301 *HO2 SAH 301 -17.609 6.129 -8.225 2255 H1* SAH 301 H1* SAH 301 -16.239 4.831 -8.797 2256 H8 SAH 301 H8 SAH 301 -15.541 1.519 -7.262 2257 1HN6 SAH 301 1HN6 SAH 301 -21.091 -0.498 -8.959 2258 2HN6 SAH 301 2HN6 SAH 301 -19.672 -0.874 -8.008 2259 H2 SAH 301 H2 SAH 301 -20.860 3.897 -9.904 2260 1HN SAH 302 1HN SAH 302 11.187 -0.601 8.194 2261 2HN SAH 302 2HN SAH 302 10.239 0.034 9.452 2262 HA SAH 302 HA SAH 302 10.690 2.309 8.349 2263 1HB SAH 302 1HB SAH 302 11.771 0.225 6.527 2264 2HB SAH 302 2HB SAH 302 10.835 1.500 5.749 2265 1HG SAH 302 1HG SAH 302 13.525 1.618 6.746 2266 2HG SAH 302 2HG SAH 302 12.533 2.737 7.680 2267 1H5* SAH 302 1H5* SAH 302 14.879 2.572 5.459 2268 2H5* SAH 302 2H5* SAH 302 14.664 3.787 4.198 2269 H4* SAH 302 H4* SAH 302 14.134 5.328 6.205 2270 H3* SAH 302 H3* SAH 302 16.492 4.617 4.696 2271 *HO3 SAH 302 *HO3 SAH 302 15.183 6.655 4.936 2272 H2* SAH 302 H2* SAH 302 18.021 4.271 6.292 2273 *HO2 SAH 302 *HO2 SAH 302 17.907 6.022 8.110 2274 H1* SAH 302 H1* SAH 302 16.543 4.733 8.716 2275 H8 SAH 302 H8 SAH 302 15.780 1.431 7.191 2276 1HN6 SAH 302 1HN6 SAH 302 21.360 -0.631 8.729 2277 2HN6 SAH 302 2HN6 SAH 302 19.912 -0.994 7.816 2278 H2 SAH 302 H2 SAH 302 21.186 3.763 9.693 Start of MODEL 12 1 1H MET 1 1H MET 1 0.065 -11.709 -7.510 2 2H MET 1 2H MET 1 0.548 -12.540 -6.110 3 3H MET 1 3H MET 1 1.160 -10.988 -6.430 4 HA MET 1 HA MET 1 -0.468 -10.590 -4.822 5 1HB MET 1 1HB MET 1 -1.007 -10.073 -7.686 6 2HB MET 1 2HB MET 1 -2.404 -9.870 -6.638 7 1HG MET 1 1HG MET 1 -0.597 -8.592 -5.141 8 2HG MET 1 2HG MET 1 0.110 -8.320 -6.728 9 1HE MET 1 1HE MET 1 -2.944 -7.358 -4.316 10 2HE MET 1 2HE MET 1 -2.612 -5.696 -4.805 11 3HE MET 1 3HE MET 1 -1.289 -6.750 -4.303 12 H PHE 2 H PHE 2 -2.121 -12.378 -7.461 13 HA PHE 2 HA PHE 2 -4.391 -13.182 -5.983 14 1HB PHE 2 1HB PHE 2 -4.580 -14.877 -7.781 15 2HB PHE 2 2HB PHE 2 -4.065 -13.326 -8.443 16 HD1 PHE 2 HD1 PHE 2 -1.873 -13.029 -9.394 17 HD2 PHE 2 HD2 PHE 2 -2.930 -16.713 -7.454 18 HE1 PHE 2 HE1 PHE 2 0.173 -14.096 -10.304 19 HE2 PHE 2 HE2 PHE 2 -0.885 -17.780 -8.365 20 HZ PHE 2 HZ PHE 2 0.666 -16.471 -9.790 21 H ASN 3 H ASN 3 -4.791 -14.909 -4.598 22 HA ASN 3 HA ASN 3 -2.521 -16.784 -4.037 23 1HB ASN 3 1HB ASN 3 -3.174 -16.530 -1.624 24 2HB ASN 3 2HB ASN 3 -2.618 -15.017 -2.338 25 1HD2 ASN 3 1HD2 ASN 3 -4.212 -14.703 -0.130 26 2HD2 ASN 3 2HD2 ASN 3 -5.778 -14.215 -0.566 27 H ASP 4 H ASP 4 -3.308 -18.803 -2.930 28 HA ASP 4 HA ASP 4 -5.345 -20.149 -4.287 29 1HB ASP 4 1HB ASP 4 -3.548 -21.042 -2.741 30 2HB ASP 4 2HB ASP 4 -4.545 -20.527 -1.380 31 H ARG 5 H ARG 5 -5.658 -17.876 -1.641 32 HA ARG 5 HA ARG 5 -8.363 -18.669 -0.892 33 1HB ARG 5 1HB ARG 5 -6.658 -16.201 -0.396 34 2HB ARG 5 2HB ARG 5 -8.187 -16.529 0.419 35 1HG ARG 5 1HG ARG 5 -6.089 -18.661 0.450 36 2HG ARG 5 2HG ARG 5 -5.869 -17.264 1.504 37 1HD ARG 5 1HD ARG 5 -8.608 -18.356 1.560 38 2HD ARG 5 2HD ARG 5 -7.372 -19.476 2.164 39 HE ARG 5 HE ARG 5 -8.146 -16.952 3.410 40 1HH1 ARG 5 1HH1 ARG 5 -5.551 -19.214 2.894 41 2HH1 ARG 5 2HH1 ARG 5 -4.706 -18.740 4.326 42 1HH2 ARG 5 1HH2 ARG 5 -7.031 -16.354 5.265 43 2HH2 ARG 5 2HH2 ARG 5 -5.536 -17.133 5.661 44 H VAL 6 H VAL 6 -6.960 -15.989 -2.811 45 HA VAL 6 HA VAL 6 -9.511 -15.762 -4.305 46 HB VAL 6 HB VAL 6 -9.627 -13.325 -3.724 47 1HG1 VAL 6 1HG1 VAL 6 -10.812 -15.191 -2.419 48 2HG1 VAL 6 2HG1 VAL 6 -10.625 -13.648 -1.585 49 3HG1 VAL 6 3HG1 VAL 6 -9.550 -14.993 -1.203 50 1HG2 VAL 6 1HG2 VAL 6 -7.558 -13.978 -1.614 51 2HG2 VAL 6 2HG2 VAL 6 -8.209 -12.394 -2.036 52 3HG2 VAL 6 3HG2 VAL 6 -7.137 -13.234 -3.157 53 H ILE 7 H ILE 7 -9.097 -13.543 -5.754 54 HA ILE 7 HA ILE 7 -6.283 -13.519 -6.724 55 HB ILE 7 HB ILE 7 -7.530 -15.296 -7.942 56 1HG1 ILE 7 1HG1 ILE 7 -7.374 -13.163 -9.998 57 2HG1 ILE 7 2HG1 ILE 7 -5.922 -13.396 -9.024 58 1HG2 ILE 7 1HG2 ILE 7 -9.711 -13.751 -7.638 59 2HG2 ILE 7 2HG2 ILE 7 -9.587 -14.967 -8.909 60 3HG2 ILE 7 3HG2 ILE 7 -9.259 -13.272 -9.274 61 1HD1 ILE 7 1HD1 ILE 7 -6.517 -14.870 -11.245 62 2HD1 ILE 7 2HD1 ILE 7 -7.201 -15.888 -9.977 63 3HD1 ILE 7 3HD1 ILE 7 -5.494 -15.446 -9.929 64 H VAL 8 H VAL 8 -5.731 -11.495 -7.625 65 HA VAL 8 HA VAL 8 -7.690 -9.333 -7.174 66 HB VAL 8 HB VAL 8 -4.771 -9.395 -8.025 67 1HG1 VAL 8 1HG1 VAL 8 -4.789 -6.990 -7.416 68 2HG1 VAL 8 2HG1 VAL 8 -6.527 -7.085 -7.133 69 3HG1 VAL 8 3HG1 VAL 8 -5.884 -7.325 -8.758 70 1HG2 VAL 8 1HG2 VAL 8 -4.391 -9.811 -5.844 71 2HG2 VAL 8 2HG2 VAL 8 -6.116 -9.727 -5.490 72 3HG2 VAL 8 3HG2 VAL 8 -5.138 -8.260 -5.461 73 H LYS 9 H LYS 9 -9.019 -8.725 -8.805 74 HA LYS 9 HA LYS 9 -7.995 -8.872 -11.616 75 1HB LYS 9 1HB LYS 9 -10.779 -9.250 -10.466 76 2HB LYS 9 2HB LYS 9 -10.410 -9.257 -12.188 77 1HG LYS 9 1HG LYS 9 -8.591 -11.062 -11.344 78 2HG LYS 9 2HG LYS 9 -9.829 -11.311 -10.116 79 1HD LYS 9 1HD LYS 9 -11.345 -12.143 -11.615 80 2HD LYS 9 2HD LYS 9 -10.778 -11.104 -12.916 81 1HE LYS 9 1HE LYS 9 -8.584 -12.707 -12.491 82 2HE LYS 9 2HE LYS 9 -9.934 -13.816 -12.206 83 1HZ LYS 9 1HZ LYS 9 -10.954 -12.825 -14.271 84 2HZ LYS 9 2HZ LYS 9 -9.593 -13.807 -14.532 85 3HZ LYS 9 3HZ LYS 9 -9.444 -12.116 -14.585 86 H LYS 10 H LYS 10 -9.076 -5.475 -12.164 87 HA LYS 10 HA LYS 10 -8.133 -6.302 -14.122 88 1HB LYS 10 1HB LYS 10 -6.705 -7.338 -11.787 89 2HB LYS 10 2HB LYS 10 -6.448 -8.314 -13.236 90 1HG LYS 10 1HG LYS 10 -4.783 -6.543 -13.170 91 2HG LYS 10 2HG LYS 10 -5.902 -6.217 -14.488 92 1HD LYS 10 1HD LYS 10 -6.890 -5.055 -12.033 93 2HD LYS 10 2HD LYS 10 -5.244 -4.502 -12.342 94 1HE LYS 10 1HE LYS 10 -7.194 -4.532 -14.628 95 2HE LYS 10 2HE LYS 10 -7.285 -3.218 -13.439 96 1HZ LYS 10 1HZ LYS 10 -4.739 -4.105 -14.683 97 2HZ LYS 10 2HZ LYS 10 -5.017 -2.694 -13.781 98 3HZ LYS 10 3HZ LYS 10 -5.684 -2.853 -15.334 99 H SER 11 H SER 11 -10.393 -7.199 -14.502 100 HA SER 11 HA SER 11 -10.370 -10.196 -14.586 101 1HB SER 11 1HB SER 11 -12.169 -8.399 -13.489 102 2HB SER 11 2HB SER 11 -12.891 -8.734 -15.062 103 HG SER 11 HG SER 11 -13.609 -10.411 -14.008 104 HA PRO 12 HA PRO 12 -10.841 -9.967 -18.966 105 1HB PRO 12 1HB PRO 12 -12.959 -11.577 -19.604 106 2HB PRO 12 2HB PRO 12 -11.438 -12.212 -18.952 107 1HG PRO 12 1HG PRO 12 -14.058 -11.862 -17.641 108 2HG PRO 12 2HG PRO 12 -12.770 -13.021 -17.298 109 1HD PRO 12 1HD PRO 12 -13.347 -10.652 -15.885 110 2HD PRO 12 2HD PRO 12 -11.927 -11.694 -15.677 111 H LEU 13 H LEU 13 -13.070 -8.332 -17.179 112 HA LEU 13 HA LEU 13 -14.523 -7.352 -19.615 113 1HB LEU 13 1HB LEU 13 -15.443 -7.585 -16.724 114 2HB LEU 13 2HB LEU 13 -16.421 -6.968 -18.057 115 HG LEU 13 HG LEU 13 -15.184 -9.731 -18.080 116 1HD1 LEU 13 1HD1 LEU 13 -17.379 -10.583 -17.389 117 2HD1 LEU 13 2HD1 LEU 13 -17.994 -8.935 -17.259 118 3HD1 LEU 13 3HD1 LEU 13 -16.739 -9.497 -16.155 119 1HD2 LEU 13 1HD2 LEU 13 -17.348 -9.888 -19.645 120 2HD2 LEU 13 2HD2 LEU 13 -15.801 -9.309 -20.264 121 3HD2 LEU 13 3HD2 LEU 13 -17.051 -8.156 -19.798 122 H GLY 14 H GLY 14 -13.270 -6.478 -16.386 123 1HA GLY 14 1HA GLY 14 -11.816 -4.327 -16.603 124 2HA GLY 14 2HA GLY 14 -13.307 -3.614 -17.221 125 H GLY 15 H GLY 15 -11.830 -2.883 -14.775 126 1HA GLY 15 1HA GLY 15 -13.075 -1.921 -12.853 127 2HA GLY 15 2HA GLY 15 -14.018 -3.411 -12.807 128 H TYR 16 H TYR 16 -11.668 -1.851 -11.171 129 HA TYR 16 HA TYR 16 -9.932 -4.196 -10.639 130 1HB TYR 16 1HB TYR 16 -9.558 -1.475 -10.761 131 2HB TYR 16 2HB TYR 16 -9.709 -1.721 -9.022 132 HD1 TYR 16 HD1 TYR 16 -8.504 -4.219 -8.420 133 HD2 TYR 16 HD2 TYR 16 -7.324 -1.362 -11.403 134 HE1 TYR 16 HE1 TYR 16 -6.186 -5.098 -8.345 135 HE2 TYR 16 HE2 TYR 16 -5.007 -2.241 -11.328 136 HH TYR 16 HH TYR 16 -4.200 -5.150 -9.573 137 H GLY 17 H GLY 17 -11.010 -5.669 -9.348 138 1HA GLY 17 1HA GLY 17 -11.805 -4.781 -6.645 139 2HA GLY 17 2HA GLY 17 -13.036 -5.611 -7.599 140 H VAL 18 H VAL 18 -12.714 -7.171 -5.617 141 HA VAL 18 HA VAL 18 -10.342 -8.938 -6.085 142 HB VAL 18 HB VAL 18 -12.302 -8.588 -3.790 143 1HG1 VAL 18 1HG1 VAL 18 -9.997 -10.518 -4.178 144 2HG1 VAL 18 2HG1 VAL 18 -11.670 -10.904 -3.777 145 3HG1 VAL 18 3HG1 VAL 18 -10.639 -10.112 -2.586 146 1HG2 VAL 18 1HG2 VAL 18 -10.107 -7.907 -2.646 147 2HG2 VAL 18 2HG2 VAL 18 -10.768 -6.773 -3.823 148 3HG2 VAL 18 3HG2 VAL 18 -9.420 -7.820 -4.268 149 H PHE 19 H PHE 19 -10.650 -11.143 -6.516 150 HA PHE 19 HA PHE 19 -13.449 -11.948 -7.227 151 1HB PHE 19 1HB PHE 19 -10.771 -12.223 -8.423 152 2HB PHE 19 2HB PHE 19 -11.681 -13.734 -8.403 153 HD1 PHE 19 HD1 PHE 19 -12.148 -10.092 -9.179 154 HD2 PHE 19 HD2 PHE 19 -13.188 -14.149 -10.136 155 HE1 PHE 19 HE1 PHE 19 -13.497 -9.293 -11.100 156 HE2 PHE 19 HE2 PHE 19 -14.537 -13.349 -12.058 157 HZ PHE 19 HZ PHE 19 -14.687 -10.920 -12.541 158 H ALA 20 H ALA 20 -14.312 -13.370 -5.768 159 HA ALA 20 HA ALA 20 -12.547 -14.756 -3.856 160 1HB ALA 20 1HB ALA 20 -15.200 -13.701 -3.983 161 2HB ALA 20 2HB ALA 20 -14.378 -14.383 -2.579 162 3HB ALA 20 3HB ALA 20 -15.335 -15.424 -3.632 163 H ARG 21 H ARG 21 -11.555 -16.379 -5.224 164 HA ARG 21 HA ARG 21 -12.935 -18.208 -6.922 165 1HB ARG 21 1HB ARG 21 -10.349 -17.715 -5.989 166 2HB ARG 21 2HB ARG 21 -10.711 -19.338 -5.399 167 1HG ARG 21 1HG ARG 21 -9.844 -19.715 -7.560 168 2HG ARG 21 2HG ARG 21 -11.585 -19.785 -7.801 169 1HD ARG 21 1HD ARG 21 -10.941 -17.061 -8.065 170 2HD ARG 21 2HD ARG 21 -9.665 -17.926 -8.943 171 HE ARG 21 HE ARG 21 -12.499 -17.873 -9.655 172 1HH1 ARG 21 1HH1 ARG 21 -9.540 -19.704 -9.769 173 2HH1 ARG 21 2HH1 ARG 21 -10.025 -20.610 -11.159 174 1HH2 ARG 21 1HH2 ARG 21 -13.106 -19.062 -11.460 175 2HH2 ARG 21 2HH2 ARG 21 -12.029 -20.251 -12.111 176 H LYS 22 H LYS 22 -12.701 -17.959 -3.451 177 HA LYS 22 HA LYS 22 -13.847 -20.669 -3.020 178 1HB LYS 22 1HB LYS 22 -13.004 -18.459 -1.097 179 2HB LYS 22 2HB LYS 22 -13.317 -20.138 -0.671 180 1HG LYS 22 1HG LYS 22 -11.478 -20.741 -2.363 181 2HG LYS 22 2HG LYS 22 -11.044 -19.032 -2.317 182 1HD LYS 22 1HD LYS 22 -9.706 -20.326 -0.695 183 2HD LYS 22 2HD LYS 22 -10.753 -19.174 0.132 184 1HE LYS 22 1HE LYS 22 -11.959 -20.833 1.137 185 2HE LYS 22 2HE LYS 22 -11.994 -21.817 -0.338 186 1HZ LYS 22 1HZ LYS 22 -10.586 -22.916 1.228 187 2HZ LYS 22 2HZ LYS 22 -9.729 -21.489 1.561 188 3HZ LYS 22 3HZ LYS 22 -9.578 -22.235 0.043 189 H SER 23 H SER 23 -16.947 -19.343 -1.485 190 HA SER 23 HA SER 23 -14.730 -21.338 -1.254 191 1HB SER 23 1HB SER 23 -17.109 -21.978 -1.892 192 2HB SER 23 2HB SER 23 -16.490 -22.806 -0.463 193 HG SER 23 HG SER 23 -17.840 -21.743 0.764 194 H PHE 24 H PHE 24 -16.520 -18.870 0.453 195 HA PHE 24 HA PHE 24 -14.874 -19.433 2.894 196 1HB PHE 24 1HB PHE 24 -15.920 -16.971 1.499 197 2HB PHE 24 2HB PHE 24 -15.501 -16.891 3.210 198 HD1 PHE 24 HD1 PHE 24 -14.224 -16.001 0.228 199 HD2 PHE 24 HD2 PHE 24 -13.181 -18.540 3.532 200 HE1 PHE 24 HE1 PHE 24 -11.826 -15.791 -0.367 201 HE2 PHE 24 HE2 PHE 24 -10.782 -18.330 2.936 202 HZ PHE 24 HZ PHE 24 -10.106 -16.955 0.986 203 H GLU 25 H GLU 25 -15.930 -18.953 4.978 204 HA GLU 25 HA GLU 25 -18.787 -19.730 4.969 205 1HB GLU 25 1HB GLU 25 -16.477 -20.109 6.594 206 2HB GLU 25 2HB GLU 25 -17.641 -19.210 7.567 207 1HG GLU 25 1HG GLU 25 -19.383 -20.922 6.820 208 2HG GLU 25 2HG GLU 25 -18.039 -21.878 6.196 209 H LYS 26 H LYS 26 -19.480 -18.439 7.428 210 HA LYS 26 HA LYS 26 -19.913 -15.674 6.416 211 1HB LYS 26 1HB LYS 26 -21.775 -17.238 7.115 212 2HB LYS 26 2HB LYS 26 -21.146 -17.165 8.757 213 1HG LYS 26 1HG LYS 26 -21.471 -14.726 8.790 214 2HG LYS 26 2HG LYS 26 -22.070 -14.777 7.132 215 1HD LYS 26 1HD LYS 26 -24.027 -15.953 7.756 216 2HD LYS 26 2HD LYS 26 -23.347 -16.432 9.310 217 1HE LYS 26 1HE LYS 26 -23.644 -14.283 10.239 218 2HE LYS 26 2HE LYS 26 -23.757 -13.512 8.646 219 1HZ LYS 26 1HZ LYS 26 -25.670 -15.607 9.488 220 2HZ LYS 26 2HZ LYS 26 -25.847 -14.444 8.263 221 3HZ LYS 26 3HZ LYS 26 -25.931 -13.978 9.894 222 H GLY 27 H GLY 27 -17.535 -15.248 7.060 223 1HA GLY 27 1HA GLY 27 -16.639 -13.564 8.648 224 2HA GLY 27 2HA GLY 27 -17.469 -14.435 9.937 225 H GLU 28 H GLU 28 -14.865 -14.787 7.525 226 HA GLU 28 HA GLU 28 -13.421 -16.504 9.506 227 1HB GLU 28 1HB GLU 28 -14.059 -17.012 6.588 228 2HB GLU 28 2HB GLU 28 -12.754 -17.864 7.413 229 1HG GLU 28 1HG GLU 28 -15.295 -17.823 8.904 230 2HG GLU 28 2HG GLU 28 -15.372 -18.694 7.373 231 H LEU 29 H LEU 29 -13.259 -13.638 8.222 232 HA LEU 29 HA LEU 29 -11.530 -12.153 7.650 233 1HB LEU 29 1HB LEU 29 -10.590 -13.458 9.643 234 2HB LEU 29 2HB LEU 29 -9.732 -14.448 8.467 235 HG LEU 29 HG LEU 29 -8.791 -12.272 7.518 236 1HD1 LEU 29 1HD1 LEU 29 -10.680 -11.091 9.085 237 2HD1 LEU 29 2HD1 LEU 29 -9.226 -10.266 8.522 238 3HD1 LEU 29 3HD1 LEU 29 -9.270 -10.973 10.137 239 1HD2 LEU 29 1HD2 LEU 29 -8.163 -13.317 10.273 240 2HD2 LEU 29 2HD2 LEU 29 -7.237 -11.981 9.588 241 3HD2 LEU 29 3HD2 LEU 29 -7.263 -13.546 8.774 242 H VAL 30 H VAL 30 -10.217 -11.697 5.822 243 HA VAL 30 HA VAL 30 -9.851 -13.970 3.896 244 HB VAL 30 HB VAL 30 -10.782 -11.109 3.457 245 1HG1 VAL 30 1HG1 VAL 30 -9.458 -11.614 1.551 246 2HG1 VAL 30 2HG1 VAL 30 -11.106 -12.007 1.057 247 3HG1 VAL 30 3HG1 VAL 30 -9.993 -13.294 1.524 248 1HG2 VAL 30 1HG2 VAL 30 -12.096 -13.742 3.714 249 2HG2 VAL 30 2HG2 VAL 30 -12.634 -12.780 2.336 250 3HG2 VAL 30 3HG2 VAL 30 -12.753 -12.125 3.970 251 H GLU 31 H GLU 31 -8.728 -10.747 4.930 252 HA GLU 31 HA GLU 31 -5.943 -11.481 4.534 253 1HB GLU 31 1HB GLU 31 -7.333 -10.796 2.255 254 2HB GLU 31 2HB GLU 31 -6.651 -9.243 2.736 255 1HG GLU 31 1HG GLU 31 -4.651 -9.881 1.926 256 2HG GLU 31 2HG GLU 31 -4.620 -11.218 3.075 257 H GLU 32 H GLU 32 -4.499 -9.640 5.104 258 HA GLU 32 HA GLU 32 -5.797 -7.231 6.234 259 1HB GLU 32 1HB GLU 32 -4.780 -7.733 8.473 260 2HB GLU 32 2HB GLU 32 -5.985 -8.929 7.995 261 1HG GLU 32 1HG GLU 32 -3.421 -9.710 6.949 262 2HG GLU 32 2HG GLU 32 -3.264 -9.385 8.676 263 H CYS 33 H CYS 33 -4.338 -5.493 6.356 264 HA CYS 33 HA CYS 33 -1.435 -6.023 6.007 265 1HB CYS 33 1HB CYS 33 -3.356 -4.978 3.997 266 2HB CYS 33 2HB CYS 33 -1.847 -4.074 4.131 267 HG CYS 33 HG CYS 33 -1.565 -6.117 2.438 268 H LEU 34 H LEU 34 -0.627 -3.416 5.498 269 HA LEU 34 HA LEU 34 -1.418 -2.055 8.030 270 1HB LEU 34 1HB LEU 34 0.943 -2.067 6.157 271 2HB LEU 34 2HB LEU 34 0.713 -0.700 7.247 272 HG LEU 34 HG LEU 34 0.650 -2.240 9.173 273 1HD1 LEU 34 1HD1 LEU 34 -0.158 -4.295 8.486 274 2HD1 LEU 34 2HD1 LEU 34 1.570 -4.645 8.466 275 3HD1 LEU 34 3HD1 LEU 34 0.732 -4.253 6.965 276 1HD2 LEU 34 1HD2 LEU 34 3.103 -3.301 8.138 277 2HD2 LEU 34 2HD2 LEU 34 2.880 -1.957 9.258 278 3HD2 LEU 34 3HD2 LEU 34 2.898 -1.662 7.519 279 H CYS 35 H CYS 35 -1.224 0.485 7.753 280 HA CYS 35 HA CYS 35 -2.355 1.390 5.149 281 1HB CYS 35 1HB CYS 35 -4.202 2.500 6.405 282 2HB CYS 35 2HB CYS 35 -4.233 0.754 6.631 283 HG CYS 35 HG CYS 35 -2.628 2.118 8.820 284 H ILE 36 H ILE 36 -2.102 3.699 4.837 285 HA ILE 36 HA ILE 36 0.057 4.870 6.529 286 HB ILE 36 HB ILE 36 -1.209 5.900 3.966 287 1HG1 ILE 36 1HG1 ILE 36 1.239 4.136 4.302 288 2HG1 ILE 36 2HG1 ILE 36 -0.312 3.604 3.653 289 1HG2 ILE 36 1HG2 ILE 36 1.028 7.023 3.754 290 2HG2 ILE 36 2HG2 ILE 36 1.418 6.444 5.373 291 3HG2 ILE 36 3HG2 ILE 36 0.088 7.578 5.139 292 1HD1 ILE 36 1HD1 ILE 36 1.667 4.448 2.056 293 2HD1 ILE 36 2HD1 ILE 36 0.938 6.014 2.412 294 3HD1 ILE 36 3HD1 ILE 36 -0.028 4.741 1.667 295 H VAL 37 H VAL 37 -1.079 5.599 8.374 296 HA VAL 37 HA VAL 37 -3.558 7.154 8.056 297 HB VAL 37 HB VAL 37 -1.826 6.455 10.457 298 1HG1 VAL 37 1HG1 VAL 37 -4.339 7.964 10.107 299 2HG1 VAL 37 2HG1 VAL 37 -3.191 7.985 11.446 300 3HG1 VAL 37 3HG1 VAL 37 -4.406 6.711 11.346 301 1HG2 VAL 37 1HG2 VAL 37 -4.346 5.045 10.225 302 2HG2 VAL 37 2HG2 VAL 37 -2.717 4.387 10.372 303 3HG2 VAL 37 3HG2 VAL 37 -3.364 4.791 8.782 304 H ARG 38 H ARG 38 -3.378 9.279 7.492 305 HA ARG 38 HA ARG 38 -1.159 10.877 8.722 306 1HB ARG 38 1HB ARG 38 -2.015 10.403 5.961 307 2HB ARG 38 2HB ARG 38 -1.912 12.121 6.340 308 1HG ARG 38 1HG ARG 38 0.287 10.095 6.857 309 2HG ARG 38 2HG ARG 38 0.247 11.214 5.495 310 1HD ARG 38 1HD ARG 38 -0.176 12.572 8.061 311 2HD ARG 38 2HD ARG 38 1.395 11.754 7.965 312 HE ARG 38 HE ARG 38 1.062 12.991 5.479 313 1HH1 ARG 38 1HH1 ARG 38 1.139 13.991 8.813 314 2HH1 ARG 38 2HH1 ARG 38 1.772 15.558 8.443 315 1HH2 ARG 38 1HH2 ARG 38 1.883 15.031 5.024 316 2HH2 ARG 38 2HH2 ARG 38 2.190 16.144 6.315 317 H HIS 39 H HIS 39 -1.738 13.006 9.384 318 HA HIS 39 HA HIS 39 -4.372 13.456 10.343 319 1HB HIS 39 1HB HIS 39 -1.850 14.978 9.911 320 2HB HIS 39 2HB HIS 39 -3.305 15.951 10.127 321 HD1 HIS 39 HD1 HIS 39 -1.643 16.396 12.421 322 HD2 HIS 39 HD2 HIS 39 -3.916 12.908 12.208 323 HE1 HIS 39 HE1 HIS 39 -1.856 15.533 14.793 324 H ASN 40 H ASN 40 -5.938 15.092 9.585 325 HA ASN 40 HA ASN 40 -6.500 14.883 6.762 326 1HB ASN 40 1HB ASN 40 -8.338 16.481 7.402 327 2HB ASN 40 2HB ASN 40 -8.234 15.078 8.465 328 1HD2 ASN 40 1HD2 ASN 40 -7.632 15.437 10.680 329 2HD2 ASN 40 2HD2 ASN 40 -7.407 16.989 11.329 330 H ASP 41 H ASP 41 -5.303 15.961 5.262 331 HA ASP 41 HA ASP 41 -5.133 18.836 5.201 332 1HB ASP 41 1HB ASP 41 -3.422 17.762 7.009 333 2HB ASP 41 2HB ASP 41 -2.418 17.643 5.564 334 H ASP 42 H ASP 42 -2.404 18.622 3.818 335 HA ASP 42 HA ASP 42 -3.180 18.302 1.144 336 1HB ASP 42 1HB ASP 42 -0.521 17.620 2.456 337 2HB ASP 42 2HB ASP 42 -0.751 18.033 0.757 338 H TRP 43 H TRP 43 -2.473 15.862 3.539 339 HA TRP 43 HA TRP 43 -2.020 13.618 1.800 340 1HB TRP 43 1HB TRP 43 -1.389 13.523 4.108 341 2HB TRP 43 2HB TRP 43 -2.977 14.061 4.644 342 HD1 TRP 43 HD1 TRP 43 -4.624 12.265 5.326 343 HE1 TRP 43 HE1 TRP 43 -4.749 9.697 5.096 344 HE3 TRP 43 HE3 TRP 43 -0.574 11.444 2.325 345 HZ2 TRP 43 HZ2 TRP 43 -3.318 7.583 3.812 346 HZ3 TRP 43 HZ3 TRP 43 0.018 9.144 1.616 347 HH2 TRP 43 HH2 TRP 43 -1.346 7.215 2.356 348 H GLY 44 H GLY 44 -4.977 14.633 3.576 349 1HA GLY 44 1HA GLY 44 -6.731 12.717 2.467 350 2HA GLY 44 2HA GLY 44 -7.242 14.295 3.065 351 H THR 45 H THR 45 -5.570 15.774 1.150 352 HA THR 45 HA THR 45 -7.444 15.797 -1.089 353 HB THR 45 HB THR 45 -4.787 17.224 -0.721 354 HG1 THR 45 HG1 THR 45 -7.383 17.909 0.189 355 1HG2 THR 45 1HG2 THR 45 -6.786 18.851 -1.895 356 2HG2 THR 45 2HG2 THR 45 -6.866 17.293 -2.716 357 3HG2 THR 45 3HG2 THR 45 -5.348 18.191 -2.674 358 H ALA 46 H ALA 46 -3.869 15.499 -1.044 359 HA ALA 46 HA ALA 46 -3.490 14.620 -3.673 360 1HB ALA 46 1HB ALA 46 -1.807 15.240 -1.861 361 2HB ALA 46 2HB ALA 46 -1.356 13.842 -2.838 362 3HB ALA 46 3HB ALA 46 -2.015 13.610 -1.219 363 H LEU 47 H LEU 47 -3.915 12.527 -0.785 364 HA LEU 47 HA LEU 47 -4.268 10.165 -2.537 365 1HB LEU 47 1HB LEU 47 -3.990 10.727 0.419 366 2HB LEU 47 2HB LEU 47 -4.498 9.134 -0.137 367 HG LEU 47 HG LEU 47 -2.079 9.151 0.168 368 1HD1 LEU 47 1HD1 LEU 47 -1.942 9.281 -2.726 369 2HD1 LEU 47 2HD1 LEU 47 -3.407 8.450 -2.201 370 3HD1 LEU 47 3HD1 LEU 47 -1.828 7.875 -1.666 371 1HD2 LEU 47 1HD2 LEU 47 -0.658 10.777 -0.680 372 2HD2 LEU 47 2HD2 LEU 47 -2.095 11.742 -0.342 373 3HD2 LEU 47 3HD2 LEU 47 -1.760 11.204 -1.989 374 H GLU 48 H GLU 48 -6.338 12.364 -2.436 375 HA GLU 48 HA GLU 48 -8.602 11.914 -0.933 376 1HB GLU 48 1HB GLU 48 -9.817 12.760 -2.944 377 2HB GLU 48 2HB GLU 48 -8.322 13.650 -2.654 378 1HG GLU 48 1HG GLU 48 -7.939 13.207 -4.862 379 2HG GLU 48 2HG GLU 48 -7.400 11.645 -4.246 380 H ASP 49 H ASP 49 -7.354 9.757 -3.420 381 HA ASP 49 HA ASP 49 -9.835 8.147 -3.359 382 1HB ASP 49 1HB ASP 49 -8.707 7.019 -5.275 383 2HB ASP 49 2HB ASP 49 -8.804 8.761 -5.517 384 H TYR 50 H TYR 50 -9.751 5.945 -2.801 385 HA TYR 50 HA TYR 50 -9.073 4.039 -1.584 386 1HB TYR 50 1HB TYR 50 -6.282 5.105 -2.134 387 2HB TYR 50 2HB TYR 50 -6.750 3.427 -1.875 388 HD1 TYR 50 HD1 TYR 50 -9.250 3.321 -3.551 389 HD2 TYR 50 HD2 TYR 50 -5.396 5.056 -4.327 390 HE1 TYR 50 HE1 TYR 50 -9.619 3.056 -5.987 391 HE2 TYR 50 HE2 TYR 50 -5.767 4.790 -6.763 392 HH TYR 50 HH TYR 50 -8.258 2.871 -8.040 393 H LEU 51 H LEU 51 -9.167 6.903 -0.295 394 HA LEU 51 HA LEU 51 -7.442 6.326 2.076 395 1HB LEU 51 1HB LEU 51 -8.543 8.720 0.698 396 2HB LEU 51 2HB LEU 51 -8.533 8.819 2.453 397 HG LEU 51 HG LEU 51 -6.152 8.352 0.635 398 1HD1 LEU 51 1HD1 LEU 51 -6.870 10.515 2.641 399 2HD1 LEU 51 2HD1 LEU 51 -6.877 10.693 0.888 400 3HD1 LEU 51 3HD1 LEU 51 -5.357 10.433 1.742 401 1HD2 LEU 51 1HD2 LEU 51 -6.563 7.724 3.497 402 2HD2 LEU 51 2HD2 LEU 51 -5.110 8.659 3.134 403 3HD2 LEU 51 3HD2 LEU 51 -5.366 7.094 2.364 404 H PHE 52 H PHE 52 -8.444 5.466 3.835 405 HA PHE 52 HA PHE 52 -11.397 5.582 4.082 406 1HB PHE 52 1HB PHE 52 -9.089 4.142 5.389 407 2HB PHE 52 2HB PHE 52 -10.652 4.193 6.205 408 HD1 PHE 52 HD1 PHE 52 -12.524 2.923 5.403 409 HD2 PHE 52 HD2 PHE 52 -8.900 3.136 3.107 410 HE1 PHE 52 HE1 PHE 52 -13.353 1.112 3.927 411 HE2 PHE 52 HE2 PHE 52 -9.729 1.324 1.631 412 HZ PHE 52 HZ PHE 52 -11.956 0.312 2.040 413 H SER 53 H SER 53 -12.003 7.616 4.834 414 HA SER 53 HA SER 53 -10.292 9.067 6.724 415 1HB SER 53 1HB SER 53 -11.828 10.870 6.252 416 2HB SER 53 2HB SER 53 -11.598 9.999 4.736 417 HG SER 53 HG SER 53 -13.807 10.081 6.442 418 H ARG 54 H ARG 54 -10.440 8.722 8.874 419 HA ARG 54 HA ARG 54 -12.964 7.638 10.028 420 1HB ARG 54 1HB ARG 54 -10.184 7.228 10.373 421 2HB ARG 54 2HB ARG 54 -10.736 8.018 11.850 422 1HG ARG 54 1HG ARG 54 -12.551 6.330 12.045 423 2HG ARG 54 2HG ARG 54 -11.925 5.519 10.609 424 1HD ARG 54 1HD ARG 54 -10.972 4.354 12.486 425 2HD ARG 54 2HD ARG 54 -9.676 5.398 11.868 426 HE ARG 54 HE ARG 54 -11.355 6.750 13.829 427 1HH1 ARG 54 1HH1 ARG 54 -8.662 4.592 13.390 428 2HH1 ARG 54 2HH1 ARG 54 -7.950 4.991 14.914 429 1HH2 ARG 54 1HH2 ARG 54 -10.414 7.251 15.805 430 2HH2 ARG 54 2HH2 ARG 54 -8.933 6.485 16.274 431 H LYS 55 H LYS 55 -13.279 8.595 12.409 432 HA LYS 55 HA LYS 55 -13.731 11.458 12.082 433 1HB LYS 55 1HB LYS 55 -14.329 9.266 14.032 434 2HB LYS 55 2HB LYS 55 -14.419 10.922 14.634 435 1HG LYS 55 1HG LYS 55 -16.556 10.791 13.818 436 2HG LYS 55 2HG LYS 55 -15.761 11.208 12.300 437 1HD LYS 55 1HD LYS 55 -15.936 9.066 11.461 438 2HD LYS 55 2HD LYS 55 -15.851 8.322 13.057 439 1HE LYS 55 1HE LYS 55 -18.175 9.363 13.482 440 2HE LYS 55 2HE LYS 55 -18.235 9.630 11.730 441 1HZ LYS 55 1HZ LYS 55 -17.782 7.308 11.364 442 2HZ LYS 55 2HZ LYS 55 -19.125 7.435 12.395 443 3HZ LYS 55 3HZ LYS 55 -17.604 7.029 13.030 444 H ASN 56 H ASN 56 -11.440 12.084 11.890 445 HA ASN 56 HA ASN 56 -9.786 11.852 14.338 446 1HB ASN 56 1HB ASN 56 -9.606 14.318 14.469 447 2HB ASN 56 2HB ASN 56 -10.693 14.473 13.089 448 1HD2 ASN 56 1HD2 ASN 56 -12.806 14.907 13.725 449 2HD2 ASN 56 2HD2 ASN 56 -13.528 14.362 15.161 450 H MET 57 H MET 57 -9.801 11.182 11.282 451 HA MET 57 HA MET 57 -7.738 12.788 10.055 452 1HB MET 57 1HB MET 57 -5.848 11.216 10.438 453 2HB MET 57 2HB MET 57 -6.457 11.850 11.966 454 1HG MET 57 1HG MET 57 -8.036 9.608 11.535 455 2HG MET 57 2HG MET 57 -6.449 9.099 10.960 456 1HE MET 57 1HE MET 57 -4.191 10.164 13.996 457 2HE MET 57 2HE MET 57 -4.750 11.218 12.697 458 3HE MET 57 3HE MET 57 -4.225 9.575 12.334 459 H SER 58 H SER 58 -6.382 10.809 8.610 460 HA SER 58 HA SER 58 -8.487 9.075 7.408 461 1HB SER 58 1HB SER 58 -8.030 9.995 5.205 462 2HB SER 58 2HB SER 58 -8.359 11.349 6.286 463 HG SER 58 HG SER 58 -6.516 11.836 5.175 464 H ALA 59 H ALA 59 -7.573 7.278 6.224 465 HA ALA 59 HA ALA 59 -4.606 6.960 6.430 466 1HB ALA 59 1HB ALA 59 -5.627 4.472 7.057 467 2HB ALA 59 2HB ALA 59 -6.805 5.549 7.808 468 3HB ALA 59 3HB ALA 59 -5.101 5.662 8.247 469 H MET 60 H MET 60 -3.716 5.670 4.765 470 HA MET 60 HA MET 60 -5.487 5.153 2.451 471 1HB MET 60 1HB MET 60 -3.308 6.262 2.162 472 2HB MET 60 2HB MET 60 -2.496 4.908 2.944 473 1HG MET 60 1HG MET 60 -2.278 4.704 0.515 474 2HG MET 60 2HG MET 60 -3.299 3.406 1.134 475 1HE MET 60 1HE MET 60 -2.575 6.005 -0.989 476 2HE MET 60 2HE MET 60 -3.804 7.220 -0.633 477 3HE MET 60 3HE MET 60 -3.945 6.221 -2.079 478 H ALA 61 H ALA 61 -5.688 3.044 1.490 479 HA ALA 61 HA ALA 61 -5.484 0.823 3.422 480 1HB ALA 61 1HB ALA 61 -6.861 1.509 0.918 481 2HB ALA 61 2HB ALA 61 -7.392 0.461 2.233 482 3HB ALA 61 3HB ALA 61 -6.327 -0.172 0.978 483 H LEU 62 H LEU 62 -3.459 -0.052 3.608 484 HA LEU 62 HA LEU 62 -1.477 -1.135 2.992 485 1HB LEU 62 1HB LEU 62 -0.885 0.062 0.517 486 2HB LEU 62 2HB LEU 62 -1.838 1.265 1.385 487 HG LEU 62 HG LEU 62 -0.300 0.795 3.390 488 1HD1 LEU 62 1HD1 LEU 62 0.691 -1.129 1.530 489 2HD1 LEU 62 2HD1 LEU 62 1.269 -0.802 3.164 490 3HD1 LEU 62 3HD1 LEU 62 1.963 0.065 1.793 491 1HD2 LEU 62 1HD2 LEU 62 1.286 2.423 2.647 492 2HD2 LEU 62 2HD2 LEU 62 -0.215 2.791 1.797 493 3HD2 LEU 62 3HD2 LEU 62 1.088 1.946 0.961 494 H GLY 63 H GLY 63 -2.641 -3.163 2.595 495 1HA GLY 63 1HA GLY 63 -2.042 -4.368 0.111 496 2HA GLY 63 2HA GLY 63 -3.198 -5.019 1.273 497 H PHE 64 H PHE 64 -4.258 -5.628 -0.889 498 HA PHE 64 HA PHE 64 -5.485 -3.539 -2.477 499 1HB PHE 64 1HB PHE 64 -6.393 -5.367 -3.685 500 2HB PHE 64 2HB PHE 64 -4.840 -5.942 -3.099 501 HD1 PHE 64 HD1 PHE 64 -5.936 -6.285 -0.120 502 HD2 PHE 64 HD2 PHE 64 -7.273 -7.591 -3.990 503 HE1 PHE 64 HE1 PHE 64 -7.077 -8.212 0.927 504 HE2 PHE 64 HE2 PHE 64 -8.417 -9.523 -2.935 505 HZ PHE 64 HZ PHE 64 -8.319 -9.833 -0.478 506 H GLY 65 H GLY 65 -6.214 -2.673 -0.074 507 1HA GLY 65 1HA GLY 65 -8.895 -3.743 0.583 508 2HA GLY 65 2HA GLY 65 -8.020 -2.523 1.508 509 H ALA 66 H ALA 66 -7.362 -1.137 -1.131 510 HA ALA 66 HA ALA 66 -9.812 0.510 -1.190 511 1HB ALA 66 1HB ALA 66 -7.474 1.403 -0.957 512 2HB ALA 66 2HB ALA 66 -8.332 2.080 -2.341 513 3HB ALA 66 3HB ALA 66 -7.128 0.814 -2.583 514 H ILE 67 H ILE 67 -8.942 -2.228 -2.847 515 HA ILE 67 HA ILE 67 -9.780 -1.234 -5.517 516 HB ILE 67 HB ILE 67 -9.434 -3.763 -6.062 517 1HG1 ILE 67 1HG1 ILE 67 -8.012 -5.008 -4.608 518 2HG1 ILE 67 2HG1 ILE 67 -7.820 -3.645 -3.511 519 1HG2 ILE 67 1HG2 ILE 67 -6.846 -3.320 -5.875 520 2HG2 ILE 67 2HG2 ILE 67 -7.365 -1.709 -5.375 521 3HG2 ILE 67 3HG2 ILE 67 -7.836 -2.336 -6.955 522 1HD1 ILE 67 1HD1 ILE 67 -9.504 -5.538 -2.899 523 2HD1 ILE 67 2HD1 ILE 67 -10.549 -4.762 -4.091 524 3HD1 ILE 67 3HD1 ILE 67 -9.997 -3.861 -2.677 525 H PHE 68 H PHE 68 -11.290 -2.434 -2.728 526 HA PHE 68 HA PHE 68 -13.316 -4.140 -3.728 527 1HB PHE 68 1HB PHE 68 -13.468 -1.978 -1.592 528 2HB PHE 68 2HB PHE 68 -14.526 -3.382 -1.711 529 HD1 PHE 68 HD1 PHE 68 -12.261 -5.347 -2.602 530 HD2 PHE 68 HD2 PHE 68 -12.588 -2.501 0.604 531 HE1 PHE 68 HE1 PHE 68 -10.662 -6.673 -1.255 532 HE2 PHE 68 HE2 PHE 68 -10.986 -3.830 1.943 533 HZ PHE 68 HZ PHE 68 -10.022 -5.915 1.014 534 H ASN 69 H ASN 69 -15.070 -3.745 -5.046 535 HA ASN 69 HA ASN 69 -15.490 -0.956 -5.991 536 1HB ASN 69 1HB ASN 69 -16.479 -3.666 -6.957 537 2HB ASN 69 2HB ASN 69 -16.707 -2.140 -7.813 538 1HD2 ASN 69 1HD2 ASN 69 -15.331 -3.921 -9.306 539 2HD2 ASN 69 2HD2 ASN 69 -13.661 -3.609 -9.297 540 H HIS 70 H HIS 70 -17.963 -0.622 -6.632 541 HA HIS 70 HA HIS 70 -19.483 -0.733 -4.123 542 1HB HIS 70 1HB HIS 70 -19.295 1.147 -5.915 543 2HB HIS 70 2HB HIS 70 -20.444 0.183 -6.842 544 HD1 HIS 70 HD1 HIS 70 -20.572 2.970 -4.793 545 HD2 HIS 70 HD2 HIS 70 -22.647 -0.644 -4.676 546 HE1 HIS 70 HE1 HIS 70 -22.672 3.393 -3.441 547 H SER 71 H SER 71 -20.613 -2.573 -3.630 548 HA SER 71 HA SER 71 -22.111 -3.932 -5.840 549 1HB SER 71 1HB SER 71 -19.966 -4.881 -4.066 550 2HB SER 71 2HB SER 71 -21.385 -5.927 -4.045 551 HG SER 71 HG SER 71 -19.928 -6.488 -5.712 552 H LYS 72 H LYS 72 -24.185 -4.609 -5.243 553 HA LYS 72 HA LYS 72 -25.462 -3.462 -2.959 554 1HB LYS 72 1HB LYS 72 -26.421 -4.318 -5.185 555 2HB LYS 72 2HB LYS 72 -26.315 -5.937 -4.494 556 1HG LYS 72 1HG LYS 72 -28.532 -5.205 -4.021 557 2HG LYS 72 2HG LYS 72 -27.648 -5.001 -2.509 558 1HD LYS 72 1HD LYS 72 -27.196 -2.599 -3.263 559 2HD LYS 72 2HD LYS 72 -28.403 -2.874 -4.518 560 1HE LYS 72 1HE LYS 72 -29.201 -3.648 -1.756 561 2HE LYS 72 2HE LYS 72 -29.062 -1.910 -2.081 562 1HZ LYS 72 1HZ LYS 72 -31.265 -2.837 -2.685 563 2HZ LYS 72 2HZ LYS 72 -30.506 -3.847 -3.819 564 3HZ LYS 72 3HZ LYS 72 -30.450 -2.161 -4.012 565 H ASP 73 H ASP 73 -25.206 -4.091 -0.853 566 HA ASP 73 HA ASP 73 -24.804 -5.464 1.025 567 1HB ASP 73 1HB ASP 73 -26.745 -6.587 -0.516 568 2HB ASP 73 2HB ASP 73 -25.554 -7.887 -0.537 569 HA PRO 74 HA PRO 74 -20.762 -6.749 -0.816 570 1HB PRO 74 1HB PRO 74 -19.331 -5.886 1.409 571 2HB PRO 74 2HB PRO 74 -19.650 -4.892 -0.023 572 1HG PRO 74 1HG PRO 74 -21.015 -4.913 2.619 573 2HG PRO 74 2HG PRO 74 -20.650 -3.554 1.548 574 1HD PRO 74 1HD PRO 74 -23.125 -4.639 1.766 575 2HD PRO 74 2HD PRO 74 -22.528 -3.895 0.268 576 H ASN 75 H ASN 75 -20.860 -8.975 -0.572 577 HA ASN 75 HA ASN 75 -21.565 -10.412 1.766 578 1HB ASN 75 1HB ASN 75 -19.921 -10.982 -0.707 579 2HB ASN 75 2HB ASN 75 -20.182 -12.229 0.512 580 1HD2 ASN 75 1HD2 ASN 75 -21.254 -12.435 -2.163 581 2HD2 ASN 75 2HD2 ASN 75 -22.947 -12.368 -2.054 582 H ALA 76 H ALA 76 -18.617 -8.752 0.989 583 HA ALA 76 HA ALA 76 -17.344 -9.954 3.423 584 1HB ALA 76 1HB ALA 76 -15.264 -9.264 1.736 585 2HB ALA 76 2HB ALA 76 -16.497 -9.811 0.600 586 3HB ALA 76 3HB ALA 76 -15.939 -10.887 1.881 587 H ARG 77 H ARG 77 -17.056 -8.333 4.896 588 HA ARG 77 HA ARG 77 -16.776 -5.528 3.913 589 1HB ARG 77 1HB ARG 77 -18.041 -6.923 6.135 590 2HB ARG 77 2HB ARG 77 -17.009 -5.617 6.719 591 1HG ARG 77 1HG ARG 77 -18.138 -4.020 5.263 592 2HG ARG 77 2HG ARG 77 -19.101 -5.310 4.545 593 1HD ARG 77 1HD ARG 77 -20.415 -4.116 6.267 594 2HD ARG 77 2HD ARG 77 -20.088 -5.776 6.801 595 HE ARG 77 HE ARG 77 -17.917 -4.146 7.648 596 1HH1 ARG 77 1HH1 ARG 77 -21.323 -4.552 8.245 597 2HH1 ARG 77 2HH1 ARG 77 -21.217 -3.986 9.875 598 1HH2 ARG 77 1HH2 ARG 77 -17.804 -3.415 9.767 599 2HH2 ARG 77 2HH2 ARG 77 -19.240 -3.347 10.733 600 H HIS 78 H HIS 78 -15.441 -4.324 5.933 601 HA HIS 78 HA HIS 78 -12.842 -5.802 6.164 602 1HB HIS 78 1HB HIS 78 -11.795 -3.540 5.760 603 2HB HIS 78 2HB HIS 78 -12.726 -4.132 4.385 604 HD1 HIS 78 HD1 HIS 78 -14.913 -2.900 3.796 605 HD2 HIS 78 HD2 HIS 78 -13.004 -1.345 7.160 606 HE1 HIS 78 HE1 HIS 78 -16.068 -0.710 4.326 607 H GLU 79 H GLU 79 -11.481 -4.962 7.980 608 HA GLU 79 HA GLU 79 -13.041 -3.554 10.109 609 1HB GLU 79 1HB GLU 79 -13.104 -6.116 10.214 610 2HB GLU 79 2HB GLU 79 -11.372 -6.052 10.540 611 1HG GLU 79 1HG GLU 79 -11.894 -4.493 12.468 612 2HG GLU 79 2HG GLU 79 -13.601 -4.850 12.204 613 H LEU 80 H LEU 80 -11.624 -2.641 11.793 614 HA LEU 80 HA LEU 80 -8.811 -2.223 10.830 615 1HB LEU 80 1HB LEU 80 -10.934 -0.456 12.025 616 2HB LEU 80 2HB LEU 80 -9.239 -0.047 12.291 617 HG LEU 80 HG LEU 80 -10.165 -0.704 9.512 618 1HD1 LEU 80 1HD1 LEU 80 -10.636 1.871 11.025 619 2HD1 LEU 80 2HD1 LEU 80 -11.800 0.928 10.094 620 3HD1 LEU 80 3HD1 LEU 80 -10.528 1.826 9.265 621 1HD2 LEU 80 1HD2 LEU 80 -7.797 -0.418 9.809 622 2HD2 LEU 80 2HD2 LEU 80 -8.034 1.045 10.764 623 3HD2 LEU 80 3HD2 LEU 80 -8.391 1.053 9.037 624 H THR 81 H THR 81 -7.166 -2.219 12.462 625 HA THR 81 HA THR 81 -7.610 -3.968 14.710 626 HB THR 81 HB THR 81 -5.233 -3.045 15.246 627 HG1 THR 81 HG1 THR 81 -4.849 -1.285 14.184 628 1HG2 THR 81 1HG2 THR 81 -5.899 -5.120 13.866 629 2HG2 THR 81 2HG2 THR 81 -4.285 -4.464 13.596 630 3HG2 THR 81 3HG2 THR 81 -5.578 -4.125 12.446 631 H ALA 82 H ALA 82 -9.533 -2.441 15.443 632 HA ALA 82 HA ALA 82 -10.368 -0.925 17.051 633 1HB ALA 82 1HB ALA 82 -9.248 -1.178 19.128 634 2HB ALA 82 2HB ALA 82 -7.667 -1.303 18.355 635 3HB ALA 82 3HB ALA 82 -8.811 -2.641 18.245 636 H GLY 83 H GLY 83 -9.037 0.337 14.803 637 1HA GLY 83 1HA GLY 83 -8.915 2.987 15.489 638 2HA GLY 83 2HA GLY 83 -7.291 2.427 15.880 639 H LEU 84 H LEU 84 -6.067 3.292 14.244 640 HA LEU 84 HA LEU 84 -6.835 2.543 11.443 641 1HB LEU 84 1HB LEU 84 -6.984 5.051 12.548 642 2HB LEU 84 2HB LEU 84 -5.349 5.071 11.891 643 HG LEU 84 HG LEU 84 -6.225 4.375 9.690 644 1HD1 LEU 84 1HD1 LEU 84 -8.594 3.856 11.301 645 2HD1 LEU 84 2HD1 LEU 84 -8.208 3.295 9.674 646 3HD1 LEU 84 3HD1 LEU 84 -8.974 4.866 9.906 647 1HD2 LEU 84 1HD2 LEU 84 -7.950 6.509 9.628 648 2HD2 LEU 84 2HD2 LEU 84 -6.194 6.645 9.530 649 3HD2 LEU 84 3HD2 LEU 84 -7.010 6.856 11.079 650 H LYS 85 H LYS 85 -5.265 0.771 11.652 651 HA LYS 85 HA LYS 85 -2.508 1.660 11.091 652 1HB LYS 85 1HB LYS 85 -3.484 0.418 13.584 653 2HB LYS 85 2HB LYS 85 -1.994 -0.266 12.940 654 1HG LYS 85 1HG LYS 85 -0.816 1.546 13.589 655 2HG LYS 85 2HG LYS 85 -1.954 2.629 12.786 656 1HD LYS 85 1HD LYS 85 -3.451 1.889 14.915 657 2HD LYS 85 2HD LYS 85 -1.842 1.765 15.620 658 1HE LYS 85 1HE LYS 85 -2.008 4.190 14.063 659 2HE LYS 85 2HE LYS 85 -3.345 4.133 15.227 660 1HZ LYS 85 1HZ LYS 85 -0.575 3.383 15.968 661 2HZ LYS 85 2HZ LYS 85 -1.870 3.769 16.997 662 3HZ LYS 85 3HZ LYS 85 -1.121 4.988 16.082 663 H ARG 86 H ARG 86 -4.534 -1.214 11.780 664 HA ARG 86 HA ARG 86 -3.282 -2.524 9.387 665 1HB ARG 86 1HB ARG 86 -3.528 -3.289 12.200 666 2HB ARG 86 2HB ARG 86 -4.201 -4.518 11.128 667 1HG ARG 86 1HG ARG 86 -1.798 -3.665 9.914 668 2HG ARG 86 2HG ARG 86 -1.428 -3.866 11.626 669 1HD ARG 86 1HD ARG 86 -2.445 -6.147 11.549 670 2HD ARG 86 2HD ARG 86 -2.704 -5.941 9.806 671 HE ARG 86 HE ARG 86 -0.375 -6.232 9.491 672 1HH1 ARG 86 1HH1 ARG 86 -1.085 -5.450 12.808 673 2HH1 ARG 86 2HH1 ARG 86 0.548 -5.683 13.327 674 1HH2 ARG 86 1HH2 ARG 86 1.737 -6.528 10.189 675 2HH2 ARG 86 2HH2 ARG 86 2.135 -6.289 11.858 676 H MET 87 H MET 87 -4.789 -2.931 7.829 677 HA MET 87 HA MET 87 -7.669 -2.827 8.540 678 1HB MET 87 1HB MET 87 -5.924 -2.468 6.150 679 2HB MET 87 2HB MET 87 -7.549 -3.081 5.840 680 1HG MET 87 1HG MET 87 -8.420 -1.169 7.271 681 2HG MET 87 2HG MET 87 -6.785 -0.508 7.243 682 1HE MET 87 1HE MET 87 -9.671 -1.899 5.302 683 2HE MET 87 2HE MET 87 -8.452 -2.524 4.191 684 3HE MET 87 3HE MET 87 -9.552 -1.249 3.667 685 H ARG 88 H ARG 88 -9.122 -4.523 7.853 686 HA ARG 88 HA ARG 88 -7.850 -7.122 7.102 687 1HB ARG 88 1HB ARG 88 -9.728 -6.494 9.405 688 2HB ARG 88 2HB ARG 88 -9.405 -8.137 8.855 689 1HG ARG 88 1HG ARG 88 -7.067 -7.939 9.385 690 2HG ARG 88 2HG ARG 88 -7.222 -6.207 9.677 691 1HD ARG 88 1HD ARG 88 -8.844 -6.773 11.556 692 2HD ARG 88 2HD ARG 88 -8.369 -8.469 11.345 693 HE ARG 88 HE ARG 88 -6.699 -6.347 12.474 694 1HH1 ARG 88 1HH1 ARG 88 -6.746 -9.382 10.769 695 2HH1 ARG 88 2HH1 ARG 88 -5.154 -9.821 11.282 696 1HH2 ARG 88 1HH2 ARG 88 -4.633 -6.939 13.126 697 2HH2 ARG 88 2HH2 ARG 88 -3.965 -8.450 12.606 698 H ILE 89 H ILE 89 -9.532 -8.685 6.295 699 HA ILE 89 HA ILE 89 -11.972 -7.294 5.244 700 HB ILE 89 HB ILE 89 -10.010 -9.154 3.851 701 1HG1 ILE 89 1HG1 ILE 89 -10.783 -6.514 2.737 702 2HG1 ILE 89 2HG1 ILE 89 -9.817 -6.469 4.211 703 1HG2 ILE 89 1HG2 ILE 89 -12.726 -8.114 3.029 704 2HG2 ILE 89 2HG2 ILE 89 -12.144 -9.779 3.008 705 3HG2 ILE 89 3HG2 ILE 89 -11.525 -8.613 1.838 706 1HD1 ILE 89 1HD1 ILE 89 -8.279 -6.485 2.356 707 2HD1 ILE 89 2HD1 ILE 89 -9.122 -7.836 1.598 708 3HD1 ILE 89 3HD1 ILE 89 -8.218 -8.087 3.092 709 H PHE 90 H PHE 90 -13.414 -8.310 6.689 710 HA PHE 90 HA PHE 90 -13.281 -11.244 7.064 711 1HB PHE 90 1HB PHE 90 -14.705 -8.880 8.250 712 2HB PHE 90 2HB PHE 90 -15.399 -10.483 8.493 713 HD1 PHE 90 HD1 PHE 90 -13.945 -12.310 9.501 714 HD2 PHE 90 HD2 PHE 90 -12.800 -8.170 9.472 715 HE1 PHE 90 HE1 PHE 90 -12.284 -12.756 11.288 716 HE2 PHE 90 HE2 PHE 90 -11.140 -8.616 11.259 717 HZ PHE 90 HZ PHE 90 -10.882 -10.910 12.167 718 H THR 91 H THR 91 -15.182 -12.585 6.635 719 HA THR 91 HA THR 91 -16.721 -11.635 4.261 720 HB THR 91 HB THR 91 -17.202 -14.189 4.204 721 HG1 THR 91 HG1 THR 91 -15.729 -15.397 5.420 722 1HG2 THR 91 1HG2 THR 91 -15.599 -14.063 2.631 723 2HG2 THR 91 2HG2 THR 91 -14.366 -14.213 3.883 724 3HG2 THR 91 3HG2 THR 91 -14.946 -12.618 3.402 725 H ILE 92 H ILE 92 -18.217 -10.362 5.643 726 HA ILE 92 HA ILE 92 -19.728 -11.313 7.811 727 HB ILE 92 HB ILE 92 -21.388 -9.598 6.994 728 1HG1 ILE 92 1HG1 ILE 92 -19.541 -8.970 4.728 729 2HG1 ILE 92 2HG1 ILE 92 -20.691 -10.288 4.511 730 1HG2 ILE 92 1HG2 ILE 92 -19.800 -7.701 7.076 731 2HG2 ILE 92 2HG2 ILE 92 -18.462 -8.817 6.805 732 3HG2 ILE 92 3HG2 ILE 92 -19.407 -8.918 8.290 733 1HD1 ILE 92 1HD1 ILE 92 -21.168 -7.398 4.604 734 2HD1 ILE 92 2HD1 ILE 92 -22.233 -8.305 5.679 735 3HD1 ILE 92 3HD1 ILE 92 -22.188 -8.683 3.957 736 H LYS 93 H LYS 93 -19.969 -12.172 4.430 737 HA LYS 93 HA LYS 93 -22.252 -13.981 5.113 738 1HB LYS 93 1HB LYS 93 -21.944 -12.213 2.656 739 2HB LYS 93 2HB LYS 93 -23.281 -13.323 2.951 740 1HG LYS 93 1HG LYS 93 -22.557 -11.043 4.811 741 2HG LYS 93 2HG LYS 93 -23.777 -10.920 3.544 742 1HD LYS 93 1HD LYS 93 -24.876 -12.976 4.593 743 2HD LYS 93 2HD LYS 93 -23.798 -12.731 5.967 744 1HE LYS 93 1HE LYS 93 -25.020 -10.964 6.730 745 2HE LYS 93 2HE LYS 93 -25.175 -10.270 5.104 746 1HZ LYS 93 1HZ LYS 93 -27.297 -11.154 6.063 747 2HZ LYS 93 2HZ LYS 93 -26.618 -12.709 6.002 748 3HZ LYS 93 3HZ LYS 93 -26.868 -11.835 4.568 749 HA PRO 94 HA PRO 94 -19.617 -17.110 3.397 750 1HB PRO 94 1HB PRO 94 -22.240 -18.106 2.405 751 2HB PRO 94 2HB PRO 94 -20.919 -18.998 3.178 752 1HG PRO 94 1HG PRO 94 -23.029 -18.296 4.542 753 2HG PRO 94 2HG PRO 94 -21.446 -18.190 5.264 754 1HD PRO 94 1HD PRO 94 -23.247 -16.034 4.292 755 2HD PRO 94 2HD PRO 94 -22.076 -16.020 5.627 756 H ILE 95 H ILE 95 -18.615 -17.334 1.354 757 HA ILE 95 HA ILE 95 -19.999 -15.978 -0.939 758 HB ILE 95 HB ILE 95 -17.071 -16.235 -0.165 759 1HG1 ILE 95 1HG1 ILE 95 -18.646 -13.695 -0.534 760 2HG1 ILE 95 2HG1 ILE 95 -18.715 -14.573 0.994 761 1HG2 ILE 95 1HG2 ILE 95 -16.854 -14.552 -2.130 762 2HG2 ILE 95 2HG2 ILE 95 -18.422 -15.174 -2.645 763 3HG2 ILE 95 3HG2 ILE 95 -17.038 -16.261 -2.526 764 1HD1 ILE 95 1HD1 ILE 95 -16.910 -13.186 1.417 765 2HD1 ILE 95 2HD1 ILE 95 -16.412 -13.144 -0.275 766 3HD1 ILE 95 3HD1 ILE 95 -16.069 -14.566 0.711 767 H ALA 96 H ALA 96 -20.074 -17.084 -2.895 768 HA ALA 96 HA ALA 96 -19.410 -19.962 -2.831 769 1HB ALA 96 1HB ALA 96 -20.716 -19.919 -4.947 770 2HB ALA 96 2HB ALA 96 -20.734 -18.155 -4.894 771 3HB ALA 96 3HB ALA 96 -21.581 -19.085 -3.656 772 H ILE 97 H ILE 97 -18.315 -20.904 -4.812 773 HA ILE 97 HA ILE 97 -15.784 -19.591 -5.305 774 HB ILE 97 HB ILE 97 -17.190 -21.961 -6.592 775 1HG1 ILE 97 1HG1 ILE 97 -14.996 -22.653 -4.890 776 2HG1 ILE 97 2HG1 ILE 97 -16.059 -21.562 -4.001 777 1HG2 ILE 97 1HG2 ILE 97 -14.750 -20.609 -7.279 778 2HG2 ILE 97 2HG2 ILE 97 -15.447 -22.053 -8.013 779 3HG2 ILE 97 3HG2 ILE 97 -14.356 -22.204 -6.635 780 1HD1 ILE 97 1HD1 ILE 97 -16.470 -24.274 -4.299 781 2HD1 ILE 97 2HD1 ILE 97 -17.501 -23.596 -5.559 782 3HD1 ILE 97 3HD1 ILE 97 -17.720 -23.102 -3.880 783 H GLY 98 H GLY 98 -15.345 -18.093 -6.871 784 1HA GLY 98 1HA GLY 98 -15.401 -17.266 -9.136 785 2HA GLY 98 2HA GLY 98 -16.915 -18.133 -9.387 786 H GLU 99 H GLU 99 -16.531 -16.264 -6.465 787 HA GLU 99 HA GLU 99 -18.634 -14.406 -7.431 788 1HB GLU 99 1HB GLU 99 -18.030 -15.894 -5.090 789 2HB GLU 99 2HB GLU 99 -17.830 -14.209 -4.661 790 1HG GLU 99 1HG GLU 99 -20.256 -15.107 -6.202 791 2HG GLU 99 2HG GLU 99 -20.201 -15.303 -4.452 792 H GLU 100 H GLU 100 -18.269 -12.148 -6.073 793 HA GLU 100 HA GLU 100 -15.441 -11.287 -6.591 794 1HB GLU 100 1HB GLU 100 -17.198 -10.592 -8.290 795 2HB GLU 100 2HB GLU 100 -17.987 -9.679 -7.004 796 1HG GLU 100 1HG GLU 100 -15.698 -8.550 -6.644 797 2HG GLU 100 2HG GLU 100 -15.250 -9.235 -8.206 798 H ILE 101 H ILE 101 -14.508 -10.493 -4.753 799 HA ILE 101 HA ILE 101 -16.198 -9.853 -2.416 800 HB ILE 101 HB ILE 101 -13.205 -10.042 -2.908 801 1HG1 ILE 101 1HG1 ILE 101 -15.158 -11.870 -1.481 802 2HG1 ILE 101 2HG1 ILE 101 -14.435 -12.172 -3.060 803 1HG2 ILE 101 1HG2 ILE 101 -14.563 -8.739 -0.797 804 2HG2 ILE 101 2HG2 ILE 101 -12.851 -9.155 -0.867 805 3HG2 ILE 101 3HG2 ILE 101 -14.003 -10.278 -0.143 806 1HD1 ILE 101 1HD1 ILE 101 -12.797 -13.240 -1.912 807 2HD1 ILE 101 2HD1 ILE 101 -13.279 -12.510 -0.381 808 3HD1 ILE 101 3HD1 ILE 101 -12.230 -11.625 -1.487 809 H THR 102 H THR 102 -16.668 -7.807 -1.797 810 HA THR 102 HA THR 102 -14.927 -5.532 -2.522 811 HB THR 102 HB THR 102 -16.853 -4.378 -3.631 812 HG1 THR 102 HG1 THR 102 -18.100 -6.914 -3.530 813 1HG2 THR 102 1HG2 THR 102 -16.674 -5.522 -5.711 814 2HG2 THR 102 2HG2 THR 102 -16.418 -7.077 -4.919 815 3HG2 THR 102 3HG2 THR 102 -15.155 -5.846 -4.874 816 H ILE 103 H ILE 103 -16.625 -3.464 -1.815 817 HA ILE 103 HA ILE 103 -17.931 -4.197 0.749 818 HB ILE 103 HB ILE 103 -16.521 -2.612 1.991 819 1HG1 ILE 103 1HG1 ILE 103 -14.419 -2.096 0.165 820 2HG1 ILE 103 2HG1 ILE 103 -15.915 -1.685 -0.670 821 1HG2 ILE 103 1HG2 ILE 103 -14.708 -4.362 0.314 822 2HG2 ILE 103 2HG2 ILE 103 -15.758 -5.005 1.576 823 3HG2 ILE 103 3HG2 ILE 103 -14.477 -3.866 1.990 824 1HD1 ILE 103 1HD1 ILE 103 -15.468 0.304 0.462 825 2HD1 ILE 103 2HD1 ILE 103 -14.767 -0.526 1.851 826 3HD1 ILE 103 3HD1 ILE 103 -16.516 -0.517 1.618 827 H SER 104 H SER 104 -18.374 -1.684 1.757 828 HA SER 104 HA SER 104 -20.058 -0.442 -0.371 829 1HB SER 104 1HB SER 104 -20.824 -1.352 1.969 830 2HB SER 104 2HB SER 104 -20.133 0.147 2.589 831 HG SER 104 HG SER 104 -22.466 0.054 1.865 832 H TYR 105 H TYR 105 -20.262 2.034 1.287 833 HA TYR 105 HA TYR 105 -17.509 3.151 0.965 834 1HB TYR 105 1HB TYR 105 -20.112 3.968 -0.319 835 2HB TYR 105 2HB TYR 105 -18.845 5.168 -0.058 836 HD1 TYR 105 HD1 TYR 105 -16.519 4.709 -0.984 837 HD2 TYR 105 HD2 TYR 105 -19.968 2.405 -2.095 838 HE1 TYR 105 HE1 TYR 105 -15.317 3.877 -2.988 839 HE2 TYR 105 HE2 TYR 105 -18.767 1.572 -4.097 840 HH TYR 105 HH TYR 105 -15.805 1.423 -4.532 841 H GLY 106 H GLY 106 -20.483 4.992 1.530 842 1HA GLY 106 1HA GLY 106 -20.429 4.978 4.381 843 2HA GLY 106 2HA GLY 106 -19.446 6.328 3.813 844 H ASP 107 H ASP 107 -20.698 8.127 4.082 845 HA ASP 107 HA ASP 107 -23.572 7.987 3.252 846 1HB ASP 107 1HB ASP 107 -22.062 9.120 5.460 847 2HB ASP 107 2HB ASP 107 -23.001 10.376 4.652 848 H ASP 108 H ASP 108 -20.612 9.011 2.047 849 HA ASP 108 HA ASP 108 -21.967 11.065 0.346 850 1HB ASP 108 1HB ASP 108 -20.049 11.477 2.392 851 2HB ASP 108 2HB ASP 108 -19.185 11.685 0.869 852 H TYR 109 H TYR 109 -19.151 8.906 0.758 853 HA TYR 109 HA TYR 109 -18.149 9.167 -1.915 854 1HB TYR 109 1HB TYR 109 -17.658 7.688 0.510 855 2HB TYR 109 2HB TYR 109 -17.599 6.576 -0.858 856 HD1 TYR 109 HD1 TYR 109 -15.315 6.197 -1.292 857 HD2 TYR 109 HD2 TYR 109 -16.714 10.208 -0.658 858 HE1 TYR 109 HE1 TYR 109 -13.081 7.075 -1.911 859 HE2 TYR 109 HE2 TYR 109 -14.479 11.085 -1.278 860 HH TYR 109 HH TYR 109 -11.814 9.526 -1.220 861 H TRP 110 H TRP 110 -19.568 8.800 -3.593 862 HA TRP 110 HA TRP 110 -20.988 7.621 -5.051 863 1HB TRP 110 1HB TRP 110 -19.262 5.648 -3.625 864 2HB TRP 110 2HB TRP 110 -20.611 4.994 -4.553 865 HD1 TRP 110 HD1 TRP 110 -17.410 7.051 -4.956 866 HE1 TRP 110 HE1 TRP 110 -16.724 7.035 -7.441 867 HE3 TRP 110 HE3 TRP 110 -21.465 4.693 -6.976 868 HZ2 TRP 110 HZ2 TRP 110 -17.758 6.141 -9.953 869 HZ3 TRP 110 HZ3 TRP 110 -21.588 4.272 -9.415 870 HH2 TRP 110 HH2 TRP 110 -19.742 4.992 -10.905 871 H LEU 111 H LEU 111 -21.259 5.139 -2.541 872 HA LEU 111 HA LEU 111 -24.025 4.833 -2.635 873 1HB LEU 111 1HB LEU 111 -22.069 3.624 -1.349 874 2HB LEU 111 2HB LEU 111 -22.528 4.696 -0.026 875 HG LEU 111 HG LEU 111 -24.799 3.370 -1.367 876 1HD1 LEU 111 1HD1 LEU 111 -22.486 1.835 -0.388 877 2HD1 LEU 111 2HD1 LEU 111 -23.835 1.313 -1.396 878 3HD1 LEU 111 3HD1 LEU 111 -24.014 1.367 0.357 879 1HD2 LEU 111 1HD2 LEU 111 -24.310 3.052 1.524 880 2HD2 LEU 111 2HD2 LEU 111 -25.734 3.663 0.683 881 3HD2 LEU 111 3HD2 LEU 111 -24.358 4.726 0.972 882 H SER 112 H SER 112 -25.575 5.389 -0.765 883 HA SER 112 HA SER 112 -26.786 7.020 0.423 884 1HB SER 112 1HB SER 112 -24.496 6.816 1.639 885 2HB SER 112 2HB SER 112 -24.105 8.351 0.863 886 HG SER 112 HG SER 112 -25.890 7.782 2.895 887 H ARG 113 H ARG 113 -26.924 7.485 -2.258 888 HA ARG 113 HA ARG 113 -27.501 10.226 -2.474 889 1HB ARG 113 1HB ARG 113 -24.734 9.615 -2.706 890 2HB ARG 113 2HB ARG 113 -25.313 10.186 -4.271 891 1HG ARG 113 1HG ARG 113 -26.136 11.676 -1.805 892 2HG ARG 113 2HG ARG 113 -24.504 11.911 -2.431 893 1HD ARG 113 1HD ARG 113 -25.512 13.479 -3.772 894 2HD ARG 113 2HD ARG 113 -26.007 12.074 -4.733 895 HE ARG 113 HE ARG 113 -28.200 12.373 -3.904 896 1HH1 ARG 113 1HH1 ARG 113 -25.884 13.971 -1.854 897 2HH1 ARG 113 2HH1 ARG 113 -27.099 14.678 -0.846 898 1HH2 ARG 113 1HH2 ARG 113 -29.758 13.303 -2.581 899 2HH2 ARG 113 2HH2 ARG 113 -29.275 14.304 -1.252 900 HA PRO 114 HA PRO 114 -27.738 8.379 -6.803 901 1HB PRO 114 1HB PRO 114 -26.407 6.055 -7.358 902 2HB PRO 114 2HB PRO 114 -25.626 7.644 -7.446 903 1HG PRO 114 1HG PRO 114 -25.474 5.566 -5.322 904 2HG PRO 114 2HG PRO 114 -24.217 6.653 -5.929 905 1HD PRO 114 1HD PRO 114 -25.631 7.041 -3.584 906 2HD PRO 114 2HD PRO 114 -24.822 8.324 -4.485 907 H ARG 115 H ARG 115 -28.515 6.861 -3.986 908 HA ARG 115 HA ARG 115 -30.161 5.279 -3.396 909 1HB ARG 115 1HB ARG 115 -30.888 6.568 -5.911 910 2HB ARG 115 2HB ARG 115 -31.554 4.938 -5.813 911 1HG ARG 115 1HG ARG 115 -33.213 6.126 -4.710 912 2HG ARG 115 2HG ARG 115 -32.175 5.705 -3.349 913 1HD ARG 115 1HD ARG 115 -31.003 8.034 -4.228 914 2HD ARG 115 2HD ARG 115 -32.721 8.351 -4.535 915 HE ARG 115 HE ARG 115 -32.530 7.113 -1.991 916 1HH1 ARG 115 1HH1 ARG 115 -31.552 10.058 -3.568 917 2HH1 ARG 115 2HH1 ARG 115 -31.603 10.985 -2.110 918 1HH2 ARG 115 1HH2 ARG 115 -32.589 8.338 -0.111 919 2HH2 ARG 115 2HH2 ARG 115 -32.186 10.021 -0.166 920 H LEU 116 H LEU 116 -30.942 3.008 -3.993 921 HA LEU 116 HA LEU 116 -28.856 1.597 -5.627 922 1HB LEU 116 1HB LEU 116 -29.815 1.336 -2.868 923 2HB LEU 116 2HB LEU 116 -29.872 -0.195 -3.741 924 HG LEU 116 HG LEU 116 -27.682 0.096 -2.653 925 1HD1 LEU 116 1HD1 LEU 116 -28.124 -0.278 -5.484 926 2HD1 LEU 116 2HD1 LEU 116 -26.945 -1.066 -4.436 927 3HD1 LEU 116 3HD1 LEU 116 -26.548 0.466 -5.213 928 1HD2 LEU 116 1HD2 LEU 116 -28.004 2.750 -3.162 929 2HD2 LEU 116 2HD2 LEU 116 -26.894 2.308 -4.460 930 3HD2 LEU 116 3HD2 LEU 116 -26.448 2.014 -2.779 931 H THR 117 H THR 117 -29.706 0.457 -7.314 932 HA THR 117 HA THR 117 -32.326 -0.875 -7.068 933 HB THR 117 HB THR 117 -31.767 1.349 -9.068 934 HG1 THR 117 HG1 THR 117 -33.261 2.484 -7.892 935 1HG2 THR 117 1HG2 THR 117 -34.509 0.676 -8.969 936 2HG2 THR 117 2HG2 THR 117 -33.638 -0.854 -9.070 937 3HG2 THR 117 3HG2 THR 117 -33.388 0.386 -10.299 938 H GLN 118 H GLN 118 -31.316 -2.848 -7.602 939 HA GLN 118 HA GLN 118 -30.371 -4.493 -9.007 940 1HB GLN 118 1HB GLN 118 -32.298 -3.418 -10.365 941 2HB GLN 118 2HB GLN 118 -31.031 -2.557 -11.240 942 1HG GLN 118 1HG GLN 118 -30.353 -5.360 -11.003 943 2HG GLN 118 2HG GLN 118 -31.951 -5.180 -11.727 944 1HE2 GLN 118 1HE2 GLN 118 -31.760 -2.916 -13.267 945 2HE2 GLN 118 2HE2 GLN 118 -30.525 -3.063 -14.421 946 H ASN 119 H ASN 119 -28.157 -4.491 -8.627 947 HA ASN 119 HA ASN 119 -25.872 -3.994 -8.954 948 1HB ASN 119 1HB ASN 119 -27.339 -3.676 -11.517 949 2HB ASN 119 2HB ASN 119 -25.730 -2.955 -11.479 950 1HD2 ASN 119 1HD2 ASN 119 -24.151 -4.655 -10.103 951 2HD2 ASN 119 2HD2 ASN 119 -24.195 -6.229 -10.736 952 1H GLY 201 1H GLY 201 -30.104 22.603 2.249 953 2H GLY 201 2H GLY 201 -31.380 23.387 3.050 954 3H GLY 201 3H GLY 201 -30.041 22.827 3.931 955 1HA GLY 201 1HA GLY 201 -30.296 25.347 3.216 956 2HA GLY 201 2HA GLY 201 -28.726 24.554 3.354 957 H LYS 202 H LYS 202 -28.384 23.098 1.171 958 HA LYS 202 HA LYS 202 -27.801 23.266 -1.113 959 1HB LYS 202 1HB LYS 202 -30.602 24.119 -0.699 960 2HB LYS 202 2HB LYS 202 -29.903 24.660 -2.225 961 1HG LYS 202 1HG LYS 202 -29.055 22.182 -2.400 962 2HG LYS 202 2HG LYS 202 -30.331 21.856 -1.227 963 1HD LYS 202 1HD LYS 202 -31.859 23.200 -2.842 964 2HD LYS 202 2HD LYS 202 -30.582 22.939 -4.030 965 1HE LYS 202 1HE LYS 202 -31.129 20.737 -4.282 966 2HE LYS 202 2HE LYS 202 -31.342 20.506 -2.536 967 1HZ LYS 202 1HZ LYS 202 -33.232 21.868 -4.390 968 2HZ LYS 202 2HZ LYS 202 -33.423 21.789 -2.704 969 3HZ LYS 202 3HZ LYS 202 -33.478 20.368 -3.633 970 H ALA 203 H ALA 203 -26.323 25.078 0.194 971 HA ALA 203 HA ALA 203 -26.388 27.452 -1.602 972 1HB ALA 203 1HB ALA 203 -27.017 28.847 0.078 973 2HB ALA 203 2HB ALA 203 -25.799 28.173 1.161 974 3HB ALA 203 3HB ALA 203 -27.384 27.409 1.031 975 HA PRO 204 HA PRO 204 -22.005 27.329 -1.583 976 1HB PRO 204 1HB PRO 204 -21.780 29.971 -0.229 977 2HB PRO 204 2HB PRO 204 -21.171 29.469 -1.816 978 1HG PRO 204 1HG PRO 204 -23.290 31.096 -1.531 979 2HG PRO 204 2HG PRO 204 -23.143 29.948 -2.869 980 1HD PRO 204 1HD PRO 204 -24.858 29.822 -0.447 981 2HD PRO 204 2HD PRO 204 -25.150 29.186 -2.079 982 H ARG 205 H ARG 205 -22.704 29.221 1.385 983 HA ARG 205 HA ARG 205 -21.978 28.876 3.607 984 1HB ARG 205 1HB ARG 205 -22.478 26.094 2.505 985 2HB ARG 205 2HB ARG 205 -22.122 26.383 4.208 986 1HG ARG 205 1HG ARG 205 -24.069 27.831 4.416 987 2HG ARG 205 2HG ARG 205 -24.387 27.709 2.686 988 1HD ARG 205 1HD ARG 205 -25.867 26.109 3.608 989 2HD ARG 205 2HD ARG 205 -24.466 25.119 3.159 990 HE ARG 205 HE ARG 205 -24.023 26.166 5.775 991 1HH1 ARG 205 1HH1 ARG 205 -26.096 23.925 4.102 992 2HH1 ARG 205 2HH1 ARG 205 -26.336 22.934 5.499 993 1HH2 ARG 205 1HH2 ARG 205 -24.350 24.864 7.574 994 2HH2 ARG 205 2HH2 ARG 205 -25.357 23.460 7.450 995 H LYS 206 H LYS 206 -19.932 28.904 1.344 996 HA LYS 206 HA LYS 206 -17.818 27.088 2.332 997 1HB LYS 206 1HB LYS 206 -18.451 27.806 -0.113 998 2HB LYS 206 2HB LYS 206 -17.534 29.266 0.259 999 1HG LYS 206 1HG LYS 206 -15.983 27.062 1.161 1000 2HG LYS 206 2HG LYS 206 -16.543 26.666 -0.464 1001 1HD LYS 206 1HD LYS 206 -15.157 29.245 0.336 1002 2HD LYS 206 2HD LYS 206 -14.400 27.906 -0.528 1003 1HE LYS 206 1HE LYS 206 -15.277 28.597 -2.507 1004 2HE LYS 206 2HE LYS 206 -16.897 28.757 -1.801 1005 1HZ LYS 206 1HZ LYS 206 -16.042 30.801 -0.669 1006 2HZ LYS 206 2HZ LYS 206 -16.155 30.937 -2.358 1007 3HZ LYS 206 3HZ LYS 206 -14.643 30.688 -1.625 1008 H GLN 207 H GLN 207 -17.454 28.029 4.460 1009 HA GLN 207 HA GLN 207 -15.812 30.514 4.348 1010 1HB GLN 207 1HB GLN 207 -18.337 30.807 4.947 1011 2HB GLN 207 2HB GLN 207 -17.902 30.056 6.483 1012 1HG GLN 207 1HG GLN 207 -15.937 31.855 6.384 1013 2HG GLN 207 2HG GLN 207 -17.098 32.712 5.371 1014 1HE2 GLN 207 1HE2 GLN 207 -17.328 30.744 8.402 1015 2HE2 GLN 207 2HE2 GLN 207 -18.281 31.877 9.233 1016 H LEU 208 H LEU 208 -14.008 29.031 4.728 1017 HA LEU 208 HA LEU 208 -12.505 27.838 6.104 1018 1HB LEU 208 1HB LEU 208 -13.009 30.074 7.295 1019 2HB LEU 208 2HB LEU 208 -14.073 29.140 8.347 1020 HG LEU 208 HG LEU 208 -12.047 27.589 8.718 1021 1HD1 LEU 208 1HD1 LEU 208 -9.851 28.687 8.377 1022 2HD1 LEU 208 2HD1 LEU 208 -10.660 30.040 7.586 1023 3HD1 LEU 208 3HD1 LEU 208 -10.692 28.439 6.847 1024 1HD2 LEU 208 1HD2 LEU 208 -11.042 29.248 10.374 1025 2HD2 LEU 208 2HD2 LEU 208 -12.783 29.005 10.507 1026 3HD2 LEU 208 3HD2 LEU 208 -12.153 30.447 9.712 1027 H ALA 209 H ALA 209 -15.207 26.629 5.468 1028 HA ALA 209 HA ALA 209 -15.113 24.512 7.558 1029 1HB ALA 209 1HB ALA 209 -17.357 24.822 8.181 1030 2HB ALA 209 2HB ALA 209 -17.759 25.649 6.676 1031 3HB ALA 209 3HB ALA 209 -16.834 26.486 7.923 1032 H THR 210 H THR 210 -14.102 23.586 5.461 1033 HA THR 210 HA THR 210 -16.237 22.673 3.566 1034 HB THR 210 HB THR 210 -14.281 22.337 2.037 1035 HG1 THR 210 HG1 THR 210 -12.311 22.589 2.760 1036 1HG2 THR 210 1HG2 THR 210 -15.041 24.931 3.258 1037 2HG2 THR 210 2HG2 THR 210 -15.073 24.430 1.567 1038 3HG2 THR 210 3HG2 THR 210 -13.556 24.942 2.306 1039 H LYS 211 H LYS 211 -16.917 20.821 4.771 1040 HA LYS 211 HA LYS 211 -15.149 18.919 5.987 1041 1HB LYS 211 1HB LYS 211 -17.876 19.431 5.772 1042 2HB LYS 211 2HB LYS 211 -17.692 17.897 4.923 1043 1HG LYS 211 1HG LYS 211 -16.308 17.134 6.954 1044 2HG LYS 211 2HG LYS 211 -16.953 18.553 7.780 1045 1HD LYS 211 1HD LYS 211 -19.110 17.719 7.818 1046 2HD LYS 211 2HD LYS 211 -18.880 16.769 6.350 1047 1HE LYS 211 1HE LYS 211 -18.610 14.969 7.717 1048 2HE LYS 211 2HE LYS 211 -17.055 15.680 8.191 1049 1HZ LYS 211 1HZ LYS 211 -19.715 16.114 9.443 1050 2HZ LYS 211 2HZ LYS 211 -18.375 17.107 9.763 1051 3HZ LYS 211 3HZ LYS 211 -18.326 15.458 10.167 1052 H ALA 212 H ALA 212 -15.699 16.449 5.020 1053 HA ALA 212 HA ALA 212 -15.405 16.277 2.113 1054 1HB ALA 212 1HB ALA 212 -13.051 15.078 2.731 1055 2HB ALA 212 2HB ALA 212 -13.109 16.285 4.016 1056 3HB ALA 212 3HB ALA 212 -13.163 16.791 2.328 1057 H ALA 213 H ALA 213 -14.145 14.318 4.834 1058 HA ALA 213 HA ALA 213 -14.589 12.074 5.420 1059 1HB ALA 213 1HB ALA 213 -16.900 11.700 5.750 1060 2HB ALA 213 2HB ALA 213 -17.342 12.585 4.289 1061 3HB ALA 213 3HB ALA 213 -16.796 13.460 5.720 1062 H ARG 214 H ARG 214 -13.198 11.293 3.630 1063 HA ARG 214 HA ARG 214 -14.208 10.736 0.999 1064 1HB ARG 214 1HB ARG 214 -11.950 9.647 2.707 1065 2HB ARG 214 2HB ARG 214 -12.171 9.181 1.021 1066 1HG ARG 214 1HG ARG 214 -11.271 11.117 0.295 1067 2HG ARG 214 2HG ARG 214 -12.332 12.065 1.337 1068 1HD ARG 214 1HD ARG 214 -10.610 11.041 3.192 1069 2HD ARG 214 2HD ARG 214 -9.534 11.199 1.791 1070 HE ARG 214 HE ARG 214 -11.054 13.560 1.854 1071 1HH1 ARG 214 1HH1 ARG 214 -8.840 11.889 3.959 1072 2HH1 ARG 214 2HH1 ARG 214 -8.279 13.344 4.705 1073 1HH2 ARG 214 1HH2 ARG 214 -10.308 15.436 2.840 1074 2HH2 ARG 214 2HH2 ARG 214 -9.102 15.337 4.079 1075 1HN MLZ 215 1HN MLZ 215 -13.086 8.056 3.034 1076 HA MLZ 215 HA MLZ 215 -15.498 6.515 2.209 1077 1HB MLZ 215 1HB MLZ 215 -12.714 6.031 2.474 1078 2HB MLZ 215 2HB MLZ 215 -13.498 5.061 3.720 1079 1HG MLZ 215 1HG MLZ 215 -14.876 4.998 1.118 1080 2HG MLZ 215 2HG MLZ 215 -14.451 3.670 2.198 1081 1HD MLZ 215 1HD MLZ 215 -12.123 4.951 0.939 1082 2HD MLZ 215 2HD MLZ 215 -12.519 3.239 1.086 1083 1HE MLZ 215 1HE MLZ 215 -13.192 5.156 -1.105 1084 2HE MLZ 215 2HE MLZ 215 -14.400 3.919 -0.710 1085 HZ MLZ 215 HZ MLZ 215 -12.685 2.232 -0.852 1086 1HCM MLZ 215 1HCM MLZ 215 -13.587 2.315 -2.913 1087 2HCM MLZ 215 2HCM MLZ 215 -11.954 2.833 -3.315 1088 3HCM MLZ 215 3HCM MLZ 215 -13.225 4.028 -3.089 1089 H SER 216 H SER 216 -17.152 6.418 3.671 1090 HA SER 216 HA SER 216 -18.278 6.230 5.741 1091 1HB SER 216 1HB SER 216 -16.654 7.830 7.378 1092 2HB SER 216 2HB SER 216 -16.339 8.416 5.744 1093 HG SER 216 HG SER 216 -18.347 9.064 7.184 1094 H ALA 217 H ALA 217 -16.108 4.253 5.199 1095 HA ALA 217 HA ALA 217 -15.021 2.520 6.377 1096 1HB ALA 217 1HB ALA 217 -14.287 5.126 7.616 1097 2HB ALA 217 2HB ALA 217 -13.245 3.873 6.943 1098 3HB ALA 217 3HB ALA 217 -13.905 3.692 8.568 1099 HA PRO 218 HA PRO 218 -17.560 0.947 9.584 1100 1HB PRO 218 1HB PRO 218 -15.283 0.403 11.397 1101 2HB PRO 218 2HB PRO 218 -16.390 -0.740 10.618 1102 1HG PRO 218 1HG PRO 218 -13.815 -0.459 9.872 1103 2HG PRO 218 2HG PRO 218 -15.099 -0.912 8.743 1104 1HD PRO 218 1HD PRO 218 -13.715 1.701 9.088 1105 2HD PRO 218 2HD PRO 218 -14.345 0.937 7.613 1106 H ALA 219 H ALA 219 -17.567 1.017 12.293 1107 HA ALA 219 HA ALA 219 -17.748 3.913 12.874 1108 1HB ALA 219 1HB ALA 219 -19.393 1.882 13.383 1109 2HB ALA 219 2HB ALA 219 -19.243 3.213 14.531 1110 3HB ALA 219 3HB ALA 219 -18.376 1.703 14.813 1111 H THR 220 H THR 220 -16.715 4.835 14.775 1112 HA THR 220 HA THR 220 -14.588 3.233 16.087 1113 HB THR 220 HB THR 220 -13.571 4.133 14.042 1114 HG1 THR 220 HG1 THR 220 -12.784 5.827 16.157 1115 1HG2 THR 220 1HG2 THR 220 -15.147 6.488 14.837 1116 2HG2 THR 220 2HG2 THR 220 -14.591 5.995 13.237 1117 3HG2 THR 220 3HG2 THR 220 -13.507 6.874 14.315 1118 H GLY 221 H GLY 221 -16.658 3.959 17.561 1119 1HA GLY 221 1HA GLY 221 -15.598 5.872 19.444 1120 2HA GLY 221 2HA GLY 221 -16.942 6.568 18.539 1121 1H MET 1 1H MET 1 0.014 -11.715 7.589 1122 2H MET 1 2H MET 1 -0.477 -12.547 6.192 1123 3H MET 1 3H MET 1 -1.088 -10.996 6.516 1124 HA MET 1 HA MET 1 0.528 -10.596 4.897 1125 1HB MET 1 1HB MET 1 1.083 -10.080 7.757 1126 2HB MET 1 2HB MET 1 2.482 -9.879 6.704 1127 1HG MET 1 1HG MET 1 0.652 -8.594 5.214 1128 2HG MET 1 2HG MET 1 -0.050 -8.323 6.809 1129 1HE MET 1 1HE MET 1 2.994 -7.357 4.377 1130 2HE MET 1 2HE MET 1 2.661 -5.696 4.868 1131 3HE MET 1 3HE MET 1 1.337 -6.752 4.374 1132 H PHE 2 H PHE 2 2.201 -12.381 7.525 1133 HA PHE 2 HA PHE 2 4.464 -13.178 6.033 1134 1HB PHE 2 1HB PHE 2 4.668 -14.874 7.828 1135 2HB PHE 2 2HB PHE 2 4.154 -13.325 8.495 1136 HD1 PHE 2 HD1 PHE 2 1.967 -13.033 9.459 1137 HD2 PHE 2 HD2 PHE 2 3.020 -16.714 7.512 1138 HE1 PHE 2 HE1 PHE 2 -0.070 -14.104 10.382 1139 HE2 PHE 2 HE2 PHE 2 0.983 -17.785 8.435 1140 HZ PHE 2 HZ PHE 2 -0.562 -16.481 9.870 1141 H ASN 3 H ASN 3 4.860 -14.904 4.645 1142 HA ASN 3 HA ASN 3 2.590 -16.784 4.098 1143 1HB ASN 3 1HB ASN 3 3.228 -16.528 1.680 1144 2HB ASN 3 2HB ASN 3 2.673 -15.016 2.398 1145 1HD2 ASN 3 1HD2 ASN 3 4.252 -14.698 0.181 1146 2HD2 ASN 3 2HD2 ASN 3 5.820 -14.206 0.608 1147 H ASP 4 H ASP 4 3.375 -18.801 2.984 1148 HA ASP 4 HA ASP 4 5.423 -20.143 4.329 1149 1HB ASP 4 1HB ASP 4 3.618 -21.039 2.793 1150 2HB ASP 4 2HB ASP 4 4.606 -20.521 1.426 1151 H ARG 5 H ARG 5 5.714 -17.868 1.681 1152 HA ARG 5 HA ARG 5 8.416 -18.655 0.915 1153 1HB ARG 5 1HB ARG 5 6.703 -16.190 0.431 1154 2HB ARG 5 2HB ARG 5 8.228 -16.514 -0.394 1155 1HG ARG 5 1HG ARG 5 6.134 -18.652 -0.413 1156 2HG ARG 5 2HG ARG 5 5.904 -17.254 -1.465 1157 1HD ARG 5 1HD ARG 5 8.645 -18.340 -1.538 1158 2HD ARG 5 2HD ARG 5 7.409 -19.463 -2.135 1159 HE ARG 5 HE ARG 5 8.169 -16.937 -3.385 1160 1HH1 ARG 5 1HH1 ARG 5 5.581 -19.204 -2.853 1161 2HH1 ARG 5 2HH1 ARG 5 4.727 -18.732 -4.281 1162 1HH2 ARG 5 1HH2 ARG 5 7.041 -16.341 -5.232 1163 2HH2 ARG 5 2HH2 ARG 5 5.545 -17.123 -5.619 1164 H VAL 6 H VAL 6 7.020 -15.978 2.843 1165 HA VAL 6 HA VAL 6 9.578 -15.750 4.322 1166 HB VAL 6 HB VAL 6 9.686 -13.309 3.741 1167 1HG1 VAL 6 1HG1 VAL 6 10.867 -15.172 2.428 1168 2HG1 VAL 6 2HG1 VAL 6 10.672 -13.629 1.596 1169 3HG1 VAL 6 3HG1 VAL 6 9.597 -14.976 1.220 1170 1HG2 VAL 6 1HG2 VAL 6 7.606 -13.966 1.644 1171 2HG2 VAL 6 2HG2 VAL 6 8.256 -12.381 2.063 1172 3HG2 VAL 6 3HG2 VAL 6 7.193 -13.224 3.190 1173 H ILE 7 H ILE 7 9.169 -13.530 5.774 1174 HA ILE 7 HA ILE 7 6.361 -13.511 6.762 1175 HB ILE 7 HB ILE 7 7.619 -15.287 7.971 1176 1HG1 ILE 7 1HG1 ILE 7 7.472 -13.154 10.029 1177 2HG1 ILE 7 2HG1 ILE 7 6.014 -13.390 9.065 1178 1HG2 ILE 7 1HG2 ILE 7 9.795 -13.737 7.654 1179 2HG2 ILE 7 2HG2 ILE 7 9.682 -14.953 8.926 1180 3HG2 ILE 7 3HG2 ILE 7 9.353 -13.260 9.293 1181 1HD1 ILE 7 1HD1 ILE 7 6.627 -14.863 11.280 1182 2HD1 ILE 7 2HD1 ILE 7 7.305 -15.880 10.008 1183 3HD1 ILE 7 3HD1 ILE 7 5.597 -15.442 9.971 1184 H VAL 8 H VAL 8 5.811 -11.489 7.666 1185 HA VAL 8 HA VAL 8 7.761 -9.322 7.205 1186 HB VAL 8 HB VAL 8 4.849 -9.391 8.074 1187 1HG1 VAL 8 1HG1 VAL 8 4.857 -6.986 7.467 1188 2HG1 VAL 8 2HG1 VAL 8 6.593 -7.077 7.172 1189 3HG1 VAL 8 3HG1 VAL 8 5.962 -7.320 8.801 1190 1HG2 VAL 8 1HG2 VAL 8 4.455 -9.808 5.895 1191 2HG2 VAL 8 2HG2 VAL 8 6.178 -9.720 5.531 1192 3HG2 VAL 8 3HG2 VAL 8 5.196 -8.255 5.508 1193 H LYS 9 H LYS 9 9.099 -8.713 8.828 1194 HA LYS 9 HA LYS 9 8.094 -8.861 11.644 1195 1HB LYS 9 1HB LYS 9 10.871 -9.230 10.474 1196 2HB LYS 9 2HB LYS 9 10.514 -9.241 12.200 1197 1HG LYS 9 1HG LYS 9 8.693 -11.049 11.368 1198 2HG LYS 9 2HG LYS 9 9.924 -11.293 10.129 1199 1HD LYS 9 1HD LYS 9 11.451 -12.126 11.623 1200 2HD LYS 9 2HD LYS 9 10.892 -11.086 12.930 1201 1HE LYS 9 1HE LYS 9 8.696 -12.698 12.517 1202 2HE LYS 9 2HE LYS 9 10.044 -13.813 12.223 1203 1HZ LYS 9 1HZ LYS 9 11.078 -12.811 14.280 1204 2HZ LYS 9 2HZ LYS 9 9.721 -13.795 14.551 1205 3HZ LYS 9 3HZ LYS 9 9.568 -12.105 14.603 1206 H LYS 10 H LYS 10 9.174 -5.463 12.189 1207 HA LYS 10 HA LYS 10 8.240 -6.296 14.154 1208 1HB LYS 10 1HB LYS 10 6.798 -7.334 11.825 1209 2HB LYS 10 2HB LYS 10 6.555 -8.309 13.276 1210 1HG LYS 10 1HG LYS 10 4.884 -6.542 13.221 1211 2HG LYS 10 2HG LYS 10 6.013 -6.214 14.531 1212 1HD LYS 10 1HD LYS 10 6.983 -5.048 12.070 1213 2HD LYS 10 2HD LYS 10 5.337 -4.499 12.390 1214 1HE LYS 10 1HE LYS 10 7.301 -4.526 14.663 1215 2HE LYS 10 2HE LYS 10 7.383 -3.212 13.475 1216 1HZ LYS 10 1HZ LYS 10 4.846 -4.104 14.735 1217 2HZ LYS 10 2HZ LYS 10 5.115 -2.692 13.831 1218 3HZ LYS 10 3HZ LYS 10 5.792 -2.850 15.380 1219 H SER 11 H SER 11 10.506 -7.186 14.517 1220 HA SER 11 HA SER 11 10.490 -10.183 14.600 1221 1HB SER 11 1HB SER 11 12.273 -8.376 13.495 1222 2HB SER 11 2HB SER 11 13.010 -8.715 15.061 1223 HG SER 11 HG SER 11 13.725 -10.390 14.000 1224 HA PRO 12 HA PRO 12 10.988 -9.954 18.977 1225 1HB PRO 12 1HB PRO 12 13.113 -11.559 19.601 1226 2HB PRO 12 2HB PRO 12 11.590 -12.197 18.959 1227 1HG PRO 12 1HG PRO 12 14.200 -11.841 17.631 1228 2HG PRO 12 2HG PRO 12 12.912 -13.004 17.298 1229 1HD PRO 12 1HD PRO 12 13.474 -10.633 15.878 1230 2HD PRO 12 2HD PRO 12 12.054 -11.679 15.683 1231 H LEU 13 H LEU 13 13.202 -8.313 17.177 1232 HA LEU 13 HA LEU 13 14.668 -7.331 19.604 1233 1HB LEU 13 1HB LEU 13 15.571 -7.560 16.707 1234 2HB LEU 13 2HB LEU 13 16.555 -6.943 18.033 1235 HG LEU 13 HG LEU 13 15.324 -9.708 18.064 1236 1HD1 LEU 13 1HD1 LEU 13 17.517 -10.555 17.358 1237 2HD1 LEU 13 2HD1 LEU 13 18.128 -8.906 17.225 1238 3HD1 LEU 13 3HD1 LEU 13 16.867 -9.470 16.129 1239 1HD2 LEU 13 1HD2 LEU 13 17.498 -9.860 19.615 1240 2HD2 LEU 13 2HD2 LEU 13 15.954 -9.285 20.243 1241 3HD2 LEU 13 3HD2 LEU 13 17.199 -8.129 19.770 1242 H GLY 14 H GLY 14 13.392 -6.459 16.384 1243 1HA GLY 14 1HA GLY 14 11.936 -4.311 16.610 1244 2HA GLY 14 2HA GLY 14 13.428 -3.595 17.219 1245 H GLY 15 H GLY 15 11.935 -2.866 14.783 1246 1HA GLY 15 1HA GLY 15 13.165 -1.901 12.854 1247 2HA GLY 15 2HA GLY 15 14.112 -3.388 12.800 1248 H TYR 16 H TYR 16 11.748 -1.833 11.180 1249 HA TYR 16 HA TYR 16 10.016 -4.179 10.656 1250 1HB TYR 16 1HB TYR 16 9.635 -1.461 10.783 1251 2HB TYR 16 2HB TYR 16 9.775 -1.707 9.043 1252 HD1 TYR 16 HD1 TYR 16 8.572 -4.207 8.447 1253 HD2 TYR 16 HD2 TYR 16 7.404 -1.354 11.440 1254 HE1 TYR 16 HE1 TYR 16 6.255 -5.091 8.387 1255 HE2 TYR 16 HE2 TYR 16 5.088 -2.239 11.379 1256 HH TYR 16 HH TYR 16 4.277 -5.148 9.627 1257 H GLY 17 H GLY 17 11.083 -5.654 9.363 1258 1HA GLY 17 1HA GLY 17 11.861 -4.762 6.653 1259 2HA GLY 17 2HA GLY 17 13.101 -5.590 7.599 1260 H VAL 18 H VAL 18 12.764 -7.146 5.626 1261 HA VAL 18 HA VAL 18 10.406 -8.923 6.100 1262 HB VAL 18 HB VAL 18 12.351 -8.566 3.793 1263 1HG1 VAL 18 1HG1 VAL 18 10.053 -10.499 4.194 1264 2HG1 VAL 18 2HG1 VAL 18 11.725 -10.882 3.782 1265 3HG1 VAL 18 3HG1 VAL 18 10.684 -10.092 2.598 1266 1HG2 VAL 18 1HG2 VAL 18 10.147 -7.889 2.663 1267 2HG2 VAL 18 2HG2 VAL 18 10.813 -6.754 3.836 1268 3HG2 VAL 18 3HG2 VAL 18 9.470 -7.804 4.288 1269 H PHE 19 H PHE 19 10.722 -11.125 6.529 1270 HA PHE 19 HA PHE 19 13.526 -11.925 7.222 1271 1HB PHE 19 1HB PHE 19 10.856 -12.206 8.434 1272 2HB PHE 19 2HB PHE 19 11.769 -13.715 8.407 1273 HD1 PHE 19 HD1 PHE 19 12.234 -10.072 9.182 1274 HD2 PHE 19 HD2 PHE 19 13.288 -14.127 10.131 1275 HE1 PHE 19 HE1 PHE 19 13.595 -9.271 11.094 1276 HE2 PHE 19 HE2 PHE 19 14.650 -13.325 12.042 1277 HZ PHE 19 HZ PHE 19 14.805 -10.899 12.520 1278 H ALA 20 H ALA 20 14.384 -13.343 5.756 1279 HA ALA 20 HA ALA 20 12.611 -14.733 3.855 1280 1HB ALA 20 1HB ALA 20 15.261 -13.673 3.964 1281 2HB ALA 20 2HB ALA 20 14.432 -14.355 2.566 1282 3HB ALA 20 3HB ALA 20 15.399 -15.395 3.612 1283 H ARG 21 H ARG 21 11.630 -16.359 5.229 1284 HA ARG 21 HA ARG 21 13.031 -18.183 6.915 1285 1HB ARG 21 1HB ARG 21 10.432 -17.699 6.001 1286 2HB ARG 21 2HB ARG 21 10.794 -19.320 5.408 1287 1HG ARG 21 1HG ARG 21 9.935 -19.702 7.574 1288 2HG ARG 21 2HG ARG 21 11.682 -19.767 7.804 1289 1HD ARG 21 1HD ARG 21 11.035 -17.045 8.072 1290 2HD ARG 21 2HD ARG 21 9.766 -17.912 8.959 1291 HE ARG 21 HE ARG 21 12.605 -17.853 9.652 1292 1HH1 ARG 21 1HH1 ARG 21 9.651 -19.690 9.784 1293 2HH1 ARG 21 2HH1 ARG 21 10.147 -20.596 11.171 1294 1HH2 ARG 21 1HH2 ARG 21 13.226 -19.041 11.452 1295 2HH2 ARG 21 2HH2 ARG 21 12.156 -20.233 12.110 1296 H LYS 22 H LYS 22 12.769 -17.935 3.447 1297 HA LYS 22 HA LYS 22 13.918 -20.643 3.008 1298 1HB LYS 22 1HB LYS 22 13.058 -18.435 1.091 1299 2HB LYS 22 2HB LYS 22 13.373 -20.113 0.662 1300 1HG LYS 22 1HG LYS 22 11.545 -20.721 2.365 1301 2HG LYS 22 2HG LYS 22 11.107 -19.013 2.322 1302 1HD LYS 22 1HD LYS 22 9.761 -20.309 0.709 1303 2HD LYS 22 2HD LYS 22 10.801 -19.154 -0.124 1304 1HE LYS 22 1HE LYS 22 12.005 -20.810 -1.138 1305 2HE LYS 22 2HE LYS 22 12.051 -21.795 0.337 1306 1HZ LYS 22 1HZ LYS 22 10.636 -22.896 -1.221 1307 2HZ LYS 22 2HZ LYS 22 9.773 -21.470 -1.548 1308 3HZ LYS 22 3HZ LYS 22 9.634 -22.218 -0.029 1309 H SER 23 H SER 23 17.005 -19.310 1.454 1310 HA SER 23 HA SER 23 14.791 -21.309 1.236 1311 1HB SER 23 1HB SER 23 17.175 -21.945 1.860 1312 2HB SER 23 2HB SER 23 16.550 -22.773 0.433 1313 HG SER 23 HG SER 23 17.890 -21.706 -0.802 1314 H PHE 24 H PHE 24 16.564 -18.837 -0.482 1315 HA PHE 24 HA PHE 24 14.905 -19.402 -2.912 1316 1HB PHE 24 1HB PHE 24 15.955 -16.939 -1.523 1317 2HB PHE 24 2HB PHE 24 15.525 -16.859 -3.231 1318 HD1 PHE 24 HD1 PHE 24 14.264 -15.973 -0.241 1319 HD2 PHE 24 HD2 PHE 24 13.206 -18.514 -3.539 1320 HE1 PHE 24 HE1 PHE 24 11.870 -15.768 0.370 1321 HE2 PHE 24 HE2 PHE 24 10.811 -18.309 -2.928 1322 HZ PHE 24 HZ PHE 24 10.144 -16.936 -0.973 1323 H GLU 25 H GLU 25 15.947 -18.918 -5.003 1324 HA GLU 25 HA GLU 25 18.805 -19.690 -5.011 1325 1HB GLU 25 1HB GLU 25 16.487 -20.074 -6.622 1326 2HB GLU 25 2HB GLU 25 17.642 -19.171 -7.602 1327 1HG GLU 25 1HG GLU 25 19.393 -20.881 -6.867 1328 2HG GLU 25 2HG GLU 25 18.055 -21.839 -6.235 1329 H LYS 26 H LYS 26 19.480 -18.397 -7.474 1330 HA LYS 26 HA LYS 26 19.914 -15.631 -6.464 1331 1HB LYS 26 1HB LYS 26 21.775 -17.190 -7.175 1332 2HB LYS 26 2HB LYS 26 21.134 -17.119 -8.816 1333 1HG LYS 26 1HG LYS 26 21.454 -14.679 -8.848 1334 2HG LYS 26 2HG LYS 26 22.064 -14.729 -7.193 1335 1HD LYS 26 1HD LYS 26 24.020 -15.900 -7.829 1336 2HD LYS 26 2HD LYS 26 23.331 -16.380 -9.380 1337 1HE LYS 26 1HE LYS 26 23.618 -14.229 -10.310 1338 2HE LYS 26 2HE LYS 26 23.739 -13.459 -8.716 1339 1HZ LYS 26 1HZ LYS 26 25.651 -15.550 -9.572 1340 2HZ LYS 26 2HZ LYS 26 25.833 -14.387 -8.347 1341 3HZ LYS 26 3HZ LYS 26 25.906 -13.921 -9.978 1342 H GLY 27 H GLY 27 17.531 -15.210 -7.093 1343 1HA GLY 27 1HA GLY 27 16.621 -13.528 -8.674 1344 2HA GLY 27 2HA GLY 27 17.445 -14.396 -9.969 1345 H GLU 28 H GLU 28 14.857 -14.755 -7.541 1346 HA GLU 28 HA GLU 28 13.405 -16.474 -9.513 1347 1HB GLU 28 1HB GLU 28 14.062 -16.982 -6.600 1348 2HB GLU 28 2HB GLU 28 12.753 -17.836 -7.417 1349 1HG GLU 28 1HG GLU 28 15.285 -17.789 -8.924 1350 2HG GLU 28 2HG GLU 28 15.374 -18.661 -7.393 1351 H LEU 29 H LEU 29 13.251 -13.608 -8.225 1352 HA LEU 29 HA LEU 29 11.514 -12.129 -7.644 1353 1HB LEU 29 1HB LEU 29 10.564 -13.437 -9.632 1354 2HB LEU 29 2HB LEU 29 9.710 -14.428 -8.450 1355 HG LEU 29 HG LEU 29 8.778 -12.253 -7.495 1356 1HD1 LEU 29 1HD1 LEU 29 10.653 -11.068 -9.073 1357 2HD1 LEU 29 2HD1 LEU 29 9.202 -10.246 -8.501 1358 3HD1 LEU 29 3HD1 LEU 29 9.237 -10.952 -10.117 1359 1HD2 LEU 29 1HD2 LEU 29 8.135 -13.299 -10.247 1360 2HD2 LEU 29 2HD2 LEU 29 7.210 -11.966 -9.555 1361 3HD2 LEU 29 3HD2 LEU 29 7.244 -13.531 -8.742 1362 H VAL 30 H VAL 30 10.213 -11.676 -5.807 1363 HA VAL 30 HA VAL 30 9.864 -13.951 -3.881 1364 HB VAL 30 HB VAL 30 10.791 -11.088 -3.446 1365 1HG1 VAL 30 1HG1 VAL 30 9.480 -11.596 -1.532 1366 2HG1 VAL 30 2HG1 VAL 30 11.131 -11.986 -1.049 1367 3HG1 VAL 30 3HG1 VAL 30 10.020 -13.275 -1.509 1368 1HG2 VAL 30 1HG2 VAL 30 12.110 -13.717 -3.712 1369 2HG2 VAL 30 2HG2 VAL 30 12.655 -12.755 -2.338 1370 3HG2 VAL 30 3HG2 VAL 30 12.762 -12.099 -3.971 1371 H GLU 31 H GLU 31 8.727 -10.730 -4.906 1372 HA GLU 31 HA GLU 31 5.946 -11.470 -4.492 1373 1HB GLU 31 1HB GLU 31 7.349 -10.783 -2.222 1374 2HB GLU 31 2HB GLU 31 6.660 -9.231 -2.698 1375 1HG GLU 31 1HG GLU 31 4.667 -9.874 -1.876 1376 2HG GLU 31 2HG GLU 31 4.632 -11.211 -3.025 1377 H GLU 32 H GLU 32 4.495 -9.631 -5.053 1378 HA GLU 32 HA GLU 32 5.780 -7.218 -6.189 1379 1HB GLU 32 1HB GLU 32 4.750 -7.723 -8.423 1380 2HB GLU 32 2HB GLU 32 5.961 -8.916 -7.953 1381 1HG GLU 32 1HG GLU 32 3.406 -9.703 -6.892 1382 2HG GLU 32 2HG GLU 32 3.237 -9.378 -8.617 1383 H CYS 33 H CYS 33 4.316 -5.485 -6.302 1384 HA CYS 33 HA CYS 33 1.417 -6.021 -5.936 1385 1HB CYS 33 1HB CYS 33 3.348 -4.974 -3.938 1386 2HB CYS 33 2HB CYS 33 1.837 -4.073 -4.061 1387 HG CYS 33 HG CYS 33 1.569 -6.117 -2.368 1388 H LEU 34 H LEU 34 0.606 -3.416 -5.420 1389 HA LEU 34 HA LEU 34 1.379 -2.053 -7.957 1390 1HB LEU 34 1HB LEU 34 -0.971 -2.070 -6.070 1391 2HB LEU 34 2HB LEU 34 -0.751 -0.703 -7.160 1392 HG LEU 34 HG LEU 34 -0.695 -2.242 -9.087 1393 1HD1 LEU 34 1HD1 LEU 34 0.121 -4.296 -8.406 1394 2HD1 LEU 34 2HD1 LEU 34 -1.607 -4.649 -8.375 1395 3HD1 LEU 34 3HD1 LEU 34 -0.760 -4.256 -6.879 1396 1HD2 LEU 34 1HD2 LEU 34 -3.140 -3.309 -8.037 1397 2HD2 LEU 34 2HD2 LEU 34 -2.927 -1.963 -9.157 1398 3HD2 LEU 34 3HD2 LEU 34 -2.935 -1.670 -7.418 1399 H CYS 35 H CYS 35 1.180 0.487 -7.677 1400 HA CYS 35 HA CYS 35 2.325 1.394 -5.079 1401 1HB CYS 35 1HB CYS 35 4.164 2.507 -6.343 1402 2HB CYS 35 2HB CYS 35 4.196 0.759 -6.572 1403 HG CYS 35 HG CYS 35 2.576 2.123 -8.752 1404 H ILE 36 H ILE 36 2.063 3.704 -4.766 1405 HA ILE 36 HA ILE 36 -0.104 4.869 -6.444 1406 HB ILE 36 HB ILE 36 1.177 5.900 -3.888 1407 1HG1 ILE 36 1HG1 ILE 36 -1.270 4.131 -4.210 1408 2HG1 ILE 36 2HG1 ILE 36 0.287 3.602 -3.571 1409 1HG2 ILE 36 1HG2 ILE 36 -1.061 7.018 -3.661 1410 2HG2 ILE 36 2HG2 ILE 36 -1.460 6.439 -5.278 1411 3HG2 ILE 36 3HG2 ILE 36 -0.131 7.575 -5.053 1412 1HD1 ILE 36 1HD1 ILE 36 -1.684 4.441 -1.961 1413 2HD1 ILE 36 2HD1 ILE 36 -0.961 6.009 -2.321 1414 3HD1 ILE 36 3HD1 ILE 36 0.013 4.738 -1.583 1415 H VAL 37 H VAL 37 1.022 5.599 -8.295 1416 HA VAL 37 HA VAL 37 3.499 7.161 -7.995 1417 HB VAL 37 HB VAL 37 1.752 6.460 -10.384 1418 1HG1 VAL 37 1HG1 VAL 37 4.264 7.974 -10.048 1419 2HG1 VAL 37 2HG1 VAL 37 3.108 7.993 -11.380 1420 3HG1 VAL 37 3HG1 VAL 37 4.326 6.722 -11.288 1421 1HG2 VAL 37 1HG2 VAL 37 4.277 5.055 -10.167 1422 2HG2 VAL 37 2HG2 VAL 37 2.648 4.393 -10.305 1423 3HG2 VAL 37 3HG2 VAL 37 3.304 4.800 -8.719 1424 H ARG 38 H ARG 38 3.317 9.285 -7.426 1425 HA ARG 38 HA ARG 38 1.086 10.879 -8.641 1426 1HB ARG 38 1HB ARG 38 1.960 10.405 -5.886 1427 2HB ARG 38 2HB ARG 38 1.852 12.124 -6.264 1428 1HG ARG 38 1HG ARG 38 -0.345 10.093 -6.769 1429 2HG ARG 38 2HG ARG 38 -0.300 11.212 -5.406 1430 1HD ARG 38 1HD ARG 38 0.104 12.571 -7.973 1431 2HD ARG 38 2HD ARG 38 -1.464 11.749 -7.870 1432 HE ARG 38 HE ARG 38 -1.119 12.987 -5.384 1433 1HH1 ARG 38 1HH1 ARG 38 -1.219 13.988 -8.717 1434 2HH1 ARG 38 2HH1 ARG 38 -1.853 15.553 -8.342 1435 1HH2 ARG 38 1HH2 ARG 38 -1.942 15.024 -4.924 1436 2HH2 ARG 38 2HH2 ARG 38 -2.260 16.137 -6.212 1437 H HIS 39 H HIS 39 1.657 13.009 -9.307 1438 HA HIS 39 HA HIS 39 4.284 13.465 -10.282 1439 1HB HIS 39 1HB HIS 39 1.761 14.982 -9.833 1440 2HB HIS 39 2HB HIS 39 3.212 15.958 -10.058 1441 HD1 HIS 39 HD1 HIS 39 1.535 16.400 -12.342 1442 HD2 HIS 39 HD2 HIS 39 3.817 12.918 -12.144 1443 HE1 HIS 39 HE1 HIS 39 1.735 15.539 -14.715 1444 H ASN 40 H ASN 40 5.850 15.105 -9.533 1445 HA ASN 40 HA ASN 40 6.431 14.896 -6.714 1446 1HB ASN 40 1HB ASN 40 8.260 16.500 -7.365 1447 2HB ASN 40 2HB ASN 40 8.156 15.098 -8.429 1448 1HD2 ASN 40 1HD2 ASN 40 7.537 15.455 -10.638 1449 2HD2 ASN 40 2HD2 ASN 40 7.304 17.006 -11.286 1450 H ASP 41 H ASP 41 5.241 15.971 -5.205 1451 HA ASP 41 HA ASP 41 5.065 18.846 -5.143 1452 1HB ASP 41 1HB ASP 41 3.345 17.768 -6.940 1453 2HB ASP 41 2HB ASP 41 2.350 17.646 -5.489 1454 H ASP 42 H ASP 42 2.344 18.625 -3.743 1455 HA ASP 42 HA ASP 42 3.139 18.306 -1.074 1456 1HB ASP 42 1HB ASP 42 0.472 17.618 -2.369 1457 2HB ASP 42 2HB ASP 42 0.712 18.031 -0.671 1458 H TRP 43 H TRP 43 2.421 15.865 -3.465 1459 HA TRP 43 HA TRP 43 1.985 13.620 -1.725 1460 1HB TRP 43 1HB TRP 43 1.339 13.524 -4.028 1461 2HB TRP 43 2HB TRP 43 2.923 14.065 -4.573 1462 HD1 TRP 43 HD1 TRP 43 4.568 12.272 -5.265 1463 HE1 TRP 43 HE1 TRP 43 4.701 9.706 -5.039 1464 HE3 TRP 43 HE3 TRP 43 0.539 11.443 -2.240 1465 HZ2 TRP 43 HZ2 TRP 43 3.283 7.588 -3.751 1466 HZ3 TRP 43 HZ3 TRP 43 -0.044 9.141 -1.529 1467 HH2 TRP 43 HH2 TRP 43 1.321 7.215 -2.279 1468 H GLY 44 H GLY 44 4.928 14.642 -3.519 1469 1HA GLY 44 1HA GLY 44 6.693 12.728 -2.421 1470 2HA GLY 44 2HA GLY 44 7.197 14.308 -3.021 1471 H THR 45 H THR 45 5.533 15.782 -1.094 1472 HA THR 45 HA THR 45 7.422 15.810 1.131 1473 HB THR 45 HB THR 45 4.758 17.230 0.781 1474 HG1 THR 45 HG1 THR 45 7.348 17.921 -0.146 1475 1HG2 THR 45 1HG2 THR 45 6.761 18.862 1.943 1476 2HG2 THR 45 2HG2 THR 45 6.850 17.303 2.763 1477 3HG2 THR 45 3HG2 THR 45 5.330 18.197 2.731 1478 H ALA 46 H ALA 46 3.846 15.504 1.108 1479 HA ALA 46 HA ALA 46 3.485 14.622 3.741 1480 1HB ALA 46 1HB ALA 46 1.790 15.239 1.939 1481 2HB ALA 46 2HB ALA 46 1.348 13.840 2.918 1482 3HB ALA 46 3HB ALA 46 1.998 13.610 1.294 1483 H LEU 47 H LEU 47 3.900 12.531 0.848 1484 HA LEU 47 HA LEU 47 4.269 10.170 2.599 1485 1HB LEU 47 1HB LEU 47 3.969 10.732 -0.357 1486 2HB LEU 47 2HB LEU 47 4.484 9.140 0.196 1487 HG LEU 47 HG LEU 47 2.063 9.153 -0.093 1488 1HD1 LEU 47 1HD1 LEU 47 1.944 9.281 2.802 1489 2HD1 LEU 47 2HD1 LEU 47 3.407 8.453 2.268 1490 3HD1 LEU 47 3HD1 LEU 47 1.825 7.875 1.744 1491 1HD2 LEU 47 1HD2 LEU 47 0.643 10.775 0.765 1492 2HD2 LEU 47 2HD2 LEU 47 2.074 11.746 0.420 1493 3HD2 LEU 47 3HD2 LEU 47 1.752 11.204 2.067 1494 H GLU 48 H GLU 48 6.332 12.373 2.484 1495 HA GLU 48 HA GLU 48 8.587 11.929 0.967 1496 1HB GLU 48 1HB GLU 48 9.812 12.777 2.970 1497 2HB GLU 48 2HB GLU 48 8.314 13.663 2.691 1498 1HG GLU 48 1HG GLU 48 7.945 13.218 4.900 1499 2HG GLU 48 2HG GLU 48 7.407 11.655 4.288 1500 H ASP 49 H ASP 49 7.352 9.783 3.463 1501 HA ASP 49 HA ASP 49 9.843 8.166 3.385 1502 1HB ASP 49 1HB ASP 49 8.731 7.029 5.308 1503 2HB ASP 49 2HB ASP 49 8.824 8.774 5.549 1504 H TYR 50 H TYR 50 9.769 5.948 2.823 1505 HA TYR 50 HA TYR 50 9.079 4.053 1.611 1506 1HB TYR 50 1HB TYR 50 6.291 5.115 2.179 1507 2HB TYR 50 2HB TYR 50 6.759 3.438 1.917 1508 HD1 TYR 50 HD1 TYR 50 9.269 3.338 3.575 1509 HD2 TYR 50 HD2 TYR 50 5.417 5.063 4.378 1510 HE1 TYR 50 HE1 TYR 50 9.655 3.071 6.010 1511 HE2 TYR 50 HE2 TYR 50 5.805 4.796 6.812 1512 HH TYR 50 HH TYR 50 8.308 2.883 8.073 1513 H LEU 51 H LEU 51 9.161 6.920 0.324 1514 HA LEU 51 HA LEU 51 7.420 6.339 -2.036 1515 1HB LEU 51 1HB LEU 51 8.525 8.735 -0.665 1516 2HB LEU 51 2HB LEU 51 8.504 8.835 -2.419 1517 HG LEU 51 HG LEU 51 6.135 8.361 -0.588 1518 1HD1 LEU 51 1HD1 LEU 51 6.836 10.527 -2.597 1519 2HD1 LEU 51 2HD1 LEU 51 6.854 10.704 -0.844 1520 3HD1 LEU 51 3HD1 LEU 51 5.329 10.442 -1.689 1521 1HD2 LEU 51 1HD2 LEU 51 6.534 7.734 -3.452 1522 2HD2 LEU 51 2HD2 LEU 51 5.082 8.664 -3.085 1523 3HD2 LEU 51 3HD2 LEU 51 5.344 7.100 -2.315 1524 H PHE 52 H PHE 52 8.411 5.481 -3.803 1525 HA PHE 52 HA PHE 52 11.363 5.604 -4.069 1526 1HB PHE 52 1HB PHE 52 9.052 4.160 -5.362 1527 2HB PHE 52 2HB PHE 52 10.609 4.215 -6.187 1528 HD1 PHE 52 HD1 PHE 52 12.489 2.949 -5.397 1529 HD2 PHE 52 HD2 PHE 52 8.879 3.152 -3.079 1530 HE1 PHE 52 HE1 PHE 52 13.332 1.139 -3.927 1531 HE2 PHE 52 HE2 PHE 52 9.722 1.342 -1.608 1532 HZ PHE 52 HZ PHE 52 11.949 0.335 -2.032 1533 H SER 53 H SER 53 11.959 7.642 -4.820 1534 HA SER 53 HA SER 53 10.238 9.092 -6.701 1535 1HB SER 53 1HB SER 53 11.772 10.896 -6.239 1536 2HB SER 53 2HB SER 53 11.553 10.024 -4.722 1537 HG SER 53 HG SER 53 13.751 10.110 -6.441 1538 H ARG 54 H ARG 54 10.371 8.746 -8.852 1539 HA ARG 54 HA ARG 54 12.890 7.670 -10.025 1540 1HB ARG 54 1HB ARG 54 10.109 7.249 -10.350 1541 2HB ARG 54 2HB ARG 54 10.649 8.041 -11.830 1542 1HG ARG 54 1HG ARG 54 12.468 6.359 -12.037 1543 2HG ARG 54 2HG ARG 54 11.853 5.545 -10.598 1544 1HD ARG 54 1HD ARG 54 10.889 4.379 -12.469 1545 2HD ARG 54 2HD ARG 54 9.596 5.421 -11.841 1546 HE ARG 54 HE ARG 54 11.259 6.776 -13.814 1547 1HH1 ARG 54 1HH1 ARG 54 8.574 4.612 -13.359 1548 2HH1 ARG 54 2HH1 ARG 54 7.851 5.010 -14.879 1549 1HH2 ARG 54 1HH2 ARG 54 10.305 7.277 -15.784 1550 2HH2 ARG 54 2HH2 ARG 54 8.823 6.507 -16.244 1551 H LYS 55 H LYS 55 13.190 8.623 -12.403 1552 HA LYS 55 HA LYS 55 13.642 11.491 -12.088 1553 1HB LYS 55 1HB LYS 55 14.228 9.299 -14.038 1554 2HB LYS 55 2HB LYS 55 14.310 10.956 -14.638 1555 1HG LYS 55 1HG LYS 55 16.453 10.829 -13.834 1556 2HG LYS 55 2HG LYS 55 15.665 11.244 -12.312 1557 1HD LYS 55 1HD LYS 55 15.850 9.103 -11.474 1558 2HD LYS 55 2HD LYS 55 15.757 8.358 -13.070 1559 1HE LYS 55 1HE LYS 55 18.076 9.405 -13.509 1560 2HE LYS 55 2HE LYS 55 18.146 9.672 -11.757 1561 1HZ LYS 55 1HZ LYS 55 17.700 7.348 -11.389 1562 2HZ LYS 55 2HZ LYS 55 19.037 7.479 -12.428 1563 3HZ LYS 55 3HZ LYS 55 17.512 7.069 -13.054 1564 H ASN 56 H ASN 56 11.344 12.111 -11.869 1565 HA ASN 56 HA ASN 56 9.676 11.875 -14.310 1566 1HB ASN 56 1HB ASN 56 9.489 14.341 -14.440 1567 2HB ASN 56 2HB ASN 56 10.585 14.499 -13.067 1568 1HD2 ASN 56 1HD2 ASN 56 12.693 14.937 -13.716 1569 2HD2 ASN 56 2HD2 ASN 56 13.407 14.394 -15.157 1570 H MET 57 H MET 57 9.699 11.205 -11.262 1571 HA MET 57 HA MET 57 7.650 12.805 -10.015 1572 1HB MET 57 1HB MET 57 5.762 11.229 -10.387 1573 2HB MET 57 2HB MET 57 6.360 11.865 -11.918 1574 1HG MET 57 1HG MET 57 7.948 9.627 -11.498 1575 2HG MET 57 2HG MET 57 6.365 9.114 -10.914 1576 1HE MET 57 1HE MET 57 4.087 10.175 -13.935 1577 2HE MET 57 2HE MET 57 4.652 11.230 -12.639 1578 3HE MET 57 3HE MET 57 4.132 9.585 -12.273 1579 H SER 58 H SER 58 6.312 10.822 -8.563 1580 HA SER 58 HA SER 58 8.427 9.092 -7.375 1581 1HB SER 58 1HB SER 58 7.981 10.011 -5.168 1582 2HB SER 58 2HB SER 58 8.300 11.366 -6.251 1583 HG SER 58 HG SER 58 6.463 11.848 -5.129 1584 H ALA 59 H ALA 59 7.524 7.293 -6.186 1585 HA ALA 59 HA ALA 59 4.557 6.969 -6.372 1586 1HB ALA 59 1HB ALA 59 5.579 4.483 -7.008 1587 2HB ALA 59 2HB ALA 59 6.749 5.564 -7.765 1588 3HB ALA 59 3HB ALA 59 5.042 5.673 -8.194 1589 H MET 60 H MET 60 3.681 5.676 -4.703 1590 HA MET 60 HA MET 60 5.465 5.160 -2.400 1591 1HB MET 60 1HB MET 60 3.289 6.267 -2.097 1592 2HB MET 60 2HB MET 60 2.472 4.912 -2.875 1593 1HG MET 60 1HG MET 60 2.270 4.706 -0.445 1594 2HG MET 60 2HG MET 60 3.290 3.410 -1.070 1595 1HE MET 60 1HE MET 60 2.574 6.006 1.058 1596 2HE MET 60 2HE MET 60 3.797 7.225 0.695 1597 3HE MET 60 3HE MET 60 3.949 6.225 2.141 1598 H ALA 61 H ALA 61 5.672 3.049 -1.443 1599 HA ALA 61 HA ALA 61 5.469 0.829 -3.372 1600 1HB ALA 61 1HB ALA 61 6.862 1.524 -0.877 1601 2HB ALA 61 2HB ALA 61 7.389 0.477 -2.195 1602 3HB ALA 61 3HB ALA 61 6.339 -0.160 -0.929 1603 H LEU 62 H LEU 62 3.441 -0.049 -3.548 1604 HA LEU 62 HA LEU 62 1.453 -1.137 -2.921 1605 1HB LEU 62 1HB LEU 62 0.887 0.060 -0.440 1606 2HB LEU 62 2HB LEU 62 1.833 1.265 -1.314 1607 HG LEU 62 HG LEU 62 0.283 0.793 -3.309 1608 1HD1 LEU 62 1HD1 LEU 62 -0.691 -1.134 -1.444 1609 2HD1 LEU 62 2HD1 LEU 62 -1.281 -0.808 -3.073 1610 3HD1 LEU 62 3HD1 LEU 62 -1.968 0.056 -1.698 1611 1HD2 LEU 62 1HD2 LEU 62 -1.302 2.417 -2.555 1612 2HD2 LEU 62 2HD2 LEU 62 0.204 2.787 -1.714 1613 3HD2 LEU 62 3HD2 LEU 62 -1.092 1.940 -0.870 1614 H GLY 63 H GLY 63 2.637 -3.161 -2.530 1615 1HA GLY 63 1HA GLY 63 2.058 -4.368 -0.043 1616 2HA GLY 63 2HA GLY 63 3.207 -5.015 -1.212 1617 H PHE 64 H PHE 64 4.282 -5.623 0.943 1618 HA PHE 64 HA PHE 64 5.508 -3.530 2.522 1619 1HB PHE 64 1HB PHE 64 6.434 -5.358 3.725 1620 2HB PHE 64 2HB PHE 64 4.878 -5.937 3.150 1621 HD1 PHE 64 HD1 PHE 64 5.957 -6.276 0.163 1622 HD2 PHE 64 HD2 PHE 64 7.321 -7.585 4.022 1623 HE1 PHE 64 HE1 PHE 64 7.096 -8.200 -0.892 1624 HE2 PHE 64 HE2 PHE 64 8.462 -9.510 2.961 1625 HZ PHE 64 HZ PHE 64 8.351 -9.819 0.504 1626 H GLY 65 H GLY 65 6.227 -2.662 0.118 1627 1HA GLY 65 1HA GLY 65 8.906 -3.727 -0.554 1628 2HA GLY 65 2HA GLY 65 8.021 -2.512 -1.476 1629 H ALA 66 H ALA 66 7.378 -1.125 1.170 1630 HA ALA 66 HA ALA 66 9.825 0.526 1.212 1631 1HB ALA 66 1HB ALA 66 7.484 1.415 0.993 1632 2HB ALA 66 2HB ALA 66 8.348 2.094 2.372 1633 3HB ALA 66 3HB ALA 66 7.149 0.824 2.620 1634 H ILE 67 H ILE 67 8.972 -2.214 2.874 1635 HA ILE 67 HA ILE 67 9.824 -1.217 5.539 1636 HB ILE 67 HB ILE 67 9.484 -3.746 6.090 1637 1HG1 ILE 67 1HG1 ILE 67 8.059 -4.996 4.639 1638 2HG1 ILE 67 2HG1 ILE 67 7.857 -3.633 3.544 1639 1HG2 ILE 67 1HG2 ILE 67 6.895 -3.306 5.916 1640 2HG2 ILE 67 2HG2 ILE 67 7.409 -1.696 5.412 1641 3HG2 ILE 67 3HG2 ILE 67 7.891 -2.323 6.988 1642 1HD1 ILE 67 1HD1 ILE 67 9.544 -5.523 2.920 1643 2HD1 ILE 67 2HD1 ILE 67 10.595 -4.747 4.102 1644 3HD1 ILE 67 3HD1 ILE 67 10.032 -3.845 2.694 1645 H PHE 68 H PHE 68 11.319 -2.414 2.740 1646 HA PHE 68 HA PHE 68 13.354 -4.115 3.726 1647 1HB PHE 68 1HB PHE 68 13.488 -1.953 1.590 1648 2HB PHE 68 2HB PHE 68 14.550 -3.354 1.701 1649 HD1 PHE 68 HD1 PHE 68 12.295 -5.325 2.606 1650 HD2 PHE 68 HD2 PHE 68 12.596 -2.476 -0.600 1651 HE1 PHE 68 HE1 PHE 68 10.690 -6.654 1.268 1652 HE2 PHE 68 HE2 PHE 68 10.988 -3.809 -1.930 1653 HZ PHE 68 HZ PHE 68 10.035 -5.896 -0.996 1654 H ASN 69 H ASN 69 15.116 -3.717 5.033 1655 HA ASN 69 HA ASN 69 15.535 -0.927 5.977 1656 1HB ASN 69 1HB ASN 69 16.536 -3.635 6.936 1657 2HB ASN 69 2HB ASN 69 16.767 -2.109 7.790 1658 1HD2 ASN 69 1HD2 ASN 69 15.404 -3.895 9.291 1659 2HD2 ASN 69 2HD2 ASN 69 13.735 -3.587 9.294 1660 H HIS 70 H HIS 70 18.011 -0.588 6.602 1661 HA HIS 70 HA HIS 70 19.515 -0.695 4.084 1662 1HB HIS 70 1HB HIS 70 19.335 1.184 5.878 1663 2HB HIS 70 2HB HIS 70 20.492 0.222 6.797 1664 HD1 HIS 70 HD1 HIS 70 20.601 3.011 4.748 1665 HD2 HIS 70 HD2 HIS 70 22.683 -0.599 4.618 1666 HE1 HIS 70 HE1 HIS 70 22.691 3.438 3.383 1667 H SER 71 H SER 71 20.647 -2.533 3.582 1668 HA SER 71 HA SER 71 22.163 -3.888 5.782 1669 1HB SER 71 1HB SER 71 20.009 -4.842 4.022 1670 2HB SER 71 2HB SER 71 21.431 -5.885 3.992 1671 HG SER 71 HG SER 71 19.984 -6.449 5.668 1672 H LYS 72 H LYS 72 24.234 -4.560 5.173 1673 HA LYS 72 HA LYS 72 25.494 -3.410 2.881 1674 1HB LYS 72 1HB LYS 72 26.468 -4.265 5.101 1675 2HB LYS 72 2HB LYS 72 26.362 -5.884 4.410 1676 1HG LYS 72 1HG LYS 72 28.574 -5.147 3.924 1677 2HG LYS 72 2HG LYS 72 27.680 -4.945 2.416 1678 1HD LYS 72 1HD LYS 72 27.228 -2.544 3.175 1679 2HD LYS 72 2HD LYS 72 28.443 -2.815 4.423 1680 1HE LYS 72 1HE LYS 72 29.225 -3.587 1.655 1681 2HE LYS 72 2HE LYS 72 29.085 -1.850 1.982 1682 1HZ LYS 72 1HZ LYS 72 31.294 -2.772 2.571 1683 2HZ LYS 72 2HZ LYS 72 30.544 -3.785 3.709 1684 3HZ LYS 72 3HZ LYS 72 30.485 -2.098 3.904 1685 H ASP 73 H ASP 73 25.226 -4.039 0.777 1686 HA ASP 73 HA ASP 73 24.817 -5.411 -1.099 1687 1HB ASP 73 1HB ASP 73 26.768 -6.531 0.429 1688 2HB ASP 73 2HB ASP 73 25.581 -7.834 0.457 1689 HA PRO 74 HA PRO 74 20.788 -6.707 0.766 1690 1HB PRO 74 1HB PRO 74 19.341 -5.846 -1.450 1691 2HB PRO 74 2HB PRO 74 19.667 -4.852 -0.019 1692 1HG PRO 74 1HG PRO 74 21.015 -4.869 -2.669 1693 2HG PRO 74 2HG PRO 74 20.654 -3.511 -1.595 1694 1HD PRO 74 1HD PRO 74 23.130 -4.591 -1.829 1695 2HD PRO 74 2HD PRO 74 22.541 -3.848 -0.327 1696 H ASN 75 H ASN 75 20.888 -8.933 0.522 1697 HA ASN 75 HA ASN 75 21.583 -10.367 -1.822 1698 1HB ASN 75 1HB ASN 75 19.956 -10.941 0.661 1699 2HB ASN 75 2HB ASN 75 20.211 -12.188 -0.560 1700 1HD2 ASN 75 1HD2 ASN 75 21.301 -12.393 2.108 1701 2HD2 ASN 75 2HD2 ASN 75 22.993 -12.321 1.988 1702 H ALA 76 H ALA 76 18.636 -8.714 -1.026 1703 HA ALA 76 HA ALA 76 17.351 -9.917 -3.453 1704 1HB ALA 76 1HB ALA 76 15.279 -9.233 -1.752 1705 2HB ALA 76 2HB ALA 76 16.521 -9.778 -0.624 1706 3HB ALA 76 3HB ALA 76 15.957 -10.854 -1.902 1707 H ARG 77 H ARG 77 17.050 -8.297 -4.922 1708 HA ARG 77 HA ARG 77 16.769 -5.493 -3.937 1709 1HB ARG 77 1HB ARG 77 18.024 -6.885 -6.168 1710 2HB ARG 77 2HB ARG 77 16.985 -5.581 -6.745 1711 1HG ARG 77 1HG ARG 77 18.120 -3.981 -5.295 1712 2HG ARG 77 2HG ARG 77 19.090 -5.270 -4.583 1713 1HD ARG 77 1HD ARG 77 20.391 -4.072 -6.313 1714 2HD ARG 77 2HD ARG 77 20.065 -5.732 -6.846 1715 HE ARG 77 HE ARG 77 17.884 -4.107 -7.678 1716 1HH1 ARG 77 1HH1 ARG 77 21.287 -4.506 -8.297 1717 2HH1 ARG 77 2HH1 ARG 77 21.170 -3.939 -9.927 1718 1HH2 ARG 77 1HH2 ARG 77 17.757 -3.375 -9.797 1719 2HH2 ARG 77 2HH2 ARG 77 19.187 -3.304 -10.772 1720 H HIS 78 H HIS 78 15.420 -4.291 -5.949 1721 HA HIS 78 HA HIS 78 12.823 -5.775 -6.164 1722 1HB HIS 78 1HB HIS 78 11.773 -3.515 -5.752 1723 2HB HIS 78 2HB HIS 78 12.714 -4.105 -4.383 1724 HD1 HIS 78 HD1 HIS 78 14.901 -2.869 -3.807 1725 HD2 HIS 78 HD2 HIS 78 12.969 -1.317 -7.159 1726 HE1 HIS 78 HE1 HIS 78 16.049 -0.676 -4.344 1727 H GLU 79 H GLU 79 11.449 -4.937 -7.971 1728 HA GLU 79 HA GLU 79 12.991 -3.524 -10.108 1729 1HB GLU 79 1HB GLU 79 13.061 -6.086 -10.216 1730 2HB GLU 79 2HB GLU 79 11.327 -6.027 -10.531 1731 1HG GLU 79 1HG GLU 79 11.832 -4.466 -12.461 1732 2HG GLU 79 2HG GLU 79 13.541 -4.819 -12.209 1733 H LEU 80 H LEU 80 11.562 -2.615 -11.783 1734 HA LEU 80 HA LEU 80 8.754 -2.202 -10.803 1735 1HB LEU 80 1HB LEU 80 10.866 -0.431 -12.010 1736 2HB LEU 80 2HB LEU 80 9.168 -0.026 -12.266 1737 HG LEU 80 HG LEU 80 10.113 -0.682 -9.493 1738 1HD1 LEU 80 1HD1 LEU 80 10.569 1.895 -11.008 1739 2HD1 LEU 80 2HD1 LEU 80 11.741 0.954 -10.084 1740 3HD1 LEU 80 3HD1 LEU 80 10.472 1.849 -9.247 1741 1HD2 LEU 80 1HD2 LEU 80 7.743 -0.401 -9.775 1742 2HD2 LEU 80 2HD2 LEU 80 7.970 1.063 -10.731 1743 3HD2 LEU 80 3HD2 LEU 80 8.338 1.071 -9.006 1744 H THR 81 H THR 81 7.099 -2.202 -12.424 1745 HA THR 81 HA THR 81 7.533 -3.949 -14.676 1746 HB THR 81 HB THR 81 5.151 -3.032 -15.196 1747 HG1 THR 81 HG1 THR 81 4.769 -1.273 -14.132 1748 1HG2 THR 81 1HG2 THR 81 5.830 -5.106 -13.822 1749 2HG2 THR 81 2HG2 THR 81 4.215 -4.453 -13.541 1750 3HG2 THR 81 3HG2 THR 81 5.515 -4.112 -12.400 1751 H ALA 82 H ALA 82 9.448 -2.417 -15.421 1752 HA ALA 82 HA ALA 82 10.270 -0.899 -17.033 1753 1HB ALA 82 1HB ALA 82 9.137 -1.154 -19.103 1754 2HB ALA 82 2HB ALA 82 7.561 -1.283 -18.321 1755 3HB ALA 82 3HB ALA 82 8.709 -2.618 -18.217 1756 H GLY 83 H GLY 83 8.950 0.359 -14.776 1757 1HA GLY 83 1HA GLY 83 8.817 3.009 -15.461 1758 2HA GLY 83 2HA GLY 83 7.192 2.444 -15.843 1759 H LEU 84 H LEU 84 5.977 3.307 -14.197 1760 HA LEU 84 HA LEU 84 6.764 2.559 -11.402 1761 1HB LEU 84 1HB LEU 84 6.900 5.068 -12.507 1762 2HB LEU 84 2HB LEU 84 5.270 5.083 -11.839 1763 HG LEU 84 HG LEU 84 6.161 4.388 -9.644 1764 1HD1 LEU 84 1HD1 LEU 84 8.520 3.876 -11.270 1765 2HD1 LEU 84 2HD1 LEU 84 8.146 3.313 -9.641 1766 3HD1 LEU 84 3HD1 LEU 84 8.907 4.886 -9.877 1767 1HD2 LEU 84 1HD2 LEU 84 7.881 6.526 -9.592 1768 2HD2 LEU 84 2HD2 LEU 84 6.126 6.658 -9.483 1769 3HD2 LEU 84 3HD2 LEU 84 6.931 6.872 -11.037 1770 H LYS 85 H LYS 85 5.199 0.782 -11.599 1771 HA LYS 85 HA LYS 85 2.439 1.668 -11.014 1772 1HB LYS 85 1HB LYS 85 3.405 0.423 -13.529 1773 2HB LYS 85 2HB LYS 85 1.919 -0.260 -12.869 1774 1HG LYS 85 1HG LYS 85 0.734 1.548 -13.513 1775 2HG LYS 85 2HG LYS 85 1.871 2.635 -12.716 1776 1HD LYS 85 1HD LYS 85 3.359 1.898 -14.853 1777 2HD LYS 85 2HD LYS 85 1.746 1.772 -15.554 1778 1HE LYS 85 1HE LYS 85 1.917 4.195 -13.991 1779 2HE LYS 85 2HE LYS 85 3.247 4.142 -15.163 1780 1HZ LYS 85 1HZ LYS 85 0.474 3.387 -15.888 1781 2HZ LYS 85 2HZ LYS 85 1.761 3.776 -16.925 1782 3HZ LYS 85 3HZ LYS 85 1.015 4.993 -16.004 1783 H ARG 86 H ARG 86 4.470 -1.203 -11.726 1784 HA ARG 86 HA ARG 86 3.235 -2.517 -9.326 1785 1HB ARG 86 1HB ARG 86 3.466 -3.281 -12.140 1786 2HB ARG 86 2HB ARG 86 4.147 -4.508 -11.073 1787 1HG ARG 86 1HG ARG 86 1.751 -3.661 -9.844 1788 2HG ARG 86 2HG ARG 86 1.370 -3.862 -11.554 1789 1HD ARG 86 1HD ARG 86 2.393 -6.141 -11.484 1790 2HD ARG 86 2HD ARG 86 2.662 -5.936 -9.743 1791 HE ARG 86 HE ARG 86 0.336 -6.232 -9.413 1792 1HH1 ARG 86 1HH1 ARG 86 1.023 -5.447 -12.734 1793 2HH1 ARG 86 2HH1 ARG 86 -0.612 -5.683 -13.243 1794 1HH2 ARG 86 1HH2 ARG 86 -1.780 -6.532 -10.098 1795 2HH2 ARG 86 2HH2 ARG 86 -2.189 -6.293 -11.763 1796 H MET 87 H MET 87 4.753 -2.922 -7.777 1797 HA MET 87 HA MET 87 7.628 -2.811 -8.506 1798 1HB MET 87 1HB MET 87 5.898 -2.456 -6.105 1799 2HB MET 87 2HB MET 87 7.525 -3.066 -5.806 1800 1HG MET 87 1HG MET 87 8.383 -1.151 -7.241 1801 2HG MET 87 2HG MET 87 6.747 -0.495 -7.203 1802 1HE MET 87 1HE MET 87 9.648 -1.879 -5.281 1803 2HE MET 87 2HE MET 87 8.437 -2.507 -4.162 1804 3HE MET 87 3HE MET 87 9.538 -1.230 -3.644 1805 H ARG 88 H ARG 88 9.090 -4.503 -7.830 1806 HA ARG 88 HA ARG 88 7.828 -7.105 -7.071 1807 1HB ARG 88 1HB ARG 88 9.690 -6.473 -9.386 1808 2HB ARG 88 2HB ARG 88 9.374 -8.117 -8.834 1809 1HG ARG 88 1HG ARG 88 7.032 -7.924 -9.349 1810 2HG ARG 88 2HG ARG 88 7.181 -6.191 -9.642 1811 1HD ARG 88 1HD ARG 88 8.792 -6.753 -11.531 1812 2HD ARG 88 2HD ARG 88 8.323 -8.450 -11.318 1813 HE ARG 88 HE ARG 88 6.641 -6.331 -12.435 1814 1HH1 ARG 88 1HH1 ARG 88 6.706 -9.367 -10.732 1815 2HH1 ARG 88 2HH1 ARG 88 5.112 -9.809 -11.235 1816 1HH2 ARG 88 1HH2 ARG 88 4.572 -6.928 -13.075 1817 2HH2 ARG 88 2HH2 ARG 88 3.911 -8.440 -12.551 1818 H ILE 89 H ILE 89 9.518 -8.665 -6.275 1819 HA ILE 89 HA ILE 89 11.962 -7.270 -5.239 1820 HB ILE 89 HB ILE 89 10.013 -9.134 -3.834 1821 1HG1 ILE 89 1HG1 ILE 89 10.787 -6.493 -2.724 1822 2HG1 ILE 89 2HG1 ILE 89 9.811 -6.450 -4.192 1823 1HG2 ILE 89 1HG2 ILE 89 12.732 -8.088 -3.029 1824 2HG2 ILE 89 2HG2 ILE 89 12.153 -9.754 -3.005 1825 3HG2 ILE 89 3HG2 ILE 89 11.539 -8.590 -1.830 1826 1HD1 ILE 89 1HD1 ILE 89 8.285 -6.469 -2.328 1827 2HD1 ILE 89 2HD1 ILE 89 9.135 -7.819 -1.575 1828 3HD1 ILE 89 3HD1 ILE 89 8.223 -8.071 -3.064 1829 H PHE 90 H PHE 90 13.396 -8.281 -6.694 1830 HA PHE 90 HA PHE 90 13.268 -11.216 -7.068 1831 1HB PHE 90 1HB PHE 90 14.679 -8.848 -8.262 1832 2HB PHE 90 2HB PHE 90 15.375 -10.449 -8.510 1833 HD1 PHE 90 HD1 PHE 90 13.919 -12.279 -9.510 1834 HD2 PHE 90 HD2 PHE 90 12.765 -8.142 -9.472 1835 HE1 PHE 90 HE1 PHE 90 12.249 -12.728 -11.287 1836 HE2 PHE 90 HE2 PHE 90 11.094 -8.591 -11.249 1837 HZ PHE 90 HZ PHE 90 10.836 -10.885 -12.157 1838 H THR 91 H THR 91 15.175 -12.553 -6.652 1839 HA THR 91 HA THR 91 16.726 -11.600 -4.287 1840 HB THR 91 HB THR 91 17.213 -14.153 -4.234 1841 HG1 THR 91 HG1 THR 91 15.736 -15.364 -5.441 1842 1HG2 THR 91 1HG2 THR 91 15.620 -14.031 -2.651 1843 2HG2 THR 91 2HG2 THR 91 14.380 -14.183 -3.896 1844 3HG2 THR 91 3HG2 THR 91 14.959 -12.587 -3.418 1845 H ILE 92 H ILE 92 18.211 -10.323 -5.678 1846 HA ILE 92 HA ILE 92 19.710 -11.270 -7.856 1847 HB ILE 92 HB ILE 92 21.371 -9.551 -7.049 1848 1HG1 ILE 92 1HG1 ILE 92 19.537 -8.928 -4.771 1849 2HG1 ILE 92 2HG1 ILE 92 20.691 -10.244 -4.562 1850 1HG2 ILE 92 1HG2 ILE 92 19.779 -7.658 -7.120 1851 2HG2 ILE 92 2HG2 ILE 92 18.445 -8.777 -6.841 1852 3HG2 ILE 92 3HG2 ILE 92 19.381 -8.875 -8.332 1853 1HD1 ILE 92 1HD1 ILE 92 21.161 -7.353 -4.657 1854 2HD1 ILE 92 2HD1 ILE 92 22.222 -8.257 -5.738 1855 3HD1 ILE 92 3HD1 ILE 92 22.188 -8.636 -4.016 1856 H LYS 93 H LYS 93 19.974 -12.130 -4.477 1857 HA LYS 93 HA LYS 93 22.257 -13.934 -5.175 1858 1HB LYS 93 1HB LYS 93 21.960 -12.167 -2.715 1859 2HB LYS 93 2HB LYS 93 23.298 -13.274 -3.019 1860 1HG LYS 93 1HG LYS 93 22.558 -10.995 -4.873 1861 2HG LYS 93 2HG LYS 93 23.784 -10.869 -3.614 1862 1HD LYS 93 1HD LYS 93 24.882 -12.923 -4.670 1863 2HD LYS 93 2HD LYS 93 23.795 -12.680 -6.038 1864 1HE LYS 93 1HE LYS 93 25.008 -10.909 -6.807 1865 2HE LYS 93 2HE LYS 93 25.171 -10.216 -5.183 1866 1HZ LYS 93 1HZ LYS 93 27.290 -11.095 -6.155 1867 2HZ LYS 93 2HZ LYS 93 26.615 -12.651 -6.091 1868 3HZ LYS 93 3HZ LYS 93 26.872 -11.778 -4.657 1869 HA PRO 94 HA PRO 94 19.610 -17.056 -3.428 1870 1HB PRO 94 1HB PRO 94 22.269 -18.062 -2.459 1871 2HB PRO 94 2HB PRO 94 20.946 -18.958 -3.233 1872 1HG PRO 94 1HG PRO 94 23.077 -18.259 -4.619 1873 2HG PRO 94 2HG PRO 94 21.466 -18.146 -5.334 1874 1HD PRO 94 1HD PRO 94 23.261 -15.982 -4.359 1875 2HD PRO 94 2HD PRO 94 22.083 -15.966 -5.689 1876 H ILE 95 H ILE 95 18.651 -17.293 -1.393 1877 HA ILE 95 HA ILE 95 20.047 -15.937 0.891 1878 HB ILE 95 HB ILE 95 17.114 -16.201 0.135 1879 1HG1 ILE 95 1HG1 ILE 95 18.686 -13.657 0.495 1880 2HG1 ILE 95 2HG1 ILE 95 18.747 -14.534 -1.033 1881 1HG2 ILE 95 1HG2 ILE 95 16.906 -14.519 2.102 1882 2HG2 ILE 95 2HG2 ILE 95 18.478 -15.138 2.606 1883 3HG2 ILE 95 3HG2 ILE 95 17.096 -16.227 2.496 1884 1HD1 ILE 95 1HD1 ILE 95 16.937 -13.151 -1.445 1885 2HD1 ILE 95 2HD1 ILE 95 16.449 -13.111 0.250 1886 3HD1 ILE 95 3HD1 ILE 95 16.103 -14.534 -0.735 1887 H ALA 96 H ALA 96 20.137 -17.045 2.845 1888 HA ALA 96 HA ALA 96 19.479 -19.924 2.784 1889 1HB ALA 96 1HB ALA 96 20.798 -19.881 4.892 1890 2HB ALA 96 2HB ALA 96 20.812 -18.118 4.839 1891 3HB ALA 96 3HB ALA 96 21.653 -19.044 3.596 1892 H ILE 97 H ILE 97 18.397 -20.869 4.772 1893 HA ILE 97 HA ILE 97 15.866 -19.561 5.281 1894 HB ILE 97 HB ILE 97 17.286 -21.929 6.559 1895 1HG1 ILE 97 1HG1 ILE 97 15.083 -22.625 4.870 1896 2HG1 ILE 97 2HG1 ILE 97 16.138 -21.532 3.975 1897 1HG2 ILE 97 1HG2 ILE 97 14.847 -20.583 7.262 1898 2HG2 ILE 97 2HG2 ILE 97 15.553 -22.026 7.990 1899 3HG2 ILE 97 3HG2 ILE 97 14.454 -22.178 6.619 1900 1HD1 ILE 97 1HD1 ILE 97 16.557 -24.243 4.269 1901 2HD1 ILE 97 2HD1 ILE 97 17.595 -23.563 5.523 1902 3HD1 ILE 97 3HD1 ILE 97 17.802 -23.068 3.843 1903 H GLY 98 H GLY 98 15.434 -18.065 6.851 1904 1HA GLY 98 1HA GLY 98 15.503 -17.239 9.117 1905 2HA GLY 98 2HA GLY 98 17.020 -18.104 9.358 1906 H GLU 99 H GLU 99 16.605 -16.247 6.451 1907 HA GLU 99 HA GLU 99 18.717 -14.370 7.389 1908 1HB GLU 99 1HB GLU 99 18.101 -15.854 5.046 1909 2HB GLU 99 2HB GLU 99 17.908 -14.158 4.616 1910 1HG GLU 99 1HG GLU 99 20.332 -15.065 6.155 1911 2HG GLU 99 2HG GLU 99 20.271 -15.264 4.405 1912 H GLU 100 H GLU 100 18.339 -12.115 6.037 1913 HA GLU 100 HA GLU 100 15.513 -11.258 6.573 1914 1HB GLU 100 1HB GLU 100 17.279 -10.561 8.261 1915 2HB GLU 100 2HB GLU 100 18.058 -9.646 6.970 1916 1HG GLU 100 1HG GLU 100 15.764 -8.521 6.625 1917 2HG GLU 100 2HG GLU 100 15.327 -9.208 8.190 1918 H ILE 101 H ILE 101 14.566 -10.466 4.741 1919 HA ILE 101 HA ILE 101 16.242 -9.824 2.394 1920 HB ILE 101 HB ILE 101 13.251 -10.017 2.904 1921 1HG1 ILE 101 1HG1 ILE 101 15.200 -11.841 1.464 1922 2HG1 ILE 101 2HG1 ILE 101 14.487 -12.145 3.049 1923 1HG2 ILE 101 1HG2 ILE 101 14.593 -8.711 0.785 1924 2HG2 ILE 101 2HG2 ILE 101 12.883 -9.131 0.866 1925 3HG2 ILE 101 3HG2 ILE 101 14.032 -10.251 0.134 1926 1HD1 ILE 101 1HD1 ILE 101 12.844 -13.216 1.910 1927 2HD1 ILE 101 2HD1 ILE 101 13.316 -12.485 0.376 1928 3HD1 ILE 101 3HD1 ILE 101 12.272 -11.602 1.489 1929 H THR 102 H THR 102 16.705 -7.774 1.771 1930 HA THR 102 HA THR 102 14.961 -5.505 2.508 1931 HB THR 102 HB THR 102 16.890 -4.346 3.606 1932 HG1 THR 102 HG1 THR 102 18.143 -6.879 3.498 1933 1HG2 THR 102 1HG2 THR 102 16.727 -5.491 5.687 1934 2HG2 THR 102 2HG2 THR 102 16.470 -7.046 4.896 1935 3HG2 THR 102 3HG2 THR 102 15.204 -5.818 4.860 1936 H ILE 103 H ILE 103 16.650 -3.432 1.793 1937 HA ILE 103 HA ILE 103 17.942 -4.161 -0.780 1938 HB ILE 103 HB ILE 103 16.520 -2.579 -2.012 1939 1HG1 ILE 103 1HG1 ILE 103 14.428 -2.068 -0.173 1940 2HG1 ILE 103 2HG1 ILE 103 15.929 -1.654 0.652 1941 1HG2 ILE 103 1HG2 ILE 103 14.722 -4.333 -0.324 1942 2HG2 ILE 103 2HG2 ILE 103 15.766 -4.973 -1.594 1943 3HG2 ILE 103 3HG2 ILE 103 14.479 -3.837 -1.999 1944 1HD1 ILE 103 1HD1 ILE 103 15.470 0.335 -0.475 1945 2HD1 ILE 103 2HD1 ILE 103 14.763 -0.496 -1.861 1946 3HD1 ILE 103 3HD1 ILE 103 16.513 -0.484 -1.639 1947 H SER 104 H SER 104 18.372 -1.646 -1.790 1948 HA SER 104 HA SER 104 20.067 -0.402 0.329 1949 1HB SER 104 1HB SER 104 20.820 -1.309 -2.017 1950 2HB SER 104 2HB SER 104 20.122 0.189 -2.632 1951 HG SER 104 HG SER 104 22.460 0.101 -1.923 1952 H TYR 105 H TYR 105 20.256 2.075 -1.330 1953 HA TYR 105 HA TYR 105 17.502 3.187 -0.991 1954 1HB TYR 105 1HB TYR 105 20.111 4.009 0.278 1955 2HB TYR 105 2HB TYR 105 18.840 5.206 0.025 1956 HD1 TYR 105 HD1 TYR 105 16.521 4.741 0.966 1957 HD2 TYR 105 HD2 TYR 105 19.982 2.445 2.054 1958 HE1 TYR 105 HE1 TYR 105 15.333 3.906 2.977 1959 HE2 TYR 105 HE2 TYR 105 18.795 1.609 4.063 1960 HH TYR 105 HH TYR 105 15.836 1.452 4.516 1961 H GLY 106 H GLY 106 20.469 5.032 -1.576 1962 1HA GLY 106 1HA GLY 106 20.396 5.022 -4.424 1963 2HA GLY 106 2HA GLY 106 19.414 6.369 -3.849 1964 H ASP 107 H ASP 107 20.660 8.171 -4.125 1965 HA ASP 107 HA ASP 107 23.539 8.037 -3.314 1966 1HB ASP 107 1HB ASP 107 22.013 9.168 -5.511 1967 2HB ASP 107 2HB ASP 107 22.955 10.425 -4.709 1968 H ASP 108 H ASP 108 20.585 9.054 -2.089 1969 HA ASP 108 HA ASP 108 21.946 11.110 -0.396 1970 1HB ASP 108 1HB ASP 108 20.014 11.519 -2.430 1971 2HB ASP 108 2HB ASP 108 19.159 11.725 -0.901 1972 H TYR 109 H TYR 109 19.134 8.944 -0.791 1973 HA TYR 109 HA TYR 109 18.146 9.203 1.888 1974 1HB TYR 109 1HB TYR 109 17.643 7.724 -0.534 1975 2HB TYR 109 2HB TYR 109 17.596 6.611 0.833 1976 HD1 TYR 109 HD1 TYR 109 15.315 6.227 1.282 1977 HD2 TYR 109 HD2 TYR 109 16.702 10.241 0.641 1978 HE1 TYR 109 HE1 TYR 109 13.083 7.099 1.915 1979 HE2 TYR 109 HE2 TYR 109 14.468 11.113 1.274 1980 HH TYR 109 HH TYR 109 11.806 9.547 1.232 1981 H TRP 110 H TRP 110 19.576 8.839 3.557 1982 HA TRP 110 HA TRP 110 21.008 7.662 5.005 1983 1HB TRP 110 1HB TRP 110 19.277 5.686 3.590 1984 2HB TRP 110 2HB TRP 110 20.634 5.034 4.510 1985 HD1 TRP 110 HD1 TRP 110 17.430 7.084 4.933 1986 HE1 TRP 110 HE1 TRP 110 16.760 7.066 7.422 1987 HE3 TRP 110 HE3 TRP 110 21.503 4.734 6.926 1988 HZ2 TRP 110 HZ2 TRP 110 17.813 6.173 9.928 1989 HZ3 TRP 110 HZ3 TRP 110 21.643 4.313 9.364 1990 HH2 TRP 110 HH2 TRP 110 19.805 5.028 10.866 1991 H LEU 111 H LEU 111 21.269 5.180 2.493 1992 HA LEU 111 HA LEU 111 24.035 4.882 2.573 1993 1HB LEU 111 1HB LEU 111 22.075 3.668 1.296 1994 2HB LEU 111 2HB LEU 111 22.524 4.742 -0.029 1995 HG LEU 111 HG LEU 111 24.804 3.419 1.297 1996 1HD1 LEU 111 1HD1 LEU 111 22.490 1.881 0.331 1997 2HD1 LEU 111 2HD1 LEU 111 23.846 1.361 1.331 1998 3HD1 LEU 111 3HD1 LEU 111 24.014 1.416 -0.424 1999 1HD2 LEU 111 1HD2 LEU 111 24.300 3.102 -1.593 2000 2HD2 LEU 111 2HD2 LEU 111 25.728 3.717 -0.761 2001 3HD2 LEU 111 3HD2 LEU 111 24.347 4.777 -1.042 2002 H SER 112 H SER 112 25.574 5.442 0.691 2003 HA SER 112 HA SER 112 26.773 7.078 -0.505 2004 1HB SER 112 1HB SER 112 24.476 6.868 -1.706 2005 2HB SER 112 2HB SER 112 24.087 8.401 -0.927 2006 HG SER 112 HG SER 112 25.860 7.837 -2.970 2007 H ARG 113 H ARG 113 26.928 7.543 2.177 2008 HA ARG 113 HA ARG 113 27.522 10.305 2.373 2009 1HB ARG 113 1HB ARG 113 24.738 9.664 2.637 2010 2HB ARG 113 2HB ARG 113 25.325 10.235 4.199 2011 1HG ARG 113 1HG ARG 113 26.126 11.731 1.729 2012 2HG ARG 113 2HG ARG 113 24.497 11.960 2.366 2013 1HD ARG 113 1HD ARG 113 25.511 13.531 3.701 2014 2HD ARG 113 2HD ARG 113 26.015 12.126 4.659 2015 HE ARG 113 HE ARG 113 28.203 12.431 3.816 2016 1HH1 ARG 113 1HH1 ARG 113 25.870 14.024 1.781 2017 2HH1 ARG 113 2HH1 ARG 113 27.077 14.734 0.766 2018 1HH2 ARG 113 1HH2 ARG 113 29.750 13.364 2.483 2019 2HH2 ARG 113 2HH2 ARG 113 29.257 14.365 1.158 2020 HA PRO 114 HA PRO 114 27.767 8.435 6.716 2021 1HB PRO 114 1HB PRO 114 26.447 6.107 7.279 2022 2HB PRO 114 2HB PRO 114 25.661 7.695 7.372 2023 1HG PRO 114 1HG PRO 114 25.501 5.615 5.250 2024 2HG PRO 114 2HG PRO 114 24.245 6.697 5.866 2025 1HD PRO 114 1HD PRO 114 25.629 7.080 3.515 2026 2HD PRO 114 2HD PRO 114 24.816 8.360 4.431 2027 H ARG 115 H ARG 115 28.530 6.920 3.894 2028 HA ARG 115 HA ARG 115 30.175 5.340 3.292 2029 1HB ARG 115 1HB ARG 115 30.915 6.631 5.804 2030 2HB ARG 115 2HB ARG 115 31.585 5.002 5.701 2031 1HG ARG 115 1HG ARG 115 33.235 6.195 4.589 2032 2HG ARG 115 2HG ARG 115 32.190 5.772 3.233 2033 1HD ARG 115 1HD ARG 115 31.017 8.098 4.120 2034 2HD ARG 115 2HD ARG 115 32.736 8.419 4.417 2035 HE ARG 115 HE ARG 115 32.532 7.181 1.873 2036 1HH1 ARG 115 1HH1 ARG 115 31.557 10.123 3.458 2037 2HH1 ARG 115 2HH1 ARG 115 31.597 11.051 1.999 2038 1HH2 ARG 115 1HH2 ARG 115 32.577 8.407 -0.007 2039 2HH2 ARG 115 2HH2 ARG 115 32.170 10.089 0.052 2040 H LEU 116 H LEU 116 30.965 3.072 3.883 2041 HA LEU 116 HA LEU 116 28.894 1.655 5.530 2042 1HB LEU 116 1HB LEU 116 29.835 1.398 2.765 2043 2HB LEU 116 2HB LEU 116 29.901 -0.134 3.637 2044 HG LEU 116 HG LEU 116 27.704 0.153 2.563 2045 1HD1 LEU 116 1HD1 LEU 116 28.164 -0.222 5.391 2046 2HD1 LEU 116 2HD1 LEU 116 26.981 -1.012 4.349 2047 3HD1 LEU 116 3HD1 LEU 116 26.585 0.519 5.130 2048 1HD2 LEU 116 1HD2 LEU 116 28.023 2.807 3.071 2049 2HD2 LEU 116 2HD2 LEU 116 26.922 2.362 4.375 2050 3HD2 LEU 116 3HD2 LEU 116 26.466 2.068 2.697 2051 H THR 117 H THR 117 29.756 0.517 7.211 2052 HA THR 117 HA THR 117 32.378 -0.810 6.948 2053 HB THR 117 HB THR 117 31.826 1.412 8.953 2054 HG1 THR 117 HG1 THR 117 33.310 2.551 7.768 2055 1HG2 THR 117 1HG2 THR 117 34.569 0.746 8.837 2056 2HG2 THR 117 2HG2 THR 117 33.702 -0.786 8.942 2057 3HG2 THR 117 3HG2 THR 117 33.457 0.453 10.174 2058 H GLN 118 H GLN 118 31.375 -2.785 7.488 2059 HA GLN 118 HA GLN 118 30.443 -4.432 8.898 2060 1HB GLN 118 1HB GLN 118 32.376 -3.354 10.245 2061 2HB GLN 118 2HB GLN 118 31.113 -2.496 11.127 2062 1HG GLN 118 1HG GLN 118 30.439 -5.300 10.894 2063 2HG GLN 118 2HG GLN 118 32.041 -5.117 11.608 2064 1HE2 GLN 118 1HE2 GLN 118 31.855 -2.854 13.150 2065 2HE2 GLN 118 2HE2 GLN 118 30.627 -3.004 14.312 2066 H ASN 119 H ASN 119 28.227 -4.435 8.532 2067 HA ASN 119 HA ASN 119 25.942 -3.944 8.873 2068 1HB ASN 119 1HB ASN 119 27.425 -3.624 11.427 2069 2HB ASN 119 2HB ASN 119 25.814 -2.906 11.400 2070 1HD2 ASN 119 1HD2 ASN 119 24.230 -4.608 10.033 2071 2HD2 ASN 119 2HD2 ASN 119 24.282 -6.183 10.665 2072 1H GLY 201 1H GLY 201 30.045 22.667 -2.345 2073 2H GLY 201 2H GLY 201 31.314 23.454 -3.153 2074 3H GLY 201 3H GLY 201 29.970 22.892 -4.027 2075 1HA GLY 201 1HA GLY 201 30.224 25.412 -3.312 2076 2HA GLY 201 2HA GLY 201 28.656 24.616 -3.441 2077 H LYS 202 H LYS 202 28.331 23.157 -1.257 2078 HA LYS 202 HA LYS 202 27.761 23.324 1.031 2079 1HB LYS 202 1HB LYS 202 30.558 24.183 0.600 2080 2HB LYS 202 2HB LYS 202 29.868 24.722 2.131 2081 1HG LYS 202 1HG LYS 202 29.026 22.242 2.310 2082 2HG LYS 202 2HG LYS 202 30.295 21.920 1.129 2083 1HD LYS 202 1HD LYS 202 31.830 23.266 2.735 2084 2HD LYS 202 2HD LYS 202 30.562 23.002 3.931 2085 1HE LYS 202 1HE LYS 202 31.115 20.801 4.179 2086 2HE LYS 202 2HE LYS 202 31.317 20.571 2.432 2087 1HZ LYS 202 1HZ LYS 202 33.216 21.937 4.274 2088 2HZ LYS 202 2HZ LYS 202 33.396 21.859 2.587 2089 3HZ LYS 202 3HZ LYS 202 33.460 20.437 3.514 2090 H ALA 203 H ALA 203 26.271 25.133 -0.266 2091 HA ALA 203 HA ALA 203 26.342 27.507 1.531 2092 1HB ALA 203 1HB ALA 203 26.958 28.903 -0.152 2093 2HB ALA 203 2HB ALA 203 25.735 28.227 -1.228 2094 3HB ALA 203 3HB ALA 203 27.321 27.467 -1.109 2095 HA PRO 204 HA PRO 204 21.959 27.374 1.539 2096 1HB PRO 204 1HB PRO 204 21.720 30.015 0.188 2097 2HB PRO 204 2HB PRO 204 21.122 29.511 1.779 2098 1HG PRO 204 1HG PRO 204 23.236 31.143 1.481 2099 2HG PRO 204 2HG PRO 204 23.100 29.995 2.819 2100 1HD PRO 204 1HD PRO 204 24.800 29.874 0.386 2101 2HD PRO 204 2HD PRO 204 25.103 29.238 2.017 2102 H ARG 205 H ARG 205 22.635 29.268 -1.432 2103 HA ARG 205 HA ARG 205 21.897 28.922 -3.649 2104 1HB ARG 205 1HB ARG 205 22.410 26.142 -2.552 2105 2HB ARG 205 2HB ARG 205 22.043 26.430 -4.252 2106 1HG ARG 205 1HG ARG 205 23.985 27.883 -4.472 2107 2HG ARG 205 2HG ARG 205 24.314 27.760 -2.744 2108 1HD ARG 205 1HD ARG 205 25.792 26.164 -3.676 2109 2HD ARG 205 2HD ARG 205 24.395 25.170 -3.219 2110 HE ARG 205 HE ARG 205 23.934 26.217 -5.831 2111 1HH1 ARG 205 1HH1 ARG 205 26.022 23.981 -4.172 2112 2HH1 ARG 205 2HH1 ARG 205 26.256 22.991 -5.571 2113 1HH2 ARG 205 1HH2 ARG 205 24.253 24.917 -7.633 2114 2HH2 ARG 205 2HH2 ARG 205 25.264 23.515 -7.516 2115 H LYS 206 H LYS 206 19.865 28.946 -1.374 2116 HA LYS 206 HA LYS 206 17.749 27.125 -2.349 2117 1HB LYS 206 1HB LYS 206 18.395 27.843 0.092 2118 2HB LYS 206 2HB LYS 206 17.473 29.301 -0.274 2119 1HG LYS 206 1HG LYS 206 15.921 27.094 -1.167 2120 2HG LYS 206 2HG LYS 206 16.492 26.699 0.454 2121 1HD LYS 206 1HD LYS 206 15.095 29.275 -0.336 2122 2HD LYS 206 2HD LYS 206 14.347 27.934 0.532 2123 1HE LYS 206 1HE LYS 206 15.235 28.626 2.506 2124 2HE LYS 206 2HE LYS 206 16.850 28.790 1.790 2125 1HZ LYS 206 1HZ LYS 206 15.983 30.833 0.664 2126 2HZ LYS 206 2HZ LYS 206 16.106 30.968 2.352 2127 3HZ LYS 206 3HZ LYS 206 14.590 30.716 1.629 2128 H GLN 207 H GLN 207 17.369 28.064 -4.474 2129 HA GLN 207 HA GLN 207 15.722 30.546 -4.351 2130 1HB GLN 207 1HB GLN 207 18.243 30.846 -4.966 2131 2HB GLN 207 2HB GLN 207 17.800 30.095 -6.500 2132 1HG GLN 207 1HG GLN 207 15.831 31.892 -6.389 2133 2HG GLN 207 2HG GLN 207 16.998 32.749 -5.382 2134 1HE2 GLN 207 1HE2 GLN 207 17.212 30.783 -8.415 2135 2HE2 GLN 207 2HE2 GLN 207 18.158 31.917 -9.251 2136 H LEU 208 H LEU 208 13.920 29.060 -4.721 2137 HA LEU 208 HA LEU 208 12.410 27.864 -6.089 2138 1HB LEU 208 1HB LEU 208 12.903 30.102 -7.281 2139 2HB LEU 208 2HB LEU 208 13.962 29.171 -8.340 2140 HG LEU 208 HG LEU 208 11.936 27.616 -8.699 2141 1HD1 LEU 208 1HD1 LEU 208 9.741 28.708 -8.344 2142 2HD1 LEU 208 2HD1 LEU 208 10.551 30.062 -7.558 2143 3HD1 LEU 208 3HD1 LEU 208 10.591 28.461 -6.819 2144 1HD2 LEU 208 1HD2 LEU 208 10.917 29.273 -10.348 2145 2HD2 LEU 208 2HD2 LEU 208 12.659 29.033 -10.492 2146 3HD2 LEU 208 3HD2 LEU 208 12.030 30.474 -9.692 2147 H ALA 209 H ALA 209 15.119 26.661 -5.470 2148 HA ALA 209 HA ALA 209 15.017 24.545 -7.559 2149 1HB ALA 209 1HB ALA 209 17.255 24.860 -8.196 2150 2HB ALA 209 2HB ALA 209 17.666 25.687 -6.694 2151 3HB ALA 209 3HB ALA 209 16.731 26.523 -7.934 2152 H THR 210 H THR 210 14.021 23.615 -5.457 2153 HA THR 210 HA THR 210 16.171 22.707 -3.576 2154 HB THR 210 HB THR 210 14.224 22.366 -2.035 2155 HG1 THR 210 HG1 THR 210 12.249 22.614 -2.745 2156 1HG2 THR 210 1HG2 THR 210 14.970 24.962 -3.259 2157 2HG2 THR 210 2HG2 THR 210 15.015 24.460 -1.568 2158 3HG2 THR 210 3HG2 THR 210 13.492 24.969 -2.298 2159 H LYS 211 H LYS 211 16.846 20.857 -4.785 2160 HA LYS 211 HA LYS 211 15.075 18.951 -5.991 2161 1HB LYS 211 1HB LYS 211 17.803 19.470 -5.793 2162 2HB LYS 211 2HB LYS 211 17.627 17.934 -4.944 2163 1HG LYS 211 1HG LYS 211 16.232 17.169 -6.965 2164 2HG LYS 211 2HG LYS 211 16.868 18.590 -7.795 2165 1HD LYS 211 1HD LYS 211 19.027 17.761 -7.847 2166 2HD LYS 211 2HD LYS 211 18.809 16.809 -6.379 2167 1HE LYS 211 1HE LYS 211 18.534 15.010 -7.744 2168 2HE LYS 211 2HE LYS 211 16.975 15.718 -8.208 2169 1HZ LYS 211 1HZ LYS 211 19.626 16.158 -9.477 2170 2HZ LYS 211 2HZ LYS 211 18.281 17.148 -9.788 2171 3HZ LYS 211 3HZ LYS 211 18.233 15.499 -10.193 2172 H ALA 212 H ALA 212 15.637 16.482 -5.029 2173 HA ALA 212 HA ALA 212 15.362 16.308 -2.120 2174 1HB ALA 212 1HB ALA 212 13.006 15.104 -2.724 2175 2HB ALA 212 2HB ALA 212 13.053 16.311 -4.009 2176 3HB ALA 212 3HB ALA 212 13.117 16.817 -2.320 2177 H ALA 213 H ALA 213 14.089 14.348 -4.833 2178 HA ALA 213 HA ALA 213 14.534 12.105 -5.424 2179 1HB ALA 213 1HB ALA 213 16.844 11.735 -5.767 2180 2HB ALA 213 2HB ALA 213 17.293 12.621 -4.310 2181 3HB ALA 213 3HB ALA 213 16.736 13.496 -5.736 2182 H ARG 214 H ARG 214 13.156 11.319 -3.625 2183 HA ARG 214 HA ARG 214 14.183 10.764 -1.001 2184 1HB ARG 214 1HB ARG 214 11.917 9.670 -2.695 2185 2HB ARG 214 2HB ARG 214 12.150 9.204 -1.010 2186 1HG ARG 214 1HG ARG 214 11.250 11.138 -0.277 2187 2HG ARG 214 2HG ARG 214 12.303 12.089 -1.326 2188 1HD ARG 214 1HD ARG 214 10.572 11.062 -3.171 2189 2HD ARG 214 2HD ARG 214 9.503 11.217 -1.763 2190 HE ARG 214 HE ARG 214 11.017 13.581 -1.835 2191 1HH1 ARG 214 1HH1 ARG 214 8.795 11.906 -3.926 2192 2HH1 ARG 214 2HH1 ARG 214 8.226 13.360 -4.669 2193 1HH2 ARG 214 1HH2 ARG 214 10.262 15.456 -2.815 2194 2HH2 ARG 214 2HH2 ARG 214 9.048 15.355 -4.047 2195 1HN MLZ 215 1HN MLZ 215 13.058 8.084 -3.032 2196 HA MLZ 215 HA MLZ 215 15.475 6.546 -2.221 2197 1HB MLZ 215 1HB MLZ 215 12.690 6.057 -2.468 2198 2HB MLZ 215 2HB MLZ 215 13.469 5.089 -3.719 2199 1HG MLZ 215 1HG MLZ 215 14.863 5.027 -1.126 2200 2HG MLZ 215 2HG MLZ 215 14.435 3.699 -2.203 2201 1HD MLZ 215 1HD MLZ 215 12.112 4.975 -0.929 2202 2HD MLZ 215 2HD MLZ 215 12.511 3.263 -1.080 2203 1HE MLZ 215 1HE MLZ 215 13.193 5.181 1.107 2204 2HE MLZ 215 2HE MLZ 215 14.402 3.947 0.705 2205 HZ MLZ 215 HZ MLZ 215 12.692 2.256 0.857 2206 1HCM MLZ 215 1HCM MLZ 215 13.607 2.339 2.908 2207 2HCM MLZ 215 2HCM MLZ 215 11.972 2.854 3.321 2208 3HCM MLZ 215 3HCM MLZ 215 13.241 4.055 3.086 2209 H SER 216 H SER 216 17.121 6.453 -3.692 2210 HA SER 216 HA SER 216 18.234 6.269 -5.770 2211 1HB SER 216 1HB SER 216 16.596 7.866 -7.395 2212 2HB SER 216 2HB SER 216 16.290 8.451 -5.760 2213 HG SER 216 HG SER 216 18.288 9.104 -7.212 2214 H ALA 217 H ALA 217 16.072 4.287 -5.214 2215 HA ALA 217 HA ALA 217 14.982 2.552 -6.387 2216 1HB ALA 217 1HB ALA 217 14.233 5.157 -7.620 2217 2HB ALA 217 2HB ALA 217 13.199 3.901 -6.941 2218 3HB ALA 217 3HB ALA 217 13.850 3.722 -8.570 2219 HA PRO 218 HA PRO 218 17.503 0.986 -9.610 2220 1HB PRO 218 1HB PRO 218 15.216 0.438 -11.409 2221 2HB PRO 218 2HB PRO 218 16.331 -0.703 -10.638 2222 1HG PRO 218 1HG PRO 218 13.760 -0.428 -9.875 2223 2HG PRO 218 2HG PRO 218 15.052 -0.879 -8.755 2224 1HD PRO 218 1HD PRO 218 13.660 1.731 -9.090 2225 2HD PRO 218 2HD PRO 218 14.301 0.968 -7.620 2226 H ALA 219 H ALA 219 17.494 1.058 -12.319 2227 HA ALA 219 HA ALA 219 17.665 3.953 -12.900 2228 1HB ALA 219 1HB ALA 219 19.310 1.926 -13.420 2229 2HB ALA 219 2HB ALA 219 19.151 3.257 -14.566 2230 3HB ALA 219 3HB ALA 219 18.285 1.746 -14.844 2231 H THR 220 H THR 220 16.618 4.875 -14.794 2232 HA THR 220 HA THR 220 14.486 3.268 -16.094 2233 HB THR 220 HB THR 220 13.480 4.165 -14.042 2234 HG1 THR 220 HG1 THR 220 12.676 5.858 -16.151 2235 1HG2 THR 220 1HG2 THR 220 15.045 6.524 -14.846 2236 2HG2 THR 220 2HG2 THR 220 14.501 6.029 -13.243 2237 3HG2 THR 220 3HG2 THR 220 13.408 6.905 -14.314 2238 H GLY 221 H GLY 221 16.545 3.999 -17.580 2239 1HA GLY 221 1HA GLY 221 15.469 5.911 -19.455 2240 2HA GLY 221 2HA GLY 221 16.818 6.609 -18.559 2241 1HN SAH 301 1HN SAH 301 -12.230 -0.780 -8.653 2242 2HN SAH 301 2HN SAH 301 -11.633 0.146 -9.949 2243 HA SAH 301 HA SAH 301 -11.993 2.143 -8.319 2244 1HB SAH 301 1HB SAH 301 -11.994 -0.392 -6.675 2245 2HB SAH 301 2HB SAH 301 -11.442 1.131 -5.982 2246 1HG SAH 301 1HG SAH 301 -13.938 0.537 -5.687 2247 2HG SAH 301 2HG SAH 301 -14.098 0.921 -7.401 2248 1H5* SAH 301 1H5* SAH 301 -15.793 2.448 -6.928 2249 2H5* SAH 301 2H5* SAH 301 -15.528 4.166 -6.633 2250 H4* SAH 301 H4* SAH 301 -13.755 3.846 -8.523 2251 H3* SAH 301 H3* SAH 301 -16.474 4.759 -8.317 2252 *HO3 SAH 301 *HO3 SAH 301 -14.135 5.358 -9.609 2253 H2* SAH 301 H2* SAH 301 -17.535 3.606 -9.914 2254 *HO2 SAH 301 *HO2 SAH 301 -16.446 3.598 -12.091 2255 H1* SAH 301 H1* SAH 301 -15.444 2.035 -11.105 2256 H8 SAH 301 H8 SAH 301 -16.338 0.397 -7.992 2257 1HN6 SAH 301 1HN6 SAH 301 -21.775 -1.255 -10.113 2258 2HN6 SAH 301 2HN6 SAH 301 -21.103 -0.742 -8.581 2259 H2 SAH 301 H2 SAH 301 -20.042 1.803 -13.013 2260 1HN SAH 302 1HN SAH 302 12.289 -0.757 8.657 2261 2HN SAH 302 2HN SAH 302 11.703 0.165 9.958 2262 HA SAH 302 HA SAH 302 12.046 2.163 8.330 2263 1HB SAH 302 1HB SAH 302 12.043 -0.373 6.684 2264 2HB SAH 302 2HB SAH 302 11.482 1.150 5.993 2265 1HG SAH 302 1HG SAH 302 13.978 0.563 5.683 2266 2HG SAH 302 2HG SAH 302 14.148 0.945 7.396 2267 1H5* SAH 302 1H5* SAH 302 15.836 2.476 6.914 2268 2H5* SAH 302 2H5* SAH 302 15.566 4.194 6.621 2269 H4* SAH 302 H4* SAH 302 13.805 3.870 8.522 2270 H3* SAH 302 H3* SAH 302 16.521 4.789 8.299 2271 *HO3 SAH 302 *HO3 SAH 302 14.189 5.382 9.604 2272 H2* SAH 302 H2* SAH 302 17.595 3.637 9.889 2273 *HO2 SAH 302 *HO2 SAH 302 16.520 3.626 12.072 2274 H1* SAH 302 H1* SAH 302 15.514 2.061 11.092 2275 H8 SAH 302 H8 SAH 302 16.391 0.425 7.972 2276 1HN6 SAH 302 1HN6 SAH 302 21.846 -1.213 10.060 2277 2HN6 SAH 302 2HN6 SAH 302 21.164 -0.703 8.532 2278 H2 SAH 302 H2 SAH 302 20.125 1.839 12.971 Start of MODEL 13 1 1H MET 1 1H MET 1 -0.311 -11.137 -7.318 2 2H MET 1 2H MET 1 -0.811 -12.435 -8.292 3 3H MET 1 3H MET 1 -1.290 -12.360 -6.664 4 HA MET 1 HA MET 1 -2.464 -10.208 -7.234 5 1HB MET 1 1HB MET 1 -1.355 -11.224 -9.826 6 2HB MET 1 2HB MET 1 -2.918 -10.410 -9.870 7 1HG MET 1 1HG MET 1 -0.457 -9.242 -8.541 8 2HG MET 1 2HG MET 1 -0.936 -8.875 -10.199 9 1HE MET 1 1HE MET 1 -0.415 -7.381 -7.478 10 2HE MET 1 2HE MET 1 -1.637 -7.985 -6.359 11 3HE MET 1 3HE MET 1 -1.738 -6.333 -6.967 12 H PHE 2 H PHE 2 -2.455 -13.495 -8.563 13 HA PHE 2 HA PHE 2 -5.395 -13.650 -7.979 14 1HB PHE 2 1HB PHE 2 -5.369 -15.300 -9.954 15 2HB PHE 2 2HB PHE 2 -5.128 -13.603 -10.362 16 HD1 PHE 2 HD1 PHE 2 -3.601 -16.926 -10.236 17 HD2 PHE 2 HD2 PHE 2 -2.859 -12.747 -10.896 18 HE1 PHE 2 HE1 PHE 2 -1.421 -17.477 -11.284 19 HE2 PHE 2 HE2 PHE 2 -0.680 -13.297 -11.943 20 HZ PHE 2 HZ PHE 2 0.038 -15.661 -12.137 21 H ASN 3 H ASN 3 -5.520 -14.921 -6.170 22 HA ASN 3 HA ASN 3 -3.811 -17.385 -6.060 23 1HB ASN 3 1HB ASN 3 -3.340 -15.702 -4.325 24 2HB ASN 3 2HB ASN 3 -5.046 -15.658 -3.881 25 1HD2 ASN 3 1HD2 ASN 3 -2.097 -17.091 -3.060 26 2HD2 ASN 3 2HD2 ASN 3 -2.693 -18.433 -2.209 27 H ASP 4 H ASP 4 -4.862 -19.334 -5.372 28 HA ASP 4 HA ASP 4 -7.408 -19.932 -6.322 29 1HB ASP 4 1HB ASP 4 -7.240 -21.879 -4.791 30 2HB ASP 4 2HB ASP 4 -5.684 -21.538 -5.547 31 H ARG 5 H ARG 5 -6.570 -18.378 -3.274 32 HA ARG 5 HA ARG 5 -9.189 -18.728 -2.048 33 1HB ARG 5 1HB ARG 5 -6.600 -17.355 -1.538 34 2HB ARG 5 2HB ARG 5 -8.008 -16.643 -0.750 35 1HG ARG 5 1HG ARG 5 -8.269 -19.435 -0.420 36 2HG ARG 5 2HG ARG 5 -6.580 -19.065 -0.072 37 1HD ARG 5 1HD ARG 5 -7.537 -17.108 1.367 38 2HD ARG 5 2HD ARG 5 -9.057 -18.020 1.299 39 HE ARG 5 HE ARG 5 -8.058 -19.670 2.673 40 1HH1 ARG 5 1HH1 ARG 5 -5.639 -17.615 1.242 41 2HH1 ARG 5 2HH1 ARG 5 -4.346 -18.324 2.145 42 1HH2 ARG 5 1HH2 ARG 5 -6.362 -20.574 3.833 43 2HH2 ARG 5 2HH2 ARG 5 -4.749 -19.986 3.602 44 H VAL 6 H VAL 6 -7.522 -15.991 -3.650 45 HA VAL 6 HA VAL 6 -10.146 -14.913 -4.498 46 HB VAL 6 HB VAL 6 -9.618 -12.723 -3.400 47 1HG1 VAL 6 1HG1 VAL 6 -9.512 -14.949 -1.356 48 2HG1 VAL 6 2HG1 VAL 6 -10.967 -14.602 -2.290 49 3HG1 VAL 6 3HG1 VAL 6 -10.298 -13.377 -1.211 50 1HG2 VAL 6 1HG2 VAL 6 -7.250 -14.324 -2.422 51 2HG2 VAL 6 2HG2 VAL 6 -7.821 -12.895 -1.562 52 3HG2 VAL 6 3HG2 VAL 6 -7.250 -12.754 -3.224 53 H ILE 7 H ILE 7 -9.886 -13.255 -6.157 54 HA ILE 7 HA ILE 7 -7.106 -13.059 -7.268 55 HB ILE 7 HB ILE 7 -8.520 -14.696 -8.480 56 1HG1 ILE 7 1HG1 ILE 7 -8.299 -12.171 -10.133 57 2HG1 ILE 7 2HG1 ILE 7 -6.892 -13.130 -9.675 58 1HG2 ILE 7 1HG2 ILE 7 -10.712 -14.319 -8.833 59 2HG2 ILE 7 2HG2 ILE 7 -10.361 -12.809 -9.674 60 3HG2 ILE 7 3HG2 ILE 7 -10.544 -12.820 -7.921 61 1HD1 ILE 7 1HD1 ILE 7 -9.104 -14.721 -10.790 62 2HD1 ILE 7 2HD1 ILE 7 -7.383 -14.768 -11.170 63 3HD1 ILE 7 3HD1 ILE 7 -8.420 -13.558 -11.926 64 H VAL 8 H VAL 8 -6.703 -11.087 -8.480 65 HA VAL 8 HA VAL 8 -8.385 -8.817 -7.551 66 HB VAL 8 HB VAL 8 -5.948 -8.823 -7.151 67 1HG1 VAL 8 1HG1 VAL 8 -4.518 -9.597 -8.708 68 2HG1 VAL 8 2HG1 VAL 8 -5.047 -8.360 -9.848 69 3HG1 VAL 8 3HG1 VAL 8 -5.889 -9.906 -9.772 70 1HG2 VAL 8 1HG2 VAL 8 -5.857 -6.588 -7.497 71 2HG2 VAL 8 2HG2 VAL 8 -7.441 -6.755 -8.254 72 3HG2 VAL 8 3HG2 VAL 8 -5.983 -6.778 -9.246 73 H LYS 9 H LYS 9 -9.636 -7.647 -8.951 74 HA LYS 9 HA LYS 9 -9.247 -8.048 -11.891 75 1HB LYS 9 1HB LYS 9 -11.850 -7.871 -10.343 76 2HB LYS 9 2HB LYS 9 -11.691 -8.158 -12.074 77 1HG LYS 9 1HG LYS 9 -10.045 -10.078 -10.819 78 2HG LYS 9 2HG LYS 9 -11.553 -10.059 -9.910 79 1HD LYS 9 1HD LYS 9 -12.833 -10.669 -11.771 80 2HD LYS 9 2HD LYS 9 -11.623 -10.085 -12.913 81 1HE LYS 9 1HE LYS 9 -10.269 -12.057 -11.470 82 2HE LYS 9 2HE LYS 9 -11.889 -12.736 -11.720 83 1HZ LYS 9 1HZ LYS 9 -10.427 -13.133 -13.637 84 2HZ LYS 9 2HZ LYS 9 -10.211 -11.458 -13.822 85 3HZ LYS 9 3HZ LYS 9 -11.746 -12.147 -14.054 86 H LYS 10 H LYS 10 -9.834 -4.512 -12.326 87 HA LYS 10 HA LYS 10 -9.344 -5.477 -14.392 88 1HB LYS 10 1HB LYS 10 -7.783 -6.848 -12.287 89 2HB LYS 10 2HB LYS 10 -7.867 -7.710 -13.823 90 1HG LYS 10 1HG LYS 10 -6.785 -6.009 -14.987 91 2HG LYS 10 2HG LYS 10 -7.284 -4.767 -13.837 92 1HD LYS 10 1HD LYS 10 -5.739 -5.687 -12.156 93 2HD LYS 10 2HD LYS 10 -5.255 -6.955 -13.282 94 1HE LYS 10 1HE LYS 10 -4.733 -4.884 -14.871 95 2HE LYS 10 2HE LYS 10 -4.592 -4.030 -13.323 96 1HZ LYS 10 1HZ LYS 10 -3.299 -6.648 -13.878 97 2HZ LYS 10 2HZ LYS 10 -3.031 -5.626 -12.548 98 3HZ LYS 10 3HZ LYS 10 -2.505 -5.162 -14.095 99 H SER 11 H SER 11 -11.857 -5.999 -14.084 100 HA SER 11 HA SER 11 -12.230 -8.961 -14.369 101 1HB SER 11 1HB SER 11 -14.253 -8.682 -13.251 102 2HB SER 11 2HB SER 11 -13.357 -7.336 -12.550 103 HG SER 11 HG SER 11 -14.241 -6.132 -14.449 104 HA PRO 12 HA PRO 12 -13.914 -8.569 -18.410 105 1HB PRO 12 1HB PRO 12 -16.709 -9.180 -17.651 106 2HB PRO 12 2HB PRO 12 -15.601 -10.109 -18.674 107 1HG PRO 12 1HG PRO 12 -16.316 -10.902 -16.199 108 2HG PRO 12 2HG PRO 12 -14.737 -11.269 -16.908 109 1HD PRO 12 1HD PRO 12 -15.463 -9.248 -14.843 110 2HD PRO 12 2HD PRO 12 -13.984 -10.218 -15.011 111 H LEU 13 H LEU 13 -16.721 -7.507 -16.439 112 HA LEU 13 HA LEU 13 -16.699 -4.943 -17.999 113 1HB LEU 13 1HB LEU 13 -18.656 -6.988 -17.591 114 2HB LEU 13 2HB LEU 13 -19.228 -5.537 -16.768 115 HG LEU 13 HG LEU 13 -18.101 -5.308 -19.543 116 1HD1 LEU 13 1HD1 LEU 13 -19.704 -6.677 -20.354 117 2HD1 LEU 13 2HD1 LEU 13 -20.873 -5.460 -19.840 118 3HD1 LEU 13 3HD1 LEU 13 -20.480 -6.810 -18.776 119 1HD2 LEU 13 1HD2 LEU 13 -19.029 -3.485 -17.744 120 2HD2 LEU 13 2HD2 LEU 13 -20.507 -3.836 -18.640 121 3HD2 LEU 13 3HD2 LEU 13 -19.079 -3.246 -19.491 122 H GLY 14 H GLY 14 -16.769 -6.420 -14.830 123 1HA GLY 14 1HA GLY 14 -17.728 -4.166 -13.339 124 2HA GLY 14 2HA GLY 14 -16.752 -5.476 -12.678 125 H GLY 15 H GLY 15 -16.193 -3.024 -11.707 126 1HA GLY 15 1HA GLY 15 -13.988 -1.851 -13.292 127 2HA GLY 15 2HA GLY 15 -14.651 -1.192 -11.797 128 H TYR 16 H TYR 16 -12.370 -1.031 -11.077 129 HA TYR 16 HA TYR 16 -10.766 -3.431 -10.726 130 1HB TYR 16 1HB TYR 16 -10.656 -0.534 -10.205 131 2HB TYR 16 2HB TYR 16 -9.813 -1.491 -8.990 132 HD1 TYR 16 HD1 TYR 16 -10.292 -1.730 -12.712 133 HD2 TYR 16 HD2 TYR 16 -7.539 -1.687 -9.415 134 HE1 TYR 16 HE1 TYR 16 -8.403 -2.066 -14.284 135 HE2 TYR 16 HE2 TYR 16 -5.651 -2.024 -10.986 136 HH TYR 16 HH TYR 16 -5.446 -1.399 -13.771 137 H GLY 17 H GLY 17 -12.396 -4.783 -9.583 138 1HA GLY 17 1HA GLY 17 -12.584 -4.074 -6.679 139 2HA GLY 17 2HA GLY 17 -13.885 -4.912 -7.527 140 H VAL 18 H VAL 18 -13.364 -6.538 -5.652 141 HA VAL 18 HA VAL 18 -11.023 -8.240 -6.452 142 HB VAL 18 HB VAL 18 -12.596 -7.878 -3.882 143 1HG1 VAL 18 1HG1 VAL 18 -11.915 -10.236 -4.124 144 2HG1 VAL 18 2HG1 VAL 18 -10.952 -9.441 -2.878 145 3HG1 VAL 18 3HG1 VAL 18 -10.263 -9.728 -4.475 146 1HG2 VAL 18 1HG2 VAL 18 -11.079 -6.068 -4.194 147 2HG2 VAL 18 2HG2 VAL 18 -9.822 -7.133 -4.822 148 3HG2 VAL 18 3HG2 VAL 18 -10.247 -7.183 -3.110 149 H PHE 19 H PHE 19 -11.369 -10.478 -6.795 150 HA PHE 19 HA PHE 19 -14.244 -11.279 -7.091 151 1HB PHE 19 1HB PHE 19 -11.792 -11.543 -8.690 152 2HB PHE 19 2HB PHE 19 -12.670 -13.062 -8.524 153 HD1 PHE 19 HD1 PHE 19 -14.010 -13.455 -10.391 154 HD2 PHE 19 HD2 PHE 19 -13.738 -9.472 -8.806 155 HE1 PHE 19 HE1 PHE 19 -15.676 -12.679 -12.056 156 HE2 PHE 19 HE2 PHE 19 -15.404 -8.696 -10.471 157 HZ PHE 19 HZ PHE 19 -16.373 -10.299 -12.096 158 H ALA 20 H ALA 20 -14.910 -12.753 -5.589 159 HA ALA 20 HA ALA 20 -12.892 -14.206 -3.984 160 1HB ALA 20 1HB ALA 20 -14.528 -14.088 -2.394 161 2HB ALA 20 2HB ALA 20 -15.767 -14.663 -3.510 162 3HB ALA 20 3HB ALA 20 -15.314 -12.958 -3.497 163 H ARG 21 H ARG 21 -12.173 -15.838 -5.481 164 HA ARG 21 HA ARG 21 -13.863 -17.539 -7.034 165 1HB ARG 21 1HB ARG 21 -11.155 -17.153 -6.534 166 2HB ARG 21 2HB ARG 21 -11.450 -18.766 -5.882 167 1HG ARG 21 1HG ARG 21 -11.235 -19.480 -8.023 168 2HG ARG 21 2HG ARG 21 -12.850 -18.814 -8.265 169 1HD ARG 21 1HD ARG 21 -12.057 -17.074 -9.515 170 2HD ARG 21 2HD ARG 21 -10.678 -16.812 -8.431 171 HE ARG 21 HE ARG 21 -10.703 -18.547 -10.786 172 1HH1 ARG 21 1HH1 ARG 21 -9.310 -17.965 -7.650 173 2HH1 ARG 21 2HH1 ARG 21 -7.850 -18.815 -8.019 174 1HH2 ARG 21 1HH2 ARG 21 -8.801 -19.645 -11.242 175 2HH2 ARG 21 2HH2 ARG 21 -7.561 -19.761 -10.038 176 H LYS 22 H LYS 22 -13.183 -17.427 -3.626 177 HA LYS 22 HA LYS 22 -14.168 -20.168 -3.116 178 1HB LYS 22 1HB LYS 22 -12.742 -17.972 -1.738 179 2HB LYS 22 2HB LYS 22 -13.806 -18.923 -0.713 180 1HG LYS 22 1HG LYS 22 -12.717 -20.992 -1.457 181 2HG LYS 22 2HG LYS 22 -11.651 -20.053 -2.504 182 1HD LYS 22 1HD LYS 22 -10.385 -20.412 -0.536 183 2HD LYS 22 2HD LYS 22 -10.988 -18.767 -0.370 184 1HE LYS 22 1HE LYS 22 -12.573 -19.385 1.256 185 2HE LYS 22 2HE LYS 22 -12.559 -21.087 0.756 186 1HZ LYS 22 1HZ LYS 22 -10.295 -19.604 1.998 187 2HZ LYS 22 2HZ LYS 22 -10.235 -21.217 1.468 188 3HZ LYS 22 3HZ LYS 22 -11.244 -20.786 2.764 189 H SER 23 H SER 23 -17.200 -19.083 -1.293 190 HA SER 23 HA SER 23 -14.782 -20.855 -1.241 191 1HB SER 23 1HB SER 23 -17.116 -21.756 0.234 192 2HB SER 23 2HB SER 23 -17.568 -21.285 -1.404 193 HG SER 23 HG SER 23 -16.159 -23.433 -0.550 194 H PHE 24 H PHE 24 -16.518 -18.465 0.558 195 HA PHE 24 HA PHE 24 -14.797 -19.057 2.934 196 1HB PHE 24 1HB PHE 24 -15.969 -16.590 1.646 197 2HB PHE 24 2HB PHE 24 -15.436 -16.542 3.326 198 HD1 PHE 24 HD1 PHE 24 -13.049 -17.138 3.887 199 HD2 PHE 24 HD2 PHE 24 -14.404 -16.579 -0.150 200 HE1 PHE 24 HE1 PHE 24 -10.701 -16.872 3.136 201 HE2 PHE 24 HE2 PHE 24 -12.056 -16.313 -0.902 202 HZ PHE 24 HZ PHE 24 -10.205 -16.459 0.741 203 H GLU 25 H GLU 25 -15.750 -19.022 5.019 204 HA GLU 25 HA GLU 25 -18.668 -19.521 5.081 205 1HB GLU 25 1HB GLU 25 -16.256 -20.201 6.589 206 2HB GLU 25 2HB GLU 25 -17.566 -19.691 7.655 207 1HG GLU 25 1HG GLU 25 -18.400 -21.777 7.431 208 2HG GLU 25 2HG GLU 25 -18.816 -21.335 5.776 209 H LYS 26 H LYS 26 -19.189 -18.616 7.708 210 HA LYS 26 HA LYS 26 -19.309 -15.686 7.238 211 1HB LYS 26 1HB LYS 26 -21.273 -17.237 7.837 212 2HB LYS 26 2HB LYS 26 -20.568 -17.333 9.451 213 1HG LYS 26 1HG LYS 26 -20.686 -14.871 9.645 214 2HG LYS 26 2HG LYS 26 -21.399 -14.780 8.034 215 1HD LYS 26 1HD LYS 26 -23.246 -16.300 8.879 216 2HD LYS 26 2HD LYS 26 -22.585 -16.081 10.500 217 1HE LYS 26 1HE LYS 26 -22.737 -13.483 9.700 218 2HE LYS 26 2HE LYS 26 -24.111 -14.172 8.815 219 1HZ LYS 26 1HZ LYS 26 -23.536 -14.489 11.719 220 2HZ LYS 26 2HZ LYS 26 -24.801 -15.266 10.893 221 3HZ LYS 26 3HZ LYS 26 -24.798 -13.574 11.044 222 H GLY 27 H GLY 27 -16.829 -15.757 7.768 223 1HA GLY 27 1HA GLY 27 -15.992 -14.365 9.847 224 2HA GLY 27 2HA GLY 27 -16.346 -15.867 10.701 225 H GLU 28 H GLU 28 -14.582 -14.779 7.776 226 HA GLU 28 HA GLU 28 -12.321 -16.547 8.618 227 1HB GLU 28 1HB GLU 28 -13.988 -16.548 6.137 228 2HB GLU 28 2HB GLU 28 -12.264 -16.862 5.945 229 1HG GLU 28 1HG GLU 28 -12.480 -18.608 7.762 230 2HG GLU 28 2HG GLU 28 -14.226 -18.384 7.680 231 H LEU 29 H LEU 29 -10.508 -15.291 8.719 232 HA LEU 29 HA LEU 29 -10.392 -12.593 7.751 233 1HB LEU 29 1HB LEU 29 -9.097 -13.861 9.625 234 2HB LEU 29 2HB LEU 29 -8.022 -14.387 8.332 235 HG LEU 29 HG LEU 29 -7.203 -12.326 9.473 236 1HD1 LEU 29 1HD1 LEU 29 -6.947 -12.885 6.930 237 2HD1 LEU 29 2HD1 LEU 29 -6.506 -11.276 7.501 238 3HD1 LEU 29 3HD1 LEU 29 -8.057 -11.534 6.700 239 1HD2 LEU 29 1HD2 LEU 29 -9.078 -10.500 8.221 240 2HD2 LEU 29 2HD2 LEU 29 -8.569 -10.589 9.907 241 3HD2 LEU 29 3HD2 LEU 29 -9.908 -11.584 9.335 242 H VAL 30 H VAL 30 -10.299 -12.061 5.617 243 HA VAL 30 HA VAL 30 -9.048 -13.924 3.673 244 HB VAL 30 HB VAL 30 -10.617 -11.329 3.419 245 1HG1 VAL 30 1HG1 VAL 30 -8.934 -12.546 1.536 246 2HG1 VAL 30 2HG1 VAL 30 -10.180 -11.342 1.205 247 3HG1 VAL 30 3HG1 VAL 30 -10.559 -13.060 1.083 248 1HG2 VAL 30 1HG2 VAL 30 -12.413 -12.877 2.615 249 2HG2 VAL 30 2HG2 VAL 30 -11.971 -13.154 4.300 250 3HG2 VAL 30 3HG2 VAL 30 -11.379 -14.241 3.043 251 H GLU 31 H GLU 31 -6.876 -13.384 4.718 252 HA GLU 31 HA GLU 31 -4.779 -12.321 4.582 253 1HB GLU 31 1HB GLU 31 -5.294 -12.606 2.168 254 2HB GLU 31 2HB GLU 31 -6.125 -11.052 2.167 255 1HG GLU 31 1HG GLU 31 -4.187 -9.882 2.108 256 2HG GLU 31 2HG GLU 31 -3.415 -10.932 3.297 257 H GLU 32 H GLU 32 -3.741 -10.300 5.108 258 HA GLU 32 HA GLU 32 -5.393 -7.874 5.421 259 1HB GLU 32 1HB GLU 32 -4.977 -7.872 7.897 260 2HB GLU 32 2HB GLU 32 -5.961 -9.243 7.384 261 1HG GLU 32 1HG GLU 32 -4.096 -10.740 7.499 262 2HG GLU 32 2HG GLU 32 -2.953 -9.408 7.669 263 H CYS 33 H CYS 33 -4.027 -6.024 6.153 264 HA CYS 33 HA CYS 33 -1.096 -6.486 6.159 265 1HB CYS 33 1HB CYS 33 -2.353 -6.079 3.798 266 2HB CYS 33 2HB CYS 33 -2.118 -4.400 4.284 267 HG CYS 33 HG CYS 33 0.502 -5.639 4.705 268 H LEU 34 H LEU 34 -0.170 -3.947 6.032 269 HA LEU 34 HA LEU 34 -1.294 -2.714 8.476 270 1HB LEU 34 1HB LEU 34 1.111 -2.045 6.736 271 2HB LEU 34 2HB LEU 34 0.798 -1.399 8.346 272 HG LEU 34 HG LEU 34 1.080 -4.359 7.758 273 1HD1 LEU 34 1HD1 LEU 34 3.094 -2.265 8.021 274 2HD1 LEU 34 2HD1 LEU 34 3.293 -3.953 7.550 275 3HD1 LEU 34 3HD1 LEU 34 3.277 -3.510 9.257 276 1HD2 LEU 34 1HD2 LEU 34 0.670 -2.662 10.187 277 2HD2 LEU 34 2HD2 LEU 34 1.667 -4.109 10.344 278 3HD2 LEU 34 3HD2 LEU 34 -0.004 -4.244 9.798 279 H CYS 35 H CYS 35 -0.837 -0.060 8.160 280 HA CYS 35 HA CYS 35 -2.128 0.836 5.632 281 1HB CYS 35 1HB CYS 35 -3.220 0.960 8.441 282 2HB CYS 35 2HB CYS 35 -3.668 2.207 7.279 283 HG CYS 35 HG CYS 35 -4.071 -0.657 6.244 284 H ILE 36 H ILE 36 -1.978 3.232 5.409 285 HA ILE 36 HA ILE 36 0.463 4.266 6.791 286 HB ILE 36 HB ILE 36 -1.123 5.484 4.505 287 1HG1 ILE 36 1HG1 ILE 36 1.218 3.555 4.357 288 2HG1 ILE 36 2HG1 ILE 36 -0.448 3.167 3.926 289 1HG2 ILE 36 1HG2 ILE 36 0.505 6.949 5.648 290 2HG2 ILE 36 2HG2 ILE 36 1.024 6.578 4.004 291 3HG2 ILE 36 3HG2 ILE 36 1.770 5.751 5.371 292 1HD1 ILE 36 1HD1 ILE 36 -0.334 4.294 1.947 293 2HD1 ILE 36 2HD1 ILE 36 1.406 4.079 2.143 294 3HD1 ILE 36 3HD1 ILE 36 0.644 5.593 2.631 295 H VAL 37 H VAL 37 -0.229 5.080 8.776 296 HA VAL 37 HA VAL 37 -2.749 6.583 8.970 297 HB VAL 37 HB VAL 37 -0.552 6.059 11.008 298 1HG1 VAL 37 1HG1 VAL 37 -3.443 6.258 11.705 299 2HG1 VAL 37 2HG1 VAL 37 -2.624 7.760 11.267 300 3HG1 VAL 37 3HG1 VAL 37 -2.028 6.792 12.616 301 1HG2 VAL 37 1HG2 VAL 37 -3.064 4.439 10.528 302 2HG2 VAL 37 2HG2 VAL 37 -1.734 4.054 11.623 303 3HG2 VAL 37 3HG2 VAL 37 -1.488 3.988 9.877 304 H ARG 38 H ARG 38 -2.892 8.776 8.842 305 HA ARG 38 HA ARG 38 -0.515 10.447 9.482 306 1HB ARG 38 1HB ARG 38 -1.979 10.190 6.857 307 2HB ARG 38 2HB ARG 38 -1.153 11.692 7.267 308 1HG ARG 38 1HG ARG 38 0.122 8.939 7.190 309 2HG ARG 38 2HG ARG 38 0.328 10.199 5.974 310 1HD ARG 38 1HD ARG 38 0.984 11.581 8.242 311 2HD ARG 38 2HD ARG 38 1.566 9.956 8.653 312 HE ARG 38 HE ARG 38 2.235 10.769 5.925 313 1HH1 ARG 38 1HH1 ARG 38 3.191 10.853 9.271 314 2HH1 ARG 38 2HH1 ARG 38 4.865 11.078 8.901 315 1HH2 ARG 38 1HH2 ARG 38 4.413 11.061 5.470 316 2HH2 ARG 38 2HH2 ARG 38 5.555 11.195 6.766 317 H HIS 39 H HIS 39 -1.114 12.623 10.064 318 HA HIS 39 HA HIS 39 -3.659 12.941 11.331 319 1HB HIS 39 1HB HIS 39 -1.298 14.633 10.589 320 2HB HIS 39 2HB HIS 39 -2.763 15.457 11.122 321 HD1 HIS 39 HD1 HIS 39 -1.103 16.064 13.236 322 HD2 HIS 39 HD2 HIS 39 -2.412 12.115 12.946 323 HE1 HIS 39 HE1 HIS 39 -0.731 15.017 15.512 324 H ASN 40 H ASN 40 -4.949 15.122 10.699 325 HA ASN 40 HA ASN 40 -5.967 14.642 7.967 326 1HB ASN 40 1HB ASN 40 -7.422 14.879 9.985 327 2HB ASN 40 2HB ASN 40 -6.843 16.534 10.181 328 1HD2 ASN 40 1HD2 ASN 40 -9.334 16.909 9.863 329 2HD2 ASN 40 2HD2 ASN 40 -9.868 17.112 8.264 330 H ASP 41 H ASP 41 -4.907 15.709 6.348 331 HA ASP 41 HA ASP 41 -4.804 18.586 6.232 332 1HB ASP 41 1HB ASP 41 -2.948 17.675 7.917 333 2HB ASP 41 2HB ASP 41 -2.064 17.361 6.424 334 H ASP 42 H ASP 42 -2.195 18.379 4.606 335 HA ASP 42 HA ASP 42 -3.219 18.019 2.018 336 1HB ASP 42 1HB ASP 42 -0.456 17.483 3.172 337 2HB ASP 42 2HB ASP 42 -0.789 17.641 1.447 338 H TRP 43 H TRP 43 -2.263 15.626 4.372 339 HA TRP 43 HA TRP 43 -1.832 13.336 2.768 340 1HB TRP 43 1HB TRP 43 -1.403 13.365 5.141 341 2HB TRP 43 2HB TRP 43 -3.061 13.835 5.500 342 HD1 TRP 43 HD1 TRP 43 -4.469 11.929 6.364 343 HE1 TRP 43 HE1 TRP 43 -4.520 9.369 6.059 344 HE3 TRP 43 HE3 TRP 43 -0.613 11.356 3.063 345 HZ2 TRP 43 HZ2 TRP 43 -3.111 7.350 4.611 346 HZ3 TRP 43 HZ3 TRP 43 0.009 9.103 2.237 347 HH2 TRP 43 HH2 TRP 43 -1.235 7.101 3.005 348 H GLY 44 H GLY 44 -4.905 14.124 4.449 349 1HA GLY 44 1HA GLY 44 -6.499 12.270 3.018 350 2HA GLY 44 2HA GLY 44 -7.127 13.710 3.820 351 H THR 45 H THR 45 -5.387 15.483 2.152 352 HA THR 45 HA THR 45 -7.251 15.932 -0.011 353 HB THR 45 HB THR 45 -4.431 16.966 0.478 354 HG1 THR 45 HG1 THR 45 -5.387 17.784 2.152 355 1HG2 THR 45 1HG2 THR 45 -5.669 17.310 -1.808 356 2HG2 THR 45 2HG2 THR 45 -4.910 18.697 -1.027 357 3HG2 THR 45 3HG2 THR 45 -6.653 18.457 -0.898 358 H ALA 46 H ALA 46 -3.730 15.314 -0.293 359 HA ALA 46 HA ALA 46 -3.777 14.568 -3.026 360 1HB ALA 46 1HB ALA 46 -1.679 15.062 -2.110 361 2HB ALA 46 2HB ALA 46 -1.608 13.301 -2.168 362 3HB ALA 46 3HB ALA 46 -1.985 14.119 -0.651 363 H LEU 47 H LEU 47 -3.874 12.473 -0.117 364 HA LEU 47 HA LEU 47 -4.335 10.092 -1.808 365 1HB LEU 47 1HB LEU 47 -3.844 10.706 1.107 366 2HB LEU 47 2HB LEU 47 -4.413 9.108 0.631 367 HG LEU 47 HG LEU 47 -1.964 9.126 0.745 368 1HD1 LEU 47 1HD1 LEU 47 -1.875 7.762 -1.047 369 2HD1 LEU 47 2HD1 LEU 47 -2.121 9.108 -2.160 370 3HD1 LEU 47 3HD1 LEU 47 -3.510 8.296 -1.437 371 1HD2 LEU 47 1HD2 LEU 47 -1.891 11.648 0.196 372 2HD2 LEU 47 2HD2 LEU 47 -1.959 11.149 -1.494 373 3HD2 LEU 47 3HD2 LEU 47 -0.613 10.636 -0.476 374 H GLU 48 H GLU 48 -6.457 12.056 -1.923 375 HA GLU 48 HA GLU 48 -8.598 11.231 -0.125 376 1HB GLU 48 1HB GLU 48 -9.851 12.839 -1.532 377 2HB GLU 48 2HB GLU 48 -8.303 13.516 -1.055 378 1HG GLU 48 1HG GLU 48 -7.794 13.810 -3.225 379 2HG GLU 48 2HG GLU 48 -7.875 12.066 -3.456 380 H ASP 49 H ASP 49 -7.946 8.848 -1.103 381 HA ASP 49 HA ASP 49 -10.108 8.250 -3.069 382 1HB ASP 49 1HB ASP 49 -7.176 8.049 -3.387 383 2HB ASP 49 2HB ASP 49 -8.051 6.590 -3.854 384 H TYR 50 H TYR 50 -7.488 6.160 -1.896 385 HA TYR 50 HA TYR 50 -9.541 4.356 -0.705 386 1HB TYR 50 1HB TYR 50 -6.568 3.839 -0.972 387 2HB TYR 50 2HB TYR 50 -7.878 2.664 -0.945 388 HD1 TYR 50 HD1 TYR 50 -5.578 4.264 -3.017 389 HD2 TYR 50 HD2 TYR 50 -9.715 3.089 -2.931 390 HE1 TYR 50 HE1 TYR 50 -5.650 4.324 -5.493 391 HE2 TYR 50 HE2 TYR 50 -9.780 3.153 -5.402 392 HH TYR 50 HH TYR 50 -8.441 3.169 -7.279 393 H LEU 51 H LEU 51 -9.298 6.590 0.832 394 HA LEU 51 HA LEU 51 -7.366 5.905 3.014 395 1HB LEU 51 1HB LEU 51 -7.884 8.224 1.551 396 2HB LEU 51 2HB LEU 51 -8.719 8.510 3.078 397 HG LEU 51 HG LEU 51 -6.574 7.788 4.245 398 1HD1 LEU 51 1HD1 LEU 51 -5.796 7.567 1.397 399 2HD1 LEU 51 2HD1 LEU 51 -5.140 6.741 2.810 400 3HD1 LEU 51 3HD1 LEU 51 -4.626 8.385 2.432 401 1HD2 LEU 51 1HD2 LEU 51 -5.387 10.016 3.405 402 2HD2 LEU 51 2HD2 LEU 51 -6.878 10.085 4.345 403 3HD2 LEU 51 3HD2 LEU 51 -6.933 10.258 2.590 404 H PHE 52 H PHE 52 -8.196 5.282 4.966 405 HA PHE 52 HA PHE 52 -11.136 5.299 5.369 406 1HB PHE 52 1HB PHE 52 -8.712 3.958 6.540 407 2HB PHE 52 2HB PHE 52 -10.181 4.038 7.513 408 HD1 PHE 52 HD1 PHE 52 -8.458 2.192 5.031 409 HD2 PHE 52 HD2 PHE 52 -12.407 3.369 6.244 410 HE1 PHE 52 HE1 PHE 52 -9.418 0.305 3.739 411 HE2 PHE 52 HE2 PHE 52 -13.367 1.482 4.952 412 HZ PHE 52 HZ PHE 52 -11.872 -0.050 3.699 413 H SER 53 H SER 53 -11.603 5.724 7.925 414 HA SER 53 HA SER 53 -10.048 8.101 8.839 415 1HB SER 53 1HB SER 53 -11.995 9.472 8.849 416 2HB SER 53 2HB SER 53 -12.090 8.603 7.319 417 HG SER 53 HG SER 53 -14.034 8.641 8.705 418 H ARG 54 H ARG 54 -9.601 7.818 10.947 419 HA ARG 54 HA ARG 54 -11.443 6.145 12.615 420 1HB ARG 54 1HB ARG 54 -9.081 5.380 12.223 421 2HB ARG 54 2HB ARG 54 -8.508 6.872 12.967 422 1HG ARG 54 1HG ARG 54 -10.482 5.289 14.529 423 2HG ARG 54 2HG ARG 54 -8.870 4.593 14.365 424 1HD ARG 54 1HD ARG 54 -7.901 6.224 15.660 425 2HD ARG 54 2HD ARG 54 -8.964 7.494 15.020 426 HE ARG 54 HE ARG 54 -10.668 5.814 16.446 427 1HH1 ARG 54 1HH1 ARG 54 -7.761 7.592 17.161 428 2HH1 ARG 54 2HH1 ARG 54 -8.178 7.819 18.824 429 1HH2 ARG 54 1HH2 ARG 54 -11.187 6.122 18.608 430 2HH2 ARG 54 2HH2 ARG 54 -10.103 6.995 19.639 431 H LYS 55 H LYS 55 -11.399 6.923 15.013 432 HA LYS 55 HA LYS 55 -12.063 9.758 15.064 433 1HB LYS 55 1HB LYS 55 -12.158 7.360 16.834 434 2HB LYS 55 2HB LYS 55 -12.114 8.919 17.656 435 1HG LYS 55 1HG LYS 55 -14.006 9.630 16.076 436 2HG LYS 55 2HG LYS 55 -14.156 7.921 15.663 437 1HD LYS 55 1HD LYS 55 -14.435 7.411 18.100 438 2HD LYS 55 2HD LYS 55 -14.426 9.144 18.427 439 1HE LYS 55 1HE LYS 55 -16.312 8.339 16.299 440 2HE LYS 55 2HE LYS 55 -16.703 7.700 17.907 441 1HZ LYS 55 1HZ LYS 55 -17.621 9.885 17.758 442 2HZ LYS 55 2HZ LYS 55 -16.165 10.530 17.169 443 3HZ LYS 55 3HZ LYS 55 -16.264 9.983 18.774 444 H ASN 56 H ASN 56 -9.723 10.259 14.352 445 HA ASN 56 HA ASN 56 -7.598 10.029 16.317 446 1HB ASN 56 1HB ASN 56 -8.656 12.814 15.833 447 2HB ASN 56 2HB ASN 56 -9.374 11.809 17.091 448 1HD2 ASN 56 1HD2 ASN 56 -7.976 11.161 18.911 449 2HD2 ASN 56 2HD2 ASN 56 -6.535 11.996 19.237 450 H MET 57 H MET 57 -8.250 9.669 13.389 451 HA MET 57 HA MET 57 -6.941 11.749 11.877 452 1HB MET 57 1HB MET 57 -4.796 10.598 11.578 453 2HB MET 57 2HB MET 57 -5.056 10.909 13.278 454 1HG MET 57 1HG MET 57 -5.951 8.291 12.137 455 2HG MET 57 2HG MET 57 -4.249 8.555 12.496 456 1HE MET 57 1HE MET 57 -3.871 8.941 16.140 457 2HE MET 57 2HE MET 57 -3.469 9.714 14.606 458 3HE MET 57 3HE MET 57 -3.263 7.972 14.797 459 H SER 58 H SER 58 -5.826 10.353 9.822 460 HA SER 58 HA SER 58 -7.985 8.467 8.927 461 1HB SER 58 1HB SER 58 -7.826 9.498 6.773 462 2HB SER 58 2HB SER 58 -7.783 10.843 7.914 463 HG SER 58 HG SER 58 -5.613 11.008 7.653 464 H ALA 59 H ALA 59 -7.122 6.907 7.199 465 HA ALA 59 HA ALA 59 -4.186 6.461 7.338 466 1HB ALA 59 1HB ALA 59 -5.080 3.949 7.869 467 2HB ALA 59 2HB ALA 59 -6.342 4.892 8.660 468 3HB ALA 59 3HB ALA 59 -4.657 5.100 9.136 469 H MET 60 H MET 60 -3.413 5.092 5.627 470 HA MET 60 HA MET 60 -5.257 4.869 3.319 471 1HB MET 60 1HB MET 60 -2.940 5.782 3.127 472 2HB MET 60 2HB MET 60 -2.305 4.231 3.673 473 1HG MET 60 1HG MET 60 -2.228 4.394 1.212 474 2HG MET 60 2HG MET 60 -3.327 3.115 1.729 475 1HE MET 60 1HE MET 60 -2.537 5.652 -0.361 476 2HE MET 60 2HE MET 60 -3.365 7.033 0.357 477 3HE MET 60 3HE MET 60 -3.991 6.300 -1.120 478 H ALA 61 H ALA 61 -5.634 2.828 2.255 479 HA ALA 61 HA ALA 61 -5.698 0.540 4.101 480 1HB ALA 61 1HB ALA 61 -6.969 1.500 1.651 481 2HB ALA 61 2HB ALA 61 -7.597 0.381 2.861 482 3HB ALA 61 3HB ALA 61 -6.583 -0.218 1.548 483 H LEU 62 H LEU 62 -3.462 -0.063 4.290 484 HA LEU 62 HA LEU 62 -1.554 -1.311 3.695 485 1HB LEU 62 1HB LEU 62 -1.265 -0.646 0.976 486 2HB LEU 62 2HB LEU 62 -2.100 0.732 1.695 487 HG LEU 62 HG LEU 62 -0.343 0.636 3.557 488 1HD1 LEU 62 1HD1 LEU 62 0.361 -1.714 2.189 489 2HD1 LEU 62 2HD1 LEU 62 1.261 -0.947 3.497 490 3HD1 LEU 62 3HD1 LEU 62 1.648 -0.566 1.820 491 1HD2 LEU 62 1HD2 LEU 62 -0.420 2.117 1.359 492 2HD2 LEU 62 2HD2 LEU 62 1.006 1.168 0.936 493 3HD2 LEU 62 3HD2 LEU 62 0.998 2.141 2.407 494 H GLY 63 H GLY 63 -3.961 -2.769 3.566 495 1HA GLY 63 1HA GLY 63 -3.198 -4.981 1.922 496 2HA GLY 63 2HA GLY 63 -4.760 -4.806 2.722 497 H PHE 64 H PHE 64 -6.118 -5.368 1.016 498 HA PHE 64 HA PHE 64 -5.717 -4.136 -1.647 499 1HB PHE 64 1HB PHE 64 -7.570 -6.191 -0.413 500 2HB PHE 64 2HB PHE 64 -7.777 -5.632 -2.072 501 HD1 PHE 64 HD1 PHE 64 -6.526 -8.265 -0.317 502 HD2 PHE 64 HD2 PHE 64 -5.220 -5.400 -3.239 503 HE1 PHE 64 HE1 PHE 64 -4.756 -9.834 -1.064 504 HE2 PHE 64 HE2 PHE 64 -3.451 -6.970 -3.987 505 HZ PHE 64 HZ PHE 64 -3.219 -9.187 -2.899 506 H GLY 65 H GLY 65 -6.915 -2.871 1.083 507 1HA GLY 65 1HA GLY 65 -9.567 -2.122 0.755 508 2HA GLY 65 2HA GLY 65 -8.359 -1.048 1.455 509 H ALA 66 H ALA 66 -6.788 -0.954 -1.062 510 HA ALA 66 HA ALA 66 -8.072 1.302 -2.311 511 1HB ALA 66 1HB ALA 66 -5.615 -0.270 -2.464 512 2HB ALA 66 2HB ALA 66 -5.860 1.438 -2.825 513 3HB ALA 66 3HB ALA 66 -6.161 0.223 -4.067 514 H ILE 67 H ILE 67 -7.075 -1.626 -4.065 515 HA ILE 67 HA ILE 67 -8.970 -1.392 -6.127 516 HB ILE 67 HB ILE 67 -8.447 -3.857 -6.449 517 1HG1 ILE 67 1HG1 ILE 67 -6.428 -4.417 -4.740 518 2HG1 ILE 67 2HG1 ILE 67 -7.450 -3.455 -3.677 519 1HG2 ILE 67 1HG2 ILE 67 -6.208 -1.902 -5.916 520 2HG2 ILE 67 2HG2 ILE 67 -6.960 -2.288 -7.465 521 3HG2 ILE 67 3HG2 ILE 67 -5.951 -3.485 -6.651 522 1HD1 ILE 67 1HD1 ILE 67 -9.015 -5.325 -5.258 523 2HD1 ILE 67 2HD1 ILE 67 -8.976 -5.095 -3.510 524 3HD1 ILE 67 3HD1 ILE 67 -7.795 -6.149 -4.288 525 H PHE 68 H PHE 68 -9.474 -2.470 -2.905 526 HA PHE 68 HA PHE 68 -11.654 -4.232 -3.139 527 1HB PHE 68 1HB PHE 68 -10.376 -2.570 -1.216 528 2HB PHE 68 2HB PHE 68 -12.093 -2.243 -1.120 529 HD1 PHE 68 HD1 PHE 68 -13.672 -4.025 -0.441 530 HD2 PHE 68 HD2 PHE 68 -9.466 -4.802 -0.803 531 HE1 PHE 68 HE1 PHE 68 -13.961 -6.179 0.756 532 HE2 PHE 68 HE2 PHE 68 -9.752 -6.949 0.391 533 HZ PHE 68 HZ PHE 68 -11.998 -7.639 1.170 534 H ASN 69 H ASN 69 -13.751 -3.954 -3.907 535 HA ASN 69 HA ASN 69 -14.536 -1.185 -4.722 536 1HB ASN 69 1HB ASN 69 -14.912 -3.970 -5.735 537 2HB ASN 69 2HB ASN 69 -16.215 -2.825 -6.051 538 1HD2 ASN 69 1HD2 ASN 69 -15.200 -3.416 -8.375 539 2HD2 ASN 69 2HD2 ASN 69 -14.020 -2.323 -8.924 540 H HIS 70 H HIS 70 -17.078 -1.045 -4.860 541 HA HIS 70 HA HIS 70 -18.151 -1.806 -2.175 542 1HB HIS 70 1HB HIS 70 -18.072 0.584 -2.729 543 2HB HIS 70 2HB HIS 70 -18.924 0.287 -4.243 544 HD1 HIS 70 HD1 HIS 70 -19.510 1.136 -0.762 545 HD2 HIS 70 HD2 HIS 70 -21.669 -0.817 -3.745 546 HE1 HIS 70 HE1 HIS 70 -21.924 1.111 0.002 547 H SER 71 H SER 71 -20.392 -2.620 -2.114 548 HA SER 71 HA SER 71 -21.544 -3.533 -4.695 549 1HB SER 71 1HB SER 71 -19.991 -5.298 -4.039 550 2HB SER 71 2HB SER 71 -20.648 -5.318 -2.403 551 HG SER 71 HG SER 71 -21.438 -6.773 -4.384 552 H LYS 72 H LYS 72 -23.791 -3.693 -4.580 553 HA LYS 72 HA LYS 72 -25.258 -2.424 -2.530 554 1HB LYS 72 1HB LYS 72 -25.781 -3.331 -4.990 555 2HB LYS 72 2HB LYS 72 -26.433 -4.702 -4.093 556 1HG LYS 72 1HG LYS 72 -28.270 -3.215 -4.343 557 2HG LYS 72 2HG LYS 72 -27.707 -2.956 -2.692 558 1HD LYS 72 1HD LYS 72 -26.161 -1.146 -3.936 559 2HD LYS 72 2HD LYS 72 -27.513 -1.165 -5.069 560 1HE LYS 72 1HE LYS 72 -28.399 -1.096 -2.271 561 2HE LYS 72 2HE LYS 72 -27.428 0.317 -2.724 562 1HZ LYS 72 1HZ LYS 72 -29.763 0.624 -3.326 563 2HZ LYS 72 2HZ LYS 72 -29.721 -0.786 -4.270 564 3HZ LYS 72 3HZ LYS 72 -28.787 0.561 -4.714 565 H ASP 73 H ASP 73 -24.156 -5.756 -2.809 566 HA ASP 73 HA ASP 73 -25.507 -6.392 -0.207 567 1HB ASP 73 1HB ASP 73 -25.029 -7.798 -2.765 568 2HB ASP 73 2HB ASP 73 -24.693 -8.775 -1.335 569 HA PRO 74 HA PRO 74 -21.094 -5.908 0.924 570 1HB PRO 74 1HB PRO 74 -22.325 -6.341 3.606 571 2HB PRO 74 2HB PRO 74 -21.208 -5.072 3.075 572 1HG PRO 74 1HG PRO 74 -23.819 -4.605 3.490 573 2HG PRO 74 2HG PRO 74 -22.888 -3.758 2.248 574 1HD PRO 74 1HD PRO 74 -24.911 -5.909 1.957 575 2HD PRO 74 2HD PRO 74 -24.488 -4.591 0.845 576 H ASN 75 H ASN 75 -19.885 -7.737 0.676 577 HA ASN 75 HA ASN 75 -20.902 -10.296 1.856 578 1HB ASN 75 1HB ASN 75 -19.413 -11.298 0.093 579 2HB ASN 75 2HB ASN 75 -20.663 -10.253 -0.583 580 1HD2 ASN 75 1HD2 ASN 75 -19.889 -8.754 -2.071 581 2HD2 ASN 75 2HD2 ASN 75 -18.301 -8.156 -2.120 582 H ALA 76 H ALA 76 -18.298 -7.982 1.886 583 HA ALA 76 HA ALA 76 -16.960 -9.558 4.028 584 1HB ALA 76 1HB ALA 76 -15.612 -10.278 2.279 585 2HB ALA 76 2HB ALA 76 -14.794 -8.759 2.646 586 3HB ALA 76 3HB ALA 76 -15.938 -8.844 1.306 587 H ARG 77 H ARG 77 -15.750 -8.217 5.468 588 HA ARG 77 HA ARG 77 -15.982 -5.266 4.977 589 1HB ARG 77 1HB ARG 77 -17.025 -7.021 7.079 590 2HB ARG 77 2HB ARG 77 -16.070 -5.692 7.738 591 1HG ARG 77 1HG ARG 77 -17.439 -4.197 6.108 592 2HG ARG 77 2HG ARG 77 -18.550 -5.564 6.029 593 1HD ARG 77 1HD ARG 77 -18.210 -5.387 8.725 594 2HD ARG 77 2HD ARG 77 -18.036 -3.682 8.265 595 HE ARG 77 HE ARG 77 -20.207 -4.526 6.776 596 1HH1 ARG 77 1HH1 ARG 77 -19.373 -4.670 10.153 597 2HH1 ARG 77 2HH1 ARG 77 -21.021 -4.609 10.675 598 1HH2 ARG 77 1HH2 ARG 77 -22.338 -4.446 7.480 599 2HH2 ARG 77 2HH2 ARG 77 -22.688 -4.483 9.176 600 H HIS 78 H HIS 78 -14.538 -4.251 6.995 601 HA HIS 78 HA HIS 78 -11.915 -5.704 6.927 602 1HB HIS 78 1HB HIS 78 -10.894 -3.446 6.639 603 2HB HIS 78 2HB HIS 78 -12.002 -3.832 5.322 604 HD1 HIS 78 HD1 HIS 78 -13.387 -1.847 4.759 605 HD2 HIS 78 HD2 HIS 78 -12.654 -2.073 8.856 606 HE1 HIS 78 HE1 HIS 78 -14.599 0.111 5.812 607 H GLU 79 H GLU 79 -10.385 -4.597 8.643 608 HA GLU 79 HA GLU 79 -11.938 -3.820 11.081 609 1HB GLU 79 1HB GLU 79 -11.182 -6.337 10.736 610 2HB GLU 79 2HB GLU 79 -9.602 -5.717 11.214 611 1HG GLU 79 1HG GLU 79 -10.464 -4.924 13.318 612 2HG GLU 79 2HG GLU 79 -12.126 -5.246 12.821 613 H LEU 80 H LEU 80 -10.687 -2.566 12.599 614 HA LEU 80 HA LEU 80 -8.083 -1.535 11.517 615 1HB LEU 80 1HB LEU 80 -10.294 -0.091 13.030 616 2HB LEU 80 2HB LEU 80 -8.804 0.651 12.447 617 HG LEU 80 HG LEU 80 -10.846 -0.713 10.665 618 1HD1 LEU 80 1HD1 LEU 80 -11.945 1.260 10.444 619 2HD1 LEU 80 2HD1 LEU 80 -10.444 2.187 10.408 620 3HD1 LEU 80 3HD1 LEU 80 -11.151 1.713 11.953 621 1HD2 LEU 80 1HD2 LEU 80 -9.049 1.228 9.457 622 2HD2 LEU 80 2HD2 LEU 80 -9.340 -0.452 9.005 623 3HD2 LEU 80 3HD2 LEU 80 -8.148 -0.067 10.246 624 H THR 81 H THR 81 -6.396 -1.546 12.984 625 HA THR 81 HA THR 81 -6.807 -2.816 15.595 626 HB THR 81 HB THR 81 -4.192 -1.826 15.437 627 HG1 THR 81 HG1 THR 81 -4.905 -2.783 12.883 628 1HG2 THR 81 1HG2 THR 81 -5.619 -4.362 15.125 629 2HG2 THR 81 2HG2 THR 81 -4.101 -4.024 15.957 630 3HG2 THR 81 3HG2 THR 81 -4.107 -4.319 14.218 631 H ALA 82 H ALA 82 -5.102 -1.517 17.281 632 HA ALA 82 HA ALA 82 -6.642 0.609 18.349 633 1HB ALA 82 1HB ALA 82 -4.649 -0.947 19.204 634 2HB ALA 82 2HB ALA 82 -4.955 0.619 19.958 635 3HB ALA 82 3HB ALA 82 -3.674 0.453 18.757 636 H GLY 83 H GLY 83 -7.051 2.090 16.560 637 1HA GLY 83 1HA GLY 83 -6.587 4.274 15.725 638 2HA GLY 83 2HA GLY 83 -4.919 4.101 16.267 639 H LEU 84 H LEU 84 -7.074 2.362 13.994 640 HA LEU 84 HA LEU 84 -6.683 1.615 11.798 641 1HB LEU 84 1HB LEU 84 -4.869 4.056 11.908 642 2HB LEU 84 2HB LEU 84 -5.466 3.301 10.434 643 HG LEU 84 HG LEU 84 -7.467 4.112 12.503 644 1HD1 LEU 84 1HD1 LEU 84 -5.906 5.990 10.721 645 2HD1 LEU 84 2HD1 LEU 84 -6.198 6.128 12.455 646 3HD1 LEU 84 3HD1 LEU 84 -7.517 6.389 11.314 647 1HD2 LEU 84 1HD2 LEU 84 -8.006 4.835 9.760 648 2HD2 LEU 84 2HD2 LEU 84 -8.862 3.686 10.788 649 3HD2 LEU 84 3HD2 LEU 84 -7.471 3.156 9.843 650 H LYS 85 H LYS 85 -3.509 2.711 11.274 651 HA LYS 85 HA LYS 85 -1.448 1.616 11.168 652 1HB LYS 85 1HB LYS 85 -2.742 0.871 13.720 653 2HB LYS 85 2HB LYS 85 -1.423 -0.186 13.212 654 1HG LYS 85 1HG LYS 85 0.146 1.435 13.514 655 2HG LYS 85 2HG LYS 85 -0.896 2.689 12.844 656 1HD LYS 85 1HD LYS 85 -1.994 1.756 15.337 657 2HD LYS 85 2HD LYS 85 -0.311 2.224 15.567 658 1HE LYS 85 1HE LYS 85 -0.740 4.441 15.139 659 2HE LYS 85 2HE LYS 85 -1.952 4.059 13.898 660 1HZ LYS 85 1HZ LYS 85 -3.202 4.820 15.712 661 2HZ LYS 85 2HZ LYS 85 -2.240 4.003 16.849 662 3HZ LYS 85 3HZ LYS 85 -3.295 3.129 15.846 663 H ARG 86 H ARG 86 -3.118 -1.197 12.530 664 HA ARG 86 HA ARG 86 -2.411 -2.712 10.070 665 1HB ARG 86 1HB ARG 86 -2.220 -3.169 12.807 666 2HB ARG 86 2HB ARG 86 -3.621 -4.132 12.340 667 1HG ARG 86 1HG ARG 86 -1.933 -4.744 10.308 668 2HG ARG 86 2HG ARG 86 -0.768 -4.465 11.601 669 1HD ARG 86 1HD ARG 86 -2.893 -5.986 12.727 670 2HD ARG 86 2HD ARG 86 -2.438 -6.758 11.198 671 HE ARG 86 HE ARG 86 -0.133 -5.905 12.775 672 1HH1 ARG 86 1HH1 ARG 86 -2.473 -8.427 12.239 673 2HH1 ARG 86 2HH1 ARG 86 -1.451 -9.664 12.883 674 1HH2 ARG 86 1HH2 ARG 86 1.176 -7.530 13.608 675 2HH2 ARG 86 2HH2 ARG 86 0.599 -9.163 13.652 676 H MET 87 H MET 87 -3.980 -3.636 8.757 677 HA MET 87 HA MET 87 -6.840 -3.292 9.589 678 1HB MET 87 1HB MET 87 -5.286 -2.370 7.234 679 2HB MET 87 2HB MET 87 -6.872 -3.048 6.866 680 1HG MET 87 1HG MET 87 -7.737 -1.527 8.777 681 2HG MET 87 2HG MET 87 -6.200 -0.679 8.610 682 1HE MET 87 1HE MET 87 -8.324 -2.160 5.232 683 2HE MET 87 2HE MET 87 -9.677 -1.216 5.854 684 3HE MET 87 3HE MET 87 -8.876 -2.398 6.890 685 H ARG 88 H ARG 88 -8.209 -5.009 9.012 686 HA ARG 88 HA ARG 88 -6.907 -7.332 7.624 687 1HB ARG 88 1HB ARG 88 -8.908 -7.297 9.918 688 2HB ARG 88 2HB ARG 88 -8.200 -8.743 9.198 689 1HG ARG 88 1HG ARG 88 -6.086 -8.314 10.096 690 2HG ARG 88 2HG ARG 88 -6.399 -6.587 10.268 691 1HD ARG 88 1HD ARG 88 -6.936 -6.990 12.437 692 2HD ARG 88 2HD ARG 88 -8.351 -7.890 11.856 693 HE ARG 88 HE ARG 88 -5.859 -9.417 11.708 694 1HH1 ARG 88 1HH1 ARG 88 -8.556 -8.488 13.703 695 2HH1 ARG 88 2HH1 ARG 88 -8.419 -9.876 14.725 696 1HH2 ARG 88 1HH2 ARG 88 -5.702 -11.211 13.049 697 2HH2 ARG 88 2HH2 ARG 88 -6.817 -11.407 14.360 698 H ILE 89 H ILE 89 -8.517 -8.779 6.554 699 HA ILE 89 HA ILE 89 -10.984 -7.295 5.701 700 HB ILE 89 HB ILE 89 -9.112 -9.117 4.138 701 1HG1 ILE 89 1HG1 ILE 89 -9.687 -6.151 3.862 702 2HG1 ILE 89 2HG1 ILE 89 -8.240 -6.830 4.608 703 1HG2 ILE 89 1HG2 ILE 89 -10.513 -8.531 2.197 704 2HG2 ILE 89 2HG2 ILE 89 -11.581 -7.597 3.244 705 3HG2 ILE 89 3HG2 ILE 89 -11.470 -9.347 3.432 706 1HD1 ILE 89 1HD1 ILE 89 -8.455 -6.194 1.948 707 2HD1 ILE 89 2HD1 ILE 89 -8.854 -7.912 1.932 708 3HD1 ILE 89 3HD1 ILE 89 -7.315 -7.371 2.601 709 H PHE 90 H PHE 90 -12.469 -8.408 7.017 710 HA PHE 90 HA PHE 90 -12.338 -11.375 7.134 711 1HB PHE 90 1HB PHE 90 -13.453 -9.112 8.689 712 2HB PHE 90 2HB PHE 90 -14.483 -10.542 8.650 713 HD1 PHE 90 HD1 PHE 90 -11.919 -8.993 10.427 714 HD2 PHE 90 HD2 PHE 90 -13.067 -12.847 8.916 715 HE1 PHE 90 HE1 PHE 90 -10.471 -10.086 12.117 716 HE2 PHE 90 HE2 PHE 90 -11.618 -13.941 10.607 717 HZ PHE 90 HZ PHE 90 -10.320 -12.559 12.207 718 H THR 91 H THR 91 -14.852 -12.210 7.297 719 HA THR 91 HA THR 91 -16.260 -11.186 4.852 720 HB THR 91 HB THR 91 -16.865 -13.693 4.617 721 HG1 THR 91 HG1 THR 91 -15.552 -15.091 5.723 722 1HG2 THR 91 1HG2 THR 91 -15.269 -12.642 3.116 723 2HG2 THR 91 2HG2 THR 91 -14.625 -14.210 3.603 724 3HG2 THR 91 3HG2 THR 91 -14.001 -12.733 4.339 725 H ILE 92 H ILE 92 -17.902 -10.061 5.970 726 HA ILE 92 HA ILE 92 -19.198 -10.819 8.359 727 HB ILE 92 HB ILE 92 -20.989 -9.307 7.490 728 1HG1 ILE 92 1HG1 ILE 92 -19.380 -9.314 4.922 729 2HG1 ILE 92 2HG1 ILE 92 -20.867 -10.236 5.142 730 1HG2 ILE 92 1HG2 ILE 92 -19.486 -7.787 8.224 731 2HG2 ILE 92 2HG2 ILE 92 -19.001 -7.600 6.539 732 3HG2 ILE 92 3HG2 ILE 92 -18.130 -8.718 7.589 733 1HD1 ILE 92 1HD1 ILE 92 -20.943 -7.344 5.867 734 2HD1 ILE 92 2HD1 ILE 92 -22.195 -8.354 5.143 735 3HD1 ILE 92 3HD1 ILE 92 -20.873 -7.740 4.150 736 H LYS 93 H LYS 93 -19.600 -12.068 5.107 737 HA LYS 93 HA LYS 93 -21.569 -14.040 6.165 738 1HB LYS 93 1HB LYS 93 -22.980 -13.584 4.140 739 2HB LYS 93 2HB LYS 93 -22.848 -12.181 5.200 740 1HG LYS 93 1HG LYS 93 -21.856 -10.968 3.578 741 2HG LYS 93 2HG LYS 93 -20.663 -12.235 3.292 742 1HD LYS 93 1HD LYS 93 -21.691 -12.556 1.302 743 2HD LYS 93 2HD LYS 93 -23.002 -13.294 2.221 744 1HE LYS 93 1HE LYS 93 -23.646 -10.669 2.521 745 2HE LYS 93 2HE LYS 93 -22.880 -10.626 0.922 746 1HZ LYS 93 1HZ LYS 93 -24.933 -12.613 1.755 747 2HZ LYS 93 2HZ LYS 93 -24.270 -12.429 0.203 748 3HZ LYS 93 3HZ LYS 93 -25.275 -11.220 0.846 749 HA PRO 94 HA PRO 94 -19.101 -16.909 3.918 750 1HB PRO 94 1HB PRO 94 -21.649 -18.263 3.177 751 2HB PRO 94 2HB PRO 94 -20.244 -18.912 4.041 752 1HG PRO 94 1HG PRO 94 -22.555 -18.331 5.281 753 2HG PRO 94 2HG PRO 94 -20.982 -18.156 6.071 754 1HD PRO 94 1HD PRO 94 -22.808 -16.068 5.009 755 2HD PRO 94 2HD PRO 94 -21.679 -15.999 6.378 756 H ILE 95 H ILE 95 -18.302 -16.577 1.880 757 HA ILE 95 HA ILE 95 -20.105 -15.456 -0.206 758 HB ILE 95 HB ILE 95 -17.092 -15.788 0.044 759 1HG1 ILE 95 1HG1 ILE 95 -18.790 -13.281 0.150 760 2HG1 ILE 95 2HG1 ILE 95 -18.255 -14.153 1.587 761 1HG2 ILE 95 1HG2 ILE 95 -17.706 -13.822 -1.863 762 2HG2 ILE 95 2HG2 ILE 95 -18.783 -15.168 -2.235 763 3HG2 ILE 95 3HG2 ILE 95 -17.039 -15.423 -2.182 764 1HD1 ILE 95 1HD1 ILE 95 -15.927 -13.889 0.094 765 2HD1 ILE 95 2HD1 ILE 95 -16.380 -12.890 1.475 766 3HD1 ILE 95 3HD1 ILE 95 -16.751 -12.351 -0.162 767 H ALA 96 H ALA 96 -20.438 -16.520 -2.186 768 HA ALA 96 HA ALA 96 -19.883 -19.422 -2.202 769 1HB ALA 96 1HB ALA 96 -21.270 -17.792 -4.337 770 2HB ALA 96 2HB ALA 96 -22.069 -18.123 -2.800 771 3HB ALA 96 3HB ALA 96 -21.589 -19.456 -3.850 772 H ILE 97 H ILE 97 -18.856 -20.453 -4.062 773 HA ILE 97 HA ILE 97 -16.466 -19.142 -4.977 774 HB ILE 97 HB ILE 97 -17.976 -21.618 -5.891 775 1HG1 ILE 97 1HG1 ILE 97 -15.482 -21.479 -4.200 776 2HG1 ILE 97 2HG1 ILE 97 -17.087 -21.392 -3.475 777 1HG2 ILE 97 1HG2 ILE 97 -15.145 -21.753 -6.333 778 2HG2 ILE 97 2HG2 ILE 97 -15.764 -20.290 -7.101 779 3HG2 ILE 97 3HG2 ILE 97 -16.443 -21.863 -7.522 780 1HD1 ILE 97 1HD1 ILE 97 -17.661 -23.539 -4.641 781 2HD1 ILE 97 2HD1 ILE 97 -16.359 -23.712 -3.464 782 3HD1 ILE 97 3HD1 ILE 97 -15.988 -23.642 -5.187 783 H GLY 98 H GLY 98 -16.522 -17.468 -6.429 784 1HA GLY 98 1HA GLY 98 -16.768 -16.936 -8.845 785 2HA GLY 98 2HA GLY 98 -18.330 -17.754 -8.794 786 H GLU 99 H GLU 99 -17.223 -15.618 -6.230 787 HA GLU 99 HA GLU 99 -19.380 -13.688 -7.026 788 1HB GLU 99 1HB GLU 99 -18.231 -14.496 -4.329 789 2HB GLU 99 2HB GLU 99 -19.460 -13.251 -4.550 790 1HG GLU 99 1HG GLU 99 -19.845 -16.045 -5.625 791 2HG GLU 99 2HG GLU 99 -20.274 -15.635 -3.965 792 H GLU 100 H GLU 100 -18.751 -11.540 -5.493 793 HA GLU 100 HA GLU 100 -15.918 -10.865 -6.207 794 1HB GLU 100 1HB GLU 100 -17.646 -9.943 -7.780 795 2HB GLU 100 2HB GLU 100 -18.399 -9.114 -6.417 796 1HG GLU 100 1HG GLU 100 -16.033 -8.103 -6.017 797 2HG GLU 100 2HG GLU 100 -15.704 -8.610 -7.673 798 H ILE 101 H ILE 101 -14.782 -9.933 -4.538 799 HA ILE 101 HA ILE 101 -16.187 -9.503 -1.974 800 HB ILE 101 HB ILE 101 -13.247 -9.245 -2.699 801 1HG1 ILE 101 1HG1 ILE 101 -14.827 -11.657 -1.755 802 2HG1 ILE 101 2HG1 ILE 101 -14.056 -11.469 -3.327 803 1HG2 ILE 101 1HG2 ILE 101 -14.244 -10.121 -0.026 804 2HG2 ILE 101 2HG2 ILE 101 -14.424 -8.415 -0.434 805 3HG2 ILE 101 3HG2 ILE 101 -12.824 -9.157 -0.433 806 1HD1 ILE 101 1HD1 ILE 101 -12.450 -12.706 -2.160 807 2HD1 ILE 101 2HD1 ILE 101 -12.780 -11.882 -0.636 808 3HD1 ILE 101 3HD1 ILE 101 -11.883 -11.055 -1.909 809 H THR 102 H THR 102 -16.696 -7.529 -1.203 810 HA THR 102 HA THR 102 -15.286 -5.084 -2.046 811 HB THR 102 HB THR 102 -17.724 -4.236 -2.715 812 HG1 THR 102 HG1 THR 102 -18.776 -6.147 -2.203 813 1HG2 THR 102 1HG2 THR 102 -16.660 -6.015 -4.824 814 2HG2 THR 102 2HG2 THR 102 -15.476 -4.920 -4.109 815 3HG2 THR 102 3HG2 THR 102 -16.938 -4.273 -4.854 816 H ILE 103 H ILE 103 -16.192 -3.170 -0.806 817 HA ILE 103 HA ILE 103 -17.732 -4.013 1.627 818 HB ILE 103 HB ILE 103 -16.142 -2.587 2.923 819 1HG1 ILE 103 1HG1 ILE 103 -14.327 -2.493 0.542 820 2HG1 ILE 103 2HG1 ILE 103 -15.606 -1.288 0.672 821 1HG2 ILE 103 1HG2 ILE 103 -15.025 -4.516 3.215 822 2HG2 ILE 103 2HG2 ILE 103 -14.085 -4.176 1.763 823 3HG2 ILE 103 3HG2 ILE 103 -15.586 -5.094 1.647 824 1HD1 ILE 103 1HD1 ILE 103 -14.711 -1.063 3.149 825 2HD1 ILE 103 2HD1 ILE 103 -13.889 -0.228 1.831 826 3HD1 ILE 103 3HD1 ILE 103 -13.239 -1.744 2.457 827 H SER 104 H SER 104 -18.767 -2.140 2.733 828 HA SER 104 HA SER 104 -19.748 -0.157 0.764 829 1HB SER 104 1HB SER 104 -20.563 -0.411 3.659 830 2HB SER 104 2HB SER 104 -21.550 0.063 2.277 831 HG SER 104 HG SER 104 -22.060 -1.942 2.072 832 H TYR 105 H TYR 105 -20.090 2.148 1.800 833 HA TYR 105 HA TYR 105 -17.617 2.890 3.331 834 1HB TYR 105 1HB TYR 105 -18.989 4.437 1.100 835 2HB TYR 105 2HB TYR 105 -17.465 4.855 1.879 836 HD1 TYR 105 HD1 TYR 105 -16.214 2.131 2.074 837 HD2 TYR 105 HD2 TYR 105 -18.344 4.030 -1.137 838 HE1 TYR 105 HE1 TYR 105 -15.002 0.719 0.434 839 HE2 TYR 105 HE2 TYR 105 -17.133 2.618 -2.776 840 HH TYR 105 HH TYR 105 -14.375 0.923 -2.058 841 H GLY 106 H GLY 106 -20.533 4.671 2.213 842 1HA GLY 106 1HA GLY 106 -22.130 5.866 3.447 843 2HA GLY 106 2HA GLY 106 -21.698 4.868 4.835 844 H ASP 107 H ASP 107 -21.958 6.973 6.013 845 HA ASP 107 HA ASP 107 -21.014 8.821 7.126 846 1HB ASP 107 1HB ASP 107 -18.842 6.958 6.359 847 2HB ASP 107 2HB ASP 107 -18.306 8.591 6.755 848 H ASP 108 H ASP 108 -18.408 8.711 4.729 849 HA ASP 108 HA ASP 108 -19.238 11.426 3.818 850 1HB ASP 108 1HB ASP 108 -16.821 10.186 4.567 851 2HB ASP 108 2HB ASP 108 -16.706 10.386 2.818 852 H TYR 109 H TYR 109 -18.291 8.229 2.540 853 HA TYR 109 HA TYR 109 -18.546 8.839 -0.233 854 1HB TYR 109 1HB TYR 109 -18.628 6.413 1.532 855 2HB TYR 109 2HB TYR 109 -19.071 6.227 -0.165 856 HD1 TYR 109 HD1 TYR 109 -16.357 6.832 2.197 857 HD2 TYR 109 HD2 TYR 109 -17.444 6.846 -1.959 858 HE1 TYR 109 HE1 TYR 109 -13.958 6.852 1.569 859 HE2 TYR 109 HE2 TYR 109 -15.045 6.866 -2.586 860 HH TYR 109 HH TYR 109 -12.585 6.127 -0.469 861 H TRP 110 H TRP 110 -20.324 8.786 -1.614 862 HA TRP 110 HA TRP 110 -22.999 8.414 -0.319 863 1HB TRP 110 1HB TRP 110 -23.605 10.004 -2.389 864 2HB TRP 110 2HB TRP 110 -23.027 10.666 -0.867 865 HD1 TRP 110 HD1 TRP 110 -21.215 12.390 -1.162 866 HE1 TRP 110 HE1 TRP 110 -19.321 12.832 -2.852 867 HE3 TRP 110 HE3 TRP 110 -21.882 8.420 -4.311 868 HZ2 TRP 110 HZ2 TRP 110 -18.232 11.658 -5.222 869 HZ3 TRP 110 HZ3 TRP 110 -20.412 8.105 -6.254 870 HH2 TRP 110 HH2 TRP 110 -18.585 9.716 -6.728 871 H LEU 111 H LEU 111 -21.517 6.261 -1.546 872 HA LEU 111 HA LEU 111 -22.099 5.695 -4.226 873 1HB LEU 111 1HB LEU 111 -20.771 4.399 -2.444 874 2HB LEU 111 2HB LEU 111 -22.314 3.726 -1.924 875 HG LEU 111 HG LEU 111 -21.031 2.279 -3.551 876 1HD1 LEU 111 1HD1 LEU 111 -23.459 2.922 -5.073 877 2HD1 LEU 111 2HD1 LEU 111 -23.736 2.747 -3.341 878 3HD1 LEU 111 3HD1 LEU 111 -23.007 1.429 -4.254 879 1HD2 LEU 111 1HD2 LEU 111 -20.545 2.949 -5.694 880 2HD2 LEU 111 2HD2 LEU 111 -20.477 4.526 -4.906 881 3HD2 LEU 111 3HD2 LEU 111 -21.930 4.039 -5.779 882 H SER 112 H SER 112 -23.890 4.823 -5.305 883 HA SER 112 HA SER 112 -26.152 4.360 -5.742 884 1HB SER 112 1HB SER 112 -25.542 3.332 -3.038 885 2HB SER 112 2HB SER 112 -27.255 3.614 -3.332 886 HG SER 112 HG SER 112 -27.244 1.883 -4.482 887 H ARG 113 H ARG 113 -27.743 5.828 -6.047 888 HA ARG 113 HA ARG 113 -27.881 8.230 -4.456 889 1HB ARG 113 1HB ARG 113 -28.838 7.169 -6.970 890 2HB ARG 113 2HB ARG 113 -30.095 8.093 -6.146 891 1HG ARG 113 1HG ARG 113 -28.487 9.978 -5.878 892 2HG ARG 113 2HG ARG 113 -27.290 9.057 -6.788 893 1HD ARG 113 1HD ARG 113 -30.025 9.556 -7.963 894 2HD ARG 113 2HD ARG 113 -28.749 10.780 -8.098 895 HE ARG 113 HE ARG 113 -28.780 8.176 -9.436 896 1HH1 ARG 113 1HH1 ARG 113 -26.802 10.738 -8.152 897 2HH1 ARG 113 2HH1 ARG 113 -25.457 10.359 -9.171 898 1HH2 ARG 113 1HH2 ARG 113 -27.021 7.705 -10.748 899 2HH2 ARG 113 2HH2 ARG 113 -25.578 8.656 -10.630 900 HA PRO 114 HA PRO 114 -32.096 6.504 -3.138 901 1HB PRO 114 1HB PRO 114 -32.727 3.924 -3.824 902 2HB PRO 114 2HB PRO 114 -33.065 5.307 -4.881 903 1HG PRO 114 1HG PRO 114 -30.893 3.287 -5.030 904 2HG PRO 114 2HG PRO 114 -31.756 4.118 -6.333 905 1HD PRO 114 1HD PRO 114 -29.218 4.771 -5.414 906 2HD PRO 114 2HD PRO 114 -30.264 5.852 -6.335 907 H ARG 115 H ARG 115 -29.201 4.669 -2.922 908 HA ARG 115 HA ARG 115 -28.270 3.451 -1.133 909 1HB ARG 115 1HB ARG 115 -30.410 4.976 0.371 910 2HB ARG 115 2HB ARG 115 -28.929 4.318 1.043 911 1HG ARG 115 1HG ARG 115 -29.188 6.563 -0.965 912 2HG ARG 115 2HG ARG 115 -28.536 6.643 0.662 913 1HD ARG 115 1HD ARG 115 -27.305 5.119 -1.647 914 2HD ARG 115 2HD ARG 115 -26.677 6.615 -0.925 915 HE ARG 115 HE ARG 115 -26.495 3.942 0.248 916 1HH1 ARG 115 1HH1 ARG 115 -26.665 7.360 0.886 917 2HH1 ARG 115 2HH1 ARG 115 -25.890 7.223 2.426 918 1HH2 ARG 115 1HH2 ARG 115 -25.492 3.789 2.251 919 2HH2 ARG 115 2HH2 ARG 115 -25.230 5.217 3.196 920 H LEU 116 H LEU 116 -29.722 2.552 1.237 921 HA LEU 116 HA LEU 116 -31.543 0.521 -0.014 922 1HB LEU 116 1HB LEU 116 -29.291 0.394 1.968 923 2HB LEU 116 2HB LEU 116 -30.599 -0.780 2.116 924 HG LEU 116 HG LEU 116 -28.980 -0.268 -0.400 925 1HD1 LEU 116 1HD1 LEU 116 -27.473 -1.643 0.565 926 2HD1 LEU 116 2HD1 LEU 116 -28.684 -2.920 0.453 927 3HD1 LEU 116 3HD1 LEU 116 -28.547 -1.962 1.927 928 1HD2 LEU 116 1HD2 LEU 116 -30.205 -2.602 -0.848 929 2HD2 LEU 116 2HD2 LEU 116 -30.976 -1.066 -1.244 930 3HD2 LEU 116 3HD2 LEU 116 -31.394 -1.903 0.251 931 H THR 117 H THR 117 -32.856 2.725 0.791 932 HA THR 117 HA THR 117 -33.975 1.977 3.472 933 HB THR 117 HB THR 117 -33.688 4.751 2.261 934 HG1 THR 117 HG1 THR 117 -31.772 4.798 3.096 935 1HG2 THR 117 1HG2 THR 117 -35.055 5.348 3.947 936 2HG2 THR 117 2HG2 THR 117 -33.848 4.762 5.093 937 3HG2 THR 117 3HG2 THR 117 -35.119 3.682 4.520 938 H GLN 118 H GLN 118 -36.051 1.284 3.185 939 HA GLN 118 HA GLN 118 -38.225 1.082 2.284 940 1HB GLN 118 1HB GLN 118 -37.452 3.859 2.573 941 2HB GLN 118 2HB GLN 118 -38.548 3.687 1.202 942 1HG GLN 118 1HG GLN 118 -39.883 2.145 2.912 943 2HG GLN 118 2HG GLN 118 -39.033 3.130 4.103 944 1HE2 GLN 118 1HE2 GLN 118 -41.929 3.019 2.567 945 2HE2 GLN 118 2HE2 GLN 118 -42.276 4.677 2.449 946 H ASN 119 H ASN 119 -39.473 1.941 0.072 947 HA ASN 119 HA ASN 119 -37.585 1.532 -2.216 948 1HB ASN 119 1HB ASN 119 -39.977 -0.034 -1.307 949 2HB ASN 119 2HB ASN 119 -39.696 0.108 -3.042 950 1HD2 ASN 119 1HD2 ASN 119 -39.416 -2.435 -2.234 951 2HD2 ASN 119 2HD2 ASN 119 -37.790 -2.883 -2.040 952 1H GLY 201 1H GLY 201 -29.008 32.814 -12.997 953 2H GLY 201 2H GLY 201 -27.649 33.493 -12.238 954 3H GLY 201 3H GLY 201 -29.160 33.530 -11.465 955 1HA GLY 201 1HA GLY 201 -27.479 31.795 -10.687 956 2HA GLY 201 2HA GLY 201 -29.138 31.274 -10.984 957 H LYS 202 H LYS 202 -26.286 30.027 -11.318 958 HA LYS 202 HA LYS 202 -26.970 28.335 -13.563 959 1HB LYS 202 1HB LYS 202 -25.605 30.860 -14.013 960 2HB LYS 202 2HB LYS 202 -24.582 29.514 -14.517 961 1HG LYS 202 1HG LYS 202 -26.965 28.703 -15.530 962 2HG LYS 202 2HG LYS 202 -27.165 30.452 -15.637 963 1HD LYS 202 1HD LYS 202 -25.635 30.632 -17.301 964 2HD LYS 202 2HD LYS 202 -24.514 29.529 -16.503 965 1HE LYS 202 1HE LYS 202 -27.025 28.430 -17.754 966 2HE LYS 202 2HE LYS 202 -25.614 28.782 -18.769 967 1HZ LYS 202 1HZ LYS 202 -25.425 26.552 -17.911 968 2HZ LYS 202 2HZ LYS 202 -25.674 27.091 -16.320 969 3HZ LYS 202 3HZ LYS 202 -24.257 27.523 -17.150 970 H ALA 203 H ALA 203 -23.837 29.657 -12.437 971 HA ALA 203 HA ALA 203 -23.084 26.871 -11.615 972 1HB ALA 203 1HB ALA 203 -20.734 27.859 -12.019 973 2HB ALA 203 2HB ALA 203 -21.563 29.238 -12.742 974 3HB ALA 203 3HB ALA 203 -21.743 27.632 -13.448 975 HA PRO 204 HA PRO 204 -23.300 29.271 -7.702 976 1HB PRO 204 1HB PRO 204 -23.550 26.966 -6.159 977 2HB PRO 204 2HB PRO 204 -24.915 27.889 -6.811 978 1HG PRO 204 1HG PRO 204 -23.666 25.384 -7.807 979 2HG PRO 204 2HG PRO 204 -25.364 25.881 -7.817 980 1HD PRO 204 1HD PRO 204 -23.788 25.946 -10.025 981 2HD PRO 204 2HD PRO 204 -25.133 27.077 -9.764 982 H ARG 205 H ARG 205 -21.522 29.682 -6.387 983 HA ARG 205 HA ARG 205 -19.091 28.046 -6.873 984 1HB ARG 205 1HB ARG 205 -19.079 30.515 -7.135 985 2HB ARG 205 2HB ARG 205 -19.567 30.693 -5.450 986 1HG ARG 205 1HG ARG 205 -17.497 29.511 -4.748 987 2HG ARG 205 2HG ARG 205 -17.003 29.406 -6.438 988 1HD ARG 205 1HD ARG 205 -17.121 31.928 -6.555 989 2HD ARG 205 2HD ARG 205 -17.395 31.936 -4.802 990 HE ARG 205 HE ARG 205 -15.167 30.267 -5.252 991 1HH1 ARG 205 1HH1 ARG 205 -16.045 33.598 -5.750 992 2HH1 ARG 205 2HH1 ARG 205 -14.420 34.165 -5.588 993 1HH2 ARG 205 1HH2 ARG 205 -13.066 31.027 -5.046 994 2HH2 ARG 205 2HH2 ARG 205 -12.743 32.722 -5.192 995 H LYS 206 H LYS 206 -20.323 29.714 -3.949 996 HA LYS 206 HA LYS 206 -20.311 29.014 -1.692 997 1HB LYS 206 1HB LYS 206 -21.069 26.651 -3.391 998 2HB LYS 206 2HB LYS 206 -20.862 26.413 -1.655 999 1HG LYS 206 1HG LYS 206 -22.782 27.518 -1.170 1000 2HG LYS 206 2HG LYS 206 -22.425 28.809 -2.317 1001 1HD LYS 206 1HD LYS 206 -24.375 27.724 -3.165 1002 2HD LYS 206 2HD LYS 206 -23.041 27.139 -4.160 1003 1HE LYS 206 1HE LYS 206 -23.347 25.475 -1.796 1004 2HE LYS 206 2HE LYS 206 -24.859 25.549 -2.720 1005 1HZ LYS 206 1HZ LYS 206 -23.516 23.872 -3.713 1006 2HZ LYS 206 2HZ LYS 206 -22.146 24.877 -3.732 1007 3HZ LYS 206 3HZ LYS 206 -23.461 25.213 -4.752 1008 H GLN 207 H GLN 207 -19.339 26.888 -0.352 1009 HA GLN 207 HA GLN 207 -16.514 27.198 -0.375 1010 1HB GLN 207 1HB GLN 207 -16.611 25.239 1.152 1011 2HB GLN 207 2HB GLN 207 -17.899 26.387 1.516 1012 1HG GLN 207 1HG GLN 207 -19.490 25.036 0.213 1013 2HG GLN 207 2HG GLN 207 -18.204 23.902 -0.200 1014 1HE2 GLN 207 1HE2 GLN 207 -19.173 25.478 2.908 1015 2HE2 GLN 207 2HE2 GLN 207 -19.274 24.024 3.779 1016 H LEU 208 H LEU 208 -15.342 24.718 -0.392 1017 HA LEU 208 HA LEU 208 -15.983 23.455 -3.016 1018 1HB LEU 208 1HB LEU 208 -13.702 25.183 -2.287 1019 2HB LEU 208 2HB LEU 208 -13.228 23.666 -3.052 1020 HG LEU 208 HG LEU 208 -15.522 25.030 -4.323 1021 1HD1 LEU 208 1HD1 LEU 208 -14.542 26.998 -4.863 1022 2HD1 LEU 208 2HD1 LEU 208 -12.997 26.220 -5.207 1023 3HD1 LEU 208 3HD1 LEU 208 -13.411 26.664 -3.551 1024 1HD2 LEU 208 1HD2 LEU 208 -14.453 24.252 -6.321 1025 2HD2 LEU 208 2HD2 LEU 208 -14.255 22.968 -5.129 1026 3HD2 LEU 208 3HD2 LEU 208 -12.909 24.047 -5.493 1027 H ALA 209 H ALA 209 -16.624 21.654 -1.572 1028 HA ALA 209 HA ALA 209 -16.198 19.633 -0.422 1029 1HB ALA 209 1HB ALA 209 -14.494 18.424 -1.469 1030 2HB ALA 209 2HB ALA 209 -13.391 19.800 -1.482 1031 3HB ALA 209 3HB ALA 209 -14.723 19.727 -2.635 1032 H THR 210 H THR 210 -16.216 20.486 1.743 1033 HA THR 210 HA THR 210 -13.901 21.749 2.944 1034 HB THR 210 HB THR 210 -16.253 20.310 4.224 1035 HG1 THR 210 HG1 THR 210 -15.971 22.889 3.110 1036 1HG2 THR 210 1HG2 THR 210 -15.809 22.324 5.867 1037 2HG2 THR 210 2HG2 THR 210 -14.200 22.299 5.144 1038 3HG2 THR 210 3HG2 THR 210 -14.816 20.870 5.975 1039 H LYS 211 H LYS 211 -15.276 18.447 3.147 1040 HA LYS 211 HA LYS 211 -12.603 17.521 4.150 1041 1HB LYS 211 1HB LYS 211 -14.609 17.677 5.780 1042 2HB LYS 211 2HB LYS 211 -15.290 16.325 4.874 1043 1HG LYS 211 1HG LYS 211 -13.679 14.841 5.612 1044 2HG LYS 211 2HG LYS 211 -12.455 16.098 5.793 1045 1HD LYS 211 1HD LYS 211 -13.258 16.766 7.877 1046 2HD LYS 211 2HD LYS 211 -14.880 16.151 7.562 1047 1HE LYS 211 1HE LYS 211 -12.967 13.977 7.452 1048 2HE LYS 211 2HE LYS 211 -12.835 14.838 8.998 1049 1HZ LYS 211 1HZ LYS 211 -14.623 13.102 8.918 1050 2HZ LYS 211 2HZ LYS 211 -15.424 14.055 7.763 1051 3HZ LYS 211 3HZ LYS 211 -15.170 14.655 9.332 1052 H ALA 212 H ALA 212 -11.722 15.958 2.856 1053 HA ALA 212 HA ALA 212 -12.871 15.028 0.446 1054 1HB ALA 212 1HB ALA 212 -10.836 13.974 0.286 1055 2HB ALA 212 2HB ALA 212 -10.994 13.227 1.876 1056 3HB ALA 212 3HB ALA 212 -10.460 14.902 1.738 1057 H ALA 213 H ALA 213 -13.654 12.843 -0.083 1058 HA ALA 213 HA ALA 213 -15.569 11.839 1.879 1059 1HB ALA 213 1HB ALA 213 -15.751 12.016 -0.687 1060 2HB ALA 213 2HB ALA 213 -16.299 10.500 0.029 1061 3HB ALA 213 3HB ALA 213 -14.719 10.587 -0.748 1062 H ARG 214 H ARG 214 -14.708 10.673 3.581 1063 HA ARG 214 HA ARG 214 -12.571 8.667 2.979 1064 1HB ARG 214 1HB ARG 214 -12.969 10.649 4.968 1065 2HB ARG 214 2HB ARG 214 -13.167 9.098 5.783 1066 1HG ARG 214 1HG ARG 214 -10.933 8.815 5.772 1067 2HG ARG 214 2HG ARG 214 -10.940 8.869 4.010 1068 1HD ARG 214 1HD ARG 214 -9.493 10.656 4.677 1069 2HD ARG 214 2HD ARG 214 -11.031 11.449 4.284 1070 HE ARG 214 HE ARG 214 -10.877 10.560 7.063 1071 1HH1 ARG 214 1HH1 ARG 214 -10.106 13.102 4.813 1072 2HH1 ARG 214 2HH1 ARG 214 -10.072 14.325 6.036 1073 1HH2 ARG 214 1HH2 ARG 214 -10.827 12.165 8.633 1074 2HH2 ARG 214 2HH2 ARG 214 -10.477 13.801 8.183 1075 1HN MLZ 215 1HN MLZ 215 -12.778 6.576 4.205 1076 HA MLZ 215 HA MLZ 215 -15.517 5.532 3.973 1077 1HB MLZ 215 1HB MLZ 215 -12.727 4.511 4.398 1078 2HB MLZ 215 2HB MLZ 215 -14.073 3.451 4.818 1079 1HG MLZ 215 1HG MLZ 215 -14.379 4.803 2.219 1080 2HG MLZ 215 2HG MLZ 215 -14.629 3.109 2.642 1081 1HD MLZ 215 1HD MLZ 215 -11.988 4.481 2.072 1082 2HD MLZ 215 2HD MLZ 215 -12.119 2.846 2.721 1083 1HE MLZ 215 1HE MLZ 215 -13.687 3.509 0.251 1084 2HE MLZ 215 2HE MLZ 215 -12.926 1.978 0.726 1085 HZ MLZ 215 HZ MLZ 215 -10.821 2.767 0.188 1086 1HCM MLZ 215 1HCM MLZ 215 -12.880 3.687 -1.693 1087 2HCM MLZ 215 2HCM MLZ 215 -11.709 2.386 -1.874 1088 3HCM MLZ 215 3HCM MLZ 215 -11.193 4.062 -2.023 1089 H SER 216 H SER 216 -16.855 5.021 5.690 1090 HA SER 216 HA SER 216 -17.645 4.911 7.911 1091 1HB SER 216 1HB SER 216 -15.300 6.749 8.483 1092 2HB SER 216 2HB SER 216 -16.757 7.307 7.661 1093 HG SER 216 HG SER 216 -16.554 7.422 10.105 1094 H ALA 217 H ALA 217 -16.986 4.139 10.131 1095 HA ALA 217 HA ALA 217 -14.619 2.317 9.920 1096 1HB ALA 217 1HB ALA 217 -13.691 3.227 11.826 1097 2HB ALA 217 2HB ALA 217 -15.264 3.568 12.547 1098 3HB ALA 217 3HB ALA 217 -14.605 4.647 11.317 1099 HA PRO 218 HA PRO 218 -17.348 -0.826 11.326 1100 1HB PRO 218 1HB PRO 218 -15.197 -1.736 13.171 1101 2HB PRO 218 2HB PRO 218 -16.001 -2.621 11.863 1102 1HG PRO 218 1HG PRO 218 -13.481 -1.716 11.653 1103 2HG PRO 218 2HG PRO 218 -14.575 -1.813 10.266 1104 1HD PRO 218 1HD PRO 218 -13.679 0.565 11.809 1105 2HD PRO 218 2HD PRO 218 -14.092 0.418 10.088 1106 H ALA 219 H ALA 219 -15.489 0.976 13.751 1107 HA ALA 219 HA ALA 219 -17.737 0.580 15.695 1108 1HB ALA 219 1HB ALA 219 -15.748 -0.243 16.655 1109 2HB ALA 219 2HB ALA 219 -15.795 1.410 17.267 1110 3HB ALA 219 3HB ALA 219 -14.758 1.006 15.899 1111 H THR 220 H THR 220 -19.028 2.354 14.923 1112 HA THR 220 HA THR 220 -17.760 5.062 15.092 1113 HB THR 220 HB THR 220 -19.812 5.675 13.729 1114 HG1 THR 220 HG1 THR 220 -21.316 4.234 13.719 1115 1HG2 THR 220 1HG2 THR 220 -18.054 5.387 12.281 1116 2HG2 THR 220 2HG2 THR 220 -19.010 3.994 11.776 1117 3HG2 THR 220 3HG2 THR 220 -17.670 3.782 12.903 1118 H GLY 221 H GLY 221 -18.400 3.848 17.548 1119 1HA GLY 221 1HA GLY 221 -19.499 5.417 19.276 1120 2HA GLY 221 2HA GLY 221 -20.964 5.172 18.326 1121 1H MET 1 1H MET 1 0.852 -11.189 7.932 1122 2H MET 1 2H MET 1 1.412 -12.485 8.875 1123 3H MET 1 3H MET 1 1.805 -12.403 7.225 1124 HA MET 1 HA MET 1 2.991 -10.244 7.738 1125 1HB MET 1 1HB MET 1 2.024 -11.275 10.381 1126 2HB MET 1 2HB MET 1 3.581 -10.448 10.348 1127 1HG MET 1 1HG MET 1 1.045 -9.298 9.151 1128 2HG MET 1 2HG MET 1 1.604 -8.932 10.783 1129 1HE MET 1 1HE MET 1 0.933 -7.434 8.096 1130 2HE MET 1 2HE MET 1 2.102 -8.025 6.915 1131 3HE MET 1 3HE MET 1 2.220 -6.373 7.522 1132 H PHE 2 H PHE 2 3.076 -13.534 9.057 1133 HA PHE 2 HA PHE 2 5.983 -13.662 8.324 1134 1HB PHE 2 1HB PHE 2 6.073 -15.317 10.293 1135 2HB PHE 2 2HB PHE 2 5.838 -13.624 10.717 1136 HD1 PHE 2 HD1 PHE 2 4.335 -16.959 10.659 1137 HD2 PHE 2 HD2 PHE 2 3.592 -12.788 11.369 1138 HE1 PHE 2 HE1 PHE 2 2.216 -17.532 11.815 1139 HE2 PHE 2 HE2 PHE 2 1.474 -13.360 12.523 1140 HZ PHE 2 HZ PHE 2 0.786 -15.730 12.746 1141 H ASN 3 H ASN 3 6.028 -14.927 6.506 1142 HA ASN 3 HA ASN 3 4.336 -17.405 6.477 1143 1HB ASN 3 1HB ASN 3 3.763 -15.722 4.773 1144 2HB ASN 3 2HB ASN 3 5.444 -15.662 4.243 1145 1HD2 ASN 3 1HD2 ASN 3 2.470 -17.118 3.569 1146 2HD2 ASN 3 2HD2 ASN 3 3.033 -18.452 2.684 1147 H ASP 4 H ASP 4 5.366 -19.344 5.729 1148 HA ASP 4 HA ASP 4 7.962 -19.922 6.547 1149 1HB ASP 4 1HB ASP 4 7.733 -21.867 5.021 1150 2HB ASP 4 2HB ASP 4 6.214 -21.541 5.856 1151 H ARG 5 H ARG 5 6.958 -18.367 3.551 1152 HA ARG 5 HA ARG 5 9.514 -18.692 2.192 1153 1HB ARG 5 1HB ARG 5 6.891 -17.339 1.818 1154 2HB ARG 5 2HB ARG 5 8.251 -16.614 0.961 1155 1HG ARG 5 1HG ARG 5 8.518 -19.402 0.610 1156 2HG ARG 5 2HG ARG 5 6.811 -19.046 0.350 1157 1HD ARG 5 1HD ARG 5 7.678 -17.077 -1.130 1158 2HD ARG 5 2HD ARG 5 9.207 -17.976 -1.141 1159 HE ARG 5 HE ARG 5 8.152 -19.630 -2.468 1160 1HH1 ARG 5 1HH1 ARG 5 5.792 -17.600 -0.910 1161 2HH1 ARG 5 2HH1 ARG 5 4.461 -18.317 -1.749 1162 1HH2 ARG 5 1HH2 ARG 5 6.407 -20.545 -3.544 1163 2HH2 ARG 5 2HH2 ARG 5 4.803 -19.972 -3.229 1164 H VAL 6 H VAL 6 7.908 -15.971 3.880 1165 HA VAL 6 HA VAL 6 10.562 -14.876 4.602 1166 HB VAL 6 HB VAL 6 9.961 -12.687 3.539 1167 1HG1 VAL 6 1HG1 VAL 6 9.769 -14.908 1.496 1168 2HG1 VAL 6 2HG1 VAL 6 11.267 -14.551 2.356 1169 3HG1 VAL 6 3HG1 VAL 6 10.534 -13.329 1.316 1170 1HG2 VAL 6 1HG2 VAL 6 7.560 -14.306 2.678 1171 2HG2 VAL 6 2HG2 VAL 6 8.075 -12.869 1.794 1172 3HG2 VAL 6 3HG2 VAL 6 7.588 -12.737 3.484 1173 H ILE 7 H ILE 7 10.373 -13.224 6.277 1174 HA ILE 7 HA ILE 7 7.652 -13.055 7.529 1175 HB ILE 7 HB ILE 7 9.140 -14.683 8.662 1176 1HG1 ILE 7 1HG1 ILE 7 8.982 -12.164 10.332 1177 2HG1 ILE 7 2HG1 ILE 7 7.562 -13.135 9.943 1178 1HG2 ILE 7 1HG2 ILE 7 11.344 -14.288 8.905 1179 2HG2 ILE 7 2HG2 ILE 7 11.024 -12.783 9.767 1180 3HG2 ILE 7 3HG2 ILE 7 11.118 -12.788 8.007 1181 1HD1 ILE 7 1HD1 ILE 7 9.840 -14.709 10.939 1182 2HD1 ILE 7 2HD1 ILE 7 8.141 -14.772 11.407 1183 3HD1 ILE 7 3HD1 ILE 7 9.205 -13.555 12.112 1184 H VAL 8 H VAL 8 7.295 -11.089 8.766 1185 HA VAL 8 HA VAL 8 8.909 -8.803 7.760 1186 HB VAL 8 HB VAL 8 6.455 -8.828 7.485 1187 1HG1 VAL 8 1HG1 VAL 8 5.112 -9.619 9.109 1188 2HG1 VAL 8 2HG1 VAL 8 5.687 -8.381 10.225 1189 3HG1 VAL 8 3HG1 VAL 8 6.538 -9.919 10.102 1190 1HG2 VAL 8 1HG2 VAL 8 6.362 -6.595 7.841 1191 2HG2 VAL 8 2HG2 VAL 8 7.984 -6.751 8.517 1192 3HG2 VAL 8 3HG2 VAL 8 6.579 -6.789 9.581 1193 H LYS 9 H LYS 9 10.218 -7.626 9.098 1194 HA LYS 9 HA LYS 9 9.983 -8.037 12.054 1195 1HB LYS 9 1HB LYS 9 12.503 -7.835 10.375 1196 2HB LYS 9 2HB LYS 9 12.434 -8.128 12.111 1197 1HG LYS 9 1HG LYS 9 10.743 -10.059 10.935 1198 2HG LYS 9 2HG LYS 9 12.204 -10.026 9.950 1199 1HD LYS 9 1HD LYS 9 13.581 -10.628 11.743 1200 2HD LYS 9 2HD LYS 9 12.426 -10.058 12.946 1201 1HE LYS 9 1HE LYS 9 11.016 -12.037 11.568 1202 2HE LYS 9 2HE LYS 9 12.652 -12.704 11.733 1203 1HZ LYS 9 1HZ LYS 9 11.293 -13.118 13.720 1204 2HZ LYS 9 2HZ LYS 9 11.073 -11.446 13.922 1205 3HZ LYS 9 3HZ LYS 9 12.623 -12.123 14.073 1206 H LYS 10 H LYS 10 10.562 -4.498 12.469 1207 HA LYS 10 HA LYS 10 10.186 -5.474 14.553 1208 1HB LYS 10 1HB LYS 10 8.531 -6.852 12.526 1209 2HB LYS 10 2HB LYS 10 8.701 -7.717 14.054 1210 1HG LYS 10 1HG LYS 10 7.665 -6.029 15.276 1211 2HG LYS 10 2HG LYS 10 8.095 -4.780 14.107 1212 1HD LYS 10 1HD LYS 10 6.474 -5.708 12.503 1213 2HD LYS 10 2HD LYS 10 6.058 -6.983 13.648 1214 1HE LYS 10 1HE LYS 10 5.601 -4.921 15.269 1215 2HE LYS 10 2HE LYS 10 5.374 -4.064 13.732 1216 1HZ LYS 10 1HZ LYS 10 4.132 -6.694 14.344 1217 2HZ LYS 10 2HZ LYS 10 3.789 -5.671 13.033 1218 3HZ LYS 10 3HZ LYS 10 3.339 -5.215 14.606 1219 H SER 11 H SER 11 12.685 -5.973 14.117 1220 HA SER 11 HA SER 11 13.096 -8.933 14.373 1221 1HB SER 11 1HB SER 11 15.057 -8.634 13.155 1222 2HB SER 11 2HB SER 11 14.116 -7.294 12.504 1223 HG SER 11 HG SER 11 15.085 -6.088 14.360 1224 HA PRO 12 HA PRO 12 14.980 -8.538 18.325 1225 1HB PRO 12 1HB PRO 12 17.738 -9.123 17.422 1226 2HB PRO 12 2HB PRO 12 16.691 -10.064 18.498 1227 1HG PRO 12 1HG PRO 12 17.286 -10.844 15.987 1228 2HG PRO 12 2HG PRO 12 15.748 -11.227 16.774 1229 1HD PRO 12 1HD PRO 12 16.351 -9.194 14.682 1230 2HD PRO 12 2HD PRO 12 14.891 -10.176 14.922 1231 H LEU 13 H LEU 13 17.674 -7.447 16.217 1232 HA LEU 13 HA LEU 13 17.710 -4.887 17.784 1233 1HB LEU 13 1HB LEU 13 19.661 -6.914 17.271 1234 2HB LEU 13 2HB LEU 13 20.179 -5.456 16.425 1235 HG LEU 13 HG LEU 13 19.192 -5.245 19.253 1236 1HD1 LEU 13 1HD1 LEU 13 20.846 -6.602 19.978 1237 2HD1 LEU 13 2HD1 LEU 13 21.977 -5.374 19.409 1238 3HD1 LEU 13 3HD1 LEU 13 21.542 -6.725 18.362 1239 1HD2 LEU 13 1HD2 LEU 13 20.012 -3.408 17.415 1240 2HD2 LEU 13 2HD2 LEU 13 21.537 -3.750 18.234 1241 3HD2 LEU 13 3HD2 LEU 13 20.149 -3.174 19.158 1242 H GLY 14 H GLY 14 17.632 -6.355 14.611 1243 1HA GLY 14 1HA GLY 14 18.495 -4.090 13.080 1244 2HA GLY 14 2HA GLY 14 17.499 -5.409 12.467 1245 H GLY 15 H GLY 15 16.870 -2.954 11.531 1246 1HA GLY 15 1HA GLY 15 14.738 -1.805 13.231 1247 2HA GLY 15 2HA GLY 15 15.316 -1.134 11.706 1248 H TYR 16 H TYR 16 13.002 -0.993 11.103 1249 HA TYR 16 HA TYR 16 11.403 -3.406 10.827 1250 1HB TYR 16 1HB TYR 16 11.245 -0.507 10.323 1251 2HB TYR 16 2HB TYR 16 10.348 -1.467 9.147 1252 HD1 TYR 16 HD1 TYR 16 11.016 -1.713 12.840 1253 HD2 TYR 16 HD2 TYR 16 8.099 -1.686 9.686 1254 HE1 TYR 16 HE1 TYR 16 9.212 -2.070 14.504 1255 HE2 TYR 16 HE2 TYR 16 6.296 -2.042 11.351 1256 HH TYR 16 HH TYR 16 6.228 -1.427 14.144 1257 H GLY 17 H GLY 17 12.985 -4.740 9.599 1258 1HA GLY 17 1HA GLY 17 13.016 -4.023 6.692 1259 2HA GLY 17 2HA GLY 17 14.366 -4.853 7.470 1260 H VAL 18 H VAL 18 13.758 -6.472 5.636 1261 HA VAL 18 HA VAL 18 11.481 -8.204 6.530 1262 HB VAL 18 HB VAL 18 12.921 -7.819 3.885 1263 1HG1 VAL 18 1HG1 VAL 18 12.271 -10.182 4.153 1264 2HG1 VAL 18 2HG1 VAL 18 11.240 -9.393 2.960 1265 3HG1 VAL 18 3HG1 VAL 18 10.635 -9.689 4.590 1266 1HG2 VAL 18 1HG2 VAL 18 11.409 -6.024 4.277 1267 2HG2 VAL 18 2HG2 VAL 18 10.194 -7.103 4.963 1268 3HG2 VAL 18 3HG2 VAL 18 10.532 -7.145 3.233 1269 H PHE 19 H PHE 19 11.865 -10.436 6.851 1270 HA PHE 19 HA PHE 19 14.757 -11.214 6.995 1271 1HB PHE 19 1HB PHE 19 12.392 -11.503 8.715 1272 2HB PHE 19 2HB PHE 19 13.273 -13.015 8.500 1273 HD1 PHE 19 HD1 PHE 19 14.709 -13.401 10.296 1274 HD2 PHE 19 HD2 PHE 19 14.323 -9.416 8.739 1275 HE1 PHE 19 HE1 PHE 19 16.451 -12.615 11.877 1276 HE2 PHE 19 HE2 PHE 19 16.066 -8.631 10.320 1277 HZ PHE 19 HZ PHE 19 17.129 -10.230 11.888 1278 H ALA 20 H ALA 20 15.357 -12.678 5.456 1279 HA ALA 20 HA ALA 20 13.273 -14.144 3.951 1280 1HB ALA 20 1HB ALA 20 14.825 -14.007 2.281 1281 2HB ALA 20 2HB ALA 20 16.123 -14.575 3.331 1282 3HB ALA 20 3HB ALA 20 15.657 -12.874 3.346 1283 H ARG 21 H ARG 21 12.644 -15.786 5.478 1284 HA ARG 21 HA ARG 21 14.425 -17.476 6.938 1285 1HB ARG 21 1HB ARG 21 11.692 -17.113 6.578 1286 2HB ARG 21 2HB ARG 21 11.967 -18.721 5.906 1287 1HG ARG 21 1HG ARG 21 11.867 -19.443 8.053 1288 2HG ARG 21 2HG ARG 21 13.486 -18.764 8.214 1289 1HD ARG 21 1HD ARG 21 12.744 -17.034 9.509 1290 2HD ARG 21 2HD ARG 21 11.309 -16.781 8.496 1291 HE ARG 21 HE ARG 21 11.469 -18.521 10.843 1292 1HH1 ARG 21 1HH1 ARG 21 9.913 -17.943 7.783 1293 2HH1 ARG 21 2HH1 ARG 21 8.481 -18.807 8.223 1294 1HH2 ARG 21 1HH2 ARG 21 9.601 -19.637 11.391 1295 2HH2 ARG 21 2HH2 ARG 21 8.303 -19.760 10.251 1296 H LYS 22 H LYS 22 13.572 -17.361 3.568 1297 HA LYS 22 HA LYS 22 14.554 -20.095 3.007 1298 1HB LYS 22 1HB LYS 22 13.041 -17.905 1.705 1299 2HB LYS 22 2HB LYS 22 14.064 -18.836 0.619 1300 1HG LYS 22 1HG LYS 22 13.026 -20.924 1.414 1301 2HG LYS 22 2HG LYS 22 12.008 -19.998 2.517 1302 1HD LYS 22 1HD LYS 22 10.639 -20.364 0.615 1303 2HD LYS 22 2HD LYS 22 11.224 -18.712 0.424 1304 1HE LYS 22 1HE LYS 22 12.730 -19.311 -1.282 1305 2HE LYS 22 2HE LYS 22 12.756 -21.014 -0.787 1306 1HZ LYS 22 1HZ LYS 22 10.420 -19.548 -1.908 1307 2HZ LYS 22 2HZ LYS 22 10.400 -21.162 -1.381 1308 3HZ LYS 22 3HZ LYS 22 11.339 -20.719 -2.725 1309 H SER 23 H SER 23 17.479 -18.977 1.029 1310 HA SER 23 HA SER 23 15.077 -20.769 1.096 1311 1HB SER 23 1HB SER 23 17.339 -21.646 -0.499 1312 2HB SER 23 2HB SER 23 17.871 -21.176 1.116 1313 HG SER 23 HG SER 23 16.438 -23.334 0.327 1314 H PHE 24 H PHE 24 16.698 -18.360 -0.782 1315 HA PHE 24 HA PHE 24 14.864 -18.959 -3.070 1316 1HB PHE 24 1HB PHE 24 16.079 -16.486 -1.835 1317 2HB PHE 24 2HB PHE 24 15.462 -16.438 -3.486 1318 HD1 PHE 24 HD1 PHE 24 13.054 -17.053 -3.926 1319 HD2 PHE 24 HD2 PHE 24 14.608 -16.493 0.039 1320 HE1 PHE 24 HE1 PHE 24 10.745 -16.809 -3.056 1321 HE2 PHE 24 HE2 PHE 24 12.299 -16.250 0.909 1322 HZ PHE 24 HZ PHE 24 10.367 -16.408 -0.638 1323 H GLU 25 H GLU 25 15.708 -18.909 -5.200 1324 HA GLU 25 HA GLU 25 18.625 -19.384 -5.411 1325 1HB GLU 25 1HB GLU 25 16.145 -20.081 -6.798 1326 2HB GLU 25 2HB GLU 25 17.395 -19.557 -7.926 1327 1HG GLU 25 1HG GLU 25 18.257 -21.638 -7.754 1328 2HG GLU 25 2HG GLU 25 18.752 -21.197 -6.120 1329 H LYS 26 H LYS 26 19.004 -18.469 -8.059 1330 HA LYS 26 HA LYS 26 19.123 -15.539 -7.587 1331 1HB LYS 26 1HB LYS 26 21.067 -17.072 -8.290 1332 2HB LYS 26 2HB LYS 26 20.282 -17.169 -9.866 1333 1HG LYS 26 1HG LYS 26 20.369 -14.707 -10.058 1334 2HG LYS 26 2HG LYS 26 21.162 -14.614 -8.485 1335 1HD LYS 26 1HD LYS 26 22.976 -16.115 -9.428 1336 2HD LYS 26 2HD LYS 26 22.232 -15.898 -11.012 1337 1HE LYS 26 1HE LYS 26 22.403 -13.300 -10.213 1338 2HE LYS 26 2HE LYS 26 23.826 -13.980 -9.401 1339 1HZ LYS 26 1HZ LYS 26 23.107 -14.294 -12.273 1340 2HZ LYS 26 2HZ LYS 26 24.418 -15.062 -11.514 1341 3HZ LYS 26 3HZ LYS 26 24.393 -13.370 -11.660 1342 H GLY 27 H GLY 27 16.620 -15.629 -7.991 1343 1HA GLY 27 1HA GLY 27 15.667 -14.240 -10.020 1344 2HA GLY 27 2HA GLY 27 15.990 -15.736 -10.895 1345 H GLU 28 H GLU 28 14.368 -14.671 -7.881 1346 HA GLU 28 HA GLU 28 12.081 -16.455 -8.613 1347 1HB GLU 28 1HB GLU 28 13.874 -16.449 -6.218 1348 2HB GLU 28 2HB GLU 28 12.163 -16.778 -5.941 1349 1HG GLU 28 1HG GLU 28 12.300 -18.518 -7.773 1350 2HG GLU 28 2HG GLU 28 14.047 -18.279 -7.779 1351 H LEU 29 H LEU 29 10.255 -15.214 -8.617 1352 HA LEU 29 HA LEU 29 10.166 -12.521 -7.637 1353 1HB LEU 29 1HB LEU 29 8.788 -13.794 -9.446 1354 2HB LEU 29 2HB LEU 29 7.784 -14.332 -8.101 1355 HG LEU 29 HG LEU 29 6.892 -12.276 -9.193 1356 1HD1 LEU 29 1HD1 LEU 29 6.770 -12.844 -6.642 1357 2HD1 LEU 29 2HD1 LEU 29 6.287 -11.237 -7.184 1358 3HD1 LEU 29 3HD1 LEU 29 7.879 -11.484 -6.465 1359 1HD2 LEU 29 1HD2 LEU 29 8.812 -10.437 -8.032 1360 2HD2 LEU 29 2HD2 LEU 29 8.220 -10.526 -9.691 1361 3HD2 LEU 29 3HD2 LEU 29 9.594 -11.511 -9.191 1362 H VAL 30 H VAL 30 10.177 -11.995 -5.498 1363 HA VAL 30 HA VAL 30 9.043 -13.873 -3.499 1364 HB VAL 30 HB VAL 30 10.601 -11.266 -3.318 1365 1HG1 VAL 30 1HG1 VAL 30 9.025 -12.502 -1.354 1366 2HG1 VAL 30 2HG1 VAL 30 10.277 -11.289 -1.084 1367 3HG1 VAL 30 3HG1 VAL 30 10.676 -13.004 -0.987 1368 1HG2 VAL 30 1HG2 VAL 30 12.448 -12.802 -2.611 1369 2HG2 VAL 30 2HG2 VAL 30 11.923 -13.078 -4.271 1370 3HG2 VAL 30 3HG2 VAL 30 11.405 -14.173 -2.989 1371 H GLU 31 H GLU 31 6.816 -13.349 -4.431 1372 HA GLU 31 HA GLU 31 4.719 -12.305 -4.185 1373 1HB GLU 31 1HB GLU 31 5.359 -12.591 -1.802 1374 2HB GLU 31 2HB GLU 31 6.176 -11.031 -1.838 1375 1HG GLU 31 1HG GLU 31 4.234 -9.877 -1.676 1376 2HG GLU 31 2HG GLU 31 3.411 -10.930 -2.828 1377 H GLU 32 H GLU 32 3.640 -10.291 -4.651 1378 HA GLU 32 HA GLU 32 5.253 -7.850 -5.041 1379 1HB GLU 32 1HB GLU 32 4.712 -7.845 -7.492 1380 2HB GLU 32 2HB GLU 32 5.732 -9.208 -7.033 1381 1HG GLU 32 1HG GLU 32 3.876 -10.721 -7.059 1382 2HG GLU 32 2HG GLU 32 2.714 -9.398 -7.166 1383 H CYS 33 H CYS 33 3.837 -6.010 -5.697 1384 HA CYS 33 HA CYS 33 0.912 -6.496 -5.555 1385 1HB CYS 33 1HB CYS 33 2.285 -6.086 -3.260 1386 2HB CYS 33 2HB CYS 33 2.011 -4.408 -3.727 1387 HG CYS 33 HG CYS 33 -0.616 -5.667 -4.018 1388 H LEU 34 H LEU 34 -0.027 -3.966 -5.373 1389 HA LEU 34 HA LEU 34 0.962 -2.716 -7.866 1390 1HB LEU 34 1HB LEU 34 -1.358 -2.073 -6.005 1391 2HB LEU 34 2HB LEU 34 -1.132 -1.420 -7.627 1392 HG LEU 34 HG LEU 34 -1.360 -4.384 -7.034 1393 1HD1 LEU 34 1HD1 LEU 34 -3.402 -2.306 -7.188 1394 2HD1 LEU 34 2HD1 LEU 34 -3.562 -3.997 -6.713 1395 3HD1 LEU 34 3HD1 LEU 34 -3.637 -3.549 -8.417 1396 1HD2 LEU 34 1HD2 LEU 34 -1.088 -2.677 -9.475 1397 2HD2 LEU 34 2HD2 LEU 34 -2.079 -4.131 -9.587 1398 3HD2 LEU 34 3HD2 LEU 34 -0.381 -4.254 -9.127 1399 H CYS 35 H CYS 35 0.499 -0.068 -7.520 1400 HA CYS 35 HA CYS 35 1.908 0.833 -5.058 1401 1HB CYS 35 1HB CYS 35 2.855 0.974 -7.918 1402 2HB CYS 35 2HB CYS 35 3.352 2.221 -6.776 1403 HG CYS 35 HG CYS 35 3.831 -0.643 -5.772 1404 H ILE 36 H ILE 36 1.741 3.230 -4.819 1405 HA ILE 36 HA ILE 36 -0.768 4.244 -6.073 1406 HB ILE 36 HB ILE 36 0.924 5.469 -3.867 1407 1HG1 ILE 36 1HG1 ILE 36 -1.390 3.520 -3.606 1408 2HG1 ILE 36 2HG1 ILE 36 0.299 3.144 -3.262 1409 1HG2 ILE 36 1HG2 ILE 36 -0.772 6.923 -4.920 1410 2HG2 ILE 36 2HG2 ILE 36 -1.204 6.543 -3.253 1411 3HG2 ILE 36 3HG2 ILE 36 -2.012 5.714 -4.583 1412 1HD1 ILE 36 1HD1 ILE 36 0.276 4.265 -1.276 1413 2HD1 ILE 36 2HD1 ILE 36 -1.469 4.035 -1.384 1414 3HD1 ILE 36 3HD1 ILE 36 -0.746 5.557 -1.905 1415 H VAL 37 H VAL 37 -0.182 5.067 -8.088 1416 HA VAL 37 HA VAL 37 2.312 6.593 -8.407 1417 HB VAL 37 HB VAL 37 0.018 6.056 -10.331 1418 1HG1 VAL 37 1HG1 VAL 37 2.866 6.285 -11.174 1419 2HG1 VAL 37 2HG1 VAL 37 2.058 7.776 -10.689 1420 3HG1 VAL 37 3HG1 VAL 37 1.403 6.807 -12.009 1421 1HG2 VAL 37 1HG2 VAL 37 2.565 4.456 -9.985 1422 2HG2 VAL 37 2HG2 VAL 37 1.184 4.063 -11.011 1423 3HG2 VAL 37 3HG2 VAL 37 1.029 3.990 -9.256 1424 H ARG 38 H ARG 38 2.443 8.787 -8.278 1425 HA ARG 38 HA ARG 38 0.023 10.440 -8.790 1426 1HB ARG 38 1HB ARG 38 1.620 10.189 -6.244 1427 2HB ARG 38 2HB ARG 38 0.762 11.685 -6.607 1428 1HG ARG 38 1HG ARG 38 -0.484 8.921 -6.475 1429 2HG ARG 38 2HG ARG 38 -0.639 10.175 -5.245 1430 1HD ARG 38 1HD ARG 38 -1.421 11.557 -7.472 1431 2HD ARG 38 2HD ARG 38 -2.009 9.929 -7.858 1432 HE ARG 38 HE ARG 38 -2.546 10.730 -5.097 1433 1HH1 ARG 38 1HH1 ARG 38 -3.671 10.814 -8.390 1434 2HH1 ARG 38 2HH1 ARG 38 -5.326 11.023 -7.935 1435 1HH2 ARG 38 1HH2 ARG 38 -4.701 11.002 -4.531 1436 2HH2 ARG 38 2HH2 ARG 38 -5.907 11.129 -5.768 1437 H HIS 39 H HIS 39 0.573 12.623 -9.396 1438 HA HIS 39 HA HIS 39 3.047 12.965 -10.789 1439 1HB HIS 39 1HB HIS 39 0.713 14.635 -9.924 1440 2HB HIS 39 2HB HIS 39 2.142 15.474 -10.527 1441 HD1 HIS 39 HD1 HIS 39 0.372 16.072 -12.552 1442 HD2 HIS 39 HD2 HIS 39 1.726 12.135 -12.340 1443 HE1 HIS 39 HE1 HIS 39 -0.106 15.028 -14.810 1444 H ASN 40 H ASN 40 4.350 15.155 -10.217 1445 HA ASN 40 HA ASN 40 5.509 14.678 -7.542 1446 1HB ASN 40 1HB ASN 40 6.859 14.933 -9.631 1447 2HB ASN 40 2HB ASN 40 6.256 16.584 -9.791 1448 1HD2 ASN 40 1HD2 ASN 40 8.756 16.978 -9.599 1449 2HD2 ASN 40 2HD2 ASN 40 9.369 17.180 -8.029 1450 H ASP 41 H ASP 41 4.524 15.730 -5.867 1451 HA ASP 41 HA ASP 41 4.403 18.607 -5.737 1452 1HB ASP 41 1HB ASP 41 2.472 17.684 -7.329 1453 2HB ASP 41 2HB ASP 41 1.667 17.358 -5.794 1454 H ASP 42 H ASP 42 1.882 18.372 -3.981 1455 HA ASP 42 HA ASP 42 3.040 18.014 -1.450 1456 1HB ASP 42 1HB ASP 42 0.226 17.458 -2.464 1457 2HB ASP 42 2HB ASP 42 0.645 17.614 -0.758 1458 H TRP 43 H TRP 43 1.984 15.619 -3.760 1459 HA TRP 43 HA TRP 43 1.655 13.322 -2.143 1460 1HB TRP 43 1HB TRP 43 1.106 13.353 -4.491 1461 2HB TRP 43 2HB TRP 43 2.740 13.838 -4.933 1462 HD1 TRP 43 HD1 TRP 43 4.117 11.946 -5.872 1463 HE1 TRP 43 HE1 TRP 43 4.205 9.387 -5.579 1464 HE3 TRP 43 HE3 TRP 43 0.440 11.332 -2.382 1465 HZ2 TRP 43 HZ2 TRP 43 2.888 7.351 -4.068 1466 HZ3 TRP 43 HZ3 TRP 43 -0.120 9.072 -1.532 1467 HH2 TRP 43 HH2 TRP 43 1.099 7.082 -2.369 1468 H GLY 44 H GLY 44 4.632 14.140 -3.975 1469 1HA GLY 44 1HA GLY 44 6.312 12.296 -2.633 1470 2HA GLY 44 2HA GLY 44 6.886 13.743 -3.462 1471 H THR 45 H THR 45 5.219 15.495 -1.699 1472 HA THR 45 HA THR 45 7.186 15.957 0.364 1473 HB THR 45 HB THR 45 4.337 16.968 0.023 1474 HG1 THR 45 HG1 THR 45 5.200 17.798 -1.695 1475 1HG2 THR 45 1HG2 THR 45 5.687 17.315 2.245 1476 2HG2 THR 45 2HG2 THR 45 4.878 18.698 1.507 1477 3HG2 THR 45 3HG2 THR 45 6.613 18.473 1.289 1478 H ALA 46 H ALA 46 3.690 15.307 0.823 1479 HA ALA 46 HA ALA 46 3.882 14.555 3.548 1480 1HB ALA 46 1HB ALA 46 1.736 15.034 2.741 1481 2HB ALA 46 2HB ALA 46 1.683 13.272 2.797 1482 3HB ALA 46 3HB ALA 46 1.975 14.097 1.266 1483 H LEU 47 H LEU 47 3.849 12.468 0.631 1484 HA LEU 47 HA LEU 47 4.415 10.086 2.290 1485 1HB LEU 47 1HB LEU 47 3.771 10.705 -0.595 1486 2HB LEU 47 2HB LEU 47 4.376 9.109 -0.154 1487 HG LEU 47 HG LEU 47 1.925 9.108 -0.143 1488 1HD1 LEU 47 1HD1 LEU 47 1.937 7.738 1.648 1489 2HD1 LEU 47 2HD1 LEU 47 2.229 9.084 2.750 1490 3HD1 LEU 47 3HD1 LEU 47 3.586 8.285 1.955 1491 1HD2 LEU 47 1HD2 LEU 47 1.859 11.628 0.417 1492 2HD2 LEU 47 2HD2 LEU 47 2.017 11.124 2.100 1493 3HD2 LEU 47 3HD2 LEU 47 0.625 10.603 1.150 1494 H GLU 48 H GLU 48 6.512 12.064 2.305 1495 HA GLU 48 HA GLU 48 8.578 11.267 0.398 1496 1HB GLU 48 1HB GLU 48 9.897 12.883 1.741 1497 2HB GLU 48 2HB GLU 48 8.314 13.548 1.345 1498 1HG GLU 48 1HG GLU 48 7.910 13.830 3.541 1499 2HG GLU 48 2HG GLU 48 8.019 12.084 3.764 1500 H ASP 49 H ASP 49 7.995 8.876 1.398 1501 HA ASP 49 HA ASP 49 10.259 8.290 3.250 1502 1HB ASP 49 1HB ASP 49 7.349 8.063 3.716 1503 2HB ASP 49 2HB ASP 49 8.259 6.611 4.133 1504 H TYR 50 H TYR 50 7.601 6.181 2.205 1505 HA TYR 50 HA TYR 50 9.605 4.398 0.906 1506 1HB TYR 50 1HB TYR 50 6.654 3.855 1.321 1507 2HB TYR 50 2HB TYR 50 7.971 2.692 1.224 1508 HD1 TYR 50 HD1 TYR 50 5.765 4.266 3.415 1509 HD2 TYR 50 HD2 TYR 50 9.897 3.128 3.108 1510 HE1 TYR 50 HE1 TYR 50 5.963 4.320 5.885 1511 HE2 TYR 50 HE2 TYR 50 10.094 3.184 5.580 1512 HH TYR 50 HH TYR 50 8.850 3.184 7.522 1513 H LEU 51 H LEU 51 9.266 6.635 -0.610 1514 HA LEU 51 HA LEU 51 7.230 5.939 -2.692 1515 1HB LEU 51 1HB LEU 51 7.804 8.258 -1.252 1516 2HB LEU 51 2HB LEU 51 8.558 8.555 -2.817 1517 HG LEU 51 HG LEU 51 6.362 7.818 -3.877 1518 1HD1 LEU 51 1HD1 LEU 51 5.732 7.583 -0.994 1519 2HD1 LEU 51 2HD1 LEU 51 5.011 6.756 -2.374 1520 3HD1 LEU 51 3HD1 LEU 51 4.503 8.394 -1.965 1521 1HD2 LEU 51 1HD2 LEU 51 5.200 10.033 -2.971 1522 2HD2 LEU 51 2HD2 LEU 51 6.641 10.118 -3.985 1523 3HD2 LEU 51 3HD2 LEU 51 6.783 10.287 -2.235 1524 H PHE 52 H PHE 52 7.962 5.328 -4.688 1525 HA PHE 52 HA PHE 52 10.879 5.371 -5.238 1526 1HB PHE 52 1HB PHE 52 8.412 4.012 -6.290 1527 2HB PHE 52 2HB PHE 52 9.829 4.107 -7.336 1528 HD1 PHE 52 HD1 PHE 52 8.250 2.240 -4.775 1529 HD2 PHE 52 HD2 PHE 52 12.123 3.454 -6.184 1530 HE1 PHE 52 HE1 PHE 52 9.290 0.358 -3.539 1531 HE2 PHE 52 HE2 PHE 52 13.162 1.572 -4.948 1532 HZ PHE 52 HZ PHE 52 11.746 0.024 -3.626 1533 H SER 53 H SER 53 11.215 5.806 -7.815 1534 HA SER 53 HA SER 53 9.596 8.173 -8.640 1535 1HB SER 53 1HB SER 53 11.528 9.560 -8.746 1536 2HB SER 53 2HB SER 53 11.709 8.689 -7.224 1537 HG SER 53 HG SER 53 13.579 8.747 -8.707 1538 H ARG 54 H ARG 54 9.042 7.893 -10.723 1539 HA ARG 54 HA ARG 54 10.812 6.243 -12.492 1540 1HB ARG 54 1HB ARG 54 8.481 5.452 -11.978 1541 2HB ARG 54 2HB ARG 54 7.855 6.940 -12.688 1542 1HG ARG 54 1HG ARG 54 9.763 5.380 -14.353 1543 2HG ARG 54 2HG ARG 54 8.167 4.670 -14.112 1544 1HD ARG 54 1HD ARG 54 7.121 6.298 -15.349 1545 2HD ARG 54 2HD ARG 54 8.204 7.574 -14.760 1546 HE ARG 54 HE ARG 54 9.846 5.912 -16.276 1547 1HH1 ARG 54 1HH1 ARG 54 6.893 7.667 -16.837 1548 2HH1 ARG 54 2HH1 ARG 54 7.223 7.902 -18.518 1549 1HH2 ARG 54 1HH2 ARG 54 10.252 6.230 -18.460 1550 2HH2 ARG 54 2HH2 ARG 54 9.110 7.096 -19.433 1551 H LYS 55 H LYS 55 10.644 7.021 -14.876 1552 HA LYS 55 HA LYS 55 11.281 9.863 -14.965 1553 1HB LYS 55 1HB LYS 55 11.302 7.470 -16.738 1554 2HB LYS 55 2HB LYS 55 11.203 9.032 -17.551 1555 1HG LYS 55 1HG LYS 55 13.166 9.754 -16.065 1556 2HG LYS 55 2HG LYS 55 13.352 8.046 -15.666 1557 1HD LYS 55 1HD LYS 55 13.512 7.545 -18.115 1558 2HD LYS 55 2HD LYS 55 13.471 9.279 -18.435 1559 1HE LYS 55 1HE LYS 55 15.469 8.484 -16.408 1560 2HE LYS 55 2HE LYS 55 15.784 7.853 -18.036 1561 1HZ LYS 55 1HZ LYS 55 16.690 10.045 -17.927 1562 2HZ LYS 55 2HZ LYS 55 15.260 10.676 -17.263 1563 3HZ LYS 55 3HZ LYS 55 15.282 10.135 -18.872 1564 H ASN 56 H ASN 56 8.971 10.344 -14.119 1565 HA ASN 56 HA ASN 56 6.752 10.099 -15.976 1566 1HB ASN 56 1HB ASN 56 7.810 12.893 -15.540 1567 2HB ASN 56 2HB ASN 56 8.473 11.898 -16.836 1568 1HD2 ASN 56 1HD2 ASN 56 6.989 11.243 -18.585 1569 2HD2 ASN 56 2HD2 ASN 56 5.526 12.066 -18.834 1570 H MET 57 H MET 57 7.540 9.737 -13.091 1571 HA MET 57 HA MET 57 6.307 11.803 -11.504 1572 1HB MET 57 1HB MET 57 4.189 10.636 -11.101 1573 2HB MET 57 2HB MET 57 4.364 10.964 -12.814 1574 1HG MET 57 1HG MET 57 5.337 8.339 -11.727 1575 2HG MET 57 2HG MET 57 3.612 8.576 -11.992 1576 1HE MET 57 1HE MET 57 3.049 8.980 -15.616 1577 2HE MET 57 2HE MET 57 2.718 9.745 -14.061 1578 3HE MET 57 3HE MET 57 2.517 8.003 -14.247 1579 H SER 58 H SER 58 5.311 10.392 -9.401 1580 HA SER 58 HA SER 58 7.527 8.521 -8.623 1581 1HB SER 58 1HB SER 58 7.470 9.546 -6.460 1582 2HB SER 58 2HB SER 58 7.357 10.893 -7.593 1583 HG SER 58 HG SER 58 5.203 11.040 -7.221 1584 H ALA 59 H ALA 59 6.764 6.949 -6.858 1585 HA ALA 59 HA ALA 59 3.831 6.479 -6.847 1586 1HB ALA 59 1HB ALA 59 4.717 3.976 -7.432 1587 2HB ALA 59 2HB ALA 59 5.930 4.933 -8.283 1588 3HB ALA 59 3HB ALA 59 4.220 5.127 -8.672 1589 H MET 60 H MET 60 3.158 5.099 -5.104 1590 HA MET 60 HA MET 60 5.118 4.884 -2.893 1591 1HB MET 60 1HB MET 60 2.807 5.779 -2.582 1592 2HB MET 60 2HB MET 60 2.157 4.224 -3.100 1593 1HG MET 60 1HG MET 60 2.204 4.379 -0.637 1594 2HG MET 60 2HG MET 60 3.286 3.111 -1.213 1595 1HE MET 60 1HE MET 60 2.582 5.635 0.922 1596 2HE MET 60 2HE MET 60 3.361 7.026 0.167 1597 3HE MET 60 3HE MET 60 4.067 6.294 1.608 1598 H ALA 61 H ALA 61 5.561 2.842 -1.857 1599 HA ALA 61 HA ALA 61 5.557 0.560 -3.709 1600 1HB ALA 61 1HB ALA 61 6.941 1.526 -1.325 1601 2HB ALA 61 2HB ALA 61 7.516 0.416 -2.569 1602 3HB ALA 61 3HB ALA 61 6.575 -0.195 -1.208 1603 H LEU 62 H LEU 62 3.317 -0.059 -3.789 1604 HA LEU 62 HA LEU 62 1.452 -1.324 -3.102 1605 1HB LEU 62 1HB LEU 62 1.296 -0.669 -0.369 1606 2HB LEU 62 2HB LEU 62 2.082 0.718 -1.125 1607 HG LEU 62 HG LEU 62 0.233 0.612 -2.896 1608 1HD1 LEU 62 1HD1 LEU 62 -0.380 -1.748 -1.501 1609 2HD1 LEU 62 2HD1 LEU 62 -1.353 -0.985 -2.760 1610 3HD1 LEU 62 3HD1 LEU 62 -1.657 -0.612 -1.063 1611 1HD2 LEU 62 1HD2 LEU 62 0.410 2.085 -0.697 1612 2HD2 LEU 62 2HD2 LEU 62 -0.986 1.124 -0.209 1613 3HD2 LEU 62 3HD2 LEU 62 -1.059 2.102 -1.674 1614 H GLY 63 H GLY 63 3.874 -2.762 -3.099 1615 1HA GLY 63 1HA GLY 63 3.214 -4.985 -1.426 1616 2HA GLY 63 2HA GLY 63 4.732 -4.795 -2.303 1617 H PHE 64 H PHE 64 6.181 -5.350 -0.671 1618 HA PHE 64 HA PHE 64 5.903 -4.128 2.011 1619 1HB PHE 64 1HB PHE 64 7.710 -6.165 0.681 1620 2HB PHE 64 2HB PHE 64 7.996 -5.608 2.329 1621 HD1 PHE 64 HD1 PHE 64 6.679 -8.247 0.631 1622 HD2 PHE 64 HD2 PHE 64 5.500 -5.402 3.625 1623 HE1 PHE 64 HE1 PHE 64 4.963 -9.833 1.463 1624 HE2 PHE 64 HE2 PHE 64 3.784 -6.988 4.457 1625 HZ PHE 64 HZ PHE 64 3.516 -9.204 3.375 1626 H GLY 65 H GLY 65 6.952 -2.846 -0.770 1627 1HA GLY 65 1HA GLY 65 9.611 -2.075 -0.574 1628 2HA GLY 65 2HA GLY 65 8.360 -1.011 -1.209 1629 H ALA 66 H ALA 66 6.918 -0.936 1.386 1630 HA ALA 66 HA ALA 66 8.246 1.327 2.574 1631 1HB ALA 66 1HB ALA 66 5.813 -0.266 2.847 1632 2HB ALA 66 2HB ALA 66 6.061 1.444 3.200 1633 3HB ALA 66 3HB ALA 66 6.435 0.227 4.421 1634 H ILE 67 H ILE 67 7.362 -1.613 4.369 1635 HA ILE 67 HA ILE 67 9.341 -1.368 6.357 1636 HB ILE 67 HB ILE 67 8.871 -3.839 6.674 1637 1HG1 ILE 67 1HG1 ILE 67 6.774 -4.412 5.064 1638 2HG1 ILE 67 2HG1 ILE 67 7.734 -3.437 3.956 1639 1HG2 ILE 67 1HG2 ILE 67 6.590 -1.900 6.259 1640 2HG2 ILE 67 2HG2 ILE 67 7.421 -2.283 7.767 1641 3HG2 ILE 67 3HG2 ILE 67 6.380 -3.485 7.003 1642 1HD1 ILE 67 1HD1 ILE 67 9.392 -5.298 5.450 1643 2HD1 ILE 67 2HD1 ILE 67 9.263 -5.065 3.706 1644 3HD1 ILE 67 3HD1 ILE 67 8.131 -6.131 4.540 1645 H PHE 68 H PHE 68 9.707 -2.433 3.085 1646 HA PHE 68 HA PHE 68 11.913 -4.176 3.202 1647 1HB PHE 68 1HB PHE 68 10.527 -2.519 1.344 1648 2HB PHE 68 2HB PHE 68 12.244 -2.189 1.142 1649 HD1 PHE 68 HD1 PHE 68 13.786 -3.947 0.404 1650 HD2 PHE 68 HD2 PHE 68 9.611 -4.760 0.977 1651 HE1 PHE 68 HE1 PHE 68 14.033 -6.096 -0.812 1652 HE2 PHE 68 HE2 PHE 68 9.854 -6.903 -0.235 1653 HZ PHE 68 HZ PHE 68 12.063 -7.572 -1.129 1654 H ASN 69 H ASN 69 14.042 -3.884 3.862 1655 HA ASN 69 HA ASN 69 14.843 -1.110 4.647 1656 1HB ASN 69 1HB ASN 69 15.293 -3.895 5.630 1657 2HB ASN 69 2HB ASN 69 16.603 -2.741 5.882 1658 1HD2 ASN 69 1HD2 ASN 69 15.711 -3.345 8.253 1659 2HD2 ASN 69 2HD2 ASN 69 14.553 -2.266 8.866 1660 H HIS 70 H HIS 70 17.390 -0.952 4.656 1661 HA HIS 70 HA HIS 70 18.330 -1.698 1.917 1662 1HB HIS 70 1HB HIS 70 18.258 0.692 2.482 1663 2HB HIS 70 2HB HIS 70 19.189 0.398 3.949 1664 HD1 HIS 70 HD1 HIS 70 19.590 1.262 0.445 1665 HD2 HIS 70 HD2 HIS 70 21.914 -0.681 3.308 1666 HE1 HIS 70 HE1 HIS 70 21.963 1.260 -0.440 1667 H SER 71 H SER 71 20.571 -2.490 1.739 1668 HA SER 71 HA SER 71 21.861 -3.400 4.255 1669 1HB SER 71 1HB SER 71 20.291 -5.176 3.674 1670 2HB SER 71 2HB SER 71 20.865 -5.186 2.007 1671 HG SER 71 HG SER 71 21.766 -6.640 3.940 1672 H LYS 72 H LYS 72 24.100 -3.541 4.026 1673 HA LYS 72 HA LYS 72 25.451 -2.253 1.908 1674 1HB LYS 72 1HB LYS 72 26.105 -3.163 4.335 1675 2HB LYS 72 2HB LYS 72 26.723 -4.526 3.402 1676 1HG LYS 72 1HG LYS 72 28.558 -3.024 3.563 1677 2HG LYS 72 2HG LYS 72 27.909 -2.765 1.944 1678 1HD LYS 72 1HD LYS 72 26.414 -0.972 3.270 1679 2HD LYS 72 2HD LYS 72 27.821 -0.982 4.333 1680 1HE LYS 72 1HE LYS 72 28.563 -0.899 1.493 1681 2HE LYS 72 2HE LYS 72 27.604 0.505 2.000 1682 1HZ LYS 72 1HZ LYS 72 29.965 0.831 2.483 1683 2HZ LYS 72 2HZ LYS 72 29.982 -0.583 3.424 1684 3HZ LYS 72 3HZ LYS 72 29.061 0.755 3.919 1685 H ASP 73 H ASP 73 24.392 -5.595 2.232 1686 HA ASP 73 HA ASP 73 25.614 -6.213 -0.437 1687 1HB ASP 73 1HB ASP 73 25.279 -7.630 2.137 1688 2HB ASP 73 2HB ASP 73 24.879 -8.606 0.723 1689 HA PRO 74 HA PRO 74 21.146 -5.764 -1.341 1690 1HB PRO 74 1HB PRO 74 22.243 -6.179 -4.084 1691 2HB PRO 74 2HB PRO 74 21.143 -4.921 -3.492 1692 1HG PRO 74 1HG PRO 74 23.725 -4.430 -4.038 1693 2HG PRO 74 2HG PRO 74 22.852 -3.595 -2.747 1694 1HD PRO 74 1HD PRO 74 24.905 -5.729 -2.567 1695 2HD PRO 74 2HD PRO 74 24.528 -4.418 -1.430 1696 H ASN 75 H ASN 75 19.966 -7.603 -1.037 1697 HA ASN 75 HA ASN 75 20.943 -10.150 -2.276 1698 1HB ASN 75 1HB ASN 75 19.554 -11.170 -0.442 1699 2HB ASN 75 2HB ASN 75 20.828 -10.116 0.172 1700 1HD2 ASN 75 1HD2 ASN 75 20.118 -8.628 1.702 1701 2HD2 ASN 75 2HD2 ASN 75 18.529 -8.044 1.834 1702 H ALA 76 H ALA 76 18.321 -7.858 -2.166 1703 HA ALA 76 HA ALA 76 16.889 -9.439 -4.242 1704 1HB ALA 76 1HB ALA 76 15.638 -10.176 -2.430 1705 2HB ALA 76 2HB ALA 76 14.790 -8.663 -2.749 1706 3HB ALA 76 3HB ALA 76 16.002 -8.741 -1.470 1707 H ARG 77 H ARG 77 15.598 -8.105 -5.615 1708 HA ARG 77 HA ARG 77 15.829 -5.153 -5.126 1709 1HB ARG 77 1HB ARG 77 16.777 -6.894 -7.284 1710 2HB ARG 77 2HB ARG 77 15.780 -5.571 -7.890 1711 1HG ARG 77 1HG ARG 77 17.217 -4.069 -6.327 1712 2HG ARG 77 2HG ARG 77 18.343 -5.427 -6.309 1713 1HD ARG 77 1HD ARG 77 17.864 -5.246 -8.983 1714 2HD ARG 77 2HD ARG 77 17.700 -3.544 -8.510 1715 HE ARG 77 HE ARG 77 19.950 -4.372 -7.136 1716 1HH1 ARG 77 1HH1 ARG 77 18.947 -4.515 -10.467 1717 2HH1 ARG 77 2HH1 ARG 77 20.565 -4.438 -11.072 1718 1HH2 ARG 77 1HH2 ARG 77 22.042 -4.274 -7.947 1719 2HH2 ARG 77 2HH2 ARG 77 22.305 -4.302 -9.659 1720 H HIS 78 H HIS 78 14.276 -4.145 -7.066 1721 HA HIS 78 HA HIS 78 11.673 -5.620 -6.870 1722 1HB HIS 78 1HB HIS 78 10.649 -3.372 -6.522 1723 2HB HIS 78 2HB HIS 78 11.825 -3.752 -5.264 1724 HD1 HIS 78 HD1 HIS 78 13.220 -1.758 -4.766 1725 HD2 HIS 78 HD2 HIS 78 12.281 -1.978 -8.822 1726 HE1 HIS 78 HE1 HIS 78 14.360 0.214 -5.873 1727 H GLU 79 H GLU 79 10.047 -4.522 -8.501 1728 HA GLU 79 HA GLU 79 11.468 -3.726 -11.013 1729 1HB GLU 79 1HB GLU 79 10.753 -6.249 -10.637 1730 2HB GLU 79 2HB GLU 79 9.145 -5.642 -11.032 1731 1HG GLU 79 1HG GLU 79 9.892 -4.837 -13.176 1732 2HG GLU 79 2HG GLU 79 11.579 -5.145 -12.765 1733 H LEU 80 H LEU 80 10.131 -2.478 -12.462 1734 HA LEU 80 HA LEU 80 7.576 -1.471 -11.245 1735 1HB LEU 80 1HB LEU 80 9.696 -0.005 -12.864 1736 2HB LEU 80 2HB LEU 80 8.232 0.723 -12.203 1737 HG LEU 80 HG LEU 80 10.372 -0.628 -10.532 1738 1HD1 LEU 80 1HD1 LEU 80 11.465 1.352 -10.362 1739 2HD1 LEU 80 2HD1 LEU 80 9.961 2.267 -10.246 1740 3HD1 LEU 80 3HD1 LEU 80 10.592 1.803 -11.827 1741 1HD2 LEU 80 1HD2 LEU 80 8.623 1.293 -9.228 1742 2HD2 LEU 80 2HD2 LEU 80 8.951 -0.385 -8.797 1743 3HD2 LEU 80 3HD2 LEU 80 7.694 -0.007 -9.975 1744 H THR 81 H THR 81 5.817 -1.493 -12.624 1745 HA THR 81 HA THR 81 6.108 -2.754 -15.254 1746 HB THR 81 HB THR 81 3.495 -1.786 -14.964 1747 HG1 THR 81 HG1 THR 81 4.344 -2.743 -12.452 1748 1HG2 THR 81 1HG2 THR 81 4.956 -4.310 -14.733 1749 2HG2 THR 81 2HG2 THR 81 3.396 -3.983 -15.486 1750 3HG2 THR 81 3HG2 THR 81 3.492 -4.282 -13.750 1751 H ALA 82 H ALA 82 4.306 -1.464 -16.851 1752 HA ALA 82 HA ALA 82 5.773 0.678 -17.989 1753 1HB ALA 82 1HB ALA 82 3.749 -0.891 -18.749 1754 2HB ALA 82 2HB ALA 82 4.006 0.679 -19.510 1755 3HB ALA 82 3HB ALA 82 2.788 0.500 -18.247 1756 H GLY 83 H GLY 83 6.259 2.158 -16.217 1757 1HA GLY 83 1HA GLY 83 5.821 4.336 -15.353 1758 2HA GLY 83 2HA GLY 83 4.128 4.150 -15.811 1759 H LEU 84 H LEU 84 6.410 2.424 -13.656 1760 HA LEU 84 HA LEU 84 6.138 1.667 -11.446 1761 1HB LEU 84 1HB LEU 84 4.300 4.092 -11.453 1762 2HB LEU 84 2HB LEU 84 4.981 3.336 -10.014 1763 HG LEU 84 HG LEU 84 6.865 4.172 -12.181 1764 1HD1 LEU 84 1HD1 LEU 84 5.380 6.031 -10.316 1765 2HD1 LEU 84 2HD1 LEU 84 5.583 6.176 -12.062 1766 3HD1 LEU 84 3HD1 LEU 84 6.957 6.446 -10.989 1767 1HD2 LEU 84 1HD2 LEU 84 7.537 4.892 -9.467 1768 2HD2 LEU 84 2HD2 LEU 84 8.349 3.753 -10.540 1769 3HD2 LEU 84 3HD2 LEU 84 7.012 3.209 -9.527 1770 H LYS 85 H LYS 85 2.986 2.735 -10.756 1771 HA LYS 85 HA LYS 85 0.944 1.616 -10.538 1772 1HB LYS 85 1HB LYS 85 2.110 0.895 -13.165 1773 2HB LYS 85 2HB LYS 85 0.827 -0.174 -12.595 1774 1HG LYS 85 1HG LYS 85 -0.769 1.435 -12.812 1775 2HG LYS 85 2HG LYS 85 0.296 2.696 -12.193 1776 1HD LYS 85 1HD LYS 85 1.275 1.778 -14.741 1777 2HD LYS 85 2HD LYS 85 -0.423 2.233 -14.888 1778 1HE LYS 85 1HE LYS 85 0.009 4.452 -14.473 1779 2HE LYS 85 2HE LYS 85 1.286 4.081 -13.299 1780 1HZ LYS 85 1HZ LYS 85 2.436 4.853 -15.168 1781 2HZ LYS 85 2HZ LYS 85 1.424 4.031 -16.257 1782 3HZ LYS 85 3HZ LYS 85 2.535 3.163 -15.311 1783 H ARG 86 H ARG 86 2.564 -1.174 -12.004 1784 HA ARG 86 HA ARG 86 1.995 -2.701 -9.515 1785 1HB ARG 86 1HB ARG 86 1.670 -3.152 -12.240 1786 2HB ARG 86 2HB ARG 86 3.101 -4.105 -11.848 1787 1HG ARG 86 1HG ARG 86 1.522 -4.736 -9.735 1788 2HG ARG 86 2HG ARG 86 0.290 -4.461 -10.967 1789 1HD ARG 86 1HD ARG 86 2.368 -5.964 -12.204 1790 2HD ARG 86 2HD ARG 86 2.000 -6.747 -10.656 1791 HE ARG 86 HE ARG 86 -0.390 -5.906 -12.112 1792 1HH1 ARG 86 1HH1 ARG 86 1.995 -8.409 -11.702 1793 2HH1 ARG 86 2HH1 ARG 86 0.952 -9.653 -12.298 1794 1HH2 ARG 86 1HH2 ARG 86 -1.726 -7.540 -12.881 1795 2HH2 ARG 86 2HH2 ARG 86 -1.139 -9.167 -12.961 1796 H MET 87 H MET 87 3.637 -3.616 -8.287 1797 HA MET 87 HA MET 87 6.448 -3.245 -9.262 1798 1HB MET 87 1HB MET 87 5.009 -2.342 -6.828 1799 2HB MET 87 2HB MET 87 6.617 -3.007 -6.544 1800 1HG MET 87 1HG MET 87 7.371 -1.475 -8.491 1801 2HG MET 87 2HG MET 87 5.837 -0.641 -8.244 1802 1HE MET 87 1HE MET 87 8.142 -2.112 -4.983 1803 2HE MET 87 2HE MET 87 9.454 -1.155 -5.670 1804 3HE MET 87 3HE MET 87 8.611 -2.341 -6.667 1805 H ARG 88 H ARG 88 7.858 -4.953 -8.761 1806 HA ARG 88 HA ARG 88 6.648 -7.290 -7.317 1807 1HB ARG 88 1HB ARG 88 8.529 -7.230 -9.708 1808 2HB ARG 88 2HB ARG 88 7.872 -8.684 -8.959 1809 1HG ARG 88 1HG ARG 88 5.711 -8.272 -9.745 1810 2HG ARG 88 2HG ARG 88 6.000 -6.541 -9.928 1811 1HD ARG 88 1HD ARG 88 6.430 -6.933 -12.123 1812 2HD ARG 88 2HD ARG 88 7.879 -7.824 -11.619 1813 HE ARG 88 HE ARG 88 5.411 -9.372 -11.347 1814 1HH1 ARG 88 1HH1 ARG 88 7.996 -8.415 -13.474 1815 2HH1 ARG 88 2HH1 ARG 88 7.819 -9.801 -14.493 1816 1HH2 ARG 88 1HH2 ARG 88 5.201 -11.164 -12.684 1817 2HH2 ARG 88 2HH2 ARG 88 6.250 -11.347 -14.051 1818 H ILE 89 H ILE 89 8.323 -8.726 -6.334 1819 HA ILE 89 HA ILE 89 10.817 -7.223 -5.602 1820 HB ILE 89 HB ILE 89 9.042 -9.065 -3.952 1821 1HG1 ILE 89 1HG1 ILE 89 9.606 -6.095 -3.696 1822 2HG1 ILE 89 2HG1 ILE 89 8.129 -6.784 -4.370 1823 1HG2 ILE 89 1HG2 ILE 89 10.536 -8.472 -2.082 1824 2HG2 ILE 89 2HG2 ILE 89 11.541 -7.527 -3.180 1825 3HG2 ILE 89 3HG2 ILE 89 11.436 -9.277 -3.368 1826 1HD1 ILE 89 1HD1 ILE 89 8.473 -6.154 -1.722 1827 2HD1 ILE 89 2HD1 ILE 89 8.887 -7.869 -1.732 1828 3HD1 ILE 89 3HD1 ILE 89 7.311 -7.339 -2.319 1829 H PHE 90 H PHE 90 12.243 -8.320 -6.995 1830 HA PHE 90 HA PHE 90 12.131 -11.288 -7.115 1831 1HB PHE 90 1HB PHE 90 13.146 -9.010 -8.718 1832 2HB PHE 90 2HB PHE 90 14.189 -10.432 -8.735 1833 HD1 PHE 90 HD1 PHE 90 11.525 -8.900 -10.375 1834 HD2 PHE 90 HD2 PHE 90 12.780 -12.749 -8.937 1835 HE1 PHE 90 HE1 PHE 90 10.002 -10.001 -11.993 1836 HE2 PHE 90 HE2 PHE 90 11.257 -13.849 -10.555 1837 HZ PHE 90 HZ PHE 90 9.867 -12.475 -12.083 1838 H THR 91 H THR 91 14.641 -12.100 -7.408 1839 HA THR 91 HA THR 91 16.162 -11.072 -5.034 1840 HB THR 91 HB THR 91 16.799 -13.574 -4.838 1841 HG1 THR 91 HG1 THR 91 15.444 -14.980 -5.881 1842 1HG2 THR 91 1HG2 THR 91 15.273 -12.540 -3.255 1843 2HG2 THR 91 2HG2 THR 91 14.618 -14.112 -3.713 1844 3HG2 THR 91 3HG2 THR 91 13.945 -12.639 -4.412 1845 H ILE 92 H ILE 92 17.735 -9.929 -6.232 1846 HA ILE 92 HA ILE 92 18.915 -10.670 -8.685 1847 HB ILE 92 HB ILE 92 20.736 -9.145 -7.904 1848 1HG1 ILE 92 1HG1 ILE 92 19.259 -9.173 -5.257 1849 2HG1 ILE 92 2HG1 ILE 92 20.741 -10.081 -5.555 1850 1HG2 ILE 92 1HG2 ILE 92 19.184 -7.636 -8.556 1851 2HG2 ILE 92 2HG2 ILE 92 18.783 -7.458 -6.847 1852 3HG2 ILE 92 3HG2 ILE 92 17.870 -8.581 -7.855 1853 1HD1 ILE 92 1HD1 ILE 92 20.755 -7.187 -6.274 1854 2HD1 ILE 92 2HD1 ILE 92 22.050 -8.189 -5.618 1855 3HD1 ILE 92 3HD1 ILE 92 20.776 -7.589 -4.557 1856 H LYS 93 H LYS 93 19.492 -11.925 -5.462 1857 HA LYS 93 HA LYS 93 21.421 -13.877 -6.625 1858 1HB LYS 93 1HB LYS 93 22.929 -13.414 -4.673 1859 2HB LYS 93 2HB LYS 93 22.731 -12.009 -5.720 1860 1HG LYS 93 1HG LYS 93 21.813 -10.810 -4.046 1861 2HG LYS 93 2HG LYS 93 20.647 -12.087 -3.703 1862 1HD LYS 93 1HD LYS 93 21.777 -12.405 -1.769 1863 2HD LYS 93 2HD LYS 93 23.046 -13.130 -2.757 1864 1HE LYS 93 1HE LYS 93 23.652 -10.499 -3.081 1865 2HE LYS 93 2HE LYS 93 22.969 -10.466 -1.444 1866 1HZ LYS 93 1HZ LYS 93 24.992 -12.434 -2.387 1867 2HZ LYS 93 2HZ LYS 93 24.408 -12.259 -0.802 1868 3HZ LYS 93 3HZ LYS 93 25.369 -11.040 -1.492 1869 HA PRO 94 HA PRO 94 19.094 -16.773 -4.264 1870 1HB PRO 94 1HB PRO 94 21.688 -18.107 -3.658 1871 2HB PRO 94 2HB PRO 94 20.246 -18.765 -4.452 1872 1HG PRO 94 1HG PRO 94 22.486 -18.161 -5.805 1873 2HG PRO 94 2HG PRO 94 20.874 -17.998 -6.514 1874 1HD PRO 94 1HD PRO 94 22.734 -15.897 -5.540 1875 2HD PRO 94 2HD PRO 94 21.536 -15.835 -6.849 1876 H ILE 95 H ILE 95 18.398 -16.452 -2.187 1877 HA ILE 95 HA ILE 95 20.294 -15.323 -0.192 1878 HB ILE 95 HB ILE 95 17.275 -15.680 -0.290 1879 1HG1 ILE 95 1HG1 ILE 95 18.945 -13.158 -0.474 1880 2HG1 ILE 95 2HG1 ILE 95 18.345 -14.030 -1.885 1881 1HG2 ILE 95 1HG2 ILE 95 17.969 -13.713 1.590 1882 2HG2 ILE 95 2HG2 ILE 95 19.076 -15.051 1.902 1883 3HG2 ILE 95 3HG2 ILE 95 17.333 -15.321 1.937 1884 1HD1 ILE 95 1HD1 ILE 95 16.094 -13.790 -0.275 1885 2HD1 ILE 95 2HD1 ILE 95 16.468 -12.784 -1.674 1886 3HD1 ILE 95 3HD1 ILE 95 16.917 -12.245 -0.056 1887 H ALA 96 H ALA 96 20.737 -16.389 1.765 1888 HA ALA 96 HA ALA 96 20.208 -19.296 1.801 1889 1HB ALA 96 1HB ALA 96 21.687 -17.659 3.867 1890 2HB ALA 96 2HB ALA 96 22.410 -17.980 2.291 1891 3HB ALA 96 3HB ALA 96 21.996 -19.320 3.359 1892 H ILE 97 H ILE 97 19.285 -20.340 3.707 1893 HA ILE 97 HA ILE 97 16.933 -19.052 4.746 1894 HB ILE 97 HB ILE 97 18.509 -21.518 5.575 1895 1HG1 ILE 97 1HG1 ILE 97 15.930 -21.395 4.012 1896 2HG1 ILE 97 2HG1 ILE 97 17.496 -21.293 3.208 1897 1HG2 ILE 97 1HG2 ILE 97 15.705 -21.678 6.160 1898 2HG2 ILE 97 2HG2 ILE 97 16.351 -20.213 6.899 1899 3HG2 ILE 97 3HG2 ILE 97 17.063 -21.781 7.280 1900 1HD1 ILE 97 1HD1 ILE 97 18.147 -23.439 4.335 1901 2HD1 ILE 97 2HD1 ILE 97 16.787 -23.618 3.226 1902 3HD1 ILE 97 3HD1 ILE 97 16.504 -23.556 4.966 1903 H GLY 98 H GLY 98 17.049 -17.381 6.198 1904 1HA GLY 98 1HA GLY 98 17.414 -16.854 8.600 1905 2HA GLY 98 2HA GLY 98 18.978 -17.659 8.468 1906 H GLU 99 H GLU 99 17.726 -15.525 5.970 1907 HA GLU 99 HA GLU 99 19.903 -13.579 6.662 1908 1HB GLU 99 1HB GLU 99 18.624 -14.390 4.024 1909 2HB GLU 99 2HB GLU 99 19.853 -13.135 4.185 1910 1HG GLU 99 1HG GLU 99 20.315 -15.929 5.232 1911 2HG GLU 99 2HG GLU 99 20.656 -15.511 3.552 1912 H GLU 100 H GLU 100 19.178 -11.431 5.169 1913 HA GLU 100 HA GLU 100 16.381 -10.782 6.033 1914 1HB GLU 100 1HB GLU 100 18.178 -9.850 7.515 1915 2HB GLU 100 2HB GLU 100 18.854 -9.012 6.118 1916 1HG GLU 100 1HG GLU 100 16.463 -8.021 5.841 1917 2HG GLU 100 2HG GLU 100 16.223 -8.535 7.511 1918 H ILE 101 H ILE 101 15.151 -9.856 4.423 1919 HA ILE 101 HA ILE 101 16.422 -9.412 1.792 1920 HB ILE 101 HB ILE 101 13.521 -9.177 2.665 1921 1HG1 ILE 101 1HG1 ILE 101 15.069 -11.573 1.630 1922 2HG1 ILE 101 2HG1 ILE 101 14.380 -11.396 3.243 1923 1HG2 ILE 101 1HG2 ILE 101 14.387 -10.037 -0.057 1924 2HG2 ILE 101 2HG2 ILE 101 14.574 -8.330 0.346 1925 3HG2 ILE 101 3HG2 ILE 101 12.983 -9.086 0.424 1926 1HD1 ILE 101 1HD1 ILE 101 12.726 -12.642 2.157 1927 2HD1 ILE 101 2HD1 ILE 101 12.971 -11.811 0.621 1928 3HD1 ILE 101 3HD1 ILE 101 12.133 -10.995 1.941 1929 H THR 102 H THR 102 16.879 -7.428 0.999 1930 HA THR 102 HA THR 102 15.489 -4.999 1.922 1931 HB THR 102 HB THR 102 17.951 -4.130 2.470 1932 HG1 THR 102 HG1 THR 102 18.992 -6.031 1.899 1933 1HG2 THR 102 1HG2 THR 102 17.010 -5.923 4.624 1934 2HG2 THR 102 2HG2 THR 102 15.782 -4.836 3.974 1935 3HG2 THR 102 3HG2 THR 102 17.275 -4.180 4.646 1936 H ILE 103 H ILE 103 16.315 -3.072 0.645 1937 HA ILE 103 HA ILE 103 17.735 -3.895 -1.866 1938 HB ILE 103 HB ILE 103 16.071 -2.479 -3.075 1939 1HG1 ILE 103 1HG1 ILE 103 14.378 -2.407 -0.605 1940 2HG1 ILE 103 2HG1 ILE 103 15.639 -1.190 -0.796 1941 1HG2 ILE 103 1HG2 ILE 103 14.956 -4.416 -3.316 1942 2HG2 ILE 103 2HG2 ILE 103 14.089 -4.089 -1.817 1943 3HG2 ILE 103 3HG2 ILE 103 15.601 -4.995 -1.781 1944 1HD1 ILE 103 1HD1 ILE 103 14.618 -0.966 -3.223 1945 2HD1 ILE 103 2HD1 ILE 103 13.856 -0.143 -1.862 1946 3HD1 ILE 103 3HD1 ILE 103 13.188 -1.662 -2.459 1947 H SER 104 H SER 104 18.698 -2.010 -3.018 1948 HA SER 104 HA SER 104 19.762 -0.024 -1.094 1949 1HB SER 104 1HB SER 104 20.430 -0.264 -4.028 1950 2HB SER 104 2HB SER 104 21.482 0.215 -2.697 1951 HG SER 104 HG SER 104 22.019 -1.787 -2.524 1952 H TYR 105 H TYR 105 20.031 2.286 -2.139 1953 HA TYR 105 HA TYR 105 17.478 3.011 -3.540 1954 1HB TYR 105 1HB TYR 105 18.948 4.564 -1.377 1955 2HB TYR 105 2HB TYR 105 17.383 4.971 -2.076 1956 HD1 TYR 105 HD1 TYR 105 16.147 2.237 -2.217 1957 HD2 TYR 105 HD2 TYR 105 18.421 4.145 0.888 1958 HE1 TYR 105 HE1 TYR 105 15.031 0.810 -0.521 1959 HE2 TYR 105 HE2 TYR 105 17.307 2.719 2.582 1960 HH TYR 105 HH TYR 105 14.529 1.003 1.999 1961 H GLY 106 H GLY 106 20.432 4.807 -2.568 1962 1HA GLY 106 1HA GLY 106 21.953 6.026 -3.876 1963 2HA GLY 106 2HA GLY 106 21.460 5.027 -5.243 1964 H ASP 107 H ASP 107 21.642 7.138 -6.427 1965 HA ASP 107 HA ASP 107 20.627 8.981 -7.485 1966 1HB ASP 107 1HB ASP 107 18.513 7.098 -6.614 1967 2HB ASP 107 2HB ASP 107 17.944 8.727 -6.976 1968 H ASP 108 H ASP 108 18.147 8.843 -4.959 1969 HA ASP 108 HA ASP 108 19.001 11.562 -4.082 1970 1HB ASP 108 1HB ASP 108 16.559 10.303 -4.711 1971 2HB ASP 108 2HB ASP 108 16.532 10.497 -2.959 1972 H TYR 109 H TYR 109 18.146 8.353 -2.768 1973 HA TYR 109 HA TYR 109 18.537 8.959 -0.009 1974 1HB TYR 109 1HB TYR 109 18.549 6.538 -1.784 1975 2HB TYR 109 2HB TYR 109 19.080 6.352 -0.113 1976 HD1 TYR 109 HD1 TYR 109 16.244 6.939 -2.331 1977 HD2 TYR 109 HD2 TYR 109 17.541 6.951 1.764 1978 HE1 TYR 109 HE1 TYR 109 13.879 6.938 -1.582 1979 HE2 TYR 109 HE2 TYR 109 15.176 6.950 2.513 1980 HH TYR 109 HH TYR 109 12.619 6.195 0.521 1981 H TRP 110 H TRP 110 20.383 8.915 1.280 1982 HA TRP 110 HA TRP 110 22.991 8.571 -0.151 1983 1HB TRP 110 1HB TRP 110 23.689 10.160 1.890 1984 2HB TRP 110 2HB TRP 110 23.029 10.822 0.401 1985 HD1 TRP 110 HD1 TRP 110 21.221 12.529 0.794 1986 HE1 TRP 110 HE1 TRP 110 19.410 12.951 2.580 1987 HE3 TRP 110 HE3 TRP 110 22.080 8.557 3.893 1988 HZ2 TRP 110 HZ2 TRP 110 18.454 11.761 4.997 1989 HZ3 TRP 110 HZ3 TRP 110 20.713 8.224 5.906 1990 HH2 TRP 110 HH2 TRP 110 18.898 9.818 6.477 1991 H LEU 111 H LEU 111 21.592 6.402 1.143 1992 HA LEU 111 HA LEU 111 22.314 5.833 3.788 1993 1HB LEU 111 1HB LEU 111 20.909 4.531 2.071 1994 2HB LEU 111 2HB LEU 111 22.428 3.873 1.472 1995 HG LEU 111 HG LEU 111 21.242 2.411 3.157 1996 1HD1 LEU 111 1HD1 LEU 111 23.739 3.070 4.556 1997 2HD1 LEU 111 2HD1 LEU 111 23.928 2.902 2.811 1998 3HD1 LEU 111 3HD1 LEU 111 23.258 1.576 3.756 1999 1HD2 LEU 111 1HD2 LEU 111 20.859 3.071 5.324 2000 2HD2 LEU 111 2HD2 LEU 111 20.737 4.649 4.546 2001 3HD2 LEU 111 3HD2 LEU 111 22.236 4.172 5.344 2002 H SER 112 H SER 112 24.166 4.974 4.771 2003 HA SER 112 HA SER 112 26.452 4.529 5.091 2004 1HB SER 112 1HB SER 112 25.714 3.503 2.417 2005 2HB SER 112 2HB SER 112 27.437 3.799 2.626 2006 HG SER 112 HG SER 112 27.497 2.064 3.770 2007 H ARG 113 H ARG 113 28.044 6.013 5.317 2008 HA ARG 113 HA ARG 113 28.064 8.447 3.721 2009 1HB ARG 113 1HB ARG 113 29.170 7.357 6.187 2010 2HB ARG 113 2HB ARG 113 30.376 8.295 5.305 2011 1HG ARG 113 1HG ARG 113 28.742 10.168 5.128 2012 2HG ARG 113 2HG ARG 113 27.601 9.233 6.094 2013 1HD ARG 113 1HD ARG 113 30.388 9.751 7.130 2014 2HD ARG 113 2HD ARG 113 29.110 10.964 7.333 2015 HE ARG 113 HE ARG 113 29.230 8.357 8.659 2016 1HH1 ARG 113 1HH1 ARG 113 27.169 10.905 7.486 2017 2HH1 ARG 113 2HH1 ARG 113 25.881 10.512 8.571 2018 1HH2 ARG 113 1HH2 ARG 113 27.544 7.867 10.057 2019 2HH2 ARG 113 2HH2 ARG 113 26.089 8.806 10.016 2020 HA PRO 114 HA PRO 114 32.241 6.735 2.207 2021 1HB PRO 114 1HB PRO 114 32.923 4.155 2.840 2022 2HB PRO 114 2HB PRO 114 33.304 5.536 3.884 2023 1HG PRO 114 1HG PRO 114 31.160 3.496 4.137 2024 2HG PRO 114 2HG PRO 114 32.083 4.330 5.395 2025 1HD PRO 114 1HD PRO 114 29.502 4.943 4.623 2026 2HD PRO 114 2HD PRO 114 30.588 6.041 5.495 2027 H ARG 115 H ARG 115 29.349 4.871 2.122 2028 HA ARG 115 HA ARG 115 28.340 3.634 0.388 2029 1HB ARG 115 1HB ARG 115 30.383 5.194 -1.231 2030 2HB ARG 115 2HB ARG 115 28.869 4.525 -1.832 2031 1HG ARG 115 1HG ARG 115 29.222 6.769 0.174 2032 2HG ARG 115 2HG ARG 115 28.489 6.864 -1.424 2033 1HD ARG 115 1HD ARG 115 27.383 5.308 0.941 2034 2HD ARG 115 2HD ARG 115 26.709 6.802 0.261 2035 HE ARG 115 HE ARG 115 26.492 4.131 -0.910 2036 1HH1 ARG 115 1HH1 ARG 115 26.600 7.551 -1.545 2037 2HH1 ARG 115 2HH1 ARG 115 25.749 7.412 -3.044 2038 1HH2 ARG 115 1HH2 ARG 115 25.390 3.974 -2.859 2039 2HH2 ARG 115 2HH2 ARG 115 25.068 5.402 -3.785 2040 H LEU 116 H LEU 116 29.675 2.769 -2.064 2041 HA LEU 116 HA LEU 116 31.575 0.751 -0.915 2042 1HB LEU 116 1HB LEU 116 29.226 0.611 -2.780 2043 2HB LEU 116 2HB LEU 116 30.534 -0.552 -2.998 2044 HG LEU 116 HG LEU 116 29.041 -0.060 -0.402 2045 1HD1 LEU 116 1HD1 LEU 116 27.498 -1.446 -1.293 2046 2HD1 LEU 116 2HD1 LEU 116 28.725 -2.712 -1.246 2047 3HD1 LEU 116 3HD1 LEU 116 28.504 -1.751 -2.709 2048 1HD2 LEU 116 1HD2 LEU 116 30.307 -2.385 -0.024 2049 2HD2 LEU 116 2HD2 LEU 116 31.084 -0.844 0.337 2050 3HD2 LEU 116 3HD2 LEU 116 31.432 -1.673 -1.180 2051 H THR 117 H THR 117 32.826 2.968 -1.779 2052 HA THR 117 HA THR 117 33.814 2.237 -4.515 2053 HB THR 117 HB THR 117 33.566 5.005 -3.283 2054 HG1 THR 117 HG1 THR 117 31.609 5.039 -4.019 2055 1HG2 THR 117 1HG2 THR 117 34.841 5.619 -5.035 2056 2HG2 THR 117 2HG2 THR 117 33.582 5.026 -6.119 2057 3HG2 THR 117 3HG2 THR 117 34.890 3.954 -5.615 2058 H GLN 118 H GLN 118 35.908 1.561 -4.337 2059 HA GLN 118 HA GLN 118 38.126 1.376 -3.547 2060 1HB GLN 118 1HB GLN 118 37.317 4.146 -3.788 2061 2HB GLN 118 2HB GLN 118 38.483 3.979 -2.475 2062 1HG GLN 118 1HG GLN 118 39.741 2.454 -4.256 2063 2HG GLN 118 2HG GLN 118 38.823 3.435 -5.398 2064 1HE2 GLN 118 1HE2 GLN 118 41.795 3.345 -4.012 2065 2HE2 GLN 118 2HE2 GLN 118 42.134 5.005 -3.907 2066 H ASN 119 H ASN 119 39.478 2.239 -1.399 2067 HA ASN 119 HA ASN 119 37.712 1.807 0.980 2068 1HB ASN 119 1HB ASN 119 40.068 0.265 -0.054 2069 2HB ASN 119 2HB ASN 119 39.874 0.400 1.694 2070 1HD2 ASN 119 1HD2 ASN 119 39.575 -2.144 0.893 2071 2HD2 ASN 119 2HD2 ASN 119 37.945 -2.605 0.780 2072 1H GLY 201 1H GLY 201 29.434 32.986 12.282 2073 2H GLY 201 2H GLY 201 28.033 33.656 11.595 2074 3H GLY 201 3H GLY 201 29.503 33.708 10.746 2075 1HA GLY 201 1HA GLY 201 27.799 31.961 10.049 2076 2HA GLY 201 2HA GLY 201 29.474 31.454 10.260 2077 H LYS 202 H LYS 202 26.654 30.181 10.734 2078 HA LYS 202 HA LYS 202 27.465 28.488 12.936 2079 1HB LYS 202 1HB LYS 202 26.104 31.001 13.463 2080 2HB LYS 202 2HB LYS 202 25.119 29.645 14.013 2081 1HG LYS 202 1HG LYS 202 27.558 28.851 14.903 2082 2HG LYS 202 2HG LYS 202 27.748 30.602 15.004 2083 1HD LYS 202 1HD LYS 202 26.303 30.764 16.745 2084 2HD LYS 202 2HD LYS 202 25.152 29.654 16.001 2085 1HE LYS 202 1HE LYS 202 27.733 28.573 17.119 2086 2HE LYS 202 2HE LYS 202 26.371 28.910 18.206 2087 1HZ LYS 202 1HZ LYS 202 26.158 26.681 17.352 2088 2HZ LYS 202 2HZ LYS 202 26.322 27.226 15.752 2089 3HZ LYS 202 3HZ LYS 202 24.945 27.644 16.654 2090 H ALA 203 H ALA 203 24.268 29.787 11.975 2091 HA ALA 203 HA ALA 203 23.498 26.997 11.184 2092 1HB ALA 203 1HB ALA 203 21.163 27.964 11.710 2093 2HB ALA 203 2HB ALA 203 22.016 29.348 12.394 2094 3HB ALA 203 3HB ALA 203 22.245 27.742 13.085 2095 HA PRO 204 HA PRO 204 23.495 29.410 7.273 2096 1HB PRO 204 1HB PRO 204 23.685 27.111 5.711 2097 2HB PRO 204 2HB PRO 204 25.073 28.044 6.296 2098 1HG PRO 204 1HG PRO 204 23.898 25.525 7.347 2099 2HG PRO 204 2HG PRO 204 25.589 26.036 7.271 2100 1HD PRO 204 1HD PRO 204 24.128 26.083 9.557 2101 2HD PRO 204 2HD PRO 204 25.448 27.226 9.232 2102 H ARG 205 H ARG 205 21.648 29.809 6.050 2103 HA ARG 205 HA ARG 205 19.258 28.151 6.654 2104 1HB ARG 205 1HB ARG 205 19.239 30.620 6.924 2105 2HB ARG 205 2HB ARG 205 19.640 30.806 5.217 2106 1HG ARG 205 1HG ARG 205 17.546 29.609 4.618 2107 2HG ARG 205 2HG ARG 205 17.140 29.495 6.330 2108 1HD ARG 205 1HD ARG 205 17.244 32.017 6.449 2109 2HD ARG 205 2HD ARG 205 17.427 32.032 4.684 2110 HE ARG 205 HE ARG 205 15.239 30.343 5.243 2111 1HH1 ARG 205 1HH1 ARG 205 16.114 33.680 5.705 2112 2HH1 ARG 205 2HH1 ARG 205 14.478 34.234 5.628 2113 1HH2 ARG 205 1HH2 ARG 205 13.124 31.086 5.145 2114 2HH2 ARG 205 2HH2 ARG 205 12.795 32.778 5.313 2115 H LYS 206 H LYS 206 20.327 29.838 3.677 2116 HA LYS 206 HA LYS 206 20.206 29.144 1.422 2117 1HB LYS 206 1HB LYS 206 21.068 26.783 3.072 2118 2HB LYS 206 2HB LYS 206 20.776 26.547 1.348 2119 1HG LYS 206 1HG LYS 206 22.659 27.670 0.770 2120 2HG LYS 206 2HG LYS 206 22.351 28.955 1.937 2121 1HD LYS 206 1HD LYS 206 24.350 27.884 2.682 2122 2HD LYS 206 2HD LYS 206 23.073 27.285 3.741 2123 1HE LYS 206 1HE LYS 206 23.272 25.631 1.360 2124 2HE LYS 206 2HE LYS 206 24.829 25.715 2.206 2125 1HZ LYS 206 1HZ LYS 206 23.552 24.023 3.261 2126 2HZ LYS 206 2HZ LYS 206 22.177 25.016 3.352 2127 3HZ LYS 206 3HZ LYS 206 23.539 25.361 4.306 2128 H GLN 207 H GLN 207 19.184 27.013 0.126 2129 HA GLN 207 HA GLN 207 16.362 27.299 0.293 2130 1HB GLN 207 1HB GLN 207 16.398 25.345 -1.242 2131 2HB GLN 207 2HB GLN 207 17.656 26.505 -1.668 2132 1HG GLN 207 1HG GLN 207 19.322 25.164 -0.452 2133 2HG GLN 207 2HG GLN 207 18.068 24.018 0.022 2134 1HE2 GLN 207 1HE2 GLN 207 18.866 25.610 -3.126 2135 2HE2 GLN 207 2HE2 GLN 207 18.933 24.160 -4.005 2136 H LEU 208 H LEU 208 15.213 24.809 0.362 2137 HA LEU 208 HA LEU 208 15.997 23.544 2.946 2138 1HB LEU 208 1HB LEU 208 13.668 25.255 2.340 2139 2HB LEU 208 2HB LEU 208 13.246 23.732 3.122 2140 HG LEU 208 HG LEU 208 15.590 25.112 4.280 2141 1HD1 LEU 208 1HD1 LEU 208 14.623 27.070 4.875 2142 2HD1 LEU 208 2HD1 LEU 208 13.104 26.278 5.294 2143 3HD1 LEU 208 3HD1 LEU 208 13.430 26.730 3.621 2144 1HD2 LEU 208 1HD2 LEU 208 14.630 24.320 6.327 2145 2HD2 LEU 208 2HD2 LEU 208 14.383 23.037 5.142 2146 3HD2 LEU 208 3HD2 LEU 208 13.048 24.103 5.578 2147 H ALA 209 H ALA 209 16.579 21.753 1.465 2148 HA ALA 209 HA ALA 209 16.112 19.732 0.332 2149 1HB ALA 209 1HB ALA 209 14.473 18.505 1.461 2150 2HB ALA 209 2HB ALA 209 13.361 19.872 1.534 2151 3HB ALA 209 3HB ALA 209 14.751 19.807 2.618 2152 H THR 210 H THR 210 16.012 20.591 -1.829 2153 HA THR 210 HA THR 210 13.629 21.837 -2.906 2154 HB THR 210 HB THR 210 15.925 20.421 -4.309 2155 HG1 THR 210 HG1 THR 210 15.678 22.995 -3.173 2156 1HG2 THR 210 1HG2 THR 210 15.381 22.436 -5.920 2157 2HG2 THR 210 2HG2 THR 210 13.811 22.396 -5.117 2158 3HG2 THR 210 3HG2 THR 210 14.396 20.974 -5.982 2159 H LYS 211 H LYS 211 15.020 18.547 -3.189 2160 HA LYS 211 HA LYS 211 12.307 17.602 -4.057 2161 1HB LYS 211 1HB LYS 211 14.226 17.779 -5.787 2162 2HB LYS 211 2HB LYS 211 14.963 16.430 -4.921 2163 1HG LYS 211 1HG LYS 211 13.329 14.935 -5.581 2164 2HG LYS 211 2HG LYS 211 12.087 16.182 -5.695 2165 1HD LYS 211 1HD LYS 211 12.777 16.863 -7.816 2166 2HD LYS 211 2HD LYS 211 14.418 16.260 -7.585 2167 1HE LYS 211 1HE LYS 211 12.531 14.070 -7.385 2168 2HE LYS 211 2HE LYS 211 12.315 14.934 -8.919 2169 1HZ LYS 211 1HZ LYS 211 14.118 13.212 -8.936 2170 2HZ LYS 211 2HZ LYS 211 14.969 14.170 -7.820 2171 3HZ LYS 211 3HZ LYS 211 14.631 14.772 -9.372 2172 H ALA 212 H ALA 212 11.506 16.028 -2.725 2173 HA ALA 212 HA ALA 212 12.784 15.101 -0.380 2174 1HB ALA 212 1HB ALA 212 10.768 14.029 -0.120 2175 2HB ALA 212 2HB ALA 212 10.851 13.288 -1.718 2176 3HB ALA 212 3HB ALA 212 10.310 14.957 -1.547 2177 H ALA 213 H ALA 213 13.611 12.921 0.101 2178 HA ALA 213 HA ALA 213 15.431 11.939 -1.958 2179 1HB ALA 213 1HB ALA 213 15.742 12.110 0.596 2180 2HB ALA 213 2HB ALA 213 16.266 10.601 -0.152 2181 3HB ALA 213 3HB ALA 213 14.726 10.673 0.705 2182 H ARG 214 H ARG 214 14.495 10.770 -3.618 2183 HA ARG 214 HA ARG 214 12.408 8.744 -2.915 2184 1HB ARG 214 1HB ARG 214 12.687 10.735 -4.915 2185 2HB ARG 214 2HB ARG 214 12.857 9.188 -5.744 2186 1HG ARG 214 1HG ARG 214 10.629 8.886 -5.620 2187 2HG ARG 214 2HG ARG 214 10.725 8.935 -3.860 2188 1HD ARG 214 1HD ARG 214 9.231 10.713 -4.447 2189 2HD ARG 214 2HD ARG 214 10.780 11.517 -4.131 2190 HE ARG 214 HE ARG 214 10.493 10.634 -6.901 2191 1HH1 ARG 214 1HH1 ARG 214 9.817 13.164 -4.607 2192 2HH1 ARG 214 2HH1 ARG 214 9.710 14.389 -5.823 2193 1HH2 ARG 214 1HH2 ARG 214 10.349 12.243 -8.461 2194 2HH2 ARG 214 2HH2 ARG 214 10.009 13.874 -7.989 2195 1HN MLZ 215 1HN MLZ 215 12.570 6.659 -4.156 2196 HA MLZ 215 HA MLZ 215 15.325 5.637 -4.067 2197 1HB MLZ 215 1HB MLZ 215 12.526 4.594 -4.352 2198 2HB MLZ 215 2HB MLZ 215 13.857 3.546 -4.843 2199 1HG MLZ 215 1HG MLZ 215 14.284 4.894 -2.259 2200 2HG MLZ 215 2HG MLZ 215 14.527 3.203 -2.700 2201 1HD MLZ 215 1HD MLZ 215 11.907 4.551 -1.991 2202 2HD MLZ 215 2HD MLZ 215 12.018 2.919 -2.652 2203 1HE MLZ 215 1HE MLZ 215 13.704 3.588 -0.262 2204 2HE MLZ 215 2HE MLZ 215 12.934 2.052 -0.703 2205 HZ MLZ 215 HZ MLZ 215 10.852 2.822 -0.055 2206 1HCM MLZ 215 1HCM MLZ 215 12.997 3.755 1.719 2207 2HCM MLZ 215 2HCM MLZ 215 11.845 2.442 1.955 2208 3HCM MLZ 215 3HCM MLZ 215 11.322 4.116 2.134 2209 H SER 216 H SER 216 16.578 5.142 -5.851 2210 HA SER 216 HA SER 216 17.256 5.045 -8.109 2211 1HB SER 216 1HB SER 216 14.869 6.864 -8.556 2212 2HB SER 216 2HB SER 216 16.361 7.432 -7.808 2213 HG SER 216 HG SER 216 16.034 7.552 -10.238 2214 H ALA 217 H ALA 217 16.492 4.274 -10.296 2215 HA ALA 217 HA ALA 217 14.153 2.431 -9.970 2216 1HB ALA 217 1HB ALA 217 13.122 3.338 -11.824 2217 2HB ALA 217 2HB ALA 217 14.653 3.695 -12.623 2218 3HB ALA 217 3HB ALA 217 14.049 4.764 -11.357 2219 HA PRO 218 HA PRO 218 16.833 -0.685 -11.523 2220 1HB PRO 218 1HB PRO 218 14.599 -1.609 -13.259 2221 2HB PRO 218 2HB PRO 218 15.476 -2.490 -11.996 2222 1HG PRO 218 1HG PRO 218 12.962 -1.607 -11.656 2223 2HG PRO 218 2HG PRO 218 14.126 -1.698 -10.327 2224 1HD PRO 218 1HD PRO 218 13.134 0.676 -11.815 2225 2HD PRO 218 2HD PRO 218 13.634 0.528 -10.117 2226 H ALA 219 H ALA 219 14.838 1.108 -13.845 2227 HA ALA 219 HA ALA 219 16.988 0.737 -15.902 2228 1HB ALA 219 1HB ALA 219 14.960 -0.101 -16.762 2229 2HB ALA 219 2HB ALA 219 14.962 1.554 -17.370 2230 3HB ALA 219 3HB ALA 219 13.999 1.137 -15.953 2231 H THR 220 H THR 220 18.301 2.518 -15.191 2232 HA THR 220 HA THR 220 17.004 5.216 -15.287 2233 HB THR 220 HB THR 220 19.118 5.843 -14.028 2234 HG1 THR 220 HG1 THR 220 20.632 4.415 -14.098 2235 1HG2 THR 220 1HG2 THR 220 17.438 5.536 -12.493 2236 2HG2 THR 220 2HG2 THR 220 18.430 4.150 -12.042 2237 3HG2 THR 220 3HG2 THR 220 17.037 3.929 -13.100 2238 H GLY 221 H GLY 221 17.529 4.015 -17.776 2239 1HA GLY 221 1HA GLY 221 18.525 5.597 -19.553 2240 2HA GLY 221 2HA GLY 221 20.039 5.362 -18.679 2241 1HN SAH 301 1HN SAH 301 -12.060 -0.176 -8.287 2242 2HN SAH 301 2HN SAH 301 -10.539 0.537 -8.548 2243 HA SAH 301 HA SAH 301 -12.871 2.089 -7.562 2244 1HB SAH 301 1HB SAH 301 -11.805 -0.066 -6.295 2245 2HB SAH 301 2HB SAH 301 -10.703 1.195 -5.741 2246 1HG SAH 301 1HG SAH 301 -12.640 0.956 -4.213 2247 2HG SAH 301 2HG SAH 301 -13.731 1.306 -5.554 2248 1H5* SAH 301 1H5* SAH 301 -14.879 2.811 -4.699 2249 2H5* SAH 301 2H5* SAH 301 -14.467 4.369 -3.984 2250 H4* SAH 301 H4* SAH 301 -13.784 4.860 -6.488 2251 H3* SAH 301 H3* SAH 301 -15.980 5.421 -4.718 2252 *HO3 SAH 301 *HO3 SAH 301 -16.007 7.330 -5.959 2253 H2* SAH 301 H2* SAH 301 -17.772 4.772 -5.889 2254 *HO2 SAH 301 *HO2 SAH 301 -17.225 5.639 -8.382 2255 H1* SAH 301 H1* SAH 301 -16.649 3.860 -8.374 2256 H8 SAH 301 H8 SAH 301 -16.132 1.289 -5.809 2257 1HN6 SAH 301 1HN6 SAH 301 -21.300 -1.130 -7.784 2258 2HN6 SAH 301 2HN6 SAH 301 -20.499 -1.063 -6.229 2259 H2 SAH 301 H2 SAH 301 -21.345 3.302 -8.926 2260 1HN SAH 302 1HN SAH 302 12.544 -0.132 8.334 2261 2HN SAH 302 2HN SAH 302 11.033 0.566 8.674 2262 HA SAH 302 HA SAH 302 13.304 2.138 7.584 2263 1HB SAH 302 1HB SAH 302 12.187 -0.019 6.359 2264 2HB SAH 302 2HB SAH 302 11.048 1.236 5.867 2265 1HG SAH 302 1HG SAH 302 12.906 1.016 4.240 2266 2HG SAH 302 2HG SAH 302 14.061 1.370 5.524 2267 1H5* SAH 302 1H5* SAH 302 15.152 2.888 4.618 2268 2H5* SAH 302 2H5* SAH 302 14.692 4.444 3.929 2269 H4* SAH 302 H4* SAH 302 14.132 4.922 6.467 2270 H3* SAH 302 H3* SAH 302 16.231 5.506 4.589 2271 *HO3 SAH 302 *HO3 SAH 302 16.304 7.412 5.832 2272 H2* SAH 302 H2* SAH 302 18.086 4.869 5.666 2273 *HO2 SAH 302 *HO2 SAH 302 17.659 5.725 8.186 2274 H1* SAH 302 H1* SAH 302 17.098 3.941 8.202 2275 H8 SAH 302 H8 SAH 302 16.472 1.372 5.659 2276 1HN6 SAH 302 1HN6 SAH 302 21.754 -1.008 7.360 2277 2HN6 SAH 302 2HN6 SAH 302 20.875 -0.943 5.849 2278 H2 SAH 302 H2 SAH 302 21.820 3.422 8.512 Start of MODEL 14 1 1H MET 1 1H MET 1 0.511 -12.194 -7.927 2 2H MET 1 2H MET 1 -0.210 -11.342 -6.648 3 3H MET 1 3H MET 1 0.418 -10.499 -7.982 4 HA MET 1 HA MET 1 -2.096 -10.784 -7.902 5 1HB MET 1 1HB MET 1 -0.053 -11.050 -9.983 6 2HB MET 1 2HB MET 1 -1.594 -11.738 -10.476 7 1HG MET 1 1HG MET 1 -2.279 -9.640 -10.933 8 2HG MET 1 2HG MET 1 -2.257 -9.343 -9.199 9 1HE MET 1 1HE MET 1 0.136 -6.743 -8.669 10 2HE MET 1 2HE MET 1 -0.681 -8.122 -7.930 11 3HE MET 1 3HE MET 1 -1.594 -6.984 -8.918 12 H PHE 2 H PHE 2 -3.804 -12.289 -8.286 13 HA PHE 2 HA PHE 2 -4.850 -14.398 -8.104 14 1HB PHE 2 1HB PHE 2 -3.938 -14.568 -10.350 15 2HB PHE 2 2HB PHE 2 -2.362 -14.980 -9.716 16 HD1 PHE 2 HD1 PHE 2 -1.920 -17.193 -10.395 17 HD2 PHE 2 HD2 PHE 2 -5.748 -16.195 -8.722 18 HE1 PHE 2 HE1 PHE 2 -2.546 -19.592 -10.396 19 HE2 PHE 2 HE2 PHE 2 -6.374 -18.594 -8.723 20 HZ PHE 2 HZ PHE 2 -4.773 -20.293 -9.560 21 H ASN 3 H ASN 3 -4.075 -14.073 -5.712 22 HA ASN 3 HA ASN 3 -1.937 -15.942 -4.887 23 1HB ASN 3 1HB ASN 3 -3.816 -14.126 -3.337 24 2HB ASN 3 2HB ASN 3 -2.393 -14.930 -2.677 25 1HD2 ASN 3 1HD2 ASN 3 -0.314 -14.014 -3.148 26 2HD2 ASN 3 2HD2 ASN 3 -0.121 -12.561 -4.004 27 H ASP 4 H ASP 4 -3.797 -17.481 -6.061 28 HA ASP 4 HA ASP 4 -5.291 -19.261 -5.717 29 1HB ASP 4 1HB ASP 4 -3.425 -19.973 -4.381 30 2HB ASP 4 2HB ASP 4 -3.957 -18.953 -3.059 31 H ARG 5 H ARG 5 -5.611 -18.211 -2.371 32 HA ARG 5 HA ARG 5 -8.395 -18.410 -2.220 33 1HB ARG 5 1HB ARG 5 -6.516 -16.479 -0.808 34 2HB ARG 5 2HB ARG 5 -8.109 -16.960 -0.225 35 1HG ARG 5 1HG ARG 5 -6.840 -19.383 -0.745 36 2HG ARG 5 2HG ARG 5 -5.564 -18.384 -0.048 37 1HD ARG 5 1HD ARG 5 -6.553 -18.370 2.015 38 2HD ARG 5 2HD ARG 5 -8.179 -18.180 1.331 39 HE ARG 5 HE ARG 5 -7.470 -20.734 0.564 40 1HH1 ARG 5 1HH1 ARG 5 -7.498 -19.040 3.605 41 2HH1 ARG 5 2HH1 ARG 5 -7.788 -20.475 4.526 42 1HH2 ARG 5 1HH2 ARG 5 -7.847 -22.582 1.782 43 2HH2 ARG 5 2HH2 ARG 5 -7.984 -22.465 3.505 44 H VAL 6 H VAL 6 -6.448 -15.654 -3.357 45 HA VAL 6 HA VAL 6 -8.929 -14.465 -4.484 46 HB VAL 6 HB VAL 6 -7.104 -13.124 -2.454 47 1HG1 VAL 6 1HG1 VAL 6 -9.236 -11.454 -2.781 48 2HG1 VAL 6 2HG1 VAL 6 -9.048 -12.070 -4.422 49 3HG1 VAL 6 3HG1 VAL 6 -7.700 -11.258 -3.625 50 1HG2 VAL 6 1HG2 VAL 6 -8.623 -14.548 -1.300 51 2HG2 VAL 6 2HG2 VAL 6 -9.952 -14.136 -2.384 52 3HG2 VAL 6 3HG2 VAL 6 -9.356 -12.945 -1.228 53 H ILE 7 H ILE 7 -8.512 -13.355 -6.368 54 HA ILE 7 HA ILE 7 -5.631 -12.941 -7.105 55 HB ILE 7 HB ILE 7 -6.877 -14.636 -8.410 56 1HG1 ILE 7 1HG1 ILE 7 -6.659 -12.189 -10.161 57 2HG1 ILE 7 2HG1 ILE 7 -5.220 -12.931 -9.463 58 1HG2 ILE 7 1HG2 ILE 7 -8.940 -12.611 -8.238 59 2HG2 ILE 7 2HG2 ILE 7 -9.078 -14.305 -8.709 60 3HG2 ILE 7 3HG2 ILE 7 -8.665 -13.086 -9.914 61 1HD1 ILE 7 1HD1 ILE 7 -5.620 -13.862 -11.688 62 2HD1 ILE 7 2HD1 ILE 7 -7.268 -14.302 -11.233 63 3HD1 ILE 7 3HD1 ILE 7 -5.893 -15.108 -10.470 64 H VAL 8 H VAL 8 -5.256 -11.025 -8.532 65 HA VAL 8 HA VAL 8 -7.079 -8.776 -7.779 66 HB VAL 8 HB VAL 8 -4.174 -8.922 -8.667 67 1HG1 VAL 8 1HG1 VAL 8 -5.904 -6.562 -7.873 68 2HG1 VAL 8 2HG1 VAL 8 -5.126 -6.826 -9.434 69 3HG1 VAL 8 3HG1 VAL 8 -4.147 -6.495 -8.005 70 1HG2 VAL 8 1HG2 VAL 8 -5.137 -7.915 -6.011 71 2HG2 VAL 8 2HG2 VAL 8 -3.596 -8.664 -6.428 72 3HG2 VAL 8 3HG2 VAL 8 -5.047 -9.655 -6.280 73 H LYS 9 H LYS 9 -8.409 -8.094 -9.401 74 HA LYS 9 HA LYS 9 -7.490 -8.449 -12.229 75 1HB LYS 9 1HB LYS 9 -10.259 -8.361 -10.991 76 2HB LYS 9 2HB LYS 9 -9.933 -8.583 -12.705 77 1HG LYS 9 1HG LYS 9 -8.315 -10.459 -11.332 78 2HG LYS 9 2HG LYS 9 -9.915 -10.546 -10.598 79 1HD LYS 9 1HD LYS 9 -10.912 -10.757 -12.860 80 2HD LYS 9 2HD LYS 9 -9.292 -10.753 -13.556 81 1HE LYS 9 1HE LYS 9 -8.747 -12.773 -12.148 82 2HE LYS 9 2HE LYS 9 -10.451 -12.828 -11.662 83 1HZ LYS 9 1HZ LYS 9 -9.391 -12.916 -14.442 84 2HZ LYS 9 2HZ LYS 9 -11.039 -12.818 -14.045 85 3HZ LYS 9 3HZ LYS 9 -10.141 -14.193 -13.611 86 H LYS 10 H LYS 10 -8.138 -4.984 -12.986 87 HA LYS 10 HA LYS 10 -7.372 -6.068 -14.908 88 1HB LYS 10 1HB LYS 10 -6.025 -7.175 -12.533 89 2HB LYS 10 2HB LYS 10 -5.915 -8.203 -13.962 90 1HG LYS 10 1HG LYS 10 -4.753 -6.602 -15.188 91 2HG LYS 10 2HG LYS 10 -5.404 -5.260 -14.245 92 1HD LYS 10 1HD LYS 10 -3.992 -5.791 -12.371 93 2HD LYS 10 2HD LYS 10 -3.498 -7.319 -13.101 94 1HE LYS 10 1HE LYS 10 -2.436 -6.033 -14.973 95 2HE LYS 10 2HE LYS 10 -2.838 -4.531 -14.119 96 1HZ LYS 10 1HZ LYS 10 -1.584 -5.237 -12.236 97 2HZ LYS 10 2HZ LYS 10 -0.585 -5.447 -13.593 98 3HZ LYS 10 3HZ LYS 10 -1.348 -6.789 -12.885 99 H SER 11 H SER 11 -9.876 -6.695 -14.888 100 HA SER 11 HA SER 11 -10.080 -9.687 -14.970 101 1HB SER 11 1HB SER 11 -12.639 -8.848 -14.877 102 2HB SER 11 2HB SER 11 -11.676 -9.040 -13.414 103 HG SER 11 HG SER 11 -12.789 -6.973 -13.692 104 HA PRO 12 HA PRO 12 -11.121 -9.744 -19.228 105 1HB PRO 12 1HB PRO 12 -13.911 -10.633 -18.696 106 2HB PRO 12 2HB PRO 12 -12.634 -11.442 -19.621 107 1HG PRO 12 1HG PRO 12 -13.411 -12.290 -17.194 108 2HG PRO 12 2HG PRO 12 -11.745 -12.443 -17.765 109 1HD PRO 12 1HD PRO 12 -12.904 -10.546 -15.792 110 2HD PRO 12 2HD PRO 12 -11.281 -11.264 -15.857 111 H LEU 13 H LEU 13 -13.557 -8.298 -17.108 112 HA LEU 13 HA LEU 13 -14.785 -6.720 -19.253 113 1HB LEU 13 1HB LEU 13 -15.220 -7.437 -16.474 114 2HB LEU 13 2HB LEU 13 -15.422 -5.698 -16.689 115 HG LEU 13 HG LEU 13 -16.679 -7.580 -18.664 116 1HD1 LEU 13 1HD1 LEU 13 -18.639 -7.835 -17.298 117 2HD1 LEU 13 2HD1 LEU 13 -18.008 -6.727 -16.080 118 3HD1 LEU 13 3HD1 LEU 13 -17.265 -8.312 -16.300 119 1HD2 LEU 13 1HD2 LEU 13 -17.600 -4.934 -17.510 120 2HD2 LEU 13 2HD2 LEU 13 -18.233 -5.751 -18.939 121 3HD2 LEU 13 3HD2 LEU 13 -16.606 -5.072 -18.960 122 H GLY 14 H GLY 14 -12.431 -6.179 -16.644 123 1HA GLY 14 1HA GLY 14 -10.632 -4.503 -17.269 124 2HA GLY 14 2HA GLY 14 -11.953 -3.450 -17.776 125 H GLY 15 H GLY 15 -10.910 -1.960 -16.147 126 1HA GLY 15 1HA GLY 15 -11.193 -0.840 -14.092 127 2HA GLY 15 2HA GLY 15 -12.390 -2.059 -13.652 128 H TYR 16 H TYR 16 -10.956 -1.539 -11.562 129 HA TYR 16 HA TYR 16 -8.844 -3.668 -11.454 130 1HB TYR 16 1HB TYR 16 -8.663 -0.839 -11.140 131 2HB TYR 16 2HB TYR 16 -8.385 -1.558 -9.556 132 HD1 TYR 16 HD1 TYR 16 -6.598 -3.294 -9.269 133 HD2 TYR 16 HD2 TYR 16 -7.069 -1.065 -12.911 134 HE1 TYR 16 HE1 TYR 16 -4.311 -3.950 -9.967 135 HE2 TYR 16 HE2 TYR 16 -4.782 -1.721 -13.609 136 HH TYR 16 HH TYR 16 -2.509 -2.605 -11.854 137 H GLY 17 H GLY 17 -10.907 -4.838 -10.696 138 1HA GLY 17 1HA GLY 17 -11.452 -4.277 -7.809 139 2HA GLY 17 2HA GLY 17 -12.571 -5.127 -8.876 140 H VAL 18 H VAL 18 -12.269 -6.711 -6.890 141 HA VAL 18 HA VAL 18 -9.856 -8.426 -7.403 142 HB VAL 18 HB VAL 18 -11.661 -8.032 -4.996 143 1HG1 VAL 18 1HG1 VAL 18 -9.642 -9.392 -3.954 144 2HG1 VAL 18 2HG1 VAL 18 -9.484 -10.004 -5.601 145 3HG1 VAL 18 3HG1 VAL 18 -10.988 -10.243 -4.712 146 1HG2 VAL 18 1HG2 VAL 18 -10.172 -6.486 -4.312 147 2HG2 VAL 18 2HG2 VAL 18 -9.511 -6.529 -5.947 148 3HG2 VAL 18 3HG2 VAL 18 -8.809 -7.542 -4.685 149 H PHE 19 H PHE 19 -10.213 -10.769 -7.298 150 HA PHE 19 HA PHE 19 -13.022 -11.556 -8.000 151 1HB PHE 19 1HB PHE 19 -10.419 -11.888 -9.298 152 2HB PHE 19 2HB PHE 19 -11.260 -13.424 -9.100 153 HD1 PHE 19 HD1 PHE 19 -12.754 -14.055 -10.767 154 HD2 PHE 19 HD2 PHE 19 -12.022 -9.876 -10.087 155 HE1 PHE 19 HE1 PHE 19 -14.248 -13.484 -12.663 156 HE2 PHE 19 HE2 PHE 19 -13.516 -9.306 -11.983 157 HZ PHE 19 HZ PHE 19 -14.629 -11.110 -13.271 158 H ALA 20 H ALA 20 -13.878 -13.054 -6.633 159 HA ALA 20 HA ALA 20 -12.153 -14.284 -4.577 160 1HB ALA 20 1HB ALA 20 -14.102 -14.226 -3.392 161 2HB ALA 20 2HB ALA 20 -15.008 -14.988 -4.699 162 3HB ALA 20 3HB ALA 20 -14.724 -13.247 -4.721 163 H ARG 21 H ARG 21 -11.004 -15.937 -5.693 164 HA ARG 21 HA ARG 21 -12.175 -17.808 -7.533 165 1HB ARG 21 1HB ARG 21 -9.672 -17.227 -6.273 166 2HB ARG 21 2HB ARG 21 -10.005 -18.943 -6.039 167 1HG ARG 21 1HG ARG 21 -8.972 -18.961 -8.128 168 2HG ARG 21 2HG ARG 21 -10.670 -18.859 -8.587 169 1HD ARG 21 1HD ARG 21 -10.454 -16.711 -9.371 170 2HD ARG 21 2HD ARG 21 -9.306 -16.259 -8.095 171 HE ARG 21 HE ARG 21 -7.548 -16.993 -9.503 172 1HH1 ARG 21 1HH1 ARG 21 -10.610 -18.249 -10.583 173 2HH1 ARG 21 2HH1 ARG 21 -9.945 -18.935 -12.024 174 1HH2 ARG 21 1HH2 ARG 21 -6.709 -17.891 -11.380 175 2HH2 ARG 21 2HH2 ARG 21 -7.753 -18.735 -12.474 176 H LYS 22 H LYS 22 -12.126 -17.577 -4.051 177 HA LYS 22 HA LYS 22 -12.986 -20.365 -3.622 178 1HB LYS 22 1HB LYS 22 -12.869 -17.994 -1.716 179 2HB LYS 22 2HB LYS 22 -12.843 -19.697 -1.281 180 1HG LYS 22 1HG LYS 22 -10.728 -19.333 -3.117 181 2HG LYS 22 2HG LYS 22 -10.634 -17.998 -1.971 182 1HD LYS 22 1HD LYS 22 -9.645 -19.429 -0.536 183 2HD LYS 22 2HD LYS 22 -11.205 -20.236 -0.390 184 1HE LYS 22 1HE LYS 22 -9.555 -20.941 -2.777 185 2HE LYS 22 2HE LYS 22 -9.011 -21.559 -1.206 186 1HZ LYS 22 1HZ LYS 22 -10.762 -22.915 -2.459 187 2HZ LYS 22 2HZ LYS 22 -11.853 -21.687 -2.026 188 3HZ LYS 22 3HZ LYS 22 -11.061 -22.583 -0.820 189 H SER 23 H SER 23 -16.446 -19.551 -2.589 190 HA SER 23 HA SER 23 -13.981 -21.119 -1.975 191 1HB SER 23 1HB SER 23 -16.417 -22.135 -0.824 192 2HB SER 23 2HB SER 23 -16.723 -21.692 -2.504 193 HG SER 23 HG SER 23 -15.876 -23.867 -2.112 194 H PHE 24 H PHE 24 -16.004 -18.676 -0.656 195 HA PHE 24 HA PHE 24 -14.744 -19.106 2.023 196 1HB PHE 24 1HB PHE 24 -15.813 -16.702 0.510 197 2HB PHE 24 2HB PHE 24 -15.323 -16.615 2.201 198 HD1 PHE 24 HD1 PHE 24 -12.976 -18.351 2.320 199 HD2 PHE 24 HD2 PHE 24 -14.174 -15.574 -0.731 200 HE1 PHE 24 HE1 PHE 24 -10.611 -18.098 1.621 201 HE2 PHE 24 HE2 PHE 24 -11.807 -15.321 -1.429 202 HZ PHE 24 HZ PHE 24 -10.026 -16.584 -0.253 203 H GLU 25 H GLU 25 -16.048 -18.891 3.908 204 HA GLU 25 HA GLU 25 -18.920 -19.507 3.493 205 1HB GLU 25 1HB GLU 25 -17.041 -20.579 5.084 206 2HB GLU 25 2HB GLU 25 -17.590 -19.305 6.171 207 1HG GLU 25 1HG GLU 25 -19.987 -20.235 5.395 208 2HG GLU 25 2HG GLU 25 -19.046 -21.709 5.171 209 H LYS 26 H LYS 26 -19.683 -18.445 6.116 210 HA LYS 26 HA LYS 26 -19.929 -15.574 5.355 211 1HB LYS 26 1HB LYS 26 -21.913 -17.095 5.788 212 2HB LYS 26 2HB LYS 26 -21.389 -17.200 7.465 213 1HG LYS 26 1HG LYS 26 -21.505 -14.692 7.586 214 2HG LYS 26 2HG LYS 26 -22.205 -14.696 5.967 215 1HD LYS 26 1HD LYS 26 -24.190 -15.676 6.682 216 2HD LYS 26 2HD LYS 26 -23.430 -16.437 8.080 217 1HE LYS 26 1HE LYS 26 -23.285 -13.497 8.137 218 2HE LYS 26 2HE LYS 26 -24.941 -14.132 8.195 219 1HZ LYS 26 1HZ LYS 26 -22.650 -14.855 9.944 220 2HZ LYS 26 2HZ LYS 26 -24.079 -15.769 9.874 221 3HZ LYS 26 3HZ LYS 26 -24.128 -14.159 10.412 222 H GLY 27 H GLY 27 -17.529 -15.496 6.193 223 1HA GLY 27 1HA GLY 27 -16.755 -13.949 8.052 224 2HA GLY 27 2HA GLY 27 -17.572 -15.057 9.154 225 H GLU 28 H GLU 28 -14.972 -14.949 6.710 226 HA GLU 28 HA GLU 28 -13.483 -16.943 8.375 227 1HB GLU 28 1HB GLU 28 -14.719 -17.333 5.854 228 2HB GLU 28 2HB GLU 28 -12.987 -17.244 5.536 229 1HG GLU 28 1HG GLU 28 -13.971 -18.908 7.834 230 2HG GLU 28 2HG GLU 28 -14.085 -19.551 6.196 231 H LEU 29 H LEU 29 -13.436 -13.874 7.242 232 HA LEU 29 HA LEU 29 -11.726 -12.281 6.949 233 1HB LEU 29 1HB LEU 29 -10.888 -14.012 8.836 234 2HB LEU 29 2HB LEU 29 -9.667 -14.318 7.634 235 HG LEU 29 HG LEU 29 -10.298 -11.696 8.989 236 1HD1 LEU 29 1HD1 LEU 29 -8.519 -13.729 9.585 237 2HD1 LEU 29 2HD1 LEU 29 -8.396 -12.062 10.147 238 3HD1 LEU 29 3HD1 LEU 29 -7.525 -12.572 8.700 239 1HD2 LEU 29 1HD2 LEU 29 -9.992 -11.095 6.688 240 2HD2 LEU 29 2HD2 LEU 29 -8.639 -12.214 6.513 241 3HD2 LEU 29 3HD2 LEU 29 -8.466 -10.764 7.505 242 H VAL 30 H VAL 30 -10.804 -11.665 5.024 243 HA VAL 30 HA VAL 30 -10.104 -13.838 3.129 244 HB VAL 30 HB VAL 30 -10.722 -10.875 2.804 245 1HG1 VAL 30 1HG1 VAL 30 -9.475 -11.184 0.900 246 2HG1 VAL 30 2HG1 VAL 30 -10.986 -11.882 0.314 247 3HG1 VAL 30 3HG1 VAL 30 -9.701 -12.933 0.911 248 1HG2 VAL 30 1HG2 VAL 30 -12.388 -13.131 3.150 249 2HG2 VAL 30 2HG2 VAL 30 -12.485 -12.712 1.440 250 3HG2 VAL 30 3HG2 VAL 30 -12.878 -11.507 2.667 251 H GLU 31 H GLU 31 -8.906 -10.479 3.390 252 HA GLU 31 HA GLU 31 -6.123 -11.573 3.570 253 1HB GLU 31 1HB GLU 31 -7.340 -9.570 1.647 254 2HB GLU 31 2HB GLU 31 -5.597 -9.695 1.887 255 1HG GLU 31 1HG GLU 31 -7.248 -12.136 1.249 256 2HG GLU 31 2HG GLU 31 -6.662 -11.080 -0.036 257 H GLU 32 H GLU 32 -4.562 -9.952 4.373 258 HA GLU 32 HA GLU 32 -5.791 -7.613 5.772 259 1HB GLU 32 1HB GLU 32 -4.474 -8.308 7.797 260 2HB GLU 32 2HB GLU 32 -5.698 -9.494 7.344 261 1HG GLU 32 1HG GLU 32 -3.231 -10.013 5.923 262 2HG GLU 32 2HG GLU 32 -2.930 -9.944 7.659 263 H CYS 33 H CYS 33 -4.405 -5.824 5.859 264 HA CYS 33 HA CYS 33 -1.543 -6.171 5.136 265 1HB CYS 33 1HB CYS 33 -1.838 -4.513 3.280 266 2HB CYS 33 2HB CYS 33 -2.766 -5.987 3.009 267 HG CYS 33 HG CYS 33 -4.252 -3.758 2.661 268 H LEU 34 H LEU 34 -0.681 -3.660 4.922 269 HA LEU 34 HA LEU 34 -1.449 -2.417 7.515 270 1HB LEU 34 1HB LEU 34 0.868 -2.054 5.595 271 2HB LEU 34 2HB LEU 34 0.684 -1.146 7.092 272 HG LEU 34 HG LEU 34 2.126 -2.940 7.634 273 1HD1 LEU 34 1HD1 LEU 34 -0.450 -4.221 8.453 274 2HD1 LEU 34 2HD1 LEU 34 -0.049 -2.619 9.072 275 3HD1 LEU 34 3HD1 LEU 34 1.025 -3.982 9.390 276 1HD2 LEU 34 1HD2 LEU 34 1.349 -4.195 5.473 277 2HD2 LEU 34 2HD2 LEU 34 0.242 -5.014 6.575 278 3HD2 LEU 34 3HD2 LEU 34 1.983 -5.122 6.833 279 H CYS 35 H CYS 35 -1.303 0.119 7.417 280 HA CYS 35 HA CYS 35 -2.292 1.232 4.841 281 1HB CYS 35 1HB CYS 35 -3.763 1.188 7.499 282 2HB CYS 35 2HB CYS 35 -4.234 2.226 6.154 283 HG CYS 35 HG CYS 35 -4.639 -0.822 6.289 284 H ILE 36 H ILE 36 -2.526 3.679 5.045 285 HA ILE 36 HA ILE 36 -0.322 4.743 6.757 286 HB ILE 36 HB ILE 36 -1.824 5.811 4.338 287 1HG1 ILE 36 1HG1 ILE 36 1.093 5.060 4.560 288 2HG1 ILE 36 2HG1 ILE 36 -0.139 3.881 4.117 289 1HG2 ILE 36 1HG2 ILE 36 -1.072 7.621 5.880 290 2HG2 ILE 36 2HG2 ILE 36 -0.199 7.645 4.347 291 3HG2 ILE 36 3HG2 ILE 36 0.570 6.983 5.790 292 1HD1 ILE 36 1HD1 ILE 36 -0.563 4.880 2.080 293 2HD1 ILE 36 2HD1 ILE 36 1.133 5.326 2.266 294 3HD1 ILE 36 3HD1 ILE 36 -0.132 6.488 2.663 295 H VAL 37 H VAL 37 -0.725 6.593 8.096 296 HA VAL 37 HA VAL 37 -3.626 7.206 8.561 297 HB VAL 37 HB VAL 37 -1.340 6.967 10.555 298 1HG1 VAL 37 1HG1 VAL 37 -4.282 7.606 10.815 299 2HG1 VAL 37 2HG1 VAL 37 -2.907 8.514 11.446 300 3HG1 VAL 37 3HG1 VAL 37 -3.349 6.967 12.169 301 1HG2 VAL 37 1HG2 VAL 37 -1.880 4.769 9.786 302 2HG2 VAL 37 2HG2 VAL 37 -3.608 5.121 9.782 303 3HG2 VAL 37 3HG2 VAL 37 -2.743 4.966 11.312 304 H ARG 38 H ARG 38 -3.232 9.072 7.092 305 HA ARG 38 HA ARG 38 -1.524 11.213 8.298 306 1HB ARG 38 1HB ARG 38 -2.135 10.223 5.616 307 2HB ARG 38 2HB ARG 38 -2.374 11.966 5.739 308 1HG ARG 38 1HG ARG 38 0.128 10.523 6.643 309 2HG ARG 38 2HG ARG 38 -0.042 11.358 5.098 310 1HD ARG 38 1HD ARG 38 -0.788 12.906 7.539 311 2HD ARG 38 2HD ARG 38 0.935 12.603 7.269 312 HE ARG 38 HE ARG 38 -0.416 13.432 4.834 313 1HH1 ARG 38 1HH1 ARG 38 1.027 14.554 7.798 314 2HH1 ARG 38 2HH1 ARG 38 1.400 16.115 7.153 315 1HH2 ARG 38 1HH2 ARG 38 0.080 15.466 4.021 316 2HH2 ARG 38 2HH2 ARG 38 0.869 16.629 5.032 317 H HIS 39 H HIS 39 -2.451 13.262 8.706 318 HA HIS 39 HA HIS 39 -5.217 13.394 9.408 319 1HB HIS 39 1HB HIS 39 -3.151 15.535 8.773 320 2HB HIS 39 2HB HIS 39 -4.680 15.840 9.599 321 HD1 HIS 39 HD1 HIS 39 -1.744 16.158 10.872 322 HD2 HIS 39 HD2 HIS 39 -4.372 12.982 11.493 323 HE1 HIS 39 HE1 HIS 39 -1.073 15.092 13.070 324 H ASN 40 H ASN 40 -6.449 15.500 8.358 325 HA ASN 40 HA ASN 40 -6.916 14.723 5.545 326 1HB ASN 40 1HB ASN 40 -8.527 15.329 7.618 327 2HB ASN 40 2HB ASN 40 -8.365 16.940 6.927 328 1HD2 ASN 40 1HD2 ASN 40 -8.045 15.863 4.137 329 2HD2 ASN 40 2HD2 ASN 40 -9.593 15.345 3.671 330 H ASP 41 H ASP 41 -7.914 17.674 5.198 331 HA ASP 41 HA ASP 41 -7.075 19.644 4.233 332 1HB ASP 41 1HB ASP 41 -4.604 18.921 5.851 333 2HB ASP 41 2HB ASP 41 -5.071 20.527 5.302 334 H ASP 42 H ASP 42 -3.917 19.679 3.833 335 HA ASP 42 HA ASP 42 -3.767 19.232 1.111 336 1HB ASP 42 1HB ASP 42 -1.713 18.670 3.280 337 2HB ASP 42 2HB ASP 42 -1.324 18.874 1.572 338 H TRP 43 H TRP 43 -3.828 16.776 3.624 339 HA TRP 43 HA TRP 43 -2.829 14.576 2.053 340 1HB TRP 43 1HB TRP 43 -2.935 14.518 4.481 341 2HB TRP 43 2HB TRP 43 -4.671 14.823 4.460 342 HD1 TRP 43 HD1 TRP 43 -6.145 12.765 4.616 343 HE1 TRP 43 HE1 TRP 43 -5.838 10.236 4.195 344 HE3 TRP 43 HE3 TRP 43 -1.368 12.727 2.798 345 HZ2 TRP 43 HZ2 TRP 43 -3.817 8.455 3.201 346 HZ3 TRP 43 HZ3 TRP 43 -0.294 10.610 2.130 347 HH2 TRP 43 HH2 TRP 43 -1.507 8.469 2.353 348 H GLY 44 H GLY 44 -6.203 15.382 2.992 349 1HA GLY 44 1HA GLY 44 -7.477 13.499 1.317 350 2HA GLY 44 2HA GLY 44 -8.222 15.003 1.858 351 H THR 45 H THR 45 -5.985 16.558 0.534 352 HA THR 45 HA THR 45 -7.275 16.796 -2.085 353 HB THR 45 HB THR 45 -4.821 18.131 -0.898 354 HG1 THR 45 HG1 THR 45 -6.185 19.191 0.267 355 1HG2 THR 45 1HG2 THR 45 -6.194 19.870 -2.611 356 2HG2 THR 45 2HG2 THR 45 -6.203 18.318 -3.452 357 3HG2 THR 45 3HG2 THR 45 -4.673 19.046 -2.957 358 H ALA 46 H ALA 46 -3.813 16.425 -1.198 359 HA ALA 46 HA ALA 46 -2.869 15.648 -3.734 360 1HB ALA 46 1HB ALA 46 -2.081 15.289 -0.874 361 2HB ALA 46 2HB ALA 46 -1.188 16.047 -2.192 362 3HB ALA 46 3HB ALA 46 -1.240 14.289 -2.059 363 H LEU 47 H LEU 47 -3.694 13.441 -1.033 364 HA LEU 47 HA LEU 47 -3.858 11.153 -2.912 365 1HB LEU 47 1HB LEU 47 -4.085 11.508 0.094 366 2HB LEU 47 2HB LEU 47 -4.193 9.944 -0.716 367 HG LEU 47 HG LEU 47 -1.932 10.919 -1.812 368 1HD1 LEU 47 1HD1 LEU 47 -1.378 12.809 -0.734 369 2HD1 LEU 47 2HD1 LEU 47 -0.778 11.697 0.491 370 3HD1 LEU 47 3HD1 LEU 47 -2.385 12.410 0.653 371 1HD2 LEU 47 1HD2 LEU 47 -1.564 8.854 -1.067 372 2HD2 LEU 47 2HD2 LEU 47 -2.588 9.095 0.344 373 3HD2 LEU 47 3HD2 LEU 47 -0.918 9.667 0.357 374 H GLU 48 H GLU 48 -5.889 12.950 -3.530 375 HA GLU 48 HA GLU 48 -8.297 12.554 -2.011 376 1HB GLU 48 1HB GLU 48 -9.347 13.451 -4.202 377 2HB GLU 48 2HB GLU 48 -8.208 14.487 -3.350 378 1HG GLU 48 1HG GLU 48 -7.937 14.318 -5.888 379 2HG GLU 48 2HG GLU 48 -6.483 14.080 -4.936 380 H ASP 49 H ASP 49 -7.560 9.968 -2.164 381 HA ASP 49 HA ASP 49 -9.751 8.601 -3.318 382 1HB ASP 49 1HB ASP 49 -7.661 9.384 -5.164 383 2HB ASP 49 2HB ASP 49 -7.752 7.627 -5.078 384 H TYR 50 H TYR 50 -9.592 6.301 -2.974 385 HA TYR 50 HA TYR 50 -8.803 4.342 -1.922 386 1HB TYR 50 1HB TYR 50 -6.034 5.516 -2.271 387 2HB TYR 50 2HB TYR 50 -6.522 3.830 -2.374 388 HD1 TYR 50 HD1 TYR 50 -5.268 6.273 -4.324 389 HD2 TYR 50 HD2 TYR 50 -8.732 3.731 -4.198 390 HE1 TYR 50 HE1 TYR 50 -5.541 6.520 -6.776 391 HE2 TYR 50 HE2 TYR 50 -9.003 3.981 -6.648 392 HH TYR 50 HH TYR 50 -7.746 4.567 -8.586 393 H LEU 51 H LEU 51 -9.112 6.999 -0.334 394 HA LEU 51 HA LEU 51 -7.223 6.370 1.896 395 1HB LEU 51 1HB LEU 51 -8.909 8.776 1.139 396 2HB LEU 51 2HB LEU 51 -8.068 8.664 2.681 397 HG LEU 51 HG LEU 51 -6.819 8.659 -0.082 398 1HD1 LEU 51 1HD1 LEU 51 -6.721 10.524 2.305 399 2HD1 LEU 51 2HD1 LEU 51 -7.354 10.879 0.698 400 3HD1 LEU 51 3HD1 LEU 51 -5.621 10.649 0.933 401 1HD2 LEU 51 1HD2 LEU 51 -4.651 8.600 1.273 402 2HD2 LEU 51 2HD2 LEU 51 -5.544 7.080 1.191 403 3HD2 LEU 51 3HD2 LEU 51 -5.634 8.078 2.642 404 H PHE 52 H PHE 52 -8.110 4.999 3.378 405 HA PHE 52 HA PHE 52 -11.026 5.037 3.918 406 1HB PHE 52 1HB PHE 52 -8.634 3.380 4.770 407 2HB PHE 52 2HB PHE 52 -10.208 3.178 5.540 408 HD1 PHE 52 HD1 PHE 52 -8.269 2.736 2.447 409 HD2 PHE 52 HD2 PHE 52 -12.132 2.318 4.279 410 HE1 PHE 52 HE1 PHE 52 -9.012 1.313 0.556 411 HE2 PHE 52 HE2 PHE 52 -12.875 0.895 2.389 412 HZ PHE 52 HZ PHE 52 -11.315 0.393 0.527 413 H SER 53 H SER 53 -11.481 6.907 5.111 414 HA SER 53 HA SER 53 -9.598 7.695 7.265 415 1HB SER 53 1HB SER 53 -10.578 9.835 6.995 416 2HB SER 53 2HB SER 53 -10.629 9.165 5.365 417 HG SER 53 HG SER 53 -12.702 9.394 7.261 418 H ARG 54 H ARG 54 -10.399 8.232 9.386 419 HA ARG 54 HA ARG 54 -12.916 6.785 10.142 420 1HB ARG 54 1HB ARG 54 -10.281 7.259 11.584 421 2HB ARG 54 2HB ARG 54 -11.698 6.555 12.362 422 1HG ARG 54 1HG ARG 54 -11.594 4.957 10.213 423 2HG ARG 54 2HG ARG 54 -9.885 5.384 10.303 424 1HD ARG 54 1HD ARG 54 -11.552 4.178 12.543 425 2HD ARG 54 2HD ARG 54 -10.250 3.376 11.649 426 HE ARG 54 HE ARG 54 -9.031 5.664 12.566 427 1HH1 ARG 54 1HH1 ARG 54 -10.927 3.171 14.088 428 2HH1 ARG 54 2HH1 ARG 54 -10.126 3.339 15.611 429 1HH2 ARG 54 1HH2 ARG 54 -8.006 5.862 14.556 430 2HH2 ARG 54 2HH2 ARG 54 -8.485 4.849 15.877 431 H LYS 55 H LYS 55 -13.467 7.769 12.556 432 HA LYS 55 HA LYS 55 -14.132 10.569 12.066 433 1HB LYS 55 1HB LYS 55 -14.947 8.347 13.716 434 2HB LYS 55 2HB LYS 55 -14.665 9.746 14.752 435 1HG LYS 55 1HG LYS 55 -16.006 10.850 12.604 436 2HG LYS 55 2HG LYS 55 -16.788 9.280 12.777 437 1HD LYS 55 1HD LYS 55 -17.807 9.895 14.702 438 2HD LYS 55 2HD LYS 55 -16.321 10.585 15.353 439 1HE LYS 55 1HE LYS 55 -16.686 12.670 14.188 440 2HE LYS 55 2HE LYS 55 -18.029 11.975 13.260 441 1HZ LYS 55 1HZ LYS 55 -18.731 13.256 15.269 442 2HZ LYS 55 2HZ LYS 55 -17.950 12.093 16.230 443 3HZ LYS 55 3HZ LYS 55 -19.268 11.645 15.256 444 H ASN 56 H ASN 56 -11.879 11.351 11.974 445 HA ASN 56 HA ASN 56 -10.286 11.281 14.454 446 1HB ASN 56 1HB ASN 56 -11.977 13.033 14.848 447 2HB ASN 56 2HB ASN 56 -10.388 13.771 14.646 448 1HD2 ASN 56 1HD2 ASN 56 -10.649 15.660 13.442 449 2HD2 ASN 56 2HD2 ASN 56 -11.630 15.810 12.066 450 H MET 57 H MET 57 -10.156 10.747 11.372 451 HA MET 57 HA MET 57 -8.276 12.675 10.304 452 1HB MET 57 1HB MET 57 -6.230 11.333 10.641 453 2HB MET 57 2HB MET 57 -6.968 11.718 12.195 454 1HG MET 57 1HG MET 57 -8.145 9.292 11.244 455 2HG MET 57 2HG MET 57 -6.395 9.136 11.092 456 1HE MET 57 1HE MET 57 -5.516 11.139 13.973 457 2HE MET 57 2HE MET 57 -4.909 10.160 12.638 458 3HE MET 57 3HE MET 57 -4.846 9.538 14.287 459 H SER 58 H SER 58 -6.758 11.177 8.616 460 HA SER 58 HA SER 58 -8.705 9.388 7.203 461 1HB SER 58 1HB SER 58 -6.768 11.381 5.979 462 2HB SER 58 2HB SER 58 -8.014 10.466 5.130 463 HG SER 58 HG SER 58 -8.282 12.603 6.934 464 H ALA 59 H ALA 59 -7.740 7.624 6.054 465 HA ALA 59 HA ALA 59 -4.791 7.271 6.444 466 1HB ALA 59 1HB ALA 59 -5.428 5.788 8.063 467 2HB ALA 59 2HB ALA 59 -5.891 4.743 6.719 468 3HB ALA 59 3HB ALA 59 -7.098 5.766 7.497 469 H MET 60 H MET 60 -4.114 5.205 5.088 470 HA MET 60 HA MET 60 -5.552 5.318 2.453 471 1HB MET 60 1HB MET 60 -3.219 6.408 2.764 472 2HB MET 60 2HB MET 60 -2.607 4.761 2.893 473 1HG MET 60 1HG MET 60 -3.135 4.250 0.682 474 2HG MET 60 2HG MET 60 -4.395 5.480 0.592 475 1HE MET 60 1HE MET 60 -2.505 7.216 -1.989 476 2HE MET 60 2HE MET 60 -3.892 7.617 -0.975 477 3HE MET 60 3HE MET 60 -3.690 5.974 -1.583 478 H ALA 61 H ALA 61 -5.521 3.314 1.220 479 HA ALA 61 HA ALA 61 -5.529 0.901 2.928 480 1HB ALA 61 1HB ALA 61 -6.088 0.200 0.288 481 2HB ALA 61 2HB ALA 61 -6.655 1.867 0.392 482 3HB ALA 61 3HB ALA 61 -7.289 0.649 1.499 483 H LEU 62 H LEU 62 -3.265 0.564 3.301 484 HA LEU 62 HA LEU 62 -1.150 -0.358 2.804 485 1HB LEU 62 1HB LEU 62 -0.930 0.842 0.169 486 2HB LEU 62 2HB LEU 62 -1.721 1.961 1.275 487 HG LEU 62 HG LEU 62 0.983 0.637 1.636 488 1HD1 LEU 62 1HD1 LEU 62 1.518 2.519 0.455 489 2HD1 LEU 62 2HD1 LEU 62 1.295 3.321 2.009 490 3HD1 LEU 62 3HD1 LEU 62 -0.016 3.306 0.830 491 1HD2 LEU 62 1HD2 LEU 62 0.928 2.247 3.719 492 2HD2 LEU 62 2HD2 LEU 62 0.199 0.645 3.835 493 3HD2 LEU 62 3HD2 LEU 62 -0.819 2.061 3.570 494 H GLY 63 H GLY 63 -2.518 -2.443 2.473 495 1HA GLY 63 1HA GLY 63 -1.500 -3.838 0.197 496 2HA GLY 63 2HA GLY 63 -2.744 -4.452 1.284 497 H PHE 64 H PHE 64 -4.261 -5.196 -0.173 498 HA PHE 64 HA PHE 64 -5.002 -3.605 -2.537 499 1HB PHE 64 1HB PHE 64 -6.051 -6.191 -1.324 500 2HB PHE 64 2HB PHE 64 -6.455 -5.592 -2.932 501 HD1 PHE 64 HD1 PHE 64 -3.784 -6.993 -0.804 502 HD2 PHE 64 HD2 PHE 64 -4.836 -5.654 -4.747 503 HE1 PHE 64 HE1 PHE 64 -1.728 -8.043 -1.709 504 HE2 PHE 64 HE2 PHE 64 -2.780 -6.705 -5.653 505 HZ PHE 64 HZ PHE 64 -1.226 -7.899 -4.134 506 H GLY 65 H GLY 65 -5.574 -2.107 -0.236 507 1HA GLY 65 1HA GLY 65 -8.401 -2.527 0.464 508 2HA GLY 65 2HA GLY 65 -7.356 -1.258 1.099 509 H ALA 66 H ALA 66 -6.544 -0.663 -1.800 510 HA ALA 66 HA ALA 66 -8.697 1.291 -2.297 511 1HB ALA 66 1HB ALA 66 -6.184 1.700 -2.389 512 2HB ALA 66 2HB ALA 66 -7.062 2.218 -3.828 513 3HB ALA 66 3HB ALA 66 -6.150 0.708 -3.847 514 H ILE 67 H ILE 67 -7.038 -1.252 -4.189 515 HA ILE 67 HA ILE 67 -8.431 -1.242 -6.554 516 HB ILE 67 HB ILE 67 -8.063 -3.775 -6.488 517 1HG1 ILE 67 1HG1 ILE 67 -6.586 -4.465 -4.503 518 2HG1 ILE 67 2HG1 ILE 67 -7.227 -3.056 -3.669 519 1HG2 ILE 67 1HG2 ILE 67 -5.748 -2.030 -5.604 520 2HG2 ILE 67 2HG2 ILE 67 -6.369 -2.114 -7.253 521 3HG2 ILE 67 3HG2 ILE 67 -5.636 -3.538 -6.512 522 1HD1 ILE 67 1HD1 ILE 67 -8.405 -5.566 -3.764 523 2HD1 ILE 67 2HD1 ILE 67 -9.327 -4.633 -4.945 524 3HD1 ILE 67 3HD1 ILE 67 -9.202 -4.073 -3.276 525 H PHE 68 H PHE 68 -9.776 -2.216 -3.450 526 HA PHE 68 HA PHE 68 -11.980 -3.772 -4.275 527 1HB PHE 68 1HB PHE 68 -11.413 -1.818 -2.053 528 2HB PHE 68 2HB PHE 68 -13.011 -2.552 -2.182 529 HD1 PHE 68 HD1 PHE 68 -12.715 -5.230 -2.941 530 HD2 PHE 68 HD2 PHE 68 -10.040 -2.901 -0.518 531 HE1 PHE 68 HE1 PHE 68 -11.836 -7.308 -1.914 532 HE2 PHE 68 HE2 PHE 68 -9.162 -4.980 0.509 533 HZ PHE 68 HZ PHE 68 -10.060 -7.184 -0.189 534 H ASN 69 H ASN 69 -14.036 -3.250 -5.085 535 HA ASN 69 HA ASN 69 -14.422 -0.393 -5.924 536 1HB ASN 69 1HB ASN 69 -15.316 -2.995 -7.221 537 2HB ASN 69 2HB ASN 69 -15.564 -1.380 -7.886 538 1HD2 ASN 69 1HD2 ASN 69 -14.055 -3.335 -9.329 539 2HD2 ASN 69 2HD2 ASN 69 -12.431 -2.830 -9.371 540 H HIS 70 H HIS 70 -16.915 -0.179 -6.579 541 HA HIS 70 HA HIS 70 -18.495 -1.012 -4.181 542 1HB HIS 70 1HB HIS 70 -18.287 1.393 -4.618 543 2HB HIS 70 2HB HIS 70 -18.817 1.163 -6.284 544 HD1 HIS 70 HD1 HIS 70 -20.078 1.635 -2.851 545 HD2 HIS 70 HD2 HIS 70 -21.624 0.350 -6.502 546 HE1 HIS 70 HE1 HIS 70 -22.600 1.687 -2.618 547 H SER 71 H SER 71 -20.633 -1.934 -4.553 548 HA SER 71 HA SER 71 -21.447 -2.541 -7.323 549 1HB SER 71 1HB SER 71 -19.752 -4.233 -6.882 550 2HB SER 71 2HB SER 71 -20.496 -4.631 -5.334 551 HG SER 71 HG SER 71 -20.979 -5.885 -7.439 552 H LYS 72 H LYS 72 -22.491 -1.362 -4.637 553 HA LYS 72 HA LYS 72 -24.543 -1.360 -3.460 554 1HB LYS 72 1HB LYS 72 -25.034 -1.285 -6.055 555 2HB LYS 72 2HB LYS 72 -25.642 -2.919 -5.792 556 1HG LYS 72 1HG LYS 72 -27.490 -1.356 -5.552 557 2HG LYS 72 2HG LYS 72 -27.105 -2.020 -3.965 558 1HD LYS 72 1HD LYS 72 -26.180 -0.033 -3.206 559 2HD LYS 72 2HD LYS 72 -25.730 0.497 -4.827 560 1HE LYS 72 1HE LYS 72 -28.394 0.493 -5.156 561 2HE LYS 72 2HE LYS 72 -28.345 0.767 -3.404 562 1HZ LYS 72 1HZ LYS 72 -28.172 2.853 -4.677 563 2HZ LYS 72 2HZ LYS 72 -26.757 2.277 -5.419 564 3HZ LYS 72 3HZ LYS 72 -26.782 2.562 -3.745 565 H ASP 73 H ASP 73 -22.694 -3.810 -3.364 566 HA ASP 73 HA ASP 73 -24.348 -5.461 -1.668 567 1HB ASP 73 1HB ASP 73 -24.382 -7.437 -3.216 568 2HB ASP 73 2HB ASP 73 -25.301 -6.072 -3.851 569 HA PRO 74 HA PRO 74 -19.655 -5.729 -1.566 570 1HB PRO 74 1HB PRO 74 -19.470 -5.044 1.119 571 2HB PRO 74 2HB PRO 74 -19.330 -3.888 -0.216 572 1HG PRO 74 1HG PRO 74 -21.655 -4.490 1.539 573 2HG PRO 74 2HG PRO 74 -21.110 -2.941 0.880 574 1HD PRO 74 1HD PRO 74 -23.214 -4.316 -0.134 575 2HD PRO 74 2HD PRO 74 -22.169 -3.283 -1.132 576 H ASN 75 H ASN 75 -19.915 -8.038 -1.722 577 HA ASN 75 HA ASN 75 -21.067 -9.716 0.280 578 1HB ASN 75 1HB ASN 75 -18.835 -10.147 -1.742 579 2HB ASN 75 2HB ASN 75 -19.651 -11.450 -0.877 580 1HD2 ASN 75 1HD2 ASN 75 -19.668 -10.754 -3.846 581 2HD2 ASN 75 2HD2 ASN 75 -21.311 -10.603 -4.242 582 H ALA 76 H ALA 76 -17.976 -8.093 0.081 583 HA ALA 76 HA ALA 76 -17.194 -9.358 2.684 584 1HB ALA 76 1HB ALA 76 -14.822 -8.703 1.525 585 2HB ALA 76 2HB ALA 76 -15.789 -9.011 0.083 586 3HB ALA 76 3HB ALA 76 -15.594 -10.272 1.300 587 H ARG 77 H ARG 77 -16.901 -7.844 4.275 588 HA ARG 77 HA ARG 77 -16.808 -4.973 3.497 589 1HB ARG 77 1HB ARG 77 -18.261 -6.386 5.328 590 2HB ARG 77 2HB ARG 77 -16.925 -5.835 6.338 591 1HG ARG 77 1HG ARG 77 -17.844 -3.785 6.442 592 2HG ARG 77 2HG ARG 77 -17.738 -3.648 4.688 593 1HD ARG 77 1HD ARG 77 -19.998 -3.772 4.576 594 2HD ARG 77 2HD ARG 77 -19.925 -5.397 5.281 595 HE ARG 77 HE ARG 77 -19.516 -3.608 7.413 596 1HH1 ARG 77 1HH1 ARG 77 -21.996 -4.285 5.066 597 2HH1 ARG 77 2HH1 ARG 77 -23.276 -3.774 6.110 598 1HH2 ARG 77 1HH2 ARG 77 -21.192 -2.952 8.748 599 2HH2 ARG 77 2HH2 ARG 77 -22.827 -3.025 8.180 600 H HIS 78 H HIS 78 -15.494 -3.785 5.523 601 HA HIS 78 HA HIS 78 -12.747 -4.979 5.405 602 1HB HIS 78 1HB HIS 78 -12.041 -2.559 5.604 603 2HB HIS 78 2HB HIS 78 -12.957 -2.913 4.141 604 HD1 HIS 78 HD1 HIS 78 -14.681 -1.192 3.687 605 HD2 HIS 78 HD2 HIS 78 -14.092 -1.696 7.782 606 HE1 HIS 78 HE1 HIS 78 -16.254 0.424 4.839 607 H GLU 79 H GLU 79 -11.401 -4.623 7.307 608 HA GLU 79 HA GLU 79 -12.887 -3.992 9.827 609 1HB GLU 79 1HB GLU 79 -12.857 -6.443 9.375 610 2HB GLU 79 2HB GLU 79 -11.102 -6.387 9.251 611 1HG GLU 79 1HG GLU 79 -11.809 -7.136 11.494 612 2HG GLU 79 2HG GLU 79 -10.961 -5.593 11.577 613 H LEU 80 H LEU 80 -11.702 -2.541 11.014 614 HA LEU 80 HA LEU 80 -8.799 -2.247 10.371 615 1HB LEU 80 1HB LEU 80 -11.001 -0.486 11.444 616 2HB LEU 80 2HB LEU 80 -9.314 -0.035 11.693 617 HG LEU 80 HG LEU 80 -10.429 -0.744 8.970 618 1HD1 LEU 80 1HD1 LEU 80 -11.677 1.182 9.595 619 2HD1 LEU 80 2HD1 LEU 80 -10.326 1.806 8.649 620 3HD1 LEU 80 3HD1 LEU 80 -10.292 1.908 10.407 621 1HD2 LEU 80 1HD2 LEU 80 -8.410 0.538 8.236 622 2HD2 LEU 80 2HD2 LEU 80 -8.004 -0.897 9.177 623 3HD2 LEU 80 3HD2 LEU 80 -7.937 0.697 9.928 624 H THR 81 H THR 81 -7.302 -2.787 11.906 625 HA THR 81 HA THR 81 -7.959 -4.179 14.299 626 HB THR 81 HB THR 81 -5.460 -3.413 14.773 627 HG1 THR 81 HG1 THR 81 -4.518 -2.404 13.148 628 1HG2 THR 81 1HG2 THR 81 -4.895 -4.942 12.610 629 2HG2 THR 81 2HG2 THR 81 -6.621 -5.271 12.765 630 3HG2 THR 81 3HG2 THR 81 -5.536 -5.607 14.114 631 H ALA 82 H ALA 82 -6.525 -3.055 16.363 632 HA ALA 82 HA ALA 82 -8.344 -1.060 17.392 633 1HB ALA 82 1HB ALA 82 -5.598 -1.587 18.501 634 2HB ALA 82 2HB ALA 82 -6.776 -2.899 18.487 635 3HB ALA 82 3HB ALA 82 -7.127 -1.409 19.362 636 H GLY 83 H GLY 83 -8.084 0.597 15.640 637 1HA GLY 83 1HA GLY 83 -7.010 2.943 16.108 638 2HA GLY 83 2HA GLY 83 -5.506 2.085 15.771 639 H LEU 84 H LEU 84 -4.836 2.247 13.690 640 HA LEU 84 HA LEU 84 -6.660 1.950 11.436 641 1HB LEU 84 1HB LEU 84 -7.053 4.284 12.385 642 2HB LEU 84 2HB LEU 84 -5.394 4.667 11.927 643 HG LEU 84 HG LEU 84 -5.934 4.052 9.575 644 1HD1 LEU 84 1HD1 LEU 84 -7.719 2.643 9.416 645 2HD1 LEU 84 2HD1 LEU 84 -8.660 4.135 9.386 646 3HD1 LEU 84 3HD1 LEU 84 -8.454 3.252 10.899 647 1HD2 LEU 84 1HD2 LEU 84 -7.783 5.971 9.373 648 2HD2 LEU 84 2HD2 LEU 84 -6.113 6.347 9.801 649 3HD2 LEU 84 3HD2 LEU 84 -7.342 6.231 11.061 650 H LYS 85 H LYS 85 -4.272 0.608 12.126 651 HA LYS 85 HA LYS 85 -2.327 1.679 10.108 652 1HB LYS 85 1HB LYS 85 -2.067 0.299 12.773 653 2HB LYS 85 2HB LYS 85 -0.752 0.201 11.603 654 1HG LYS 85 1HG LYS 85 -0.718 2.684 11.469 655 2HG LYS 85 2HG LYS 85 -1.980 2.750 12.698 656 1HD LYS 85 1HD LYS 85 -0.434 1.421 14.205 657 2HD LYS 85 2HD LYS 85 0.833 1.671 13.005 658 1HE LYS 85 1HE LYS 85 -0.643 4.115 13.838 659 2HE LYS 85 2HE LYS 85 0.417 3.391 15.062 660 1HZ LYS 85 1HZ LYS 85 1.239 3.843 12.242 661 2HZ LYS 85 2HZ LYS 85 2.231 3.409 13.551 662 3HZ LYS 85 3HZ LYS 85 1.547 4.962 13.483 663 H ARG 86 H ARG 86 -4.342 -0.989 11.014 664 HA ARG 86 HA ARG 86 -3.121 -2.617 8.811 665 1HB ARG 86 1HB ARG 86 -3.307 -3.105 11.637 666 2HB ARG 86 2HB ARG 86 -4.322 -4.280 10.801 667 1HG ARG 86 1HG ARG 86 -2.278 -4.564 9.210 668 2HG ARG 86 2HG ARG 86 -1.363 -3.797 10.508 669 1HD ARG 86 1HD ARG 86 -3.076 -6.293 10.806 670 2HD ARG 86 2HD ARG 86 -1.304 -6.252 10.761 671 HE ARG 86 HE ARG 86 -1.984 -4.399 12.721 672 1HH1 ARG 86 1HH1 ARG 86 -2.669 -7.763 12.143 673 2HH1 ARG 86 2HH1 ARG 86 -2.809 -8.137 13.825 674 1HH2 ARG 86 1HH2 ARG 86 -2.172 -4.908 14.898 675 2HH2 ARG 86 2HH2 ARG 86 -2.530 -6.534 15.377 676 H MET 87 H MET 87 -4.629 -3.788 7.542 677 HA MET 87 HA MET 87 -7.516 -3.159 8.082 678 1HB MET 87 1HB MET 87 -5.737 -2.996 5.708 679 2HB MET 87 2HB MET 87 -7.352 -3.630 5.397 680 1HG MET 87 1HG MET 87 -6.843 -1.067 6.929 681 2HG MET 87 2HG MET 87 -7.145 -1.111 5.192 682 1HE MET 87 1HE MET 87 -10.468 -0.507 4.866 683 2HE MET 87 2HE MET 87 -9.977 -2.082 4.244 684 3HE MET 87 3HE MET 87 -8.829 -0.744 4.258 685 H ARG 88 H ARG 88 -9.040 -4.812 7.360 686 HA ARG 88 HA ARG 88 -7.931 -7.514 6.785 687 1HB ARG 88 1HB ARG 88 -9.136 -6.507 9.295 688 2HB ARG 88 2HB ARG 88 -9.825 -8.025 8.719 689 1HG ARG 88 1HG ARG 88 -7.552 -8.991 8.572 690 2HG ARG 88 2HG ARG 88 -6.879 -7.480 9.187 691 1HD ARG 88 1HD ARG 88 -7.496 -7.960 11.335 692 2HD ARG 88 2HD ARG 88 -9.078 -8.587 10.828 693 HE ARG 88 HE ARG 88 -7.195 -10.433 9.868 694 1HH1 ARG 88 1HH1 ARG 88 -8.110 -9.118 12.959 695 2HH1 ARG 88 2HH1 ARG 88 -7.662 -10.547 13.823 696 1HH2 ARG 88 1HH2 ARG 88 -6.621 -12.277 11.012 697 2HH2 ARG 88 2HH2 ARG 88 -6.825 -12.324 12.732 698 H ILE 89 H ILE 89 -9.113 -8.071 4.969 699 HA ILE 89 HA ILE 89 -11.828 -6.983 4.590 700 HB ILE 89 HB ILE 89 -9.966 -8.745 2.958 701 1HG1 ILE 89 1HG1 ILE 89 -10.555 -6.211 1.787 702 2HG1 ILE 89 2HG1 ILE 89 -10.117 -5.928 3.469 703 1HG2 ILE 89 1HG2 ILE 89 -12.336 -9.169 2.378 704 2HG2 ILE 89 2HG2 ILE 89 -11.503 -8.315 1.078 705 3HG2 ILE 89 3HG2 ILE 89 -12.586 -7.437 2.158 706 1HD1 ILE 89 1HD1 ILE 89 -8.159 -7.597 2.960 707 2HD1 ILE 89 2HD1 ILE 89 -8.027 -5.922 2.423 708 3HD1 ILE 89 3HD1 ILE 89 -8.486 -7.183 1.277 709 H PHE 90 H PHE 90 -13.536 -8.055 5.466 710 HA PHE 90 HA PHE 90 -13.325 -11.007 5.887 711 1HB PHE 90 1HB PHE 90 -14.417 -8.689 7.308 712 2HB PHE 90 2HB PHE 90 -15.581 -10.011 7.200 713 HD1 PHE 90 HD1 PHE 90 -14.745 -12.376 7.813 714 HD2 PHE 90 HD2 PHE 90 -12.657 -8.777 8.874 715 HE1 PHE 90 HE1 PHE 90 -13.500 -13.616 9.561 716 HE2 PHE 90 HE2 PHE 90 -11.411 -10.016 10.624 717 HZ PHE 90 HZ PHE 90 -11.824 -12.442 10.955 718 H THR 91 H THR 91 -15.364 -12.251 5.505 719 HA THR 91 HA THR 91 -16.798 -11.209 3.095 720 HB THR 91 HB THR 91 -17.300 -13.744 2.909 721 HG1 THR 91 HG1 THR 91 -15.756 -14.992 4.096 722 1HG2 THR 91 1HG2 THR 91 -15.195 -12.183 2.033 723 2HG2 THR 91 2HG2 THR 91 -15.526 -13.831 1.500 724 3HG2 THR 91 3HG2 THR 91 -14.372 -13.541 2.802 725 H ILE 92 H ILE 92 -18.392 -10.001 4.357 726 HA ILE 92 HA ILE 92 -19.935 -10.964 6.509 727 HB ILE 92 HB ILE 92 -21.604 -9.288 5.634 728 1HG1 ILE 92 1HG1 ILE 92 -19.684 -8.711 3.399 729 2HG1 ILE 92 2HG1 ILE 92 -20.898 -9.973 3.184 730 1HG2 ILE 92 1HG2 ILE 92 -19.821 -8.429 6.987 731 2HG2 ILE 92 2HG2 ILE 92 -19.940 -7.359 5.590 732 3HG2 ILE 92 3HG2 ILE 92 -18.663 -8.573 5.665 733 1HD1 ILE 92 1HD1 ILE 92 -22.276 -8.276 2.566 734 2HD1 ILE 92 2HD1 ILE 92 -21.227 -7.050 3.279 735 3HD1 ILE 92 3HD1 ILE 92 -22.375 -7.926 4.292 736 H LYS 93 H LYS 93 -20.041 -11.851 3.136 737 HA LYS 93 HA LYS 93 -22.347 -13.666 3.739 738 1HB LYS 93 1HB LYS 93 -21.838 -12.010 1.237 739 2HB LYS 93 2HB LYS 93 -23.202 -13.101 1.478 740 1HG LYS 93 1HG LYS 93 -23.438 -11.589 3.707 741 2HG LYS 93 2HG LYS 93 -22.709 -10.405 2.623 742 1HD LYS 93 1HD LYS 93 -24.573 -11.497 0.970 743 2HD LYS 93 2HD LYS 93 -25.393 -11.657 2.524 744 1HE LYS 93 1HE LYS 93 -25.782 -9.419 2.634 745 2HE LYS 93 2HE LYS 93 -24.101 -9.043 2.212 746 1HZ LYS 93 1HZ LYS 93 -26.037 -10.101 0.230 747 2HZ LYS 93 2HZ LYS 93 -24.544 -9.346 -0.063 748 3HZ LYS 93 3HZ LYS 93 -25.860 -8.434 0.502 749 HA PRO 94 HA PRO 94 -19.656 -16.830 2.236 750 1HB PRO 94 1HB PRO 94 -22.045 -18.048 1.047 751 2HB PRO 94 2HB PRO 94 -20.921 -18.728 2.221 752 1HG PRO 94 1HG PRO 94 -23.400 -17.932 2.896 753 2HG PRO 94 2HG PRO 94 -22.027 -17.819 4.000 754 1HD PRO 94 1HD PRO 94 -23.420 -15.676 2.491 755 2HD PRO 94 2HD PRO 94 -22.595 -15.606 4.063 756 H ILE 95 H ILE 95 -18.435 -16.773 0.393 757 HA ILE 95 HA ILE 95 -19.715 -15.719 -2.098 758 HB ILE 95 HB ILE 95 -16.850 -15.855 -1.088 759 1HG1 ILE 95 1HG1 ILE 95 -18.519 -13.407 -1.673 760 2HG1 ILE 95 2HG1 ILE 95 -18.548 -14.191 -0.094 761 1HG2 ILE 95 1HG2 ILE 95 -16.730 -16.035 -3.473 762 2HG2 ILE 95 2HG2 ILE 95 -16.429 -14.338 -3.096 763 3HG2 ILE 95 3HG2 ILE 95 -18.011 -14.840 -3.693 764 1HD1 ILE 95 1HD1 ILE 95 -15.893 -14.044 -0.404 765 2HD1 ILE 95 2HD1 ILE 95 -16.821 -12.707 0.275 766 3HD1 ILE 95 3HD1 ILE 95 -16.345 -12.677 -1.423 767 H ALA 96 H ALA 96 -19.692 -16.981 -3.949 768 HA ALA 96 HA ALA 96 -18.827 -19.794 -3.670 769 1HB ALA 96 1HB ALA 96 -21.042 -18.997 -4.622 770 2HB ALA 96 2HB ALA 96 -20.144 -20.071 -5.694 771 3HB ALA 96 3HB ALA 96 -20.143 -18.332 -5.986 772 H ILE 97 H ILE 97 -17.570 -20.773 -5.511 773 HA ILE 97 HA ILE 97 -15.145 -19.286 -6.028 774 HB ILE 97 HB ILE 97 -16.313 -21.875 -7.111 775 1HG1 ILE 97 1HG1 ILE 97 -14.021 -22.012 -5.316 776 2HG1 ILE 97 2HG1 ILE 97 -15.386 -21.187 -4.568 777 1HG2 ILE 97 1HG2 ILE 97 -13.425 -21.718 -7.122 778 2HG2 ILE 97 2HG2 ILE 97 -14.106 -20.403 -8.080 779 3HG2 ILE 97 3HG2 ILE 97 -14.518 -22.076 -8.459 780 1HD1 ILE 97 1HD1 ILE 97 -16.720 -23.065 -4.611 781 2HD1 ILE 97 2HD1 ILE 97 -15.150 -23.865 -4.542 782 3HD1 ILE 97 3HD1 ILE 97 -15.980 -23.684 -6.087 783 H GLY 98 H GLY 98 -15.136 -17.608 -7.484 784 1HA GLY 98 1HA GLY 98 -15.039 -17.133 -9.932 785 2HA GLY 98 2HA GLY 98 -16.543 -18.040 -10.089 786 H GLU 99 H GLU 99 -15.700 -15.631 -7.608 787 HA GLU 99 HA GLU 99 -17.956 -13.938 -8.647 788 1HB GLU 99 1HB GLU 99 -17.034 -14.661 -5.848 789 2HB GLU 99 2HB GLU 99 -18.176 -13.355 -6.159 790 1HG GLU 99 1HG GLU 99 -18.707 -16.038 -7.382 791 2HG GLU 99 2HG GLU 99 -19.039 -15.815 -5.664 792 H GLU 100 H GLU 100 -17.659 -11.637 -7.380 793 HA GLU 100 HA GLU 100 -14.794 -10.827 -7.758 794 1HB GLU 100 1HB GLU 100 -16.462 -10.133 -9.552 795 2HB GLU 100 2HB GLU 100 -17.282 -9.175 -8.319 796 1HG GLU 100 1HG GLU 100 -14.789 -8.278 -7.914 797 2HG GLU 100 2HG GLU 100 -14.622 -8.737 -9.608 798 H ILE 101 H ILE 101 -13.931 -9.960 -5.912 799 HA ILE 101 HA ILE 101 -15.723 -9.302 -3.657 800 HB ILE 101 HB ILE 101 -12.696 -9.271 -3.953 801 1HG1 ILE 101 1HG1 ILE 101 -14.557 -11.412 -2.881 802 2HG1 ILE 101 2HG1 ILE 101 -13.670 -11.494 -4.403 803 1HG2 ILE 101 1HG2 ILE 101 -12.572 -9.083 -1.617 804 2HG2 ILE 101 2HG2 ILE 101 -14.239 -9.613 -1.391 805 3HG2 ILE 101 3HG2 ILE 101 -13.903 -7.999 -2.016 806 1HD1 ILE 101 1HD1 ILE 101 -12.520 -11.420 -1.600 807 2HD1 ILE 101 2HD1 ILE 101 -11.540 -11.187 -3.049 808 3HD1 ILE 101 3HD1 ILE 101 -12.377 -12.717 -2.787 809 H THR 102 H THR 102 -16.352 -7.254 -3.229 810 HA THR 102 HA THR 102 -14.644 -4.942 -3.916 811 HB THR 102 HB THR 102 -16.628 -3.972 -5.219 812 HG1 THR 102 HG1 THR 102 -17.419 -6.686 -5.297 813 1HG2 THR 102 1HG2 THR 102 -15.953 -4.985 -7.252 814 2HG2 THR 102 2HG2 THR 102 -15.585 -6.518 -6.461 815 3HG2 THR 102 3HG2 THR 102 -14.541 -5.120 -6.203 816 H ILE 103 H ILE 103 -15.140 -3.170 -2.562 817 HA ILE 103 HA ILE 103 -17.491 -3.536 -0.733 818 HB ILE 103 HB ILE 103 -16.049 -2.612 1.034 819 1HG1 ILE 103 1HG1 ILE 103 -13.490 -2.699 -0.195 820 2HG1 ILE 103 2HG1 ILE 103 -14.523 -1.715 -1.232 821 1HG2 ILE 103 1HG2 ILE 103 -14.165 -4.568 -0.125 822 2HG2 ILE 103 2HG2 ILE 103 -15.842 -5.109 -0.064 823 3HG2 ILE 103 3HG2 ILE 103 -15.023 -4.608 1.415 824 1HD1 ILE 103 1HD1 ILE 103 -13.704 -1.261 1.614 825 2HD1 ILE 103 2HD1 ILE 103 -15.277 -0.664 1.085 826 3HD1 ILE 103 3HD1 ILE 103 -13.808 -0.108 0.284 827 H SER 104 H SER 104 -18.638 -1.632 -0.190 828 HA SER 104 HA SER 104 -18.371 0.580 -2.109 829 1HB SER 104 1HB SER 104 -20.550 -0.384 -1.483 830 2HB SER 104 2HB SER 104 -20.254 0.006 0.211 831 HG SER 104 HG SER 104 -21.342 1.729 -0.411 832 H TYR 105 H TYR 105 -19.137 2.779 -0.625 833 HA TYR 105 HA TYR 105 -16.902 3.103 1.355 834 1HB TYR 105 1HB TYR 105 -18.022 5.241 -0.488 835 2HB TYR 105 2HB TYR 105 -16.520 5.293 0.430 836 HD1 TYR 105 HD1 TYR 105 -15.453 2.554 -0.123 837 HD2 TYR 105 HD2 TYR 105 -17.296 5.427 -2.730 838 HE1 TYR 105 HE1 TYR 105 -14.247 1.574 -2.057 839 HE2 TYR 105 HE2 TYR 105 -16.091 4.448 -4.662 840 HH TYR 105 HH TYR 105 -14.672 1.480 -4.630 841 H GLY 106 H GLY 106 -19.774 4.963 0.287 842 1HA GLY 106 1HA GLY 106 -21.629 4.771 2.163 843 2HA GLY 106 2HA GLY 106 -20.377 5.543 3.135 844 H ASP 107 H ASP 107 -22.653 6.947 2.916 845 HA ASP 107 HA ASP 107 -23.262 8.558 0.764 846 1HB ASP 107 1HB ASP 107 -23.986 10.189 2.516 847 2HB ASP 107 2HB ASP 107 -24.426 8.531 2.927 848 H ASP 108 H ASP 108 -20.442 8.874 2.875 849 HA ASP 108 HA ASP 108 -19.692 11.533 2.092 850 1HB ASP 108 1HB ASP 108 -18.662 9.243 3.599 851 2HB ASP 108 2HB ASP 108 -17.379 10.128 2.774 852 H TYR 109 H TYR 109 -18.703 8.319 0.853 853 HA TYR 109 HA TYR 109 -17.298 9.707 -1.394 854 1HB TYR 109 1HB TYR 109 -16.744 7.515 0.373 855 2HB TYR 109 2HB TYR 109 -16.839 6.877 -1.268 856 HD1 TYR 109 HD1 TYR 109 -14.606 6.533 -1.928 857 HD2 TYR 109 HD2 TYR 109 -15.724 10.244 -0.076 858 HE1 TYR 109 HE1 TYR 109 -12.354 7.452 -2.411 859 HE2 TYR 109 HE2 TYR 109 -13.472 11.163 -0.559 860 HH TYR 109 HH TYR 109 -10.897 9.485 -1.160 861 H TRP 110 H TRP 110 -18.541 9.818 -3.215 862 HA TRP 110 HA TRP 110 -19.985 9.189 -4.956 863 1HB TRP 110 1HB TRP 110 -18.389 7.439 -5.295 864 2HB TRP 110 2HB TRP 110 -18.949 6.546 -3.889 865 HD1 TRP 110 HD1 TRP 110 -21.148 5.125 -4.102 866 HE1 TRP 110 HE1 TRP 110 -22.483 4.281 -6.144 867 HE3 TRP 110 HE3 TRP 110 -19.115 8.055 -7.756 868 HZ2 TRP 110 HZ2 TRP 110 -22.661 4.786 -8.955 869 HZ3 TRP 110 HZ3 TRP 110 -19.883 7.854 -10.104 870 HH2 TRP 110 HH2 TRP 110 -21.652 6.225 -10.708 871 H LEU 111 H LEU 111 -20.737 6.465 -2.771 872 HA LEU 111 HA LEU 111 -23.489 6.405 -3.138 873 1HB LEU 111 1HB LEU 111 -21.714 5.024 -1.699 874 2HB LEU 111 2HB LEU 111 -22.346 6.017 -0.389 875 HG LEU 111 HG LEU 111 -24.619 5.242 -0.846 876 1HD1 LEU 111 1HD1 LEU 111 -23.263 3.918 -3.191 877 2HD1 LEU 111 2HD1 LEU 111 -24.723 4.910 -3.175 878 3HD1 LEU 111 3HD1 LEU 111 -24.765 3.265 -2.536 879 1HD2 LEU 111 1HD2 LEU 111 -24.376 3.086 0.053 880 2HD2 LEU 111 2HD2 LEU 111 -22.848 3.852 0.486 881 3HD2 LEU 111 3HD2 LEU 111 -22.925 2.754 -0.892 882 H SER 112 H SER 112 -25.263 7.136 -1.657 883 HA SER 112 HA SER 112 -24.693 9.570 -0.064 884 1HB SER 112 1HB SER 112 -25.547 11.027 -1.612 885 2HB SER 112 2HB SER 112 -25.208 9.731 -2.760 886 HG SER 112 HG SER 112 -27.267 9.300 -2.914 887 H ARG 113 H ARG 113 -25.855 9.233 1.781 888 HA ARG 113 HA ARG 113 -27.570 8.479 3.225 889 1HB ARG 113 1HB ARG 113 -28.446 10.315 1.426 890 2HB ARG 113 2HB ARG 113 -29.543 8.985 1.052 891 1HG ARG 113 1HG ARG 113 -30.702 10.095 2.753 892 2HG ARG 113 2HG ARG 113 -29.832 8.856 3.660 893 1HD ARG 113 1HD ARG 113 -27.944 10.712 3.786 894 2HD ARG 113 2HD ARG 113 -29.310 11.810 3.509 895 HE ARG 113 HE ARG 113 -30.073 9.880 5.472 896 1HH1 ARG 113 1HH1 ARG 113 -27.930 12.591 5.053 897 2HH1 ARG 113 2HH1 ARG 113 -27.960 13.014 6.729 898 1HH2 ARG 113 1HH2 ARG 113 -30.096 10.449 7.643 899 2HH2 ARG 113 2HH2 ARG 113 -29.176 11.813 8.186 900 HA PRO 114 HA PRO 114 -28.272 4.601 0.613 901 1HB PRO 114 1HB PRO 114 -26.293 2.994 1.618 902 2HB PRO 114 2HB PRO 114 -26.054 4.042 0.207 903 1HG PRO 114 1HG PRO 114 -25.234 4.450 3.040 904 2HG PRO 114 2HG PRO 114 -24.370 4.851 1.549 905 1HD PRO 114 1HD PRO 114 -25.743 6.673 3.072 906 2HD PRO 114 2HD PRO 114 -25.437 6.861 1.333 907 H ARG 115 H ARG 115 -29.473 2.857 1.489 908 HA ARG 115 HA ARG 115 -29.561 2.682 4.483 909 1HB ARG 115 1HB ARG 115 -31.748 2.836 2.394 910 2HB ARG 115 2HB ARG 115 -32.064 2.243 4.025 911 1HG ARG 115 1HG ARG 115 -30.894 4.954 3.323 912 2HG ARG 115 2HG ARG 115 -32.545 4.656 3.864 913 1HD ARG 115 1HD ARG 115 -31.201 3.426 5.868 914 2HD ARG 115 2HD ARG 115 -30.020 4.678 5.437 915 HE ARG 115 HE ARG 115 -32.763 5.680 5.583 916 1HH1 ARG 115 1HH1 ARG 115 -29.860 4.970 7.368 917 2HH1 ARG 115 2HH1 ARG 115 -30.223 6.104 8.622 918 1HH2 ARG 115 1HH2 ARG 115 -33.212 7.145 7.223 919 2HH2 ARG 115 2HH2 ARG 115 -32.105 7.327 8.543 920 H LEU 116 H LEU 116 -30.152 1.030 1.384 921 HA LEU 116 HA LEU 116 -30.208 -1.275 0.857 922 1HB LEU 116 1HB LEU 116 -28.052 -0.672 2.785 923 2HB LEU 116 2HB LEU 116 -28.484 -2.380 2.705 924 HG LEU 116 HG LEU 116 -28.439 -1.777 0.059 925 1HD1 LEU 116 1HD1 LEU 116 -26.073 -0.483 0.064 926 2HD1 LEU 116 2HD1 LEU 116 -26.798 0.247 1.497 927 3HD1 LEU 116 3HD1 LEU 116 -27.615 0.364 -0.062 928 1HD2 LEU 116 1HD2 LEU 116 -27.210 -3.569 1.434 929 2HD2 LEU 116 2HD2 LEU 116 -25.896 -2.401 1.568 930 3HD2 LEU 116 3HD2 LEU 116 -26.394 -2.990 -0.018 931 H THR 117 H THR 117 -32.297 -0.396 2.685 932 HA THR 117 HA THR 117 -32.663 -2.925 4.256 933 HB THR 117 HB THR 117 -33.576 -0.122 4.996 934 HG1 THR 117 HG1 THR 117 -31.659 0.162 5.756 935 1HG2 THR 117 1HG2 THR 117 -34.755 -2.228 5.911 936 2HG2 THR 117 2HG2 THR 117 -34.174 -1.055 7.093 937 3HG2 THR 117 3HG2 THR 117 -33.257 -2.531 6.791 938 H GLN 118 H GLN 118 -34.886 -3.636 4.413 939 HA GLN 118 HA GLN 118 -36.743 -2.333 2.447 940 1HB GLN 118 1HB GLN 118 -35.504 -4.890 2.431 941 2HB GLN 118 2HB GLN 118 -37.203 -5.166 2.815 942 1HG GLN 118 1HG GLN 118 -36.370 -3.353 0.548 943 2HG GLN 118 2HG GLN 118 -36.561 -5.091 0.317 944 1HE2 GLN 118 1HE2 GLN 118 -38.459 -4.730 -1.080 945 2HE2 GLN 118 2HE2 GLN 118 -39.950 -4.264 -0.417 946 H ASN 119 H ASN 119 -38.862 -2.076 3.168 947 HA ASN 119 HA ASN 119 -39.653 -3.384 5.733 948 1HB ASN 119 1HB ASN 119 -40.405 -1.150 6.540 949 2HB ASN 119 2HB ASN 119 -38.672 -1.165 6.214 950 1HD2 ASN 119 1HD2 ASN 119 -37.942 0.511 4.891 951 2HD2 ASN 119 2HD2 ASN 119 -38.916 1.411 3.833 952 1H GLY 201 1H GLY 201 -21.059 36.159 -9.164 953 2H GLY 201 2H GLY 201 -19.881 35.072 -8.601 954 3H GLY 201 3H GLY 201 -20.748 36.032 -7.499 955 1HA GLY 201 1HA GLY 201 -22.812 34.896 -8.163 956 2HA GLY 201 2HA GLY 201 -21.833 33.837 -9.179 957 H LYS 202 H LYS 202 -23.417 32.931 -6.960 958 HA LYS 202 HA LYS 202 -21.237 31.963 -5.139 959 1HB LYS 202 1HB LYS 202 -23.327 33.661 -4.518 960 2HB LYS 202 2HB LYS 202 -23.988 32.087 -4.075 961 1HG LYS 202 1HG LYS 202 -22.816 32.258 -2.152 962 2HG LYS 202 2HG LYS 202 -21.359 32.031 -3.120 963 1HD LYS 202 1HD LYS 202 -22.642 34.745 -2.763 964 2HD LYS 202 2HD LYS 202 -21.430 34.128 -1.640 965 1HE LYS 202 1HE LYS 202 -19.774 33.976 -3.396 966 2HE LYS 202 2HE LYS 202 -20.989 34.320 -4.641 967 1HZ LYS 202 1HZ LYS 202 -20.312 36.133 -2.380 968 2HZ LYS 202 2HZ LYS 202 -21.388 36.465 -3.651 969 3HZ LYS 202 3HZ LYS 202 -19.725 36.318 -3.962 970 H ALA 203 H ALA 203 -20.986 29.807 -5.594 971 HA ALA 203 HA ALA 203 -21.536 27.560 -6.071 972 1HB ALA 203 1HB ALA 203 -22.669 28.078 -3.852 973 2HB ALA 203 2HB ALA 203 -23.427 26.776 -4.770 974 3HB ALA 203 3HB ALA 203 -24.149 28.385 -4.760 975 HA PRO 204 HA PRO 204 -23.771 28.757 -9.896 976 1HB PRO 204 1HB PRO 204 -22.341 26.342 -10.879 977 2HB PRO 204 2HB PRO 204 -22.387 27.975 -11.567 978 1HG PRO 204 1HG PRO 204 -20.217 27.000 -10.321 979 2HG PRO 204 2HG PRO 204 -20.656 28.713 -10.264 980 1HD PRO 204 1HD PRO 204 -20.934 26.616 -8.171 981 2HD PRO 204 2HD PRO 204 -20.594 28.351 -8.001 982 H ARG 205 H ARG 205 -23.274 25.478 -8.570 983 HA ARG 205 HA ARG 205 -26.132 24.880 -9.264 984 1HB ARG 205 1HB ARG 205 -23.601 23.583 -9.953 985 2HB ARG 205 2HB ARG 205 -24.719 22.463 -9.175 986 1HG ARG 205 1HG ARG 205 -25.824 22.287 -11.129 987 2HG ARG 205 2HG ARG 205 -26.264 23.989 -10.990 988 1HD ARG 205 1HD ARG 205 -24.711 24.631 -12.546 989 2HD ARG 205 2HD ARG 205 -23.496 23.493 -11.933 990 HE ARG 205 HE ARG 205 -25.595 21.962 -13.074 991 1HH1 ARG 205 1HH1 ARG 205 -23.157 24.245 -14.057 992 2HH1 ARG 205 2HH1 ARG 205 -23.022 23.583 -15.649 993 1HH2 ARG 205 1HH2 ARG 205 -25.401 21.120 -15.147 994 2HH2 ARG 205 2HH2 ARG 205 -24.282 21.827 -16.263 995 H LYS 206 H LYS 206 -24.678 25.812 -6.713 996 HA LYS 206 HA LYS 206 -24.747 25.309 -4.404 997 1HB LYS 206 1HB LYS 206 -27.176 24.391 -5.770 998 2HB LYS 206 2HB LYS 206 -26.882 23.518 -4.266 999 1HG LYS 206 1HG LYS 206 -26.617 25.698 -3.090 1000 2HG LYS 206 2HG LYS 206 -27.009 26.531 -4.594 1001 1HD LYS 206 1HD LYS 206 -28.812 24.569 -3.142 1002 2HD LYS 206 2HD LYS 206 -29.007 26.322 -3.159 1003 1HE LYS 206 1HE LYS 206 -28.942 25.949 -5.805 1004 2HE LYS 206 2HE LYS 206 -29.521 24.337 -5.342 1005 1HZ LYS 206 1HZ LYS 206 -31.096 25.590 -3.806 1006 2HZ LYS 206 2HZ LYS 206 -31.449 25.646 -5.467 1007 3HZ LYS 206 3HZ LYS 206 -30.713 26.976 -4.710 1008 H GLN 207 H GLN 207 -22.674 23.969 -5.064 1009 HA GLN 207 HA GLN 207 -23.050 21.041 -4.938 1010 1HB GLN 207 1HB GLN 207 -20.996 23.020 -5.668 1011 2HB GLN 207 2HB GLN 207 -20.340 21.625 -4.812 1012 1HG GLN 207 1HG GLN 207 -22.237 21.360 -7.156 1013 2HG GLN 207 2HG GLN 207 -20.484 21.393 -7.349 1014 1HE2 GLN 207 1HE2 GLN 207 -19.424 19.799 -5.491 1015 2HE2 GLN 207 2HE2 GLN 207 -20.114 18.248 -5.475 1016 H LEU 208 H LEU 208 -23.616 20.422 -2.841 1017 HA LEU 208 HA LEU 208 -22.676 21.679 -0.439 1018 1HB LEU 208 1HB LEU 208 -24.484 19.691 -1.252 1019 2HB LEU 208 2HB LEU 208 -23.339 18.843 -0.212 1020 HG LEU 208 HG LEU 208 -25.204 19.768 1.113 1021 1HD1 LEU 208 1HD1 LEU 208 -22.591 19.871 1.750 1022 2HD1 LEU 208 2HD1 LEU 208 -23.849 20.463 2.836 1023 3HD1 LEU 208 3HD1 LEU 208 -22.958 21.594 1.817 1024 1HD2 LEU 208 1HD2 LEU 208 -25.878 21.976 1.017 1025 2HD2 LEU 208 2HD2 LEU 208 -25.302 21.783 -0.639 1026 3HD2 LEU 208 3HD2 LEU 208 -24.273 22.555 0.568 1027 H ALA 209 H ALA 209 -20.367 21.826 -0.503 1028 HA ALA 209 HA ALA 209 -18.642 19.582 -1.085 1029 1HB ALA 209 1HB ALA 209 -17.804 21.807 -1.322 1030 2HB ALA 209 2HB ALA 209 -16.984 21.173 0.106 1031 3HB ALA 209 3HB ALA 209 -18.356 22.267 0.289 1032 H THR 210 H THR 210 -17.660 18.128 0.353 1033 HA THR 210 HA THR 210 -18.605 18.238 3.201 1034 HB THR 210 HB THR 210 -18.237 15.632 2.843 1035 HG1 THR 210 HG1 THR 210 -18.852 15.201 0.598 1036 1HG2 THR 210 1HG2 THR 210 -20.599 16.806 1.396 1037 2HG2 THR 210 2HG2 THR 210 -20.409 17.072 3.129 1038 3HG2 THR 210 3HG2 THR 210 -20.545 15.431 2.499 1039 H LYS 211 H LYS 211 -16.559 19.396 3.690 1040 HA LYS 211 HA LYS 211 -14.012 18.004 3.208 1041 1HB LYS 211 1HB LYS 211 -14.812 20.474 4.792 1042 2HB LYS 211 2HB LYS 211 -13.148 19.994 4.463 1043 1HG LYS 211 1HG LYS 211 -15.170 20.423 2.256 1044 2HG LYS 211 2HG LYS 211 -14.158 21.729 2.872 1045 1HD LYS 211 1HD LYS 211 -12.420 19.547 2.437 1046 2HD LYS 211 2HD LYS 211 -13.468 19.619 1.020 1047 1HE LYS 211 1HE LYS 211 -12.199 22.134 2.113 1048 2HE LYS 211 2HE LYS 211 -11.318 21.082 0.989 1049 1HZ LYS 211 1HZ LYS 211 -12.687 22.797 -0.142 1050 2HZ LYS 211 2HZ LYS 211 -14.078 22.098 0.536 1051 3HZ LYS 211 3HZ LYS 211 -13.130 21.212 -0.560 1052 H ALA 212 H ALA 212 -15.084 16.061 4.500 1053 HA ALA 212 HA ALA 212 -13.856 16.050 7.157 1054 1HB ALA 212 1HB ALA 212 -16.210 15.449 8.139 1055 2HB ALA 212 2HB ALA 212 -16.834 16.237 6.690 1056 3HB ALA 212 3HB ALA 212 -15.842 17.146 7.829 1057 H ALA 213 H ALA 213 -12.953 14.037 7.164 1058 HA ALA 213 HA ALA 213 -12.694 11.713 6.839 1059 1HB ALA 213 1HB ALA 213 -14.710 11.924 8.364 1060 2HB ALA 213 2HB ALA 213 -14.698 10.454 7.391 1061 3HB ALA 213 3HB ALA 213 -15.730 11.808 6.930 1062 H ARG 214 H ARG 214 -13.438 9.859 5.314 1063 HA ARG 214 HA ARG 214 -14.506 10.892 2.726 1064 1HB ARG 214 1HB ARG 214 -11.788 9.836 3.397 1065 2HB ARG 214 2HB ARG 214 -12.468 9.376 1.837 1066 1HG ARG 214 1HG ARG 214 -12.385 11.520 1.017 1067 2HG ARG 214 2HG ARG 214 -12.700 12.245 2.594 1068 1HD ARG 214 1HD ARG 214 -10.373 11.660 3.295 1069 2HD ARG 214 2HD ARG 214 -10.069 11.037 1.662 1070 HE ARG 214 HE ARG 214 -10.277 13.852 2.406 1071 1HH1 ARG 214 1HH1 ARG 214 -10.774 11.513 -0.123 1072 2HH1 ARG 214 2HH1 ARG 214 -10.624 12.684 -1.387 1073 1HH2 ARG 214 1HH2 ARG 214 -10.086 15.354 0.749 1074 2HH2 ARG 214 2HH2 ARG 214 -10.237 14.843 -0.899 1075 1HN MLZ 215 1HN MLZ 215 -12.838 7.810 3.301 1076 HA MLZ 215 HA MLZ 215 -15.217 6.342 2.403 1077 1HB MLZ 215 1HB MLZ 215 -12.360 5.991 2.668 1078 2HB MLZ 215 2HB MLZ 215 -13.189 4.624 3.412 1079 1HG MLZ 215 1HG MLZ 215 -14.281 5.513 0.803 1080 2HG MLZ 215 2HG MLZ 215 -14.024 3.880 1.418 1081 1HD MLZ 215 1HD MLZ 215 -11.789 5.721 0.518 1082 2HD MLZ 215 2HD MLZ 215 -11.647 4.019 0.955 1083 1HE MLZ 215 1HE MLZ 215 -13.287 5.080 -1.377 1084 2HE MLZ 215 2HE MLZ 215 -13.032 3.374 -0.964 1085 HZ MLZ 215 HZ MLZ 215 -10.688 3.635 -1.262 1086 1HCM MLZ 215 1HCM MLZ 215 -11.553 5.146 -3.595 1087 2HCM MLZ 215 2HCM MLZ 215 -12.430 3.657 -3.262 1088 3HCM MLZ 215 3HCM MLZ 215 -10.687 3.616 -3.505 1089 H SER 216 H SER 216 -16.771 5.604 3.786 1090 HA SER 216 HA SER 216 -17.797 4.817 5.764 1091 1HB SER 216 1HB SER 216 -15.801 6.798 6.922 1092 2HB SER 216 2HB SER 216 -17.341 7.247 6.188 1093 HG SER 216 HG SER 216 -17.595 7.074 8.408 1094 H ALA 217 H ALA 217 -16.572 4.642 8.384 1095 HA ALA 217 HA ALA 217 -15.258 2.065 8.134 1096 1HB ALA 217 1HB ALA 217 -13.467 3.637 7.414 1097 2HB ALA 217 2HB ALA 217 -13.042 2.836 8.927 1098 3HB ALA 217 3HB ALA 217 -13.624 4.501 8.943 1099 HA PRO 218 HA PRO 218 -16.868 1.770 12.220 1100 1HB PRO 218 1HB PRO 218 -14.488 0.101 12.870 1101 2HB PRO 218 2HB PRO 218 -16.209 -0.311 12.973 1102 1HG PRO 218 1HG PRO 218 -14.613 -1.292 11.053 1103 2HG PRO 218 2HG PRO 218 -16.323 -0.937 10.773 1104 1HD PRO 218 1HD PRO 218 -13.910 0.562 9.895 1105 2HD PRO 218 2HD PRO 218 -15.482 0.371 9.092 1106 H ALA 219 H ALA 219 -15.702 1.732 14.625 1107 HA ALA 219 HA ALA 219 -13.333 3.443 14.806 1108 1HB ALA 219 1HB ALA 219 -15.081 5.043 14.135 1109 2HB ALA 219 2HB ALA 219 -14.620 5.342 15.811 1110 3HB ALA 219 3HB ALA 219 -16.118 4.486 15.448 1111 H THR 220 H THR 220 -12.361 2.481 16.548 1112 HA THR 220 HA THR 220 -14.019 2.003 18.995 1113 HB THR 220 HB THR 220 -13.730 -0.088 17.693 1114 HG1 THR 220 HG1 THR 220 -13.625 -0.113 20.009 1115 1HG2 THR 220 1HG2 THR 220 -11.671 0.521 16.506 1116 2HG2 THR 220 2HG2 THR 220 -11.433 -0.991 17.384 1117 3HG2 THR 220 3HG2 THR 220 -10.774 0.514 18.025 1118 H GLY 221 H GLY 221 -11.978 0.988 20.598 1119 1HA GLY 221 1HA GLY 221 -10.118 1.641 21.872 1120 2HA GLY 221 2HA GLY 221 -9.510 2.445 20.425 1121 1H MET 1 1H MET 1 -0.581 -12.255 7.677 1122 2H MET 1 2H MET 1 0.159 -11.401 6.410 1123 3H MET 1 3H MET 1 -0.503 -10.560 7.728 1124 HA MET 1 HA MET 1 2.015 -10.824 7.702 1125 1HB MET 1 1HB MET 1 -0.072 -11.105 9.742 1126 2HB MET 1 2HB MET 1 1.468 -11.780 10.268 1127 1HG MET 1 1HG MET 1 2.126 -9.674 10.736 1128 2HG MET 1 2HG MET 1 2.143 -9.376 8.999 1129 1HE MET 1 1HE MET 1 -0.268 -6.798 8.410 1130 2HE MET 1 2HE MET 1 0.575 -8.169 7.688 1131 3HE MET 1 3HE MET 1 1.459 -7.020 8.692 1132 H PHE 2 H PHE 2 3.726 -12.314 8.125 1133 HA PHE 2 HA PHE 2 4.793 -14.415 7.973 1134 1HB PHE 2 1HB PHE 2 3.830 -14.586 10.199 1135 2HB PHE 2 2HB PHE 2 2.262 -15.019 9.531 1136 HD1 PHE 2 HD1 PHE 2 1.840 -17.228 10.208 1137 HD2 PHE 2 HD2 PHE 2 5.693 -16.201 8.612 1138 HE1 PHE 2 HE1 PHE 2 2.486 -19.622 10.230 1139 HE2 PHE 2 HE2 PHE 2 6.339 -18.596 8.633 1140 HZ PHE 2 HZ PHE 2 4.736 -20.306 9.442 1141 H ASN 3 H ASN 3 4.065 -14.099 5.563 1142 HA ASN 3 HA ASN 3 1.959 -15.991 4.701 1143 1HB ASN 3 1HB ASN 3 3.857 -14.163 3.181 1144 2HB ASN 3 2HB ASN 3 2.453 -14.981 2.496 1145 1HD2 ASN 3 1HD2 ASN 3 0.358 -14.082 2.921 1146 2HD2 ASN 3 2HD2 ASN 3 0.135 -12.628 3.769 1147 H ASP 4 H ASP 4 3.812 -17.508 5.917 1148 HA ASP 4 HA ASP 4 5.333 -19.280 5.624 1149 1HB ASP 4 1HB ASP 4 3.491 -20.013 4.233 1150 2HB ASP 4 2HB ASP 4 4.034 -18.991 2.904 1151 H ARG 5 H ARG 5 5.705 -18.239 2.265 1152 HA ARG 5 HA ARG 5 8.493 -18.412 2.172 1153 1HB ARG 5 1HB ARG 5 6.627 -16.501 0.717 1154 2HB ARG 5 2HB ARG 5 8.235 -16.970 0.168 1155 1HG ARG 5 1HG ARG 5 6.976 -19.402 0.669 1156 2HG ARG 5 2HG ARG 5 5.707 -18.416 -0.058 1157 1HD ARG 5 1HD ARG 5 6.738 -18.400 -2.099 1158 2HD ARG 5 2HD ARG 5 8.348 -18.195 -1.382 1159 HE ARG 5 HE ARG 5 7.645 -20.753 -0.622 1160 1HH1 ARG 5 1HH1 ARG 5 7.722 -19.067 -3.667 1161 2HH1 ARG 5 2HH1 ARG 5 8.043 -20.501 -4.578 1162 1HH2 ARG 5 1HH2 ARG 5 8.061 -22.601 -1.828 1163 2HH2 ARG 5 2HH2 ARG 5 8.234 -22.487 -3.547 1164 H VAL 6 H VAL 6 6.506 -15.667 3.262 1165 HA VAL 6 HA VAL 6 8.950 -14.456 4.434 1166 HB VAL 6 HB VAL 6 7.154 -13.137 2.364 1167 1HG1 VAL 6 1HG1 VAL 6 9.264 -11.448 2.730 1168 2HG1 VAL 6 2HG1 VAL 6 9.047 -12.061 4.370 1169 3HG1 VAL 6 3HG1 VAL 6 7.709 -11.263 3.543 1170 1HG2 VAL 6 1HG2 VAL 6 8.707 -14.551 1.246 1171 2HG2 VAL 6 2HG2 VAL 6 10.010 -14.125 2.356 1172 3HG2 VAL 6 3HG2 VAL 6 9.429 -12.943 1.184 1173 H ILE 7 H ILE 7 8.481 -13.344 6.307 1174 HA ILE 7 HA ILE 7 5.585 -12.953 6.982 1175 HB ILE 7 HB ILE 7 6.816 -14.635 8.321 1176 1HG1 ILE 7 1HG1 ILE 7 6.542 -12.184 10.058 1177 2HG1 ILE 7 2HG1 ILE 7 5.124 -12.941 9.333 1178 1HG2 ILE 7 1HG2 ILE 7 8.868 -12.591 8.182 1179 2HG2 ILE 7 2HG2 ILE 7 9.012 -14.283 8.661 1180 3HG2 ILE 7 3HG2 ILE 7 8.565 -13.063 9.854 1181 1HD1 ILE 7 1HD1 ILE 7 5.488 -13.862 11.569 1182 2HD1 ILE 7 2HD1 ILE 7 7.147 -14.288 11.149 1183 3HD1 ILE 7 3HD1 ILE 7 5.798 -15.109 10.361 1184 H VAL 8 H VAL 8 5.163 -11.037 8.397 1185 HA VAL 8 HA VAL 8 6.982 -8.775 7.675 1186 HB VAL 8 HB VAL 8 4.060 -8.942 8.503 1187 1HG1 VAL 8 1HG1 VAL 8 5.787 -6.570 7.739 1188 2HG1 VAL 8 2HG1 VAL 8 4.979 -6.836 9.283 1189 3HG1 VAL 8 3HG1 VAL 8 4.027 -6.518 7.833 1190 1HG2 VAL 8 1HG2 VAL 8 5.070 -7.934 5.865 1191 2HG2 VAL 8 2HG2 VAL 8 3.527 -8.695 6.252 1192 3HG2 VAL 8 3HG2 VAL 8 4.990 -9.675 6.137 1193 H LYS 9 H LYS 9 8.273 -8.077 9.322 1194 HA LYS 9 HA LYS 9 7.299 -8.432 12.132 1195 1HB LYS 9 1HB LYS 9 10.090 -8.319 10.946 1196 2HB LYS 9 2HB LYS 9 9.734 -8.542 12.657 1197 1HG LYS 9 1HG LYS 9 8.159 -10.437 11.257 1198 2HG LYS 9 2HG LYS 9 9.776 -10.512 10.557 1199 1HD LYS 9 1HD LYS 9 10.727 -10.715 12.845 1200 2HD LYS 9 2HD LYS 9 9.091 -10.718 13.503 1201 1HE LYS 9 1HE LYS 9 8.592 -12.746 12.090 1202 2HE LYS 9 2HE LYS 9 10.307 -12.787 11.639 1203 1HZ LYS 9 1HZ LYS 9 9.190 -12.876 14.396 1204 2HZ LYS 9 2HZ LYS 9 10.846 -12.767 14.033 1205 3HZ LYS 9 3HZ LYS 9 9.968 -14.150 13.585 1206 H LYS 10 H LYS 10 7.902 -4.960 12.892 1207 HA LYS 10 HA LYS 10 7.106 -6.044 14.800 1208 1HB LYS 10 1HB LYS 10 5.816 -7.171 12.402 1209 2HB LYS 10 2HB LYS 10 5.686 -8.194 13.832 1210 1HG LYS 10 1HG LYS 10 4.485 -6.599 15.028 1211 2HG LYS 10 2HG LYS 10 5.144 -5.255 14.095 1212 1HD LYS 10 1HD LYS 10 3.776 -5.803 12.193 1213 2HD LYS 10 2HD LYS 10 3.280 -7.333 12.918 1214 1HE LYS 10 1HE LYS 10 2.169 -6.051 14.764 1215 2HE LYS 10 2HE LYS 10 2.576 -4.548 13.914 1216 1HZ LYS 10 1HZ LYS 10 1.368 -5.269 12.008 1217 2HZ LYS 10 2HZ LYS 10 0.342 -5.484 13.344 1218 3HZ LYS 10 3HZ LYS 10 1.131 -6.821 12.656 1219 H SER 11 H SER 11 9.615 -6.651 14.835 1220 HA SER 11 HA SER 11 9.842 -9.641 14.930 1221 1HB SER 11 1HB SER 11 12.394 -8.781 14.886 1222 2HB SER 11 2HB SER 11 11.464 -8.984 13.404 1223 HG SER 11 HG SER 11 12.554 -6.908 13.699 1224 HA PRO 12 HA PRO 12 10.795 -9.677 19.208 1225 1HB PRO 12 1HB PRO 12 13.602 -10.545 18.736 1226 2HB PRO 12 2HB PRO 12 12.313 -11.361 19.637 1227 1HG PRO 12 1HG PRO 12 13.148 -12.209 17.229 1228 2HG PRO 12 2HG PRO 12 11.471 -12.374 17.766 1229 1HD PRO 12 1HD PRO 12 12.655 -10.474 15.811 1230 2HD PRO 12 2HD PRO 12 11.037 -11.205 15.846 1231 H LEU 13 H LEU 13 13.262 -8.217 17.134 1232 HA LEU 13 HA LEU 13 14.432 -6.623 19.299 1233 1HB LEU 13 1HB LEU 13 14.931 -7.344 16.533 1234 2HB LEU 13 2HB LEU 13 15.114 -5.603 16.746 1235 HG LEU 13 HG LEU 13 16.345 -7.469 18.752 1236 1HD1 LEU 13 1HD1 LEU 13 18.335 -7.711 17.428 1237 2HD1 LEU 13 2HD1 LEU 13 17.720 -6.612 16.194 1238 3HD1 LEU 13 3HD1 LEU 13 16.986 -8.202 16.402 1239 1HD2 LEU 13 1HD2 LEU 13 17.268 -4.817 17.610 1240 2HD2 LEU 13 2HD2 LEU 13 17.878 -5.625 19.054 1241 3HD2 LEU 13 3HD2 LEU 13 16.245 -4.960 19.039 1242 H GLY 14 H GLY 14 12.128 -6.108 16.641 1243 1HA GLY 14 1HA GLY 14 10.303 -4.445 17.224 1244 2HA GLY 14 2HA GLY 14 11.604 -3.380 17.755 1245 H GLY 15 H GLY 15 10.584 -1.903 16.100 1246 1HA GLY 15 1HA GLY 15 10.899 -0.787 14.049 1247 2HA GLY 15 2HA GLY 15 12.115 -1.997 13.637 1248 H TYR 16 H TYR 16 10.720 -1.495 11.517 1249 HA TYR 16 HA TYR 16 8.629 -3.640 11.372 1250 1HB TYR 16 1HB TYR 16 8.426 -0.810 11.044 1251 2HB TYR 16 2HB TYR 16 8.191 -1.541 9.457 1252 HD1 TYR 16 HD1 TYR 16 6.425 -3.292 9.139 1253 HD2 TYR 16 HD2 TYR 16 6.803 -1.050 12.782 1254 HE1 TYR 16 HE1 TYR 16 4.129 -3.966 9.791 1255 HE2 TYR 16 HE2 TYR 16 4.507 -1.724 13.435 1256 HH TYR 16 HH TYR 16 2.278 -2.631 11.637 1257 H GLY 17 H GLY 17 10.722 -4.802 10.661 1258 1HA GLY 17 1HA GLY 17 11.313 -4.240 7.784 1259 2HA GLY 17 2HA GLY 17 12.419 -5.079 8.874 1260 H VAL 18 H VAL 18 12.165 -6.668 6.897 1261 HA VAL 18 HA VAL 18 9.762 -8.404 7.355 1262 HB VAL 18 HB VAL 18 11.614 -8.000 4.986 1263 1HG1 VAL 18 1HG1 VAL 18 9.629 -9.380 3.906 1264 2HG1 VAL 18 2HG1 VAL 18 9.442 -9.989 5.550 1265 3HG1 VAL 18 3HG1 VAL 18 10.967 -10.217 4.694 1266 1HG2 VAL 18 1HG2 VAL 18 10.127 -6.468 4.266 1267 2HG2 VAL 18 2HG2 VAL 18 9.433 -6.513 5.887 1268 3HG2 VAL 18 3HG2 VAL 18 8.766 -7.535 4.614 1269 H PHE 19 H PHE 19 10.141 -10.743 7.265 1270 HA PHE 19 HA PHE 19 12.942 -11.503 8.028 1271 1HB PHE 19 1HB PHE 19 10.316 -11.854 9.272 1272 2HB PHE 19 2HB PHE 19 11.173 -13.384 9.096 1273 HD1 PHE 19 HD1 PHE 19 12.638 -13.997 10.795 1274 HD2 PHE 19 HD2 PHE 19 11.885 -9.827 10.088 1275 HE1 PHE 19 HE1 PHE 19 14.087 -13.409 12.720 1276 HE2 PHE 19 HE2 PHE 19 13.335 -9.239 12.012 1277 HZ PHE 19 HZ PHE 19 14.436 -11.030 13.328 1278 H ALA 20 H ALA 20 13.839 -12.999 6.683 1279 HA ALA 20 HA ALA 20 12.167 -14.248 4.595 1280 1HB ALA 20 1HB ALA 20 14.139 -14.179 3.449 1281 2HB ALA 20 2HB ALA 20 15.025 -14.929 4.777 1282 3HB ALA 20 3HB ALA 20 14.727 -13.191 4.787 1283 H ARG 21 H ARG 21 11.007 -15.907 5.692 1284 HA ARG 21 HA ARG 21 12.159 -17.761 7.561 1285 1HB ARG 21 1HB ARG 21 9.676 -17.208 6.247 1286 2HB ARG 21 2HB ARG 21 10.028 -18.922 6.025 1287 1HG ARG 21 1HG ARG 21 8.949 -18.943 8.094 1288 2HG ARG 21 2HG ARG 21 10.638 -18.826 8.587 1289 1HD ARG 21 1HD ARG 21 10.389 -16.677 9.359 1290 2HD ARG 21 2HD ARG 21 9.265 -16.238 8.059 1291 HE ARG 21 HE ARG 21 7.483 -16.983 9.433 1292 1HH1 ARG 21 1HH1 ARG 21 10.533 -18.210 10.579 1293 2HH1 ARG 21 2HH1 ARG 21 9.844 -18.897 12.008 1294 1HH2 ARG 21 1HH2 ARG 21 6.613 -17.883 11.295 1295 2HH2 ARG 21 2HH2 ARG 21 7.642 -18.715 12.413 1296 H LYS 22 H LYS 22 12.178 -17.543 4.078 1297 HA LYS 22 HA LYS 22 13.069 -20.326 3.674 1298 1HB LYS 22 1HB LYS 22 12.972 -17.961 1.759 1299 2HB LYS 22 2HB LYS 22 12.972 -19.667 1.329 1300 1HG LYS 22 1HG LYS 22 10.815 -19.315 3.120 1301 2HG LYS 22 2HG LYS 22 10.730 -17.980 1.970 1302 1HD LYS 22 1HD LYS 22 9.785 -19.425 0.517 1303 2HD LYS 22 2HD LYS 22 11.355 -20.220 0.407 1304 1HE LYS 22 1HE LYS 22 9.662 -20.932 2.761 1305 2HE LYS 22 2HE LYS 22 9.155 -21.559 1.181 1306 1HZ LYS 22 1HZ LYS 22 10.892 -22.897 2.474 1307 2HZ LYS 22 2HZ LYS 22 11.981 -21.661 2.060 1308 3HZ LYS 22 3HZ LYS 22 11.221 -22.567 0.841 1309 H SER 23 H SER 23 16.543 -19.485 2.710 1310 HA SER 23 HA SER 23 14.104 -21.078 2.050 1311 1HB SER 23 1HB SER 23 16.573 -22.075 0.953 1312 2HB SER 23 2HB SER 23 16.840 -21.624 2.638 1313 HG SER 23 HG SER 23 16.020 -23.807 2.235 1314 H PHE 24 H PHE 24 16.134 -18.619 0.767 1315 HA PHE 24 HA PHE 24 14.932 -19.067 -1.935 1316 1HB PHE 24 1HB PHE 24 15.951 -16.650 -0.409 1317 2HB PHE 24 2HB PHE 24 15.495 -16.573 -2.110 1318 HD1 PHE 24 HD1 PHE 24 13.166 -18.328 -2.272 1319 HD2 PHE 24 HD2 PHE 24 14.277 -15.532 0.795 1320 HE1 PHE 24 HE1 PHE 24 10.784 -18.093 -1.623 1321 HE2 PHE 24 HE2 PHE 24 11.895 -15.298 1.443 1322 HZ PHE 24 HZ PHE 24 10.149 -16.578 0.235 1323 H GLU 25 H GLU 25 16.274 -18.846 -3.795 1324 HA GLU 25 HA GLU 25 19.142 -19.437 -3.319 1325 1HB GLU 25 1HB GLU 25 17.305 -20.529 -4.946 1326 2HB GLU 25 2HB GLU 25 17.868 -19.254 -6.026 1327 1HG GLU 25 1HG GLU 25 20.254 -20.162 -5.196 1328 2HG GLU 25 2HG GLU 25 19.321 -21.643 -4.988 1329 H LYS 26 H LYS 26 19.951 -18.376 -5.928 1330 HA LYS 26 HA LYS 26 20.157 -15.501 -5.171 1331 1HB LYS 26 1HB LYS 26 22.161 -17.009 -5.559 1332 2HB LYS 26 2HB LYS 26 21.671 -17.121 -7.248 1333 1HG LYS 26 1HG LYS 26 21.771 -14.612 -7.372 1334 2HG LYS 26 2HG LYS 26 22.437 -14.606 -5.739 1335 1HD LYS 26 1HD LYS 26 24.445 -15.571 -6.409 1336 2HD LYS 26 2HD LYS 26 23.720 -16.343 -7.820 1337 1HE LYS 26 1HE LYS 26 23.553 -13.403 -7.890 1338 2HE LYS 26 2HE LYS 26 25.214 -14.025 -7.912 1339 1HZ LYS 26 1HZ LYS 26 22.966 -14.772 -9.705 1340 2HZ LYS 26 2HZ LYS 26 24.401 -15.675 -9.603 1341 3HZ LYS 26 3HZ LYS 26 24.447 -14.066 -10.144 1342 H GLY 27 H GLY 27 17.773 -15.445 -6.059 1343 1HA GLY 27 1HA GLY 27 17.026 -13.911 -7.937 1344 2HA GLY 27 2HA GLY 27 17.874 -15.015 -9.019 1345 H GLU 28 H GLU 28 15.224 -14.922 -6.630 1346 HA GLU 28 HA GLU 28 13.786 -16.933 -8.319 1347 1HB GLU 28 1HB GLU 28 14.973 -17.306 -5.772 1348 2HB GLU 28 2HB GLU 28 13.233 -17.231 -5.491 1349 1HG GLU 28 1HG GLU 28 14.279 -18.891 -7.763 1350 2HG GLU 28 2HG GLU 28 14.365 -19.529 -6.121 1351 H LEU 29 H LEU 29 13.696 -13.860 -7.194 1352 HA LEU 29 HA LEU 29 11.960 -12.282 -6.944 1353 1HB LEU 29 1HB LEU 29 11.173 -14.028 -8.855 1354 2HB LEU 29 2HB LEU 29 9.922 -14.342 -7.661 1355 HG LEU 29 HG LEU 29 10.571 -11.715 -9.013 1356 1HD1 LEU 29 1HD1 LEU 29 8.820 -13.763 -9.643 1357 2HD1 LEU 29 2HD1 LEU 29 8.697 -12.098 -10.211 1358 3HD1 LEU 29 3HD1 LEU 29 7.798 -12.611 -8.783 1359 1HD2 LEU 29 1HD2 LEU 29 10.211 -11.110 -6.720 1360 2HD2 LEU 29 2HD2 LEU 29 8.865 -12.240 -6.571 1361 3HD2 LEU 29 3HD2 LEU 29 8.699 -10.795 -7.569 1362 H VAL 30 H VAL 30 10.995 -11.671 -5.039 1363 HA VAL 30 HA VAL 30 10.272 -13.840 -3.131 1364 HB VAL 30 HB VAL 30 10.859 -10.871 -2.825 1365 1HG1 VAL 30 1HG1 VAL 30 9.577 -11.186 -0.945 1366 2HG1 VAL 30 2HG1 VAL 30 11.081 -11.869 -0.327 1367 3HG1 VAL 30 3HG1 VAL 30 9.817 -12.933 -0.947 1368 1HG2 VAL 30 1HG2 VAL 30 12.551 -13.115 -3.129 1369 2HG2 VAL 30 2HG2 VAL 30 12.610 -12.690 -1.418 1370 3HG2 VAL 30 3HG2 VAL 30 13.018 -11.486 -2.640 1371 H GLU 31 H GLU 31 9.054 -10.493 -3.448 1372 HA GLU 31 HA GLU 31 6.285 -11.611 -3.683 1373 1HB GLU 31 1HB GLU 31 7.444 -9.593 -1.741 1374 2HB GLU 31 2HB GLU 31 5.708 -9.733 -2.017 1375 1HG GLU 31 1HG GLU 31 7.366 -12.158 -1.338 1376 2HG GLU 31 2HG GLU 31 6.744 -11.103 -0.069 1377 H GLU 32 H GLU 32 4.727 -10.005 -4.523 1378 HA GLU 32 HA GLU 32 5.965 -7.660 -5.903 1379 1HB GLU 32 1HB GLU 32 4.695 -8.372 -7.952 1380 2HB GLU 32 2HB GLU 32 5.919 -9.546 -7.471 1381 1HG GLU 32 1HG GLU 32 3.428 -10.081 -6.100 1382 2HG GLU 32 2HG GLU 32 3.163 -10.020 -7.842 1383 H CYS 33 H CYS 33 4.565 -5.882 -6.023 1384 HA CYS 33 HA CYS 33 1.692 -6.251 -5.360 1385 1HB CYS 33 1HB CYS 33 1.936 -4.586 -3.502 1386 2HB CYS 33 2HB CYS 33 2.870 -6.052 -3.208 1387 HG CYS 33 HG CYS 33 4.330 -3.809 -2.836 1388 H LEU 34 H LEU 34 0.806 -3.747 -5.171 1389 HA LEU 34 HA LEU 34 1.629 -2.502 -7.748 1390 1HB LEU 34 1HB LEU 34 -0.742 -2.155 -5.882 1391 2HB LEU 34 2HB LEU 34 -0.535 -1.251 -7.377 1392 HG LEU 34 HG LEU 34 -1.962 -3.061 -7.942 1393 1HD1 LEU 34 1HD1 LEU 34 0.651 -4.320 -8.703 1394 2HD1 LEU 34 2HD1 LEU 34 0.249 -2.723 -9.334 1395 3HD1 LEU 34 3HD1 LEU 34 -0.805 -4.096 -9.672 1396 1HD2 LEU 34 1HD2 LEU 34 -1.208 -4.301 -5.761 1397 2HD2 LEU 34 2HD2 LEU 34 -0.071 -5.113 -6.839 1398 3HD2 LEU 34 3HD2 LEU 34 -1.806 -5.238 -7.130 1399 H CYS 35 H CYS 35 1.449 0.029 -7.663 1400 HA CYS 35 HA CYS 35 2.375 1.159 -5.071 1401 1HB CYS 35 1HB CYS 35 3.900 1.119 -7.697 1402 2HB CYS 35 2HB CYS 35 4.334 2.164 -6.345 1403 HG CYS 35 HG CYS 35 4.767 -0.880 -6.463 1404 H ILE 36 H ILE 36 2.589 3.608 -5.277 1405 HA ILE 36 HA ILE 36 0.415 4.646 -7.040 1406 HB ILE 36 HB ILE 36 1.858 5.735 -4.591 1407 1HG1 ILE 36 1HG1 ILE 36 -1.048 4.958 -4.870 1408 2HG1 ILE 36 2HG1 ILE 36 0.184 3.790 -4.399 1409 1HG2 ILE 36 1HG2 ILE 36 1.122 7.533 -6.152 1410 2HG2 ILE 36 2HG2 ILE 36 0.218 7.554 -4.639 1411 3HG2 ILE 36 3HG2 ILE 36 -0.516 6.882 -6.095 1412 1HD1 ILE 36 1HD1 ILE 36 0.558 4.799 -2.353 1413 2HD1 ILE 36 2HD1 ILE 36 -1.138 5.230 -2.577 1414 3HD1 ILE 36 3HD1 ILE 36 0.126 6.402 -2.950 1415 H VAL 37 H VAL 37 0.831 6.497 -8.374 1416 HA VAL 37 HA VAL 37 3.735 7.132 -8.780 1417 HB VAL 37 HB VAL 37 1.492 6.869 -10.819 1418 1HG1 VAL 37 1HG1 VAL 37 4.433 7.533 -11.022 1419 2HG1 VAL 37 2HG1 VAL 37 3.064 8.427 -11.684 1420 3HG1 VAL 37 3HG1 VAL 37 3.533 6.882 -12.393 1421 1HG2 VAL 37 1HG2 VAL 37 2.035 4.678 -10.034 1422 2HG2 VAL 37 2HG2 VAL 37 3.759 5.044 -9.996 1423 3HG2 VAL 37 3HG2 VAL 37 2.928 4.878 -11.542 1424 H ARG 38 H ARG 38 3.295 8.999 -7.324 1425 HA ARG 38 HA ARG 38 1.595 11.122 -8.572 1426 1HB ARG 38 1HB ARG 38 2.158 10.143 -5.876 1427 2HB ARG 38 2HB ARG 38 2.392 11.887 -5.995 1428 1HG ARG 38 1HG ARG 38 -0.086 10.424 -6.948 1429 2HG ARG 38 2HG ARG 38 0.046 11.265 -5.403 1430 1HD ARG 38 1HD ARG 38 0.827 12.812 -7.834 1431 2HD ARG 38 2HD ARG 38 -0.902 12.496 -7.599 1432 HE ARG 38 HE ARG 38 0.396 13.341 -5.139 1433 1HH1 ARG 38 1HH1 ARG 38 -0.994 14.444 -8.134 1434 2HH1 ARG 38 2HH1 ARG 38 -1.393 16.004 -7.502 1435 1HH2 ARG 38 1HH2 ARG 38 -0.132 15.374 -4.341 1436 2HH2 ARG 38 2HH2 ARG 38 -0.910 16.528 -5.372 1437 H HIS 39 H HIS 39 2.513 13.179 -8.967 1438 HA HIS 39 HA HIS 39 5.291 13.331 -9.612 1439 1HB HIS 39 1HB HIS 39 3.196 15.457 -9.026 1440 2HB HIS 39 2HB HIS 39 4.738 15.773 -9.820 1441 HD1 HIS 39 HD1 HIS 39 1.827 16.062 -11.156 1442 HD2 HIS 39 HD2 HIS 39 4.493 12.906 -11.713 1443 HE1 HIS 39 HE1 HIS 39 1.211 14.985 -13.364 1444 H ASN 40 H ASN 40 6.484 15.451 -8.543 1445 HA ASN 40 HA ASN 40 6.900 14.686 -5.718 1446 1HB ASN 40 1HB ASN 40 8.548 15.299 -7.760 1447 2HB ASN 40 2HB ASN 40 8.360 16.913 -7.079 1448 1HD2 ASN 40 1HD2 ASN 40 7.990 15.838 -4.290 1449 2HD2 ASN 40 2HD2 ASN 40 9.532 15.335 -3.791 1450 H ASP 41 H ASP 41 7.866 17.646 -5.360 1451 HA ASP 41 HA ASP 41 6.991 19.612 -4.418 1452 1HB ASP 41 1HB ASP 41 4.559 18.863 -6.084 1453 2HB ASP 41 2HB ASP 41 5.001 20.474 -5.531 1454 H ASP 42 H ASP 42 3.825 19.621 -4.083 1455 HA ASP 42 HA ASP 42 3.622 19.180 -1.363 1456 1HB ASP 42 1HB ASP 42 1.618 18.595 -3.573 1457 2HB ASP 42 2HB ASP 42 1.193 18.801 -1.874 1458 H TRP 43 H TRP 43 3.755 16.718 -3.867 1459 HA TRP 43 HA TRP 43 2.743 14.514 -2.311 1460 1HB TRP 43 1HB TRP 43 2.899 14.450 -4.736 1461 2HB TRP 43 2HB TRP 43 4.632 14.770 -4.680 1462 HD1 TRP 43 HD1 TRP 43 6.125 12.721 -4.796 1463 HE1 TRP 43 HE1 TRP 43 5.831 10.193 -4.378 1464 HE3 TRP 43 HE3 TRP 43 1.309 12.657 -3.099 1465 HZ2 TRP 43 HZ2 TRP 43 3.812 8.389 -3.445 1466 HZ3 TRP 43 HZ3 TRP 43 0.233 10.524 -2.455 1467 HH2 TRP 43 HH2 TRP 43 1.476 8.392 -2.630 1468 H GLY 44 H GLY 44 6.128 15.345 -3.183 1469 1HA GLY 44 1HA GLY 44 7.383 13.477 -1.476 1470 2HA GLY 44 2HA GLY 44 8.126 14.986 -2.006 1471 H THR 45 H THR 45 5.849 16.526 -0.733 1472 HA THR 45 HA THR 45 7.085 16.781 1.910 1473 HB THR 45 HB THR 45 4.643 18.096 0.668 1474 HG1 THR 45 HG1 THR 45 6.022 19.162 -0.470 1475 1HG2 THR 45 1HG2 THR 45 5.965 19.851 2.404 1476 2HG2 THR 45 2HG2 THR 45 5.969 18.304 3.251 1477 3HG2 THR 45 3HG2 THR 45 4.445 19.015 2.722 1478 H ALA 46 H ALA 46 3.644 16.380 0.954 1479 HA ALA 46 HA ALA 46 2.654 15.602 3.472 1480 1HB ALA 46 1HB ALA 46 1.928 15.228 0.598 1481 2HB ALA 46 2HB ALA 46 1.001 15.983 1.894 1482 3HB ALA 46 3HB ALA 46 1.071 14.225 1.768 1483 H LEU 47 H LEU 47 3.556 13.395 0.795 1484 HA LEU 47 HA LEU 47 3.705 11.123 2.693 1485 1HB LEU 47 1HB LEU 47 3.977 11.461 -0.314 1486 2HB LEU 47 2HB LEU 47 4.085 9.901 0.503 1487 HG LEU 47 HG LEU 47 1.797 10.866 1.590 1488 1HD1 LEU 47 1HD1 LEU 47 1.247 12.746 0.452 1489 2HD1 LEU 47 2HD1 LEU 47 0.685 11.620 -0.778 1490 3HD1 LEU 47 3HD1 LEU 47 2.289 12.344 -0.909 1491 1HD2 LEU 47 1HD2 LEU 47 1.454 8.785 0.797 1492 2HD2 LEU 47 2HD2 LEU 47 2.510 9.038 -0.590 1493 3HD2 LEU 47 3HD2 LEU 47 0.837 9.599 -0.638 1494 H GLU 48 H GLU 48 5.701 12.929 3.338 1495 HA GLU 48 HA GLU 48 8.144 12.546 1.868 1496 1HB GLU 48 1HB GLU 48 9.139 13.460 4.081 1497 2HB GLU 48 2HB GLU 48 8.012 14.482 3.204 1498 1HG GLU 48 1HG GLU 48 7.685 14.322 5.738 1499 2HG GLU 48 2HG GLU 48 6.255 14.064 4.754 1500 H ASP 49 H ASP 49 7.425 9.959 2.014 1501 HA ASP 49 HA ASP 49 9.603 8.612 3.218 1502 1HB ASP 49 1HB ASP 49 7.468 9.382 5.020 1503 2HB ASP 49 2HB ASP 49 7.574 7.624 4.944 1504 H TYR 50 H TYR 50 9.469 6.310 2.878 1505 HA TYR 50 HA TYR 50 8.718 4.341 1.817 1506 1HB TYR 50 1HB TYR 50 5.933 5.493 2.105 1507 2HB TYR 50 2HB TYR 50 6.432 3.811 2.223 1508 HD1 TYR 50 HD1 TYR 50 5.118 6.249 4.140 1509 HD2 TYR 50 HD2 TYR 50 8.604 3.737 4.089 1510 HE1 TYR 50 HE1 TYR 50 5.338 6.504 6.596 1511 HE2 TYR 50 HE2 TYR 50 8.823 3.994 6.545 1512 HH TYR 50 HH TYR 50 7.523 4.574 8.456 1513 H LEU 51 H LEU 51 9.038 6.997 0.227 1514 HA LEU 51 HA LEU 51 7.200 6.345 -2.039 1515 1HB LEU 51 1HB LEU 51 8.850 8.767 -1.255 1516 2HB LEU 51 2HB LEU 51 8.042 8.645 -2.813 1517 HG LEU 51 HG LEU 51 6.737 8.636 -0.077 1518 1HD1 LEU 51 1HD1 LEU 51 6.673 10.494 -2.471 1519 2HD1 LEU 51 2HD1 LEU 51 7.269 10.858 -0.852 1520 3HD1 LEU 51 3HD1 LEU 51 5.544 10.613 -1.122 1521 1HD2 LEU 51 1HD2 LEU 51 4.598 8.553 -1.476 1522 2HD2 LEU 51 2HD2 LEU 51 5.502 7.042 -1.371 1523 3HD2 LEU 51 3HD2 LEU 51 5.613 8.037 -2.823 1524 H PHE 52 H PHE 52 8.129 4.976 -3.497 1525 HA PHE 52 HA PHE 52 11.055 5.037 -3.979 1526 1HB PHE 52 1HB PHE 52 8.695 3.359 -4.874 1527 2HB PHE 52 2HB PHE 52 10.286 3.168 -5.612 1528 HD1 PHE 52 HD1 PHE 52 8.288 2.718 -2.558 1529 HD2 PHE 52 HD2 PHE 52 12.191 2.327 -4.309 1530 HE1 PHE 52 HE1 PHE 52 9.004 1.307 -0.648 1531 HE2 PHE 52 HE2 PHE 52 12.906 0.916 -2.399 1532 HZ PHE 52 HZ PHE 52 11.313 0.406 -0.569 1533 H SER 53 H SER 53 11.516 6.911 -5.165 1534 HA SER 53 HA SER 53 9.674 7.675 -7.363 1535 1HB SER 53 1HB SER 53 10.631 9.824 -7.080 1536 2HB SER 53 2HB SER 53 10.654 9.159 -5.446 1537 HG SER 53 HG SER 53 12.763 9.400 -7.300 1538 H ARG 54 H ARG 54 10.514 8.213 -9.468 1539 HA ARG 54 HA ARG 54 13.060 6.788 -10.170 1540 1HB ARG 54 1HB ARG 54 10.450 7.231 -11.665 1541 2HB ARG 54 2HB ARG 54 11.888 6.537 -12.411 1542 1HG ARG 54 1HG ARG 54 11.754 4.946 -10.260 1543 2HG ARG 54 2HG ARG 54 10.044 5.358 -10.386 1544 1HD ARG 54 1HD ARG 54 11.767 4.160 -12.588 1545 2HD ARG 54 2HD ARG 54 10.453 3.349 -11.718 1546 HE ARG 54 HE ARG 54 9.233 5.625 -12.668 1547 1HH1 ARG 54 1HH1 ARG 54 11.181 3.144 -14.143 1548 2HH1 ARG 54 2HH1 ARG 54 10.411 3.301 -15.683 1549 1HH2 ARG 54 1HH2 ARG 54 8.248 5.809 -14.679 1550 2HH2 ARG 54 2HH2 ARG 54 8.763 4.797 -15.987 1551 H LYS 55 H LYS 55 13.653 7.764 -12.571 1552 HA LYS 55 HA LYS 55 14.289 10.574 -12.085 1553 1HB LYS 55 1HB LYS 55 15.151 8.353 -13.706 1554 2HB LYS 55 2HB LYS 55 14.878 9.748 -14.751 1555 1HG LYS 55 1HG LYS 55 16.164 10.869 -12.577 1556 2HG LYS 55 2HG LYS 55 16.964 9.304 -12.730 1557 1HD LYS 55 1HD LYS 55 18.017 9.923 -14.635 1558 2HD LYS 55 2HD LYS 55 16.539 10.599 -15.319 1559 1HE LYS 55 1HE LYS 55 16.863 12.689 -14.152 1560 2HE LYS 55 2HE LYS 55 18.192 12.009 -13.194 1561 1HZ LYS 55 1HZ LYS 55 18.924 13.290 -15.193 1562 2HZ LYS 55 2HZ LYS 55 18.173 12.118 -16.166 1563 3HZ LYS 55 3HZ LYS 55 19.474 11.684 -15.164 1564 H ASN 56 H ASN 56 12.020 11.338 -12.030 1565 HA ASN 56 HA ASN 56 10.481 11.246 -14.545 1566 1HB ASN 56 1HB ASN 56 12.165 13.011 -14.910 1567 2HB ASN 56 2HB ASN 56 10.566 13.737 -14.743 1568 1HD2 ASN 56 1HD2 ASN 56 10.787 15.631 -13.540 1569 2HD2 ASN 56 2HD2 ASN 56 11.738 15.794 -12.144 1570 H MET 57 H MET 57 10.281 10.723 -11.472 1571 HA MET 57 HA MET 57 8.372 12.637 -10.443 1572 1HB MET 57 1HB MET 57 6.346 11.276 -10.818 1573 2HB MET 57 2HB MET 57 7.113 11.662 -12.358 1574 1HG MET 57 1HG MET 57 8.291 9.249 -11.375 1575 2HG MET 57 2HG MET 57 6.540 9.078 -11.259 1576 1HE MET 57 1HE MET 57 5.704 11.066 -14.163 1577 2HE MET 57 2HE MET 57 5.078 10.086 -12.838 1578 3HE MET 57 3HE MET 57 5.053 9.459 -14.487 1579 H SER 58 H SER 58 6.836 11.130 -8.783 1580 HA SER 58 HA SER 58 8.766 9.361 -7.323 1581 1HB SER 58 1HB SER 58 6.788 11.341 -6.146 1582 2HB SER 58 2HB SER 58 8.023 10.439 -5.268 1583 HG SER 58 HG SER 58 8.311 12.573 -7.073 1584 H ALA 59 H ALA 59 7.791 7.595 -6.188 1585 HA ALA 59 HA ALA 59 4.855 7.213 -6.639 1586 1HB ALA 59 1HB ALA 59 5.538 5.731 -8.239 1587 2HB ALA 59 2HB ALA 59 5.982 4.694 -6.883 1588 3HB ALA 59 3HB ALA 59 7.196 5.725 -7.639 1589 H MET 60 H MET 60 4.168 5.146 -5.291 1590 HA MET 60 HA MET 60 5.550 5.276 -2.628 1591 1HB MET 60 1HB MET 60 3.220 6.350 -2.991 1592 2HB MET 60 2HB MET 60 2.619 4.698 -3.127 1593 1HG MET 60 1HG MET 60 3.106 4.195 -0.904 1594 2HG MET 60 2HG MET 60 4.353 5.436 -0.791 1595 1HE MET 60 1HE MET 60 2.397 7.163 1.745 1596 2HE MET 60 2HE MET 60 3.800 7.573 0.759 1597 3HE MET 60 3HE MET 60 3.600 5.930 1.367 1598 H ALA 61 H ALA 61 5.509 3.275 -1.391 1599 HA ALA 61 HA ALA 61 5.575 0.858 -3.089 1600 1HB ALA 61 1HB ALA 61 6.084 0.170 -0.436 1601 2HB ALA 61 2HB ALA 61 6.639 1.841 -0.534 1602 3HB ALA 61 3HB ALA 61 7.306 0.625 -1.624 1603 H LEU 62 H LEU 62 3.320 0.502 -3.509 1604 HA LEU 62 HA LEU 62 1.204 -0.436 -3.052 1605 1HB LEU 62 1HB LEU 62 0.920 0.771 -0.426 1606 2HB LEU 62 2HB LEU 62 1.723 1.893 -1.519 1607 HG LEU 62 HG LEU 62 -0.962 0.544 -1.931 1608 1HD1 LEU 62 1HD1 LEU 62 -1.540 2.425 -0.770 1609 2HD1 LEU 62 2HD1 LEU 62 -1.288 3.225 -2.320 1610 3HD1 LEU 62 3HD1 LEU 62 -0.005 3.222 -1.111 1611 1HD2 LEU 62 1HD2 LEU 62 -0.877 2.148 -4.020 1612 2HD2 LEU 62 2HD2 LEU 62 -0.132 0.552 -4.114 1613 3HD2 LEU 62 3HD2 LEU 62 0.868 1.977 -3.834 1614 H GLY 63 H GLY 63 2.582 -2.508 -2.687 1615 1HA GLY 63 1HA GLY 63 1.529 -3.906 -0.428 1616 2HA GLY 63 2HA GLY 63 2.800 -4.512 -1.488 1617 H PHE 64 H PHE 64 4.292 -5.239 0.002 1618 HA PHE 64 HA PHE 64 4.971 -3.636 2.376 1619 1HB PHE 64 1HB PHE 64 6.067 -6.216 1.193 1620 2HB PHE 64 2HB PHE 64 6.432 -5.609 2.807 1621 HD1 PHE 64 HD1 PHE 64 3.817 -7.038 0.628 1622 HD2 PHE 64 HD2 PHE 64 4.777 -5.680 4.589 1623 HE1 PHE 64 HE1 PHE 64 1.751 -8.104 1.494 1624 HE2 PHE 64 HE2 PHE 64 2.711 -6.745 5.455 1625 HZ PHE 64 HZ PHE 64 1.199 -7.957 3.907 1626 H GLY 65 H GLY 65 5.578 -2.140 0.083 1627 1HA GLY 65 1HA GLY 65 8.423 -2.538 -0.557 1628 2HA GLY 65 2HA GLY 65 7.380 -1.279 -1.217 1629 H ALA 66 H ALA 66 6.503 -0.683 1.663 1630 HA ALA 66 HA ALA 66 8.629 1.290 2.199 1631 1HB ALA 66 1HB ALA 66 6.112 1.678 2.237 1632 2HB ALA 66 2HB ALA 66 6.956 2.208 3.692 1633 3HB ALA 66 3HB ALA 66 6.056 0.691 3.697 1634 H ILE 67 H ILE 67 6.953 -1.260 4.063 1635 HA ILE 67 HA ILE 67 8.296 -1.233 6.456 1636 HB ILE 67 HB ILE 67 7.951 -3.768 6.391 1637 1HG1 ILE 67 1HG1 ILE 67 6.521 -4.477 4.377 1638 2HG1 ILE 67 2HG1 ILE 67 7.168 -3.065 3.552 1639 1HG2 ILE 67 1HG2 ILE 67 5.640 -2.046 5.454 1640 2HG2 ILE 67 2HG2 ILE 67 6.227 -2.120 7.115 1641 3HG2 ILE 67 3HG2 ILE 67 5.523 -3.552 6.363 1642 1HD1 ILE 67 1HD1 ILE 67 8.364 -5.564 3.679 1643 2HD1 ILE 67 2HD1 ILE 67 9.254 -4.621 4.876 1644 3HD1 ILE 67 3HD1 ILE 67 9.159 -4.067 3.203 1645 H PHE 68 H PHE 68 9.714 -2.204 3.384 1646 HA PHE 68 HA PHE 68 11.913 -3.740 4.259 1647 1HB PHE 68 1HB PHE 68 11.375 -1.797 2.019 1648 2HB PHE 68 2HB PHE 68 12.977 -2.517 2.184 1649 HD1 PHE 68 HD1 PHE 68 12.687 -5.195 2.944 1650 HD2 PHE 68 HD2 PHE 68 10.044 -2.896 0.460 1651 HE1 PHE 68 HE1 PHE 68 11.847 -7.283 1.905 1652 HE2 PHE 68 HE2 PHE 68 9.204 -4.985 -0.579 1653 HZ PHE 68 HZ PHE 68 10.106 -7.178 0.144 1654 H ASN 69 H ASN 69 13.949 -3.197 5.108 1655 HA ASN 69 HA ASN 69 14.291 -0.334 5.945 1656 1HB ASN 69 1HB ASN 69 15.179 -2.925 7.269 1657 2HB ASN 69 2HB ASN 69 15.401 -1.307 7.934 1658 1HD2 ASN 69 1HD2 ASN 69 13.879 -3.266 9.353 1659 2HD2 ASN 69 2HD2 ASN 69 12.252 -2.781 9.361 1660 H HIS 70 H HIS 70 16.770 -0.100 6.654 1661 HA HIS 70 HA HIS 70 18.405 -0.927 4.290 1662 1HB HIS 70 1HB HIS 70 18.167 1.478 4.716 1663 2HB HIS 70 2HB HIS 70 18.665 1.258 6.394 1664 HD1 HIS 70 HD1 HIS 70 19.994 1.731 2.985 1665 HD2 HIS 70 HD2 HIS 70 21.474 0.469 6.671 1666 HE1 HIS 70 HE1 HIS 70 22.519 1.804 2.805 1667 H SER 71 H SER 71 20.543 -1.829 4.709 1668 HA SER 71 HA SER 71 21.307 -2.420 7.497 1669 1HB SER 71 1HB SER 71 19.632 -4.128 7.027 1670 2HB SER 71 2HB SER 71 20.412 -4.524 5.496 1671 HG SER 71 HG SER 71 20.862 -5.769 7.613 1672 H LYS 72 H LYS 72 22.394 -1.241 4.829 1673 HA LYS 72 HA LYS 72 24.469 -1.225 3.695 1674 1HB LYS 72 1HB LYS 72 24.906 -1.138 6.300 1675 2HB LYS 72 2HB LYS 72 25.533 -2.768 6.054 1676 1HG LYS 72 1HG LYS 72 27.373 -1.190 5.848 1677 2HG LYS 72 2HG LYS 72 27.026 -1.862 4.255 1678 1HD LYS 72 1HD LYS 72 26.100 0.115 3.471 1679 2HD LYS 72 2HD LYS 72 25.613 0.646 5.081 1680 1HE LYS 72 1HE LYS 72 28.269 0.665 5.465 1681 2HE LYS 72 2HE LYS 72 28.254 0.934 3.711 1682 1HZ LYS 72 1HZ LYS 72 28.038 3.022 4.974 1683 2HZ LYS 72 2HZ LYS 72 26.613 2.436 5.689 1684 3HZ LYS 72 3HZ LYS 72 26.670 2.717 4.015 1685 H ASP 73 H ASP 73 22.644 -3.691 3.568 1686 HA ASP 73 HA ASP 73 24.346 -5.332 1.911 1687 1HB ASP 73 1HB ASP 73 24.364 -7.304 3.466 1688 2HB ASP 73 2HB ASP 73 25.258 -5.930 4.116 1689 HA PRO 74 HA PRO 74 19.658 -5.640 1.714 1690 1HB PRO 74 1HB PRO 74 19.523 -4.964 -0.977 1691 2HB PRO 74 2HB PRO 74 19.346 -3.805 0.352 1692 1HG PRO 74 1HG PRO 74 21.711 -4.392 -1.353 1693 2HG PRO 74 2HG PRO 74 21.140 -2.847 -0.710 1694 1HD PRO 74 1HD PRO 74 23.234 -4.201 0.351 1695 2HD PRO 74 2HD PRO 74 22.160 -3.174 1.325 1696 H ASN 75 H ASN 75 19.934 -7.946 1.882 1697 HA ASN 75 HA ASN 75 21.141 -9.620 -0.090 1698 1HB ASN 75 1HB ASN 75 18.871 -10.064 1.886 1699 2HB ASN 75 2HB ASN 75 19.716 -11.362 1.042 1700 1HD2 ASN 75 1HD2 ASN 75 19.666 -10.658 4.008 1701 2HD2 ASN 75 2HD2 ASN 75 21.299 -10.492 4.438 1702 H ALA 76 H ALA 76 18.033 -8.022 0.039 1703 HA ALA 76 HA ALA 76 17.317 -9.301 -2.577 1704 1HB ALA 76 1HB ALA 76 14.914 -8.663 -1.467 1705 2HB ALA 76 2HB ALA 76 15.855 -8.959 -0.005 1706 3HB ALA 76 3HB ALA 76 15.695 -10.225 -1.223 1707 H ARG 77 H ARG 77 17.042 -7.794 -4.177 1708 HA ARG 77 HA ARG 77 16.910 -4.921 -3.409 1709 1HB ARG 77 1HB ARG 77 18.412 -6.328 -5.205 1710 2HB ARG 77 2HB ARG 77 17.092 -5.791 -6.245 1711 1HG ARG 77 1HG ARG 77 17.997 -3.733 -6.335 1712 2HG ARG 77 2HG ARG 77 17.853 -3.592 -4.584 1713 1HD ARG 77 1HD ARG 77 20.111 -3.697 -4.425 1714 2HD ARG 77 2HD ARG 77 20.067 -5.324 -5.128 1715 HE ARG 77 HE ARG 77 19.686 -3.545 -7.272 1716 1HH1 ARG 77 1HH1 ARG 77 22.123 -4.194 -4.872 1717 2HH1 ARG 77 2HH1 ARG 77 23.420 -3.676 -5.891 1718 1HH2 ARG 77 1HH2 ARG 77 21.385 -2.879 -8.575 1719 2HH2 ARG 77 2HH2 ARG 77 23.008 -2.936 -7.973 1720 H HIS 78 H HIS 78 15.629 -3.750 -5.466 1721 HA HIS 78 HA HIS 78 12.889 -4.967 -5.399 1722 1HB HIS 78 1HB HIS 78 12.169 -2.552 -5.623 1723 2HB HIS 78 2HB HIS 78 13.055 -2.896 -4.139 1724 HD1 HIS 78 HD1 HIS 78 14.757 -1.159 -3.654 1725 HD2 HIS 78 HD2 HIS 78 14.257 -1.680 -7.759 1726 HE1 HIS 78 HE1 HIS 78 16.340 0.466 -4.778 1727 H GLU 79 H GLU 79 11.578 -4.630 -7.330 1728 HA GLU 79 HA GLU 79 13.114 -3.989 -9.817 1729 1HB GLU 79 1HB GLU 79 13.099 -6.437 -9.362 1730 2HB GLU 79 2HB GLU 79 11.339 -6.400 -9.274 1731 1HG GLU 79 1HG GLU 79 12.097 -7.149 -11.501 1732 2HG GLU 79 2HG GLU 79 11.234 -5.615 -11.607 1733 H LEU 80 H LEU 80 11.940 -2.554 -11.037 1734 HA LEU 80 HA LEU 80 9.022 -2.281 -10.454 1735 1HB LEU 80 1HB LEU 80 11.231 -0.506 -11.487 1736 2HB LEU 80 2HB LEU 80 9.546 -0.070 -11.773 1737 HG LEU 80 HG LEU 80 10.611 -0.761 -9.025 1738 1HD1 LEU 80 1HD1 LEU 80 11.855 1.173 -9.630 1739 2HD1 LEU 80 2HD1 LEU 80 10.480 1.788 -8.713 1740 3HD1 LEU 80 3HD1 LEU 80 10.481 1.885 -10.472 1741 1HD2 LEU 80 1HD2 LEU 80 8.567 0.506 -8.336 1742 2HD2 LEU 80 2HD2 LEU 80 8.191 -0.935 -9.281 1743 3HD2 LEU 80 3HD2 LEU 80 8.128 0.657 -10.038 1744 H THR 81 H THR 81 7.562 -2.839 -12.019 1745 HA THR 81 HA THR 81 8.281 -4.232 -14.392 1746 HB THR 81 HB THR 81 5.785 -3.488 -14.921 1747 HG1 THR 81 HG1 THR 81 4.801 -2.482 -13.319 1748 1HG2 THR 81 1HG2 THR 81 5.189 -5.016 -12.767 1749 2HG2 THR 81 2HG2 THR 81 6.920 -5.330 -12.884 1750 3HG2 THR 81 3HG2 THR 81 5.866 -5.679 -14.254 1751 H ALA 82 H ALA 82 6.879 -3.126 -16.490 1752 HA ALA 82 HA ALA 82 8.702 -1.118 -17.487 1753 1HB ALA 82 1HB ALA 82 5.984 -1.671 -18.651 1754 2HB ALA 82 2HB ALA 82 7.173 -2.973 -18.610 1755 3HB ALA 82 3HB ALA 82 7.529 -1.482 -19.481 1756 H GLY 83 H GLY 83 8.392 0.542 -15.746 1757 1HA GLY 83 1HA GLY 83 7.308 2.877 -16.244 1758 2HA GLY 83 2HA GLY 83 5.806 2.007 -15.934 1759 H LEU 84 H LEU 84 5.092 2.170 -13.868 1760 HA LEU 84 HA LEU 84 6.871 1.893 -11.577 1761 1HB LEU 84 1HB LEU 84 7.264 4.229 -12.523 1762 2HB LEU 84 2HB LEU 84 5.593 4.599 -12.101 1763 HG LEU 84 HG LEU 84 6.090 3.996 -9.736 1764 1HD1 LEU 84 1HD1 LEU 84 7.883 2.602 -9.536 1765 2HD1 LEU 84 2HD1 LEU 84 8.810 4.101 -9.492 1766 3HD1 LEU 84 3HD1 LEU 84 8.642 3.213 -11.006 1767 1HD2 LEU 84 1HD2 LEU 84 7.918 5.929 -9.503 1768 2HD2 LEU 84 2HD2 LEU 84 6.255 6.290 -9.965 1769 3HD2 LEU 84 3HD2 LEU 84 7.510 6.181 -11.200 1770 H LYS 85 H LYS 85 4.509 0.530 -12.311 1771 HA LYS 85 HA LYS 85 2.515 1.592 -10.334 1772 1HB LYS 85 1HB LYS 85 2.321 0.202 -13.003 1773 2HB LYS 85 2HB LYS 85 0.982 0.094 -11.860 1774 1HG LYS 85 1HG LYS 85 0.925 2.579 -11.733 1775 2HG LYS 85 2HG LYS 85 2.212 2.652 -12.937 1776 1HD LYS 85 1HD LYS 85 0.707 1.305 -14.473 1777 2HD LYS 85 2HD LYS 85 -0.586 1.549 -13.299 1778 1HE LYS 85 1HE LYS 85 0.887 4.003 -14.108 1779 2HE LYS 85 2HE LYS 85 -0.141 3.266 -15.351 1780 1HZ LYS 85 1HZ LYS 85 -1.025 3.719 -12.550 1781 2HZ LYS 85 2HZ LYS 85 -1.987 3.273 -13.878 1782 3HZ LYS 85 3HZ LYS 85 -1.317 4.832 -13.800 1783 H ARG 86 H ARG 86 4.570 -1.062 -11.192 1784 HA ARG 86 HA ARG 86 3.316 -2.694 -9.011 1785 1HB ARG 86 1HB ARG 86 3.565 -3.189 -11.830 1786 2HB ARG 86 2HB ARG 86 4.572 -4.354 -10.971 1787 1HG ARG 86 1HG ARG 86 2.498 -4.650 -9.421 1788 2HG ARG 86 2HG ARG 86 1.603 -3.895 -10.740 1789 1HD ARG 86 1HD ARG 86 3.343 -6.377 -10.996 1790 2HD ARG 86 2HD ARG 86 1.570 -6.352 -10.989 1791 HE ARG 86 HE ARG 86 2.276 -4.497 -12.939 1792 1HH1 ARG 86 1HH1 ARG 86 2.976 -7.854 -12.337 1793 2HH1 ARG 86 2HH1 ARG 86 3.154 -8.231 -14.015 1794 1HH2 ARG 86 1HH2 ARG 86 2.512 -5.011 -15.110 1795 2HH2 ARG 86 2HH2 ARG 86 2.894 -6.634 -15.576 1796 H MET 87 H MET 87 4.807 -3.850 -7.708 1797 HA MET 87 HA MET 87 7.699 -3.197 -8.190 1798 1HB MET 87 1HB MET 87 5.871 -3.044 -5.853 1799 2HB MET 87 2HB MET 87 7.485 -3.663 -5.508 1800 1HG MET 87 1HG MET 87 6.986 -1.109 -7.058 1801 2HG MET 87 2HG MET 87 7.252 -1.145 -5.315 1802 1HE MET 87 1HE MET 87 10.562 -0.512 -4.921 1803 2HE MET 87 2HE MET 87 10.072 -2.090 -4.305 1804 3HE MET 87 3HE MET 87 8.913 -0.761 -4.347 1805 H ARG 88 H ARG 88 9.224 -4.835 -7.432 1806 HA ARG 88 HA ARG 88 8.126 -7.545 -6.872 1807 1HB ARG 88 1HB ARG 88 9.371 -6.535 -9.360 1808 2HB ARG 88 2HB ARG 88 10.063 -8.044 -8.767 1809 1HG ARG 88 1HG ARG 88 7.795 -9.031 -8.661 1810 2HG ARG 88 2HG ARG 88 7.122 -7.528 -9.295 1811 1HD ARG 88 1HD ARG 88 7.785 -8.008 -11.429 1812 2HD ARG 88 2HD ARG 88 9.359 -8.624 -10.890 1813 HE ARG 88 HE ARG 88 7.476 -10.480 -9.961 1814 1HH1 ARG 88 1HH1 ARG 88 8.443 -9.165 -13.036 1815 2HH1 ARG 88 2HH1 ARG 88 8.025 -10.600 -13.905 1816 1HH2 ARG 88 1HH2 ARG 88 6.941 -12.332 -11.111 1817 2HH2 ARG 88 2HH2 ARG 88 7.181 -12.381 -12.826 1818 H ILE 89 H ILE 89 9.274 -8.087 -5.033 1819 HA ILE 89 HA ILE 89 11.971 -6.977 -4.597 1820 HB ILE 89 HB ILE 89 10.090 -8.750 -3.000 1821 1HG1 ILE 89 1HG1 ILE 89 10.633 -6.207 -1.824 1822 2HG1 ILE 89 2HG1 ILE 89 10.227 -5.933 -3.516 1823 1HG2 ILE 89 1HG2 ILE 89 12.451 -9.152 -2.370 1824 2HG2 ILE 89 2HG2 ILE 89 11.584 -8.302 -1.090 1825 3HG2 ILE 89 3HG2 ILE 89 12.682 -7.417 -2.150 1826 1HD1 ILE 89 1HD1 ILE 89 8.274 -7.617 -3.042 1827 2HD1 ILE 89 2HD1 ILE 89 8.116 -5.942 -2.513 1828 3HD1 ILE 89 3HD1 ILE 89 8.563 -7.195 -1.354 1829 H PHE 90 H PHE 90 13.706 -8.037 -5.435 1830 HA PHE 90 HA PHE 90 13.527 -10.992 -5.852 1831 1HB PHE 90 1HB PHE 90 14.628 -8.668 -7.257 1832 2HB PHE 90 2HB PHE 90 15.801 -9.980 -7.122 1833 HD1 PHE 90 HD1 PHE 90 14.997 -12.353 -7.745 1834 HD2 PHE 90 HD2 PHE 90 12.903 -8.775 -8.859 1835 HE1 PHE 90 HE1 PHE 90 13.802 -13.607 -9.518 1836 HE2 PHE 90 HE2 PHE 90 11.706 -10.028 -10.633 1837 HZ PHE 90 HZ PHE 90 12.153 -12.446 -10.961 1838 H THR 91 H THR 91 15.568 -12.217 -5.425 1839 HA THR 91 HA THR 91 16.943 -11.156 -2.989 1840 HB THR 91 HB THR 91 17.463 -13.687 -2.785 1841 HG1 THR 91 HG1 THR 91 15.953 -14.951 -4.000 1842 1HG2 THR 91 1HG2 THR 91 15.327 -12.140 -1.958 1843 2HG2 THR 91 2HG2 THR 91 15.660 -13.784 -1.412 1844 3HG2 THR 91 3HG2 THR 91 14.531 -13.507 -2.738 1845 H ILE 92 H ILE 92 18.553 -9.938 -4.221 1846 HA ILE 92 HA ILE 92 20.148 -10.895 -6.339 1847 HB ILE 92 HB ILE 92 21.785 -9.202 -5.433 1848 1HG1 ILE 92 1HG1 ILE 92 19.815 -8.636 -3.241 1849 2HG1 ILE 92 2HG1 ILE 92 21.034 -9.886 -2.997 1850 1HG2 ILE 92 1HG2 ILE 92 20.023 -8.362 -6.826 1851 2HG2 ILE 92 2HG2 ILE 92 20.104 -7.288 -5.430 1852 3HG2 ILE 92 3HG2 ILE 92 18.839 -8.512 -5.528 1853 1HD1 ILE 92 1HD1 ILE 92 22.384 -8.177 -2.356 1854 2HD1 ILE 92 2HD1 ILE 92 21.341 -6.961 -3.094 1855 3HD1 ILE 92 3HD1 ILE 92 22.517 -7.830 -4.080 1856 H LYS 93 H LYS 93 20.192 -11.771 -2.961 1857 HA LYS 93 HA LYS 93 22.525 -13.568 -3.511 1858 1HB LYS 93 1HB LYS 93 21.951 -11.911 -1.025 1859 2HB LYS 93 2HB LYS 93 23.328 -12.992 -1.234 1860 1HG LYS 93 1HG LYS 93 23.598 -11.483 -3.463 1861 2HG LYS 93 2HG LYS 93 22.836 -10.301 -2.398 1862 1HD LYS 93 1HD LYS 93 24.675 -11.373 -0.704 1863 2HD LYS 93 2HD LYS 93 25.528 -11.531 -2.239 1864 1HE LYS 93 1HE LYS 93 25.902 -9.291 -2.348 1865 2HE LYS 93 2HE LYS 93 24.209 -8.925 -1.962 1866 1HZ LYS 93 1HZ LYS 93 26.112 -9.963 0.063 1867 2HZ LYS 93 2HZ LYS 93 24.607 -9.220 0.323 1868 3HZ LYS 93 3HZ LYS 93 25.926 -8.298 -0.218 1869 HA PRO 94 HA PRO 94 19.818 -16.742 -2.060 1870 1HB PRO 94 1HB PRO 94 22.219 -17.953 -0.807 1871 2HB PRO 94 2HB PRO 94 21.112 -18.640 -2.007 1872 1HG PRO 94 1HG PRO 94 23.597 -17.824 -2.632 1873 2HG PRO 94 2HG PRO 94 22.245 -17.726 -3.766 1874 1HD PRO 94 1HD PRO 94 23.589 -15.567 -2.236 1875 2HD PRO 94 2HD PRO 94 22.795 -15.507 -3.823 1876 H ILE 95 H ILE 95 18.570 -16.698 -0.237 1877 HA ILE 95 HA ILE 95 19.790 -15.628 2.276 1878 HB ILE 95 HB ILE 95 16.947 -15.790 1.208 1879 1HG1 ILE 95 1HG1 ILE 95 18.584 -13.327 1.820 1880 2HG1 ILE 95 2HG1 ILE 95 18.652 -14.115 0.244 1881 1HG2 ILE 95 1HG2 ILE 95 16.782 -15.962 3.592 1882 2HG2 ILE 95 2HG2 ILE 95 16.473 -14.270 3.202 1883 3HG2 ILE 95 3HG2 ILE 95 18.047 -14.756 3.833 1884 1HD1 ILE 95 1HD1 ILE 95 15.990 -13.989 0.498 1885 2HD1 ILE 95 2HD1 ILE 95 16.921 -12.646 -0.165 1886 3HD1 ILE 95 3HD1 ILE 95 16.409 -12.615 1.522 1887 H ALA 96 H ALA 96 19.740 -16.884 4.130 1888 HA ALA 96 HA ALA 96 18.903 -19.705 3.842 1889 1HB ALA 96 1HB ALA 96 21.091 -18.887 4.836 1890 2HB ALA 96 2HB ALA 96 20.181 -19.966 5.894 1891 3HB ALA 96 3HB ALA 96 20.160 -18.226 6.180 1892 H ILE 97 H ILE 97 17.617 -20.690 5.659 1893 HA ILE 97 HA ILE 97 15.170 -19.219 6.122 1894 HB ILE 97 HB ILE 97 16.336 -21.797 7.236 1895 1HG1 ILE 97 1HG1 ILE 97 14.082 -21.961 5.393 1896 2HG1 ILE 97 2HG1 ILE 97 15.457 -21.127 4.671 1897 1HG2 ILE 97 1HG2 ILE 97 13.447 -21.665 7.188 1898 2HG2 ILE 97 2HG2 ILE 97 14.098 -20.342 8.155 1899 3HG2 ILE 97 3HG2 ILE 97 14.516 -22.010 8.548 1900 1HD1 ILE 97 1HD1 ILE 97 16.805 -22.991 4.749 1901 2HD1 ILE 97 2HD1 ILE 97 15.244 -23.805 4.650 1902 3HD1 ILE 97 3HD1 ILE 97 16.040 -23.612 6.211 1903 H GLY 98 H GLY 98 15.117 -17.539 7.572 1904 1HA GLY 98 1HA GLY 98 14.965 -17.059 10.017 1905 2HA GLY 98 2HA GLY 98 16.474 -17.953 10.207 1906 H GLU 99 H GLU 99 15.663 -15.557 7.704 1907 HA GLU 99 HA GLU 99 17.881 -13.843 8.783 1908 1HB GLU 99 1HB GLU 99 17.024 -14.582 5.967 1909 2HB GLU 99 2HB GLU 99 18.149 -13.265 6.298 1910 1HG GLU 99 1HG GLU 99 18.676 -15.940 7.539 1911 2HG GLU 99 2HG GLU 99 19.042 -15.720 5.828 1912 H GLU 100 H GLU 100 17.591 -11.548 7.504 1913 HA GLU 100 HA GLU 100 14.713 -10.761 7.819 1914 1HB GLU 100 1HB GLU 100 16.337 -10.049 9.646 1915 2HB GLU 100 2HB GLU 100 17.175 -9.088 8.426 1916 1HG GLU 100 1HG GLU 100 14.685 -8.213 7.968 1917 2HG GLU 100 2HG GLU 100 14.486 -8.668 9.660 1918 H ILE 101 H ILE 101 13.882 -9.908 5.952 1919 HA ILE 101 HA ILE 101 15.712 -9.243 3.732 1920 HB ILE 101 HB ILE 101 12.681 -9.233 3.968 1921 1HG1 ILE 101 1HG1 ILE 101 14.581 -11.362 2.941 1922 2HG1 ILE 101 2HG1 ILE 101 13.663 -11.446 4.444 1923 1HG2 ILE 101 1HG2 ILE 101 12.603 -9.053 1.629 1924 2HG2 ILE 101 2HG2 ILE 101 14.278 -9.570 1.439 1925 3HG2 ILE 101 3HG2 ILE 101 13.917 -7.956 2.053 1926 1HD1 ILE 101 1HD1 ILE 101 12.572 -11.389 1.619 1927 2HD1 ILE 101 2HD1 ILE 101 11.560 -11.161 3.046 1928 3HD1 ILE 101 3HD1 ILE 101 12.415 -12.685 2.805 1929 H THR 102 H THR 102 16.338 -7.188 3.312 1930 HA THR 102 HA THR 102 14.594 -4.890 3.957 1931 HB THR 102 HB THR 102 16.541 -3.898 5.298 1932 HG1 THR 102 HG1 THR 102 17.353 -6.605 5.400 1933 1HG2 THR 102 1HG2 THR 102 15.831 -4.912 7.320 1934 2HG2 THR 102 2HG2 THR 102 15.493 -6.449 6.525 1935 3HG2 THR 102 3HG2 THR 102 14.443 -5.061 6.242 1936 H ILE 103 H ILE 103 15.103 -3.116 2.609 1937 HA ILE 103 HA ILE 103 17.494 -3.468 0.830 1938 HB ILE 103 HB ILE 103 16.081 -2.560 -0.969 1939 1HG1 ILE 103 1HG1 ILE 103 13.497 -2.665 0.207 1940 2HG1 ILE 103 2HG1 ILE 103 14.501 -1.670 1.262 1941 1HG2 ILE 103 1HG2 ILE 103 14.189 -4.529 0.157 1942 2HG2 ILE 103 2HG2 ILE 103 15.872 -5.056 0.132 1943 3HG2 ILE 103 3HG2 ILE 103 15.080 -4.565 -1.365 1944 1HD1 ILE 103 1HD1 ILE 103 13.737 -1.231 -1.602 1945 2HD1 ILE 103 2HD1 ILE 103 15.294 -0.619 -1.042 1946 3HD1 ILE 103 3HD1 ILE 103 13.803 -0.073 -0.273 1947 H SER 104 H SER 104 18.636 -1.555 0.305 1948 HA SER 104 HA SER 104 18.310 0.660 2.212 1949 1HB SER 104 1HB SER 104 20.511 -0.288 1.634 1950 2HB SER 104 2HB SER 104 20.245 0.095 -0.067 1951 HG SER 104 HG SER 104 21.307 1.829 0.572 1952 H TYR 105 H TYR 105 19.089 2.860 0.738 1953 HA TYR 105 HA TYR 105 16.893 3.161 -1.290 1954 1HB TYR 105 1HB TYR 105 17.956 5.314 0.571 1955 2HB TYR 105 2HB TYR 105 16.473 5.351 -0.378 1956 HD1 TYR 105 HD1 TYR 105 15.418 2.603 0.160 1957 HD2 TYR 105 HD2 TYR 105 17.183 5.499 2.796 1958 HE1 TYR 105 HE1 TYR 105 14.181 1.619 2.071 1959 HE2 TYR 105 HE2 TYR 105 15.946 4.516 4.706 1960 HH TYR 105 HH TYR 105 14.553 1.536 4.653 1961 H GLY 106 H GLY 106 19.725 5.048 -0.165 1962 1HA GLY 106 1HA GLY 106 21.624 4.869 -1.992 1963 2HA GLY 106 2HA GLY 106 20.387 5.623 -3.003 1964 H ASP 107 H ASP 107 22.641 7.047 -2.745 1965 HA ASP 107 HA ASP 107 23.194 8.673 -0.582 1966 1HB ASP 107 1HB ASP 107 23.940 10.302 -2.325 1967 2HB ASP 107 2HB ASP 107 24.403 8.647 -2.721 1968 H ASP 108 H ASP 108 20.417 8.956 -2.754 1969 HA ASP 108 HA ASP 108 19.628 11.612 -1.993 1970 1HB ASP 108 1HB ASP 108 18.647 9.309 -3.514 1971 2HB ASP 108 2HB ASP 108 17.340 10.186 -2.719 1972 H TYR 109 H TYR 109 18.654 8.391 -0.758 1973 HA TYR 109 HA TYR 109 17.177 9.775 1.448 1974 1HB TYR 109 1HB TYR 109 16.678 7.573 -0.323 1975 2HB TYR 109 2HB TYR 109 16.744 6.941 1.321 1976 HD1 TYR 109 HD1 TYR 109 14.501 6.580 1.936 1977 HD2 TYR 109 HD2 TYR 109 15.626 10.295 0.096 1978 HE1 TYR 109 HE1 TYR 109 12.233 7.482 2.369 1979 HE2 TYR 109 HE2 TYR 109 13.357 11.197 0.530 1980 HH TYR 109 HH TYR 109 10.784 9.500 1.084 1981 H TRP 110 H TRP 110 18.380 9.900 3.293 1982 HA TRP 110 HA TRP 110 19.795 9.290 5.066 1983 1HB TRP 110 1HB TRP 110 18.206 7.527 5.377 1984 2HB TRP 110 2HB TRP 110 18.803 6.635 3.985 1985 HD1 TRP 110 HD1 TRP 110 21.008 5.233 4.248 1986 HE1 TRP 110 HE1 TRP 110 22.307 4.406 6.320 1987 HE3 TRP 110 HE3 TRP 110 18.876 8.156 7.851 1988 HZ2 TRP 110 HZ2 TRP 110 22.423 4.920 9.133 1989 HZ3 TRP 110 HZ3 TRP 110 19.597 7.968 10.214 1990 HH2 TRP 110 HH2 TRP 110 21.366 6.356 10.859 1991 H LEU 111 H LEU 111 20.613 6.566 2.905 1992 HA LEU 111 HA LEU 111 23.356 6.526 3.322 1993 1HB LEU 111 1HB LEU 111 21.624 5.131 1.856 1994 2HB LEU 111 2HB LEU 111 22.276 6.124 0.557 1995 HG LEU 111 HG LEU 111 24.544 5.370 1.065 1996 1HD1 LEU 111 1HD1 LEU 111 23.151 4.039 3.384 1997 2HD1 LEU 111 2HD1 LEU 111 24.602 5.041 3.397 1998 3HD1 LEU 111 3HD1 LEU 111 24.671 3.397 2.761 1999 1HD2 LEU 111 1HD2 LEU 111 24.338 3.210 0.167 2000 2HD2 LEU 111 2HD2 LEU 111 22.813 3.961 -0.300 2001 3HD2 LEU 111 3HD2 LEU 111 22.871 2.868 1.082 2002 H SER 112 H SER 112 25.155 7.272 1.883 2003 HA SER 112 HA SER 112 24.599 9.697 0.271 2004 1HB SER 112 1HB SER 112 25.410 11.166 1.830 2005 2HB SER 112 2HB SER 112 25.057 9.876 2.977 2006 HG SER 112 HG SER 112 27.115 9.456 3.175 2007 H ARG 113 H ARG 113 25.802 9.365 -1.549 2008 HA ARG 113 HA ARG 113 27.552 8.620 -2.955 2009 1HB ARG 113 1HB ARG 113 28.376 10.468 -1.143 2010 2HB ARG 113 2HB ARG 113 29.475 9.149 -0.743 2011 1HG ARG 113 1HG ARG 113 30.660 10.264 -2.423 2012 2HG ARG 113 2HG ARG 113 29.820 9.016 -3.343 2013 1HD ARG 113 1HD ARG 113 27.919 10.855 -3.515 2014 2HD ARG 113 2HD ARG 113 29.269 11.965 -3.213 2015 HE ARG 113 HE ARG 113 30.090 10.036 -5.154 2016 1HH1 ARG 113 1HH1 ARG 113 27.916 12.731 -4.787 2017 2HH1 ARG 113 2HH1 ARG 113 27.977 13.149 -6.464 2018 1HH2 ARG 113 1HH2 ARG 113 30.152 10.600 -7.326 2019 2HH2 ARG 113 2HH2 ARG 113 29.232 11.954 -7.892 2020 HA PRO 114 HA PRO 114 28.232 4.756 -0.317 2021 1HB PRO 114 1HB PRO 114 26.288 3.130 -1.358 2022 2HB PRO 114 2HB PRO 114 26.011 4.179 0.045 2023 1HG PRO 114 1HG PRO 114 25.246 4.572 -2.806 2024 2HG PRO 114 2HG PRO 114 24.348 4.971 -1.335 2025 1HD PRO 114 1HD PRO 114 25.737 6.800 -2.834 2026 2HD PRO 114 2HD PRO 114 25.394 6.990 -1.102 2027 H ARG 115 H ARG 115 29.465 3.019 -1.163 2028 HA ARG 115 HA ARG 115 29.614 2.836 -4.154 2029 1HB ARG 115 1HB ARG 115 31.759 3.015 -2.021 2030 2HB ARG 115 2HB ARG 115 32.114 2.421 -3.643 2031 1HG ARG 115 1HG ARG 115 30.907 5.124 -2.974 2032 2HG ARG 115 2HG ARG 115 32.572 4.838 -3.480 2033 1HD ARG 115 1HD ARG 115 31.279 3.591 -5.508 2034 2HD ARG 115 2HD ARG 115 30.079 4.835 -5.104 2035 HE ARG 115 HE ARG 115 32.816 5.859 -5.197 2036 1HH1 ARG 115 1HH1 ARG 115 29.956 5.119 -7.039 2037 2HH1 ARG 115 2HH1 ARG 115 30.335 6.252 -8.288 2038 1HH2 ARG 115 1HH2 ARG 115 33.286 7.323 -6.831 2039 2HH2 ARG 115 2HH2 ARG 115 32.206 7.492 -8.175 2040 H LEU 116 H LEU 116 30.158 1.198 -1.039 2041 HA LEU 116 HA LEU 116 30.221 -1.105 -0.504 2042 1HB LEU 116 1HB LEU 116 28.101 -0.525 -2.478 2043 2HB LEU 116 2HB LEU 116 28.545 -2.229 -2.385 2044 HG LEU 116 HG LEU 116 28.441 -1.619 0.259 2045 1HD1 LEU 116 1HD1 LEU 116 26.065 -0.345 0.201 2046 2HD1 LEU 116 2HD1 LEU 116 26.812 0.388 -1.218 2047 3HD1 LEU 116 3HD1 LEU 116 27.596 0.515 0.356 2048 1HD2 LEU 116 1HD2 LEU 116 27.255 -3.425 -1.136 2049 2HD2 LEU 116 2HD2 LEU 116 25.934 -2.269 -1.300 2050 3HD2 LEU 116 3HD2 LEU 116 26.405 -2.849 0.297 2051 H THR 117 H THR 117 32.341 -0.213 -2.291 2052 HA THR 117 HA THR 117 32.760 -2.744 -3.847 2053 HB THR 117 HB THR 117 33.664 0.065 -4.576 2054 HG1 THR 117 HG1 THR 117 31.762 0.331 -5.377 2055 1HG2 THR 117 1HG2 THR 117 34.880 -2.033 -5.460 2056 2HG2 THR 117 2HG2 THR 117 34.314 -0.869 -6.658 2057 3HG2 THR 117 3HG2 THR 117 33.403 -2.351 -6.370 2058 H GLN 118 H GLN 118 34.992 -3.436 -3.956 2059 HA GLN 118 HA GLN 118 36.796 -2.113 -1.956 2060 1HB GLN 118 1HB GLN 118 35.579 -4.679 -1.957 2061 2HB GLN 118 2HB GLN 118 37.287 -4.943 -2.306 2062 1HG GLN 118 1HG GLN 118 36.393 -3.130 -0.062 2063 2HG GLN 118 2HG GLN 118 36.594 -4.866 0.179 2064 1HE2 GLN 118 1HE2 GLN 118 38.459 -4.485 1.613 2065 2HE2 GLN 118 2HE2 GLN 118 39.959 -4.009 0.979 2066 H ASN 119 H ASN 119 38.927 -1.840 -2.634 2067 HA ASN 119 HA ASN 119 39.783 -3.148 -5.178 2068 1HB ASN 119 1HB ASN 119 40.532 -0.910 -5.976 2069 2HB ASN 119 2HB ASN 119 38.793 -0.938 -5.686 2070 1HD2 ASN 119 1HD2 ASN 119 38.022 0.735 -4.383 2071 2HD2 ASN 119 2HD2 ASN 119 38.967 1.646 -3.307 2072 1H GLY 201 1H GLY 201 20.557 36.279 9.216 2073 2H GLY 201 2H GLY 201 19.400 35.181 8.632 2074 3H GLY 201 3H GLY 201 20.281 36.145 7.546 2075 1HA GLY 201 1HA GLY 201 22.341 35.028 8.256 2076 2HA GLY 201 2HA GLY 201 21.350 33.964 9.253 2077 H LYS 202 H LYS 202 22.987 33.065 7.071 2078 HA LYS 202 HA LYS 202 20.853 32.074 5.209 2079 1HB LYS 202 1HB LYS 202 22.941 33.787 4.625 2080 2HB LYS 202 2HB LYS 202 23.624 32.217 4.200 2081 1HG LYS 202 1HG LYS 202 22.491 32.374 2.253 2082 2HG LYS 202 2HG LYS 202 21.016 32.137 3.191 2083 1HD LYS 202 1HD LYS 202 22.284 34.861 2.853 2084 2HD LYS 202 2HD LYS 202 21.100 34.230 1.708 2085 1HE LYS 202 1HE LYS 202 19.409 34.070 3.429 2086 2HE LYS 202 2HE LYS 202 20.596 34.427 4.698 2087 1HZ LYS 202 1HZ LYS 202 19.951 36.228 2.418 2088 2HZ LYS 202 2HZ LYS 202 20.998 36.573 3.710 2089 3HZ LYS 202 3HZ LYS 202 19.330 36.412 3.988 2090 H ALA 203 H ALA 203 20.610 29.917 5.664 2091 HA ALA 203 HA ALA 203 21.169 27.676 6.159 2092 1HB ALA 203 1HB ALA 203 22.343 28.197 3.963 2093 2HB ALA 203 2HB ALA 203 23.093 26.905 4.899 2094 3HB ALA 203 3HB ALA 203 23.802 28.519 4.900 2095 HA PRO 204 HA PRO 204 23.315 28.902 10.026 2096 1HB PRO 204 1HB PRO 204 21.885 26.478 10.986 2097 2HB PRO 204 2HB PRO 204 21.904 28.113 11.670 2098 1HG PRO 204 1HG PRO 204 19.768 27.117 10.382 2099 2HG PRO 204 2HG PRO 204 20.194 28.833 10.330 2100 1HD PRO 204 1HD PRO 204 20.533 26.733 8.249 2101 2HD PRO 204 2HD PRO 204 20.181 28.465 8.067 2102 H ARG 205 H ARG 205 22.872 25.616 8.699 2103 HA ARG 205 HA ARG 205 25.720 25.044 9.454 2104 1HB ARG 205 1HB ARG 205 23.186 23.727 10.095 2105 2HB ARG 205 2HB ARG 205 24.329 22.615 9.343 2106 1HG ARG 205 1HG ARG 205 25.395 22.453 11.320 2107 2HG ARG 205 2HG ARG 205 25.824 24.158 11.186 2108 1HD ARG 205 1HD ARG 205 24.234 24.791 12.707 2109 2HD ARG 205 2HD ARG 205 23.041 23.642 12.072 2110 HE ARG 205 HE ARG 205 25.129 22.132 13.260 2111 1HH1 ARG 205 1HH1 ARG 205 22.653 24.397 14.187 2112 2HH1 ARG 205 2HH1 ARG 205 22.491 23.738 15.777 2113 1HH2 ARG 205 1HH2 ARG 205 24.900 21.294 15.331 2114 2HH2 ARG 205 2HH2 ARG 205 23.752 21.995 16.422 2115 H LYS 206 H LYS 206 24.312 25.956 6.871 2116 HA LYS 206 HA LYS 206 24.432 25.447 4.566 2117 1HB LYS 206 1HB LYS 206 26.840 24.553 5.984 2118 2HB LYS 206 2HB LYS 206 26.585 23.674 4.476 2119 1HG LYS 206 1HG LYS 206 26.326 25.848 3.289 2120 2HG LYS 206 2HG LYS 206 26.680 26.689 4.798 2121 1HD LYS 206 1HD LYS 206 28.528 24.738 3.390 2122 2HD LYS 206 2HD LYS 206 28.709 26.492 3.405 2123 1HE LYS 206 1HE LYS 206 28.593 26.126 6.050 2124 2HE LYS 206 2HE LYS 206 29.194 24.518 5.605 2125 1HZ LYS 206 1HZ LYS 206 30.790 25.780 4.097 2126 2HZ LYS 206 2HZ LYS 206 31.108 25.843 5.765 2127 3HZ LYS 206 3HZ LYS 206 30.377 27.165 4.989 2128 H GLN 207 H GLN 207 22.358 24.091 5.186 2129 HA GLN 207 HA GLN 207 22.761 21.167 5.076 2130 1HB GLN 207 1HB GLN 207 20.676 23.131 5.759 2131 2HB GLN 207 2HB GLN 207 20.049 21.728 4.893 2132 1HG GLN 207 1HG GLN 207 21.899 21.485 7.276 2133 2HG GLN 207 2HG GLN 207 20.143 21.504 7.433 2134 1HE2 GLN 207 1HE2 GLN 207 19.134 19.897 5.558 2135 2HE2 GLN 207 2HE2 GLN 207 19.837 18.352 5.561 2136 H LEU 208 H LEU 208 23.374 20.547 2.994 2137 HA LEU 208 HA LEU 208 22.474 21.789 0.569 2138 1HB LEU 208 1HB LEU 208 24.281 19.819 1.425 2139 2HB LEU 208 2HB LEU 208 23.166 18.959 0.364 2140 HG LEU 208 HG LEU 208 25.050 19.895 -0.925 2141 1HD1 LEU 208 1HD1 LEU 208 22.449 19.974 -1.616 2142 2HD1 LEU 208 2HD1 LEU 208 23.724 20.574 -2.677 2143 3HD1 LEU 208 3HD1 LEU 208 22.804 21.701 -1.681 2144 1HD2 LEU 208 1HD2 LEU 208 25.702 22.109 -0.821 2145 2HD2 LEU 208 2HD2 LEU 208 25.094 21.916 0.823 2146 3HD2 LEU 208 3HD2 LEU 208 24.084 22.675 -0.407 2147 H ALA 209 H ALA 209 20.163 21.917 0.585 2148 HA ALA 209 HA ALA 209 18.446 19.660 1.137 2149 1HB ALA 209 1HB ALA 209 17.584 21.879 1.351 2150 2HB ALA 209 2HB ALA 209 16.799 21.234 -0.091 2151 3HB ALA 209 3HB ALA 209 18.165 22.339 -0.250 2152 H THR 210 H THR 210 17.505 18.195 -0.316 2153 HA THR 210 HA THR 210 18.508 18.305 -3.145 2154 HB THR 210 HB THR 210 18.154 15.696 -2.786 2155 HG1 THR 210 HG1 THR 210 18.726 15.277 -0.528 2156 1HG2 THR 210 1HG2 THR 210 20.476 16.893 -1.294 2157 2HG2 THR 210 2HG2 THR 210 20.320 17.154 -3.031 2158 3HG2 THR 210 3HG2 THR 210 20.456 15.515 -2.394 2159 H LYS 211 H LYS 211 16.463 19.444 -3.679 2160 HA LYS 211 HA LYS 211 13.918 18.032 -3.245 2161 1HB LYS 211 1HB LYS 211 14.731 20.505 -4.820 2162 2HB LYS 211 2HB LYS 211 13.063 20.011 -4.524 2163 1HG LYS 211 1HG LYS 211 15.036 20.462 -2.277 2164 2HG LYS 211 2HG LYS 211 14.027 21.759 -2.917 2165 1HD LYS 211 1HD LYS 211 12.298 19.564 -2.512 2166 2HD LYS 211 2HD LYS 211 13.315 19.648 -1.074 2167 1HE LYS 211 1HE LYS 211 12.048 22.150 -2.200 2168 2HE LYS 211 2HE LYS 211 11.153 21.093 -1.091 2169 1HZ LYS 211 1HZ LYS 211 12.484 22.823 0.063 2170 2HZ LYS 211 2HZ LYS 211 13.895 22.134 -0.584 2171 3HZ LYS 211 3HZ LYS 211 12.932 21.243 0.494 2172 H ALA 212 H ALA 212 15.033 16.094 -4.509 2173 HA ALA 212 HA ALA 212 13.860 16.066 -7.191 2174 1HB ALA 212 1HB ALA 212 16.238 15.482 -8.122 2175 2HB ALA 212 2HB ALA 212 16.826 16.279 -6.663 2176 3HB ALA 212 3HB ALA 212 15.850 17.177 -7.825 2177 H ALA 213 H ALA 213 12.974 14.045 -7.210 2178 HA ALA 213 HA ALA 213 12.727 11.720 -6.884 2179 1HB ALA 213 1HB ALA 213 14.773 11.944 -8.368 2180 2HB ALA 213 2HB ALA 213 14.753 10.476 -7.391 2181 3HB ALA 213 3HB ALA 213 15.764 11.840 -6.913 2182 H ARG 214 H ARG 214 13.455 9.876 -5.339 2183 HA ARG 214 HA ARG 214 14.461 10.926 -2.732 2184 1HB ARG 214 1HB ARG 214 11.766 9.845 -3.456 2185 2HB ARG 214 2HB ARG 214 12.418 9.395 -1.880 2186 1HG ARG 214 1HG ARG 214 12.300 11.541 -1.069 2187 2HG ARG 214 2HG ARG 214 12.642 12.264 -2.641 2188 1HD ARG 214 1HD ARG 214 10.335 11.657 -3.389 2189 2HD ARG 214 2HD ARG 214 10.002 11.036 -1.761 2190 HE ARG 214 HE ARG 214 10.202 13.851 -2.509 2191 1HH1 ARG 214 1HH1 ARG 214 10.666 11.523 0.038 2192 2HH1 ARG 214 2HH1 ARG 214 10.480 12.696 1.294 2193 1HH2 ARG 214 1HH2 ARG 214 9.964 15.356 -0.860 2194 2HH2 ARG 214 2HH2 ARG 214 10.086 14.851 0.793 2195 1HN MLZ 215 1HN MLZ 215 12.834 7.829 -3.334 2196 HA MLZ 215 HA MLZ 215 15.203 6.382 -2.382 2197 1HB MLZ 215 1HB MLZ 215 12.355 6.007 -2.705 2198 2HB MLZ 215 2HB MLZ 215 13.210 4.645 -3.427 2199 1HG MLZ 215 1HG MLZ 215 14.241 5.550 -0.798 2200 2HG MLZ 215 2HG MLZ 215 14.009 3.913 -1.414 2201 1HD MLZ 215 1HD MLZ 215 11.742 5.739 -0.566 2202 2HD MLZ 215 2HD MLZ 215 11.623 4.034 -1.001 2203 1HE MLZ 215 1HE MLZ 215 13.206 5.115 1.362 2204 2HE MLZ 215 2HE MLZ 215 12.974 3.406 0.948 2205 HZ MLZ 215 HZ MLZ 215 10.622 3.648 1.199 2206 1HCM MLZ 215 1HCM MLZ 215 11.426 5.175 3.540 2207 2HCM MLZ 215 2HCM MLZ 215 12.324 3.690 3.228 2208 3HCM MLZ 215 3HCM MLZ 215 10.574 3.635 3.438 2209 H SER 216 H SER 216 16.792 5.654 -3.730 2210 HA SER 216 HA SER 216 17.865 4.870 -5.684 2211 1HB SER 216 1HB SER 216 15.877 6.831 -6.888 2212 2HB SER 216 2HB SER 216 17.397 7.294 -6.125 2213 HG SER 216 HG SER 216 17.699 7.118 -8.338 2214 H ALA 217 H ALA 217 16.696 4.677 -8.328 2215 HA ALA 217 HA ALA 217 15.398 2.090 -8.098 2216 1HB ALA 217 1HB ALA 217 13.580 3.649 -7.419 2217 2HB ALA 217 2HB ALA 217 13.192 2.840 -8.938 2218 3HB ALA 217 3HB ALA 217 13.760 4.510 -8.948 2219 HA PRO 218 HA PRO 218 17.094 1.798 -12.149 2220 1HB PRO 218 1HB PRO 218 14.742 0.107 -12.843 2221 2HB PRO 218 2HB PRO 218 16.468 -0.291 -12.909 2222 1HG PRO 218 1HG PRO 218 14.841 -1.280 -11.020 2223 2HG PRO 218 2HG PRO 218 16.542 -0.910 -10.706 2224 1HD PRO 218 1HD PRO 218 14.099 0.571 -9.882 2225 2HD PRO 218 2HD PRO 218 15.656 0.396 -9.045 2226 H ALA 219 H ALA 219 15.978 1.743 -14.577 2227 HA ALA 219 HA ALA 219 13.600 3.434 -14.812 2228 1HB ALA 219 1HB ALA 219 15.320 5.050 -14.110 2229 2HB ALA 219 2HB ALA 219 14.891 5.341 -15.796 2230 3HB ALA 219 3HB ALA 219 16.389 4.498 -15.399 2231 H THR 220 H THR 220 12.672 2.459 -16.571 2232 HA THR 220 HA THR 220 14.384 1.988 -18.981 2233 HB THR 220 HB THR 220 14.085 -0.102 -17.680 2234 HG1 THR 220 HG1 THR 220 14.028 -0.134 -19.997 2235 1HG2 THR 220 1HG2 THR 220 11.997 0.493 -16.538 2236 2HG2 THR 220 2HG2 THR 220 11.790 -1.023 -17.415 2237 3HG2 THR 220 3HG2 THR 220 11.132 0.475 -18.074 2238 H GLY 221 H GLY 221 12.385 0.952 -20.623 2239 1HA GLY 221 1HA GLY 221 10.546 1.585 -21.938 2240 2HA GLY 221 2HA GLY 221 9.902 2.388 -20.506 2241 1HN SAH 301 1HN SAH 301 -10.604 -0.536 -8.533 2242 2HN SAH 301 2HN SAH 301 -8.962 -0.133 -8.376 2243 HA SAH 301 HA SAH 301 -11.113 1.850 -8.920 2244 1HB SAH 301 1HB SAH 301 -10.453 0.363 -6.591 2245 2HB SAH 301 2HB SAH 301 -9.817 1.989 -6.340 2246 1HG SAH 301 1HG SAH 301 -12.304 1.482 -5.687 2247 2HG SAH 301 2HG SAH 301 -12.600 1.615 -7.421 2248 1H5* SAH 301 1H5* SAH 301 -14.218 3.056 -6.679 2249 2H5* SAH 301 2H5* SAH 301 -14.065 4.699 -6.060 2250 H4* SAH 301 H4* SAH 301 -12.966 4.986 -8.477 2251 H3* SAH 301 H3* SAH 301 -15.428 5.625 -7.116 2252 *HO3 SAH 301 *HO3 SAH 301 -15.293 7.416 -8.538 2253 H2* SAH 301 H2* SAH 301 -16.990 4.826 -8.503 2254 *HO2 SAH 301 *HO2 SAH 301 -15.959 6.776 -9.855 2255 H1* SAH 301 H1* SAH 301 -15.430 3.762 -10.681 2256 H8 SAH 301 H8 SAH 301 -15.353 1.333 -7.966 2257 1HN6 SAH 301 1HN6 SAH 301 -19.448 -1.426 -10.421 2258 2HN6 SAH 301 2HN6 SAH 301 -20.415 -0.755 -9.126 2259 H2 SAH 301 H2 SAH 301 -20.035 3.220 -11.896 2260 1HN SAH 302 1HN SAH 302 10.426 -0.499 8.473 2261 2HN SAH 302 2HN SAH 302 8.782 -0.115 8.284 2262 HA SAH 302 HA SAH 302 10.906 1.884 8.871 2263 1HB SAH 302 1HB SAH 302 10.302 0.390 6.530 2264 2HB SAH 302 2HB SAH 302 9.659 2.010 6.263 2265 1HG SAH 302 1HG SAH 302 12.163 1.521 5.661 2266 2HG SAH 302 2HG SAH 302 12.423 1.661 7.400 2267 1H5* SAH 302 1H5* SAH 302 14.043 3.114 6.688 2268 2H5* SAH 302 2H5* SAH 302 13.890 4.754 6.061 2269 H4* SAH 302 H4* SAH 302 12.740 5.038 8.454 2270 H3* SAH 302 H3* SAH 302 15.223 5.694 7.142 2271 *HO3 SAH 302 *HO3 SAH 302 15.044 7.488 8.557 2272 H2* SAH 302 H2* SAH 302 16.764 4.912 8.563 2273 *HO2 SAH 302 *HO2 SAH 302 15.688 6.856 9.888 2274 H1* SAH 302 H1* SAH 302 15.167 3.840 10.712 2275 H8 SAH 302 H8 SAH 302 15.166 1.403 8.003 2276 1HN6 SAH 302 1HN6 SAH 302 19.233 -1.314 10.550 2277 2HN6 SAH 302 2HN6 SAH 302 20.220 -0.639 9.274 2278 H2 SAH 302 H2 SAH 302 19.751 3.340 12.024 Start of MODEL 15 1 1H MET 1 1H MET 1 -2.743 -9.883 -5.515 2 2H MET 1 2H MET 1 -1.851 -8.921 -6.592 3 3H MET 1 3H MET 1 -1.209 -10.392 -6.035 4 HA MET 1 HA MET 1 -3.361 -9.933 -8.005 5 1HB MET 1 1HB MET 1 -0.691 -11.286 -7.742 6 2HB MET 1 2HB MET 1 -1.828 -11.882 -8.951 7 1HG MET 1 1HG MET 1 -0.690 -10.261 -10.178 8 2HG MET 1 2HG MET 1 -2.049 -9.321 -9.561 9 1HE MET 1 1HE MET 1 -1.485 -7.003 -7.756 10 2HE MET 1 2HE MET 1 -1.652 -7.364 -9.474 11 3HE MET 1 3HE MET 1 -0.272 -6.429 -8.900 12 H PHE 2 H PHE 2 -1.879 -12.997 -6.997 13 HA PHE 2 HA PHE 2 -4.592 -13.912 -6.097 14 1HB PHE 2 1HB PHE 2 -4.078 -16.021 -7.317 15 2HB PHE 2 2HB PHE 2 -4.056 -14.630 -8.401 16 HD1 PHE 2 HD1 PHE 2 -1.989 -17.114 -6.618 17 HD2 PHE 2 HD2 PHE 2 -1.978 -13.806 -9.358 18 HE1 PHE 2 HE1 PHE 2 0.353 -17.639 -7.242 19 HE2 PHE 2 HE2 PHE 2 0.364 -14.332 -9.982 20 HZ PHE 2 HZ PHE 2 1.530 -16.248 -8.925 21 H ASN 3 H ASN 3 -4.578 -15.098 -4.216 22 HA ASN 3 HA ASN 3 -2.053 -16.344 -3.266 23 1HB ASN 3 1HB ASN 3 -2.361 -15.150 -1.069 24 2HB ASN 3 2HB ASN 3 -2.015 -14.051 -2.405 25 1HD2 ASN 3 1HD2 ASN 3 -4.275 -14.763 0.095 26 2HD2 ASN 3 2HD2 ASN 3 -5.497 -13.693 -0.398 27 H ASP 4 H ASP 4 -2.509 -17.767 -1.341 28 HA ASP 4 HA ASP 4 -4.864 -19.375 -1.742 29 1HB ASP 4 1HB ASP 4 -2.511 -19.928 -0.799 30 2HB ASP 4 2HB ASP 4 -3.121 -19.300 0.732 31 H ARG 5 H ARG 5 -6.180 -17.141 -1.460 32 HA ARG 5 HA ARG 5 -7.845 -17.409 0.852 33 1HB ARG 5 1HB ARG 5 -5.419 -16.285 1.476 34 2HB ARG 5 2HB ARG 5 -6.353 -14.862 1.075 35 1HG ARG 5 1HG ARG 5 -6.619 -15.227 3.428 36 2HG ARG 5 2HG ARG 5 -8.141 -15.661 2.648 37 1HD ARG 5 1HD ARG 5 -7.169 -18.039 2.526 38 2HD ARG 5 2HD ARG 5 -6.005 -17.490 3.743 39 HE ARG 5 HE ARG 5 -8.552 -16.622 4.603 40 1HH1 ARG 5 1HH1 ARG 5 -6.897 -19.623 3.991 41 2HH1 ARG 5 2HH1 ARG 5 -7.813 -20.495 5.172 42 1HH2 ARG 5 1HH2 ARG 5 -9.725 -17.774 6.128 43 2HH2 ARG 5 2HH2 ARG 5 -9.402 -19.458 6.374 44 H VAL 6 H VAL 6 -6.487 -15.204 -1.577 45 HA VAL 6 HA VAL 6 -9.208 -14.492 -2.488 46 HB VAL 6 HB VAL 6 -7.251 -12.562 -1.181 47 1HG1 VAL 6 1HG1 VAL 6 -9.693 -11.987 -2.882 48 2HG1 VAL 6 2HG1 VAL 6 -8.042 -11.434 -3.159 49 3HG1 VAL 6 3HG1 VAL 6 -8.967 -10.801 -1.798 50 1HG2 VAL 6 1HG2 VAL 6 -10.009 -13.585 -0.571 51 2HG2 VAL 6 2HG2 VAL 6 -9.527 -11.986 -0.008 52 3HG2 VAL 6 3HG2 VAL 6 -8.623 -13.410 0.507 53 H ILE 7 H ILE 7 -9.016 -12.982 -4.441 54 HA ILE 7 HA ILE 7 -6.353 -13.047 -5.773 55 HB ILE 7 HB ILE 7 -7.498 -15.110 -6.434 56 1HG1 ILE 7 1HG1 ILE 7 -7.832 -13.095 -8.669 57 2HG1 ILE 7 2HG1 ILE 7 -6.267 -13.732 -8.165 58 1HG2 ILE 7 1HG2 ILE 7 -9.776 -13.286 -7.257 59 2HG2 ILE 7 2HG2 ILE 7 -9.788 -14.366 -5.864 60 3HG2 ILE 7 3HG2 ILE 7 -9.717 -15.032 -7.495 61 1HD1 ILE 7 1HD1 ILE 7 -8.580 -15.518 -8.950 62 2HD1 ILE 7 2HD1 ILE 7 -6.887 -15.969 -8.753 63 3HD1 ILE 7 3HD1 ILE 7 -7.377 -14.954 -10.110 64 H VAL 8 H VAL 8 -6.118 -11.312 -7.274 65 HA VAL 8 HA VAL 8 -8.114 -9.161 -6.967 66 HB VAL 8 HB VAL 8 -5.415 -9.335 -8.357 67 1HG1 VAL 8 1HG1 VAL 8 -7.466 -7.364 -8.522 68 2HG1 VAL 8 2HG1 VAL 8 -5.822 -7.270 -9.155 69 3HG1 VAL 8 3HG1 VAL 8 -6.172 -6.692 -7.527 70 1HG2 VAL 8 1HG2 VAL 8 -5.485 -7.659 -6.029 71 2HG2 VAL 8 2HG2 VAL 8 -4.527 -9.114 -6.301 72 3HG2 VAL 8 3HG2 VAL 8 -6.143 -9.240 -5.605 73 H LYS 9 H LYS 9 -9.863 -9.515 -8.303 74 HA LYS 9 HA LYS 9 -9.301 -9.790 -11.227 75 1HB LYS 9 1HB LYS 9 -11.668 -10.835 -9.675 76 2HB LYS 9 2HB LYS 9 -11.323 -11.122 -11.368 77 1HG LYS 9 1HG LYS 9 -9.025 -11.836 -9.786 78 2HG LYS 9 2HG LYS 9 -10.451 -12.646 -9.150 79 1HD LYS 9 1HD LYS 9 -10.587 -12.773 -11.984 80 2HD LYS 9 2HD LYS 9 -8.964 -13.272 -11.512 81 1HE LYS 9 1HE LYS 9 -10.199 -14.730 -9.719 82 2HE LYS 9 2HE LYS 9 -11.611 -14.511 -10.770 83 1HZ LYS 9 1HZ LYS 9 -8.931 -15.407 -11.703 84 2HZ LYS 9 2HZ LYS 9 -10.346 -15.304 -12.637 85 3HZ LYS 9 3HZ LYS 9 -10.231 -16.455 -11.393 86 H LYS 10 H LYS 10 -11.453 -6.960 -11.756 87 HA LYS 10 HA LYS 10 -10.553 -7.595 -13.794 88 1HB LYS 10 1HB LYS 10 -8.286 -8.717 -12.123 89 2HB LYS 10 2HB LYS 10 -8.213 -8.038 -13.732 90 1HG LYS 10 1HG LYS 10 -8.008 -5.954 -12.952 91 2HG LYS 10 2HG LYS 10 -9.377 -6.154 -11.867 92 1HD LYS 10 1HD LYS 10 -7.561 -5.819 -10.399 93 2HD LYS 10 2HD LYS 10 -7.754 -7.572 -10.423 94 1HE LYS 10 1HE LYS 10 -5.991 -6.476 -12.542 95 2HE LYS 10 2HE LYS 10 -5.367 -6.345 -10.886 96 1HZ LYS 10 1HZ LYS 10 -4.779 -8.497 -11.565 97 2HZ LYS 10 2HZ LYS 10 -6.270 -8.770 -12.331 98 3HZ LYS 10 3HZ LYS 10 -6.181 -8.732 -10.636 99 H SER 11 H SER 11 -12.471 -9.395 -13.088 100 HA SER 11 HA SER 11 -11.274 -12.071 -13.662 101 1HB SER 11 1HB SER 11 -13.346 -11.118 -11.958 102 2HB SER 11 2HB SER 11 -14.119 -12.104 -13.198 103 HG SER 11 HG SER 11 -13.000 -13.826 -12.572 104 HA PRO 12 HA PRO 12 -14.268 -11.530 -17.224 105 1HB PRO 12 1HB PRO 12 -16.249 -9.693 -17.208 106 2HB PRO 12 2HB PRO 12 -16.368 -11.164 -16.222 107 1HG PRO 12 1HG PRO 12 -15.756 -8.378 -15.410 108 2HG PRO 12 2HG PRO 12 -16.602 -9.651 -14.524 109 1HD PRO 12 1HD PRO 12 -13.901 -8.878 -14.228 110 2HD PRO 12 2HD PRO 12 -14.697 -10.285 -13.508 111 H LEU 13 H LEU 13 -11.943 -9.731 -16.685 112 HA LEU 13 HA LEU 13 -10.758 -7.998 -17.769 113 1HB LEU 13 1HB LEU 13 -12.539 -9.312 -19.658 114 2HB LEU 13 2HB LEU 13 -12.317 -7.618 -20.096 115 HG LEU 13 HG LEU 13 -9.941 -9.305 -19.343 116 1HD1 LEU 13 1HD1 LEU 13 -10.820 -9.010 -22.202 117 2HD1 LEU 13 2HD1 LEU 13 -11.467 -10.325 -21.221 118 3HD1 LEU 13 3HD1 LEU 13 -9.728 -10.200 -21.493 119 1HD2 LEU 13 1HD2 LEU 13 -10.486 -6.778 -20.887 120 2HD2 LEU 13 2HD2 LEU 13 -8.995 -7.681 -21.156 121 3HD2 LEU 13 3HD2 LEU 13 -9.360 -7.039 -19.555 122 H GLY 14 H GLY 14 -12.449 -7.056 -15.821 123 1HA GLY 14 1HA GLY 14 -13.790 -4.703 -17.094 124 2HA GLY 14 2HA GLY 14 -14.352 -5.445 -15.600 125 H GLY 15 H GLY 15 -13.855 -4.198 -13.885 126 1HA GLY 15 1HA GLY 15 -11.504 -2.401 -14.055 127 2HA GLY 15 2HA GLY 15 -12.817 -2.272 -12.891 128 H TYR 16 H TYR 16 -11.339 -2.236 -11.100 129 HA TYR 16 HA TYR 16 -9.838 -4.795 -10.640 130 1HB TYR 16 1HB TYR 16 -9.362 -1.892 -10.182 131 2HB TYR 16 2HB TYR 16 -8.789 -2.967 -8.907 132 HD1 TYR 16 HD1 TYR 16 -8.922 -3.061 -12.664 133 HD2 TYR 16 HD2 TYR 16 -6.554 -3.556 -9.115 134 HE1 TYR 16 HE1 TYR 16 -6.961 -3.666 -14.057 135 HE2 TYR 16 HE2 TYR 16 -4.593 -4.161 -10.507 136 HH TYR 16 HH TYR 16 -4.804 -5.037 -13.696 137 H GLY 17 H GLY 17 -11.091 -6.065 -9.291 138 1HA GLY 17 1HA GLY 17 -12.065 -4.815 -6.765 139 2HA GLY 17 2HA GLY 17 -13.166 -5.823 -7.706 140 H VAL 18 H VAL 18 -12.736 -6.732 -5.185 141 HA VAL 18 HA VAL 18 -10.480 -8.680 -5.313 142 HB VAL 18 HB VAL 18 -12.428 -7.862 -3.128 143 1HG1 VAL 18 1HG1 VAL 18 -11.031 -9.121 -1.612 144 2HG1 VAL 18 2HG1 VAL 18 -9.876 -9.475 -2.896 145 3HG1 VAL 18 3HG1 VAL 18 -11.485 -10.195 -2.936 146 1HG2 VAL 18 1HG2 VAL 18 -9.593 -7.255 -2.777 147 2HG2 VAL 18 2HG2 VAL 18 -10.992 -6.193 -2.618 148 3HG2 VAL 18 3HG2 VAL 18 -10.271 -6.470 -4.203 149 H PHE 19 H PHE 19 -10.885 -10.813 -5.771 150 HA PHE 19 HA PHE 19 -13.747 -11.682 -5.896 151 1HB PHE 19 1HB PHE 19 -11.288 -12.091 -7.480 152 2HB PHE 19 2HB PHE 19 -12.224 -13.563 -7.221 153 HD1 PHE 19 HD1 PHE 19 -13.326 -10.003 -7.590 154 HD2 PHE 19 HD2 PHE 19 -13.387 -13.976 -9.223 155 HE1 PHE 19 HE1 PHE 19 -14.942 -9.267 -9.321 156 HE2 PHE 19 HE2 PHE 19 -15.003 -13.240 -10.954 157 HZ PHE 19 HZ PHE 19 -15.779 -10.884 -11.005 158 H ALA 20 H ALA 20 -14.404 -13.317 -4.552 159 HA ALA 20 HA ALA 20 -12.407 -14.461 -2.675 160 1HB ALA 20 1HB ALA 20 -15.222 -15.181 -2.331 161 2HB ALA 20 2HB ALA 20 -15.005 -13.438 -2.493 162 3HB ALA 20 3HB ALA 20 -14.152 -14.319 -1.225 163 H ARG 21 H ARG 21 -11.461 -16.050 -4.139 164 HA ARG 21 HA ARG 21 -12.896 -17.966 -5.681 165 1HB ARG 21 1HB ARG 21 -10.253 -17.342 -4.964 166 2HB ARG 21 2HB ARG 21 -10.489 -18.984 -4.366 167 1HG ARG 21 1HG ARG 21 -10.796 -19.856 -6.479 168 2HG ARG 21 2HG ARG 21 -11.490 -18.362 -7.109 169 1HD ARG 21 1HD ARG 21 -9.084 -17.383 -6.753 170 2HD ARG 21 2HD ARG 21 -8.587 -19.086 -6.740 171 HE ARG 21 HE ARG 21 -9.614 -17.616 -9.052 172 1HH1 ARG 21 1HH1 ARG 21 -9.288 -20.728 -7.525 173 2HH1 ARG 21 2HH1 ARG 21 -9.421 -21.596 -9.015 174 1HH2 ARG 21 1HH2 ARG 21 -9.785 -18.765 -10.973 175 2HH2 ARG 21 2HH2 ARG 21 -9.701 -20.495 -10.954 176 H LYS 22 H LYS 22 -12.272 -17.710 -2.252 177 HA LYS 22 HA LYS 22 -13.125 -20.460 -1.636 178 1HB LYS 22 1HB LYS 22 -12.656 -18.030 0.145 179 2HB LYS 22 2HB LYS 22 -12.647 -19.715 0.655 180 1HG LYS 22 1HG LYS 22 -10.762 -19.983 -1.143 181 2HG LYS 22 2HG LYS 22 -10.606 -18.235 -0.973 182 1HD LYS 22 1HD LYS 22 -9.078 -19.205 0.600 183 2HD LYS 22 2HD LYS 22 -10.448 -18.616 1.539 184 1HE LYS 22 1HE LYS 22 -11.146 -20.739 2.091 185 2HE LYS 22 2HE LYS 22 -10.622 -21.421 0.540 186 1HZ LYS 22 1HZ LYS 22 -9.136 -22.123 2.310 187 2HZ LYS 22 2HZ LYS 22 -8.848 -20.508 2.748 188 3HZ LYS 22 3HZ LYS 22 -8.315 -21.088 1.244 189 H SER 23 H SER 23 -16.389 -19.535 -0.151 190 HA SER 23 HA SER 23 -13.884 -21.130 0.199 191 1HB SER 23 1HB SER 23 -16.370 -21.852 1.627 192 2HB SER 23 2HB SER 23 -16.530 -21.827 -0.129 193 HG SER 23 HG SER 23 -15.668 -23.804 1.112 194 H PHE 24 H PHE 24 -15.941 -18.751 1.688 195 HA PHE 24 HA PHE 24 -14.247 -18.866 4.158 196 1HB PHE 24 1HB PHE 24 -15.559 -16.700 2.528 197 2HB PHE 24 2HB PHE 24 -15.112 -16.386 4.193 198 HD1 PHE 24 HD1 PHE 24 -12.605 -17.725 4.603 199 HD2 PHE 24 HD2 PHE 24 -14.033 -15.710 1.088 200 HE1 PHE 24 HE1 PHE 24 -10.265 -17.320 3.881 201 HE2 PHE 24 HE2 PHE 24 -11.696 -15.305 0.369 202 HZ PHE 24 HZ PHE 24 -9.814 -16.109 1.764 203 H GLU 25 H GLU 25 -15.331 -18.609 6.189 204 HA GLU 25 HA GLU 25 -18.183 -19.409 6.172 205 1HB GLU 25 1HB GLU 25 -15.936 -19.974 7.715 206 2HB GLU 25 2HB GLU 25 -16.856 -18.873 8.739 207 1HG GLU 25 1HG GLU 25 -18.839 -20.279 8.537 208 2HG GLU 25 2HG GLU 25 -18.002 -21.342 7.407 209 H LYS 26 H LYS 26 -18.907 -18.155 8.637 210 HA LYS 26 HA LYS 26 -19.591 -15.483 7.653 211 1HB LYS 26 1HB LYS 26 -21.089 -17.047 8.945 212 2HB LYS 26 2HB LYS 26 -20.054 -16.804 10.351 213 1HG LYS 26 1HG LYS 26 -20.512 -14.375 10.263 214 2HG LYS 26 2HG LYS 26 -21.555 -14.626 8.863 215 1HD LYS 26 1HD LYS 26 -23.191 -15.736 10.116 216 2HD LYS 26 2HD LYS 26 -22.057 -16.166 11.397 217 1HE LYS 26 1HE LYS 26 -22.184 -14.065 12.395 218 2HE LYS 26 2HE LYS 26 -22.588 -13.255 10.870 219 1HZ LYS 26 1HZ LYS 26 -24.719 -14.436 10.879 220 2HZ LYS 26 2HZ LYS 26 -24.555 -13.465 12.262 221 3HZ LYS 26 3HZ LYS 26 -24.332 -15.145 12.373 222 H GLY 27 H GLY 27 -16.833 -16.672 9.148 223 1HA GLY 27 1HA GLY 27 -15.999 -13.970 9.916 224 2HA GLY 27 2HA GLY 27 -16.119 -15.101 11.264 225 H GLU 28 H GLU 28 -14.716 -14.942 7.969 226 HA GLU 28 HA GLU 28 -12.377 -16.494 9.032 227 1HB GLU 28 1HB GLU 28 -13.986 -16.541 6.506 228 2HB GLU 28 2HB GLU 28 -12.260 -16.879 6.368 229 1HG GLU 28 1HG GLU 28 -12.699 -18.477 8.414 230 2HG GLU 28 2HG GLU 28 -14.371 -18.408 7.861 231 H LEU 29 H LEU 29 -10.570 -15.236 9.177 232 HA LEU 29 HA LEU 29 -10.302 -12.574 8.300 233 1HB LEU 29 1HB LEU 29 -8.873 -13.773 9.949 234 2HB LEU 29 2HB LEU 29 -8.172 -14.720 8.637 235 HG LEU 29 HG LEU 29 -7.522 -12.485 7.568 236 1HD1 LEU 29 1HD1 LEU 29 -7.863 -11.418 10.372 237 2HD1 LEU 29 2HD1 LEU 29 -9.136 -11.246 9.164 238 3HD1 LEU 29 3HD1 LEU 29 -7.554 -10.519 8.886 239 1HD2 LEU 29 1HD2 LEU 29 -5.904 -13.962 8.715 240 2HD2 LEU 29 2HD2 LEU 29 -6.313 -13.208 10.256 241 3HD2 LEU 29 3HD2 LEU 29 -5.521 -12.263 8.995 242 H VAL 30 H VAL 30 -10.043 -11.714 6.287 243 HA VAL 30 HA VAL 30 -9.367 -13.547 4.027 244 HB VAL 30 HB VAL 30 -10.547 -10.743 4.124 245 1HG1 VAL 30 1HG1 VAL 30 -11.167 -11.158 1.799 246 2HG1 VAL 30 2HG1 VAL 30 -10.468 -12.776 1.876 247 3HG1 VAL 30 3HG1 VAL 30 -9.425 -11.358 1.984 248 1HG2 VAL 30 1HG2 VAL 30 -12.086 -12.255 5.182 249 2HG2 VAL 30 2HG2 VAL 30 -11.817 -13.485 3.948 250 3HG2 VAL 30 3HG2 VAL 30 -12.674 -11.999 3.539 251 H GLU 31 H GLU 31 -7.029 -13.326 4.909 252 HA GLU 31 HA GLU 31 -4.857 -12.452 4.630 253 1HB GLU 31 1HB GLU 31 -5.723 -12.580 2.263 254 2HB GLU 31 2HB GLU 31 -6.244 -10.903 2.411 255 1HG GLU 31 1HG GLU 31 -4.053 -10.990 1.327 256 2HG GLU 31 2HG GLU 31 -3.899 -10.245 2.917 257 H GLU 32 H GLU 32 -3.595 -10.391 4.832 258 HA GLU 32 HA GLU 32 -5.083 -7.951 5.545 259 1HB GLU 32 1HB GLU 32 -4.168 -8.008 7.882 260 2HB GLU 32 2HB GLU 32 -5.277 -9.341 7.559 261 1HG GLU 32 1HG GLU 32 -3.547 -10.918 7.427 262 2HG GLU 32 2HG GLU 32 -2.327 -9.692 7.083 263 H CYS 33 H CYS 33 -3.620 -6.128 5.841 264 HA CYS 33 HA CYS 33 -0.732 -6.630 5.331 265 1HB CYS 33 1HB CYS 33 -2.755 -5.686 3.439 266 2HB CYS 33 2HB CYS 33 -1.422 -4.543 3.598 267 HG CYS 33 HG CYS 33 -0.933 -7.555 2.891 268 H LEU 34 H LEU 34 -0.041 -3.948 4.829 269 HA LEU 34 HA LEU 34 -0.545 -2.753 7.503 270 1HB LEU 34 1HB LEU 34 1.492 -2.541 5.316 271 2HB LEU 34 2HB LEU 34 1.316 -1.192 6.436 272 HG LEU 34 HG LEU 34 3.011 -2.824 7.214 273 1HD1 LEU 34 1HD1 LEU 34 2.437 -2.354 9.345 274 2HD1 LEU 34 2HD1 LEU 34 0.957 -3.306 9.230 275 3HD1 LEU 34 3HD1 LEU 34 0.975 -1.635 8.669 276 1HD2 LEU 34 1HD2 LEU 34 1.553 -4.771 6.191 277 2HD2 LEU 34 2HD2 LEU 34 0.812 -4.776 7.792 278 3HD2 LEU 34 3HD2 LEU 34 2.544 -5.068 7.619 279 H CYS 35 H CYS 35 -0.458 -0.174 7.280 280 HA CYS 35 HA CYS 35 -2.038 0.796 4.966 281 1HB CYS 35 1HB CYS 35 -2.975 0.381 7.757 282 2HB CYS 35 2HB CYS 35 -3.430 1.917 7.026 283 HG CYS 35 HG CYS 35 -5.242 0.556 5.991 284 H ILE 36 H ILE 36 -2.412 3.324 5.423 285 HA ILE 36 HA ILE 36 0.198 4.352 6.493 286 HB ILE 36 HB ILE 36 -1.667 5.538 4.406 287 1HG1 ILE 36 1HG1 ILE 36 0.839 3.841 4.115 288 2HG1 ILE 36 2HG1 ILE 36 -0.788 3.425 3.580 289 1HG2 ILE 36 1HG2 ILE 36 -0.211 7.175 5.535 290 2HG2 ILE 36 2HG2 ILE 36 0.314 6.933 3.869 291 3HG2 ILE 36 3HG2 ILE 36 1.197 6.172 5.191 292 1HD1 ILE 36 1HD1 ILE 36 1.208 4.830 2.122 293 2HD1 ILE 36 2HD1 ILE 36 -0.082 5.981 2.472 294 3HD1 ILE 36 3HD1 ILE 36 -0.447 4.480 1.622 295 H VAL 37 H VAL 37 0.122 5.980 8.036 296 HA VAL 37 HA VAL 37 -2.611 6.905 8.863 297 HB VAL 37 HB VAL 37 -0.075 6.515 10.499 298 1HG1 VAL 37 1HG1 VAL 37 -1.548 6.793 12.427 299 2HG1 VAL 37 2HG1 VAL 37 -2.948 6.960 11.366 300 3HG1 VAL 37 3HG1 VAL 37 -1.695 8.202 11.375 301 1HG2 VAL 37 1HG2 VAL 37 -1.907 4.591 9.472 302 2HG2 VAL 37 2HG2 VAL 37 -2.225 4.743 11.200 303 3HG2 VAL 37 3HG2 VAL 37 -0.607 4.331 10.635 304 H ARG 38 H ARG 38 -2.845 9.019 8.225 305 HA ARG 38 HA ARG 38 -0.672 10.938 8.900 306 1HB ARG 38 1HB ARG 38 -0.322 10.145 6.576 307 2HB ARG 38 2HB ARG 38 -1.977 10.601 6.172 308 1HG ARG 38 1HG ARG 38 -0.445 12.363 5.446 309 2HG ARG 38 2HG ARG 38 -1.438 12.957 6.775 310 1HD ARG 38 1HD ARG 38 0.478 13.478 7.875 311 2HD ARG 38 2HD ARG 38 0.833 11.743 7.970 312 HE ARG 38 HE ARG 38 1.474 12.630 5.341 313 1HH1 ARG 38 1HH1 ARG 38 2.535 13.044 8.631 314 2HH1 ARG 38 2HH1 ARG 38 4.175 13.356 8.179 315 1HH2 ARG 38 1HH2 ARG 38 3.610 13.037 4.780 316 2HH2 ARG 38 2HH2 ARG 38 4.781 13.353 6.016 317 H HIS 39 H HIS 39 -1.471 13.186 8.899 318 HA HIS 39 HA HIS 39 -4.140 13.433 9.980 319 1HB HIS 39 1HB HIS 39 -1.984 15.365 9.069 320 2HB HIS 39 2HB HIS 39 -3.480 15.906 9.830 321 HD1 HIS 39 HD1 HIS 39 -0.920 16.472 11.339 322 HD2 HIS 39 HD2 HIS 39 -3.053 12.923 11.818 323 HE1 HIS 39 HE1 HIS 39 -0.252 15.534 13.595 324 H ASN 40 H ASN 40 -5.366 15.558 8.961 325 HA ASN 40 HA ASN 40 -6.257 14.667 6.297 326 1HB ASN 40 1HB ASN 40 -7.131 16.938 8.125 327 2HB ASN 40 2HB ASN 40 -8.039 16.321 6.746 328 1HD2 ASN 40 1HD2 ASN 40 -8.266 16.221 9.952 329 2HD2 ASN 40 2HD2 ASN 40 -8.768 14.620 10.207 330 H ASP 41 H ASP 41 -6.991 17.682 5.831 331 HA ASP 41 HA ASP 41 -6.079 19.498 4.644 332 1HB ASP 41 1HB ASP 41 -4.522 19.103 6.806 333 2HB ASP 41 2HB ASP 41 -3.330 18.748 5.556 334 H ASP 42 H ASP 42 -3.139 19.251 3.672 335 HA ASP 42 HA ASP 42 -3.515 18.531 1.030 336 1HB ASP 42 1HB ASP 42 -1.171 18.305 2.927 337 2HB ASP 42 2HB ASP 42 -0.992 17.927 1.214 338 H TRP 43 H TRP 43 -3.145 16.343 3.763 339 HA TRP 43 HA TRP 43 -2.465 13.949 2.361 340 1HB TRP 43 1HB TRP 43 -2.369 14.172 4.791 341 2HB TRP 43 2HB TRP 43 -4.098 14.508 4.867 342 HD1 TRP 43 HD1 TRP 43 -5.569 12.501 5.364 343 HE1 TRP 43 HE1 TRP 43 -5.335 9.942 5.171 344 HE3 TRP 43 HE3 TRP 43 -0.968 12.198 3.170 345 HZ2 TRP 43 HZ2 TRP 43 -3.447 8.022 4.212 346 HZ3 TRP 43 HZ3 TRP 43 0.018 9.989 2.629 347 HH2 TRP 43 HH2 TRP 43 -1.211 7.906 3.150 348 H GLY 44 H GLY 44 -5.697 15.088 3.437 349 1HA GLY 44 1HA GLY 44 -7.199 13.081 2.114 350 2HA GLY 44 2HA GLY 44 -7.824 14.675 2.539 351 H THR 45 H THR 45 -5.870 16.135 0.927 352 HA THR 45 HA THR 45 -7.278 16.131 -1.597 353 HB THR 45 HB THR 45 -4.624 17.344 -0.734 354 HG1 THR 45 HG1 THR 45 -6.275 18.058 0.565 355 1HG2 THR 45 1HG2 THR 45 -5.630 17.179 -3.285 356 2HG2 THR 45 2HG2 THR 45 -4.559 18.459 -2.715 357 3HG2 THR 45 3HG2 THR 45 -6.304 18.712 -2.734 358 H ALA 46 H ALA 46 -3.749 15.659 -1.156 359 HA ALA 46 HA ALA 46 -3.251 14.436 -3.640 360 1HB ALA 46 1HB ALA 46 -1.427 15.144 -2.284 361 2HB ALA 46 2HB ALA 46 -1.307 13.384 -2.269 362 3HB ALA 46 3HB ALA 46 -2.006 14.233 -0.889 363 H LEU 47 H LEU 47 -3.821 12.773 -0.509 364 HA LEU 47 HA LEU 47 -4.198 10.208 -1.933 365 1HB LEU 47 1HB LEU 47 -4.223 11.036 0.994 366 2HB LEU 47 2HB LEU 47 -4.365 9.372 0.440 367 HG LEU 47 HG LEU 47 -2.069 9.640 0.976 368 1HD1 LEU 47 1HD1 LEU 47 -1.106 8.949 -0.978 369 2HD1 LEU 47 2HD1 LEU 47 -1.731 10.321 -1.893 370 3HD1 LEU 47 3HD1 LEU 47 -2.777 8.947 -1.540 371 1HD2 LEU 47 1HD2 LEU 47 -2.421 12.261 0.847 372 2HD2 LEU 47 2HD2 LEU 47 -1.714 12.053 -0.755 373 3HD2 LEU 47 3HD2 LEU 47 -0.813 11.557 0.677 374 H GLU 48 H GLU 48 -6.199 12.050 -2.632 375 HA GLU 48 HA GLU 48 -8.552 11.838 -0.961 376 1HB GLU 48 1HB GLU 48 -9.636 12.757 -3.023 377 2HB GLU 48 2HB GLU 48 -8.169 13.637 -2.592 378 1HG GLU 48 1HG GLU 48 -7.499 13.255 -4.721 379 2HG GLU 48 2HG GLU 48 -7.224 11.592 -4.209 380 H ASP 49 H ASP 49 -6.990 9.495 -2.854 381 HA ASP 49 HA ASP 49 -9.545 7.994 -3.244 382 1HB ASP 49 1HB ASP 49 -7.789 8.830 -5.141 383 2HB ASP 49 2HB ASP 49 -7.059 7.279 -4.728 384 H TYR 50 H TYR 50 -9.541 5.828 -2.564 385 HA TYR 50 HA TYR 50 -8.921 3.982 -1.219 386 1HB TYR 50 1HB TYR 50 -6.127 4.879 -2.018 387 2HB TYR 50 2HB TYR 50 -6.626 3.248 -1.576 388 HD1 TYR 50 HD1 TYR 50 -5.350 4.497 -4.239 389 HD2 TYR 50 HD2 TYR 50 -9.274 3.184 -3.084 390 HE1 TYR 50 HE1 TYR 50 -5.890 4.021 -6.612 391 HE2 TYR 50 HE2 TYR 50 -9.813 2.709 -5.457 392 HH TYR 50 HH TYR 50 -8.019 2.135 -7.671 393 H LEU 51 H LEU 51 -9.262 6.543 0.100 394 HA LEU 51 HA LEU 51 -7.240 6.294 2.305 395 1HB LEU 51 1HB LEU 51 -7.462 8.358 0.623 396 2HB LEU 51 2HB LEU 51 -8.756 8.819 1.729 397 HG LEU 51 HG LEU 51 -7.084 8.486 3.624 398 1HD1 LEU 51 1HD1 LEU 51 -5.185 7.421 2.992 399 2HD1 LEU 51 2HD1 LEU 51 -4.688 8.979 2.331 400 3HD1 LEU 51 3HD1 LEU 51 -5.454 7.783 1.287 401 1HD2 LEU 51 1HD2 LEU 51 -7.673 10.680 2.131 402 2HD2 LEU 51 2HD2 LEU 51 -5.928 10.596 1.890 403 3HD2 LEU 51 3HD2 LEU 51 -6.588 10.717 3.521 404 H PHE 52 H PHE 52 -8.169 5.630 4.191 405 HA PHE 52 HA PHE 52 -11.110 5.952 4.563 406 1HB PHE 52 1HB PHE 52 -8.911 4.254 5.763 407 2HB PHE 52 2HB PHE 52 -10.495 4.361 6.531 408 HD1 PHE 52 HD1 PHE 52 -12.538 3.629 5.291 409 HD2 PHE 52 HD2 PHE 52 -8.582 3.020 3.732 410 HE1 PHE 52 HE1 PHE 52 -13.428 1.966 3.681 411 HE2 PHE 52 HE2 PHE 52 -9.473 1.357 2.123 412 HZ PHE 52 HZ PHE 52 -11.896 0.831 2.097 413 H SER 53 H SER 53 -11.880 7.420 6.054 414 HA SER 53 HA SER 53 -9.898 9.030 7.563 415 1HB SER 53 1HB SER 53 -11.728 10.597 7.733 416 2HB SER 53 2HB SER 53 -11.778 9.942 6.098 417 HG SER 53 HG SER 53 -13.327 8.407 6.909 418 H ARG 54 H ARG 54 -9.563 8.710 9.709 419 HA ARG 54 HA ARG 54 -11.477 6.979 11.202 420 1HB ARG 54 1HB ARG 54 -9.137 6.233 11.016 421 2HB ARG 54 2HB ARG 54 -8.569 7.784 11.626 422 1HG ARG 54 1HG ARG 54 -8.530 6.062 13.393 423 2HG ARG 54 2HG ARG 54 -9.669 7.342 13.790 424 1HD ARG 54 1HD ARG 54 -11.463 5.831 12.687 425 2HD ARG 54 2HD ARG 54 -10.257 4.539 12.817 426 HE ARG 54 HE ARG 54 -11.668 5.805 15.047 427 1HH1 ARG 54 1HH1 ARG 54 -8.776 4.160 14.025 428 2HH1 ARG 54 2HH1 ARG 54 -8.402 3.595 15.616 429 1HH2 ARG 54 1HH2 ARG 54 -11.162 5.060 17.104 430 2HH2 ARG 54 2HH2 ARG 54 -9.742 4.099 17.348 431 H LYS 55 H LYS 55 -11.625 7.647 13.631 432 HA LYS 55 HA LYS 55 -12.419 10.454 13.757 433 1HB LYS 55 1HB LYS 55 -12.365 8.074 15.634 434 2HB LYS 55 2HB LYS 55 -12.896 9.662 16.187 435 1HG LYS 55 1HG LYS 55 -14.227 9.231 13.741 436 2HG LYS 55 2HG LYS 55 -14.342 7.704 14.618 437 1HD LYS 55 1HD LYS 55 -14.831 10.190 16.184 438 2HD LYS 55 2HD LYS 55 -16.073 9.727 15.020 439 1HE LYS 55 1HE LYS 55 -16.822 8.146 16.460 440 2HE LYS 55 2HE LYS 55 -15.226 7.372 16.442 441 1HZ LYS 55 1HZ LYS 55 -15.926 9.780 18.044 442 2HZ LYS 55 2HZ LYS 55 -14.452 8.937 18.079 443 3HZ LYS 55 3HZ LYS 55 -15.865 8.202 18.669 444 H ASN 56 H ASN 56 -10.272 11.391 13.396 445 HA ASN 56 HA ASN 56 -8.275 11.046 15.554 446 1HB ASN 56 1HB ASN 56 -8.285 13.506 15.931 447 2HB ASN 56 2HB ASN 56 -9.603 13.662 14.772 448 1HD2 ASN 56 1HD2 ASN 56 -11.624 13.739 15.757 449 2HD2 ASN 56 2HD2 ASN 56 -12.023 12.998 17.232 450 H MET 57 H MET 57 -8.690 10.760 12.454 451 HA MET 57 HA MET 57 -6.937 12.680 11.200 452 1HB MET 57 1HB MET 57 -4.935 11.212 11.075 453 2HB MET 57 2HB MET 57 -5.344 11.576 12.751 454 1HG MET 57 1HG MET 57 -6.851 9.316 12.233 455 2HG MET 57 2HG MET 57 -5.363 9.005 11.341 456 1HE MET 57 1HE MET 57 -2.665 9.743 14.092 457 2HE MET 57 2HE MET 57 -3.532 11.052 13.290 458 3HE MET 57 3HE MET 57 -3.022 9.638 12.368 459 H SER 58 H SER 58 -5.727 10.976 9.299 460 HA SER 58 HA SER 58 -7.976 9.375 8.157 461 1HB SER 58 1HB SER 58 -6.526 11.764 7.003 462 2HB SER 58 2HB SER 58 -7.286 10.579 5.942 463 HG SER 58 HG SER 58 -9.237 10.940 7.112 464 H ALA 59 H ALA 59 -7.104 7.383 7.753 465 HA ALA 59 HA ALA 59 -4.199 7.218 7.047 466 1HB ALA 59 1HB ALA 59 -4.948 4.691 7.688 467 2HB ALA 59 2HB ALA 59 -6.172 5.593 8.583 468 3HB ALA 59 3HB ALA 59 -4.460 5.871 8.904 469 H MET 60 H MET 60 -3.585 5.790 5.314 470 HA MET 60 HA MET 60 -5.639 5.536 3.189 471 1HB MET 60 1HB MET 60 -3.070 6.383 3.207 472 2HB MET 60 2HB MET 60 -2.796 4.676 2.866 473 1HG MET 60 1HG MET 60 -3.689 4.823 0.779 474 2HG MET 60 2HG MET 60 -4.976 5.908 1.304 475 1HE MET 60 1HE MET 60 -2.006 6.709 -1.447 476 2HE MET 60 2HE MET 60 -3.696 7.191 -1.596 477 3HE MET 60 3HE MET 60 -3.288 5.550 -1.095 478 H ALA 61 H ALA 61 -5.244 3.403 1.808 479 HA ALA 61 HA ALA 61 -5.675 1.126 3.627 480 1HB ALA 61 1HB ALA 61 -5.436 0.676 0.714 481 2HB ALA 61 2HB ALA 61 -6.597 1.931 1.146 482 3HB ALA 61 3HB ALA 61 -6.781 0.299 1.792 483 H LEU 62 H LEU 62 -4.469 -0.762 1.615 484 HA LEU 62 HA LEU 62 -1.916 -1.138 2.815 485 1HB LEU 62 1HB LEU 62 -1.005 -0.421 0.234 486 2HB LEU 62 2HB LEU 62 -2.083 0.882 0.736 487 HG LEU 62 HG LEU 62 -0.782 0.695 3.015 488 1HD1 LEU 62 1HD1 LEU 62 0.479 -1.328 1.650 489 2HD1 LEU 62 2HD1 LEU 62 1.151 -0.489 3.048 490 3HD1 LEU 62 3HD1 LEU 62 1.594 0.019 1.418 491 1HD2 LEU 62 1HD2 LEU 62 -0.773 2.591 1.315 492 2HD2 LEU 62 2HD2 LEU 62 0.671 1.849 0.624 493 3HD2 LEU 62 3HD2 LEU 62 0.691 2.440 2.286 494 H GLY 63 H GLY 63 -3.314 -3.178 2.572 495 1HA GLY 63 1HA GLY 63 -2.225 -4.795 0.408 496 2HA GLY 63 2HA GLY 63 -3.372 -5.345 1.630 497 H PHE 64 H PHE 64 -5.391 -5.764 0.891 498 HA PHE 64 HA PHE 64 -6.153 -4.873 -1.831 499 1HB PHE 64 1HB PHE 64 -7.340 -6.754 0.242 500 2HB PHE 64 2HB PHE 64 -8.045 -6.492 -1.353 501 HD1 PHE 64 HD1 PHE 64 -5.993 -6.465 -3.256 502 HD2 PHE 64 HD2 PHE 64 -6.137 -8.738 0.386 503 HE1 PHE 64 HE1 PHE 64 -4.414 -8.115 -4.223 504 HE2 PHE 64 HE2 PHE 64 -4.558 -10.388 -0.581 505 HZ PHE 64 HZ PHE 64 -3.697 -10.077 -2.886 506 H GLY 65 H GLY 65 -6.070 -2.880 0.374 507 1HA GLY 65 1HA GLY 65 -8.908 -2.374 0.995 508 2HA GLY 65 2HA GLY 65 -7.541 -1.469 1.621 509 H ALA 66 H ALA 66 -6.495 -1.323 -1.267 510 HA ALA 66 HA ALA 66 -7.932 1.181 -1.894 511 1HB ALA 66 1HB ALA 66 -5.521 1.205 -1.859 512 2HB ALA 66 2HB ALA 66 -5.997 1.330 -3.553 513 3HB ALA 66 3HB ALA 66 -5.434 -0.212 -2.907 514 H ILE 67 H ILE 67 -7.842 -2.091 -3.076 515 HA ILE 67 HA ILE 67 -8.904 -1.269 -5.728 516 HB ILE 67 HB ILE 67 -8.820 -3.853 -6.057 517 1HG1 ILE 67 1HG1 ILE 67 -7.343 -5.089 -4.620 518 2HG1 ILE 67 2HG1 ILE 67 -6.958 -3.654 -3.678 519 1HG2 ILE 67 1HG2 ILE 67 -7.231 -2.564 -7.208 520 2HG2 ILE 67 2HG2 ILE 67 -6.234 -3.658 -6.249 521 3HG2 ILE 67 3HG2 ILE 67 -6.478 -1.994 -5.719 522 1HD1 ILE 67 1HD1 ILE 67 -9.076 -3.611 -2.658 523 2HD1 ILE 67 2HD1 ILE 67 -8.726 -5.337 -2.748 524 3HD1 ILE 67 3HD1 ILE 67 -9.806 -4.594 -3.928 525 H PHE 68 H PHE 68 -10.223 -1.928 -2.710 526 HA PHE 68 HA PHE 68 -12.437 -3.601 -3.236 527 1HB PHE 68 1HB PHE 68 -11.812 -1.316 -1.390 528 2HB PHE 68 2HB PHE 68 -13.467 -1.920 -1.440 529 HD1 PHE 68 HD1 PHE 68 -10.777 -2.157 0.533 530 HD2 PHE 68 HD2 PHE 68 -13.211 -4.766 -1.857 531 HE1 PHE 68 HE1 PHE 68 -10.123 -4.076 1.962 532 HE2 PHE 68 HE2 PHE 68 -12.558 -6.685 -0.428 533 HZ PHE 68 HZ PHE 68 -11.014 -6.340 1.482 534 H ASN 69 H ASN 69 -14.555 -3.177 -3.989 535 HA ASN 69 HA ASN 69 -14.905 -0.587 -5.469 536 1HB ASN 69 1HB ASN 69 -16.037 -3.362 -6.003 537 2HB ASN 69 2HB ASN 69 -16.254 -1.947 -7.032 538 1HD2 ASN 69 1HD2 ASN 69 -15.079 -4.117 -8.254 539 2HD2 ASN 69 2HD2 ASN 69 -13.413 -3.854 -8.467 540 H HIS 70 H HIS 70 -17.609 -0.760 -5.988 541 HA HIS 70 HA HIS 70 -18.779 -0.657 -3.236 542 1HB HIS 70 1HB HIS 70 -18.814 1.411 -4.596 543 2HB HIS 70 2HB HIS 70 -19.652 0.553 -5.890 544 HD1 HIS 70 HD1 HIS 70 -20.150 1.685 -2.306 545 HD2 HIS 70 HD2 HIS 70 -22.418 0.286 -5.513 546 HE1 HIS 70 HE1 HIS 70 -22.577 1.943 -1.633 547 H SER 71 H SER 71 -20.819 -1.706 -2.870 548 HA SER 71 HA SER 71 -22.072 -3.277 -5.014 549 1HB SER 71 1HB SER 71 -20.488 -4.521 -2.738 550 2HB SER 71 2HB SER 71 -21.591 -5.434 -3.766 551 HG SER 71 HG SER 71 -19.946 -5.605 -5.037 552 H LYS 72 H LYS 72 -24.153 -4.046 -4.369 553 HA LYS 72 HA LYS 72 -25.329 -2.625 -2.097 554 1HB LYS 72 1HB LYS 72 -26.172 -3.357 -4.554 555 2HB LYS 72 2HB LYS 72 -26.790 -4.729 -3.633 556 1HG LYS 72 1HG LYS 72 -28.569 -3.359 -3.240 557 2HG LYS 72 2HG LYS 72 -27.516 -2.647 -2.018 558 1HD LYS 72 1HD LYS 72 -26.695 -1.351 -4.302 559 2HD LYS 72 2HD LYS 72 -28.424 -1.539 -4.592 560 1HE LYS 72 1HE LYS 72 -28.754 0.241 -3.224 561 2HE LYS 72 2HE LYS 72 -28.173 -0.759 -1.879 562 1HZ LYS 72 1HZ LYS 72 -25.911 -0.170 -2.443 563 2HZ LYS 72 2HZ LYS 72 -26.810 1.251 -2.200 564 3HZ LYS 72 3HZ LYS 72 -26.437 0.741 -3.777 565 H ASP 73 H ASP 73 -23.859 -5.703 -2.497 566 HA ASP 73 HA ASP 73 -25.085 -6.600 0.084 567 1HB ASP 73 1HB ASP 73 -24.743 -8.024 -2.561 568 2HB ASP 73 2HB ASP 73 -24.895 -8.936 -1.060 569 HA PRO 74 HA PRO 74 -20.374 -6.647 -0.029 570 1HB PRO 74 1HB PRO 74 -20.773 -5.522 2.691 571 2HB PRO 74 2HB PRO 74 -19.698 -4.967 1.396 572 1HG PRO 74 1HG PRO 74 -21.932 -3.642 2.090 573 2HG PRO 74 2HG PRO 74 -21.317 -3.672 0.432 574 1HD PRO 74 1HD PRO 74 -23.625 -5.124 1.623 575 2HD PRO 74 2HD PRO 74 -23.414 -4.481 -0.019 576 H ASN 75 H ASN 75 -20.081 -8.853 0.268 577 HA ASN 75 HA ASN 75 -21.264 -10.276 2.540 578 1HB ASN 75 1HB ASN 75 -20.075 -12.186 1.464 579 2HB ASN 75 2HB ASN 75 -21.015 -11.263 0.293 580 1HD2 ASN 75 1HD2 ASN 75 -19.193 -12.510 -1.083 581 2HD2 ASN 75 2HD2 ASN 75 -17.791 -11.602 -1.387 582 H ALA 76 H ALA 76 -18.475 -8.370 2.169 583 HA ALA 76 HA ALA 76 -17.324 -9.541 4.650 584 1HB ALA 76 1HB ALA 76 -15.707 -8.957 2.148 585 2HB ALA 76 2HB ALA 76 -16.326 -10.561 2.537 586 3HB ALA 76 3HB ALA 76 -15.156 -9.785 3.604 587 H ARG 77 H ARG 77 -16.076 -8.012 5.843 588 HA ARG 77 HA ARG 77 -16.134 -5.205 4.779 589 1HB ARG 77 1HB ARG 77 -17.604 -6.275 6.860 590 2HB ARG 77 2HB ARG 77 -16.209 -5.604 7.704 591 1HG ARG 77 1HG ARG 77 -16.590 -3.456 6.411 592 2HG ARG 77 2HG ARG 77 -18.111 -4.149 5.849 593 1HD ARG 77 1HD ARG 77 -19.131 -3.769 7.851 594 2HD ARG 77 2HD ARG 77 -17.733 -4.367 8.765 595 HE ARG 77 HE ARG 77 -16.928 -2.142 8.866 596 1HH1 ARG 77 1HH1 ARG 77 -19.333 -2.477 6.371 597 2HH1 ARG 77 2HH1 ARG 77 -19.369 -0.783 6.026 598 1HH2 ARG 77 1HH2 ARG 77 -16.994 0.053 8.400 599 2HH2 ARG 77 2HH2 ARG 77 -18.057 0.640 7.165 600 H HIS 78 H HIS 78 -14.691 -4.089 6.959 601 HA HIS 78 HA HIS 78 -12.086 -5.564 6.849 602 1HB HIS 78 1HB HIS 78 -11.041 -3.307 6.504 603 2HB HIS 78 2HB HIS 78 -12.109 -3.775 5.183 604 HD1 HIS 78 HD1 HIS 78 -13.319 -1.727 4.448 605 HD2 HIS 78 HD2 HIS 78 -13.032 -1.924 8.602 606 HE1 HIS 78 HE1 HIS 78 -14.608 0.257 5.349 607 H GLU 79 H GLU 79 -10.541 -4.728 8.561 608 HA GLU 79 HA GLU 79 -11.904 -3.515 10.921 609 1HB GLU 79 1HB GLU 79 -12.146 -5.956 11.088 610 2HB GLU 79 2HB GLU 79 -10.417 -6.167 10.812 611 1HG GLU 79 1HG GLU 79 -10.793 -6.330 13.191 612 2HG GLU 79 2HG GLU 79 -10.009 -4.780 12.885 613 H LEU 80 H LEU 80 -10.490 -2.266 12.162 614 HA LEU 80 HA LEU 80 -7.678 -2.070 11.163 615 1HB LEU 80 1HB LEU 80 -9.498 -0.212 12.738 616 2HB LEU 80 2HB LEU 80 -7.833 0.175 12.305 617 HG LEU 80 HG LEU 80 -10.037 -0.492 10.328 618 1HD1 LEU 80 1HD1 LEU 80 -9.034 2.120 9.950 619 2HD1 LEU 80 2HD1 LEU 80 -9.323 1.962 11.682 620 3HD1 LEU 80 3HD1 LEU 80 -10.634 1.670 10.539 621 1HD2 LEU 80 1HD2 LEU 80 -8.168 0.621 8.820 622 2HD2 LEU 80 2HD2 LEU 80 -8.079 -1.093 9.226 623 3HD2 LEU 80 3HD2 LEU 80 -7.100 0.075 10.113 624 H THR 81 H THR 81 -5.946 -2.220 12.649 625 HA THR 81 HA THR 81 -6.303 -3.876 14.960 626 HB THR 81 HB THR 81 -3.871 -2.915 15.340 627 HG1 THR 81 HG1 THR 81 -3.089 -1.781 13.657 628 1HG2 THR 81 1HG2 THR 81 -4.244 -4.231 12.670 629 2HG2 THR 81 2HG2 THR 81 -4.755 -5.088 14.124 630 3HG2 THR 81 3HG2 THR 81 -3.072 -4.593 13.937 631 H ALA 82 H ALA 82 -5.177 -0.464 14.878 632 HA ALA 82 HA ALA 82 -6.989 0.346 17.004 633 1HB ALA 82 1HB ALA 82 -5.567 0.171 18.835 634 2HB ALA 82 2HB ALA 82 -4.114 0.336 17.848 635 3HB ALA 82 3HB ALA 82 -4.983 -1.198 17.888 636 H GLY 83 H GLY 83 -3.828 0.994 15.457 637 1HA GLY 83 1HA GLY 83 -4.552 3.897 15.469 638 2HA GLY 83 2HA GLY 83 -2.891 3.310 15.533 639 H LEU 84 H LEU 84 -5.531 2.135 13.453 640 HA LEU 84 HA LEU 84 -5.617 1.941 11.098 641 1HB LEU 84 1HB LEU 84 -4.147 4.580 11.468 642 2HB LEU 84 2HB LEU 84 -4.947 4.073 9.981 643 HG LEU 84 HG LEU 84 -6.442 4.177 12.601 644 1HD1 LEU 84 1HD1 LEU 84 -5.282 6.405 11.297 645 2HD1 LEU 84 2HD1 LEU 84 -6.494 6.429 12.577 646 3HD1 LEU 84 3HD1 LEU 84 -6.997 6.433 10.886 647 1HD2 LEU 84 1HD2 LEU 84 -8.341 3.979 11.281 648 2HD2 LEU 84 2HD2 LEU 84 -7.188 3.062 10.311 649 3HD2 LEU 84 3HD2 LEU 84 -7.572 4.729 9.881 650 H LYS 85 H LYS 85 -3.531 0.424 12.169 651 HA LYS 85 HA LYS 85 -1.199 1.009 10.383 652 1HB LYS 85 1HB LYS 85 -1.538 -0.571 12.956 653 2HB LYS 85 2HB LYS 85 -0.029 -0.503 12.046 654 1HG LYS 85 1HG LYS 85 0.082 1.914 12.324 655 2HG LYS 85 2HG LYS 85 -1.498 1.930 13.105 656 1HD LYS 85 1HD LYS 85 -0.676 0.771 15.018 657 2HD LYS 85 2HD LYS 85 0.819 0.328 14.196 658 1HE LYS 85 1HE LYS 85 1.803 2.299 14.763 659 2HE LYS 85 2HE LYS 85 0.390 3.229 14.229 660 1HZ LYS 85 1HZ LYS 85 -0.733 2.288 16.291 661 2HZ LYS 85 2HZ LYS 85 0.439 3.489 16.551 662 3HZ LYS 85 3HZ LYS 85 0.821 1.857 16.823 663 H ARG 86 H ARG 86 -2.290 -2.034 11.897 664 HA ARG 86 HA ARG 86 -1.853 -3.439 9.338 665 1HB ARG 86 1HB ARG 86 -2.204 -4.059 12.228 666 2HB ARG 86 2HB ARG 86 -2.760 -5.300 11.104 667 1HG ARG 86 1HG ARG 86 -0.600 -5.967 11.014 668 2HG ARG 86 2HG ARG 86 -0.327 -4.532 10.026 669 1HD ARG 86 1HD ARG 86 1.219 -4.086 11.689 670 2HD ARG 86 2HD ARG 86 -0.208 -3.415 12.500 671 HE ARG 86 HE ARG 86 -0.158 -5.270 13.966 672 1HH1 ARG 86 1HH1 ARG 86 1.659 -5.938 11.073 673 2HH1 ARG 86 2HH1 ARG 86 2.228 -7.465 11.651 674 1HH2 ARG 86 1HH2 ARG 86 0.594 -7.257 14.694 675 2HH2 ARG 86 2HH2 ARG 86 1.631 -8.208 13.685 676 H MET 87 H MET 87 -3.496 -3.850 7.925 677 HA MET 87 HA MET 87 -6.302 -3.355 8.806 678 1HB MET 87 1HB MET 87 -4.723 -2.687 6.574 679 2HB MET 87 2HB MET 87 -5.841 -3.915 5.981 680 1HG MET 87 1HG MET 87 -6.765 -1.555 7.631 681 2HG MET 87 2HG MET 87 -6.664 -1.492 5.871 682 1HE MET 87 1HE MET 87 -8.795 -0.628 6.552 683 2HE MET 87 2HE MET 87 -10.182 -1.512 7.187 684 3HE MET 87 3HE MET 87 -9.867 -1.494 5.451 685 H ARG 88 H ARG 88 -7.441 -5.171 9.377 686 HA ARG 88 HA ARG 88 -6.743 -7.761 8.037 687 1HB ARG 88 1HB ARG 88 -8.195 -7.211 10.652 688 2HB ARG 88 2HB ARG 88 -7.647 -8.784 10.074 689 1HG ARG 88 1HG ARG 88 -5.309 -8.003 10.148 690 2HG ARG 88 2HG ARG 88 -5.851 -6.425 10.719 691 1HD ARG 88 1HD ARG 88 -5.461 -7.378 12.785 692 2HD ARG 88 2HD ARG 88 -7.083 -8.050 12.532 693 HE ARG 88 HE ARG 88 -4.962 -9.629 11.280 694 1HH1 ARG 88 1HH1 ARG 88 -6.780 -9.036 14.189 695 2HH1 ARG 88 2HH1 ARG 88 -6.503 -10.624 14.816 696 1HH2 ARG 88 1HH2 ARG 88 -4.617 -11.684 12.115 697 2HH2 ARG 88 2HH2 ARG 88 -5.288 -12.113 13.653 698 H ILE 89 H ILE 89 -8.194 -8.192 6.415 699 HA ILE 89 HA ILE 89 -10.932 -7.085 6.531 700 HB ILE 89 HB ILE 89 -9.423 -8.772 4.499 701 1HG1 ILE 89 1HG1 ILE 89 -10.141 -5.872 4.181 702 2HG1 ILE 89 2HG1 ILE 89 -8.722 -6.311 5.132 703 1HG2 ILE 89 1HG2 ILE 89 -11.375 -8.977 3.400 704 2HG2 ILE 89 2HG2 ILE 89 -11.542 -7.221 3.367 705 3HG2 ILE 89 3HG2 ILE 89 -12.203 -8.145 4.716 706 1HD1 ILE 89 1HD1 ILE 89 -9.196 -7.385 2.343 707 2HD1 ILE 89 2HD1 ILE 89 -7.698 -7.412 3.275 708 3HD1 ILE 89 3HD1 ILE 89 -8.315 -5.886 2.640 709 H PHE 90 H PHE 90 -12.759 -8.327 6.928 710 HA PHE 90 HA PHE 90 -12.354 -11.273 7.329 711 1HB PHE 90 1HB PHE 90 -13.520 -9.104 9.041 712 2HB PHE 90 2HB PHE 90 -14.253 -10.705 9.136 713 HD1 PHE 90 HD1 PHE 90 -12.867 -12.681 9.784 714 HD2 PHE 90 HD2 PHE 90 -11.340 -8.670 9.942 715 HE1 PHE 90 HE1 PHE 90 -11.008 -13.446 11.237 716 HE2 PHE 90 HE2 PHE 90 -9.481 -9.435 11.395 717 HZ PHE 90 HZ PHE 90 -9.315 -11.823 12.042 718 H THR 91 H THR 91 -14.701 -12.309 7.514 719 HA THR 91 HA THR 91 -16.345 -11.182 5.271 720 HB THR 91 HB THR 91 -17.041 -13.730 5.242 721 HG1 THR 91 HG1 THR 91 -15.801 -15.018 6.357 722 1HG2 THR 91 1HG2 THR 91 -14.215 -13.037 4.419 723 2HG2 THR 91 2HG2 THR 91 -15.626 -12.417 3.563 724 3HG2 THR 91 3HG2 THR 91 -15.329 -14.154 3.632 725 H ILE 92 H ILE 92 -17.823 -9.978 6.554 726 HA ILE 92 HA ILE 92 -19.002 -10.649 8.999 727 HB ILE 92 HB ILE 92 -20.866 -9.194 8.163 728 1HG1 ILE 92 1HG1 ILE 92 -19.386 -9.466 5.527 729 2HG1 ILE 92 2HG1 ILE 92 -20.990 -10.107 5.881 730 1HG2 ILE 92 1HG2 ILE 92 -18.581 -8.317 8.898 731 2HG2 ILE 92 2HG2 ILE 92 -19.522 -7.237 7.869 732 3HG2 ILE 92 3HG2 ILE 92 -18.191 -8.171 7.185 733 1HD1 ILE 92 1HD1 ILE 92 -21.675 -8.128 4.970 734 2HD1 ILE 92 2HD1 ILE 92 -20.147 -7.319 5.321 735 3HD1 ILE 92 3HD1 ILE 92 -21.352 -7.517 6.593 736 H LYS 93 H LYS 93 -19.881 -11.808 5.753 737 HA LYS 93 HA LYS 93 -21.687 -13.802 7.076 738 1HB LYS 93 1HB LYS 93 -23.140 -13.508 5.033 739 2HB LYS 93 2HB LYS 93 -23.017 -12.053 6.020 740 1HG LYS 93 1HG LYS 93 -22.125 -10.906 4.301 741 2HG LYS 93 2HG LYS 93 -20.860 -12.117 4.099 742 1HD LYS 93 1HD LYS 93 -21.886 -12.515 2.100 743 2HD LYS 93 2HD LYS 93 -23.030 -13.437 3.075 744 1HE LYS 93 1HE LYS 93 -24.619 -11.692 3.078 745 2HE LYS 93 2HE LYS 93 -23.407 -10.467 2.661 746 1HZ LYS 93 1HZ LYS 93 -23.144 -11.419 0.510 747 2HZ LYS 93 2HZ LYS 93 -24.814 -11.229 0.751 748 3HZ LYS 93 3HZ LYS 93 -24.103 -12.763 0.906 749 HA PRO 94 HA PRO 94 -19.403 -16.972 5.099 750 1HB PRO 94 1HB PRO 94 -22.043 -18.022 4.149 751 2HB PRO 94 2HB PRO 94 -20.758 -18.857 5.042 752 1HG PRO 94 1HG PRO 94 -23.009 -18.052 6.239 753 2HG PRO 94 2HG PRO 94 -21.447 -18.024 7.068 754 1HD PRO 94 1HD PRO 94 -23.056 -15.777 5.992 755 2HD PRO 94 2HD PRO 94 -21.926 -15.810 7.361 756 H ILE 95 H ILE 95 -18.400 -16.964 3.133 757 HA ILE 95 HA ILE 95 -19.883 -15.816 0.793 758 HB ILE 95 HB ILE 95 -17.029 -15.745 1.783 759 1HG1 ILE 95 1HG1 ILE 95 -18.891 -13.574 0.797 760 2HG1 ILE 95 2HG1 ILE 95 -18.701 -14.026 2.491 761 1HG2 ILE 95 1HG2 ILE 95 -17.920 -15.750 -1.010 762 2HG2 ILE 95 2HG2 ILE 95 -16.289 -15.896 -0.347 763 3HG2 ILE 95 3HG2 ILE 95 -17.007 -14.302 -0.579 764 1HD1 ILE 95 1HD1 ILE 95 -16.782 -12.629 0.670 765 2HD1 ILE 95 2HD1 ILE 95 -16.123 -13.680 1.925 766 3HD1 ILE 95 3HD1 ILE 95 -17.149 -12.314 2.366 767 H ALA 96 H ALA 96 -19.786 -16.958 -1.174 768 HA ALA 96 HA ALA 96 -18.936 -19.798 -0.962 769 1HB ALA 96 1HB ALA 96 -20.671 -18.159 -2.834 770 2HB ALA 96 2HB ALA 96 -21.196 -19.388 -1.682 771 3HB ALA 96 3HB ALA 96 -20.308 -19.860 -3.131 772 H ILE 97 H ILE 97 -17.929 -20.756 -2.977 773 HA ILE 97 HA ILE 97 -15.524 -19.378 -3.721 774 HB ILE 97 HB ILE 97 -17.015 -21.755 -4.885 775 1HG1 ILE 97 1HG1 ILE 97 -14.535 -21.884 -3.200 776 2HG1 ILE 97 2HG1 ILE 97 -16.097 -21.647 -2.417 777 1HG2 ILE 97 1HG2 ILE 97 -15.450 -21.848 -6.499 778 2HG2 ILE 97 2HG2 ILE 97 -14.182 -21.884 -5.274 779 3HG2 ILE 97 3HG2 ILE 97 -14.754 -20.340 -5.905 780 1HD1 ILE 97 1HD1 ILE 97 -16.698 -23.665 -4.152 781 2HD1 ILE 97 2HD1 ILE 97 -16.197 -23.925 -2.481 782 3HD1 ILE 97 3HD1 ILE 97 -15.014 -24.037 -3.784 783 H GLY 98 H GLY 98 -15.682 -17.496 -4.910 784 1HA GLY 98 1HA GLY 98 -15.798 -16.680 -7.248 785 2HA GLY 98 2HA GLY 98 -17.265 -17.639 -7.443 786 H GLU 99 H GLU 99 -16.474 -15.630 -4.634 787 HA GLU 99 HA GLU 99 -18.975 -14.081 -5.151 788 1HB GLU 99 1HB GLU 99 -17.394 -15.030 -2.830 789 2HB GLU 99 2HB GLU 99 -18.072 -13.412 -2.642 790 1HG GLU 99 1HG GLU 99 -19.622 -15.907 -3.401 791 2HG GLU 99 2HG GLU 99 -19.646 -15.126 -1.822 792 H GLU 100 H GLU 100 -18.899 -11.722 -4.906 793 HA GLU 100 HA GLU 100 -16.263 -10.599 -5.733 794 1HB GLU 100 1HB GLU 100 -18.861 -10.326 -6.658 795 2HB GLU 100 2HB GLU 100 -18.648 -8.866 -5.693 796 1HG GLU 100 1HG GLU 100 -16.613 -9.769 -7.745 797 2HG GLU 100 2HG GLU 100 -17.949 -8.692 -8.148 798 H ILE 101 H ILE 101 -15.084 -9.934 -3.971 799 HA ILE 101 HA ILE 101 -16.440 -8.848 -1.575 800 HB ILE 101 HB ILE 101 -13.495 -9.227 -2.242 801 1HG1 ILE 101 1HG1 ILE 101 -15.326 -11.091 -0.706 802 2HG1 ILE 101 2HG1 ILE 101 -14.899 -11.324 -2.402 803 1HG2 ILE 101 1HG2 ILE 101 -14.647 -7.858 -0.148 804 2HG2 ILE 101 2HG2 ILE 101 -13.048 -8.600 -0.105 805 3HG2 ILE 101 3HG2 ILE 101 -14.441 -9.471 0.536 806 1HD1 ILE 101 1HD1 ILE 101 -12.641 -10.859 -0.520 807 2HD1 ILE 101 2HD1 ILE 101 -12.741 -11.938 -1.912 808 3HD1 ILE 101 3HD1 ILE 101 -13.474 -12.408 -0.378 809 H THR 102 H THR 102 -16.897 -6.696 -1.516 810 HA THR 102 HA THR 102 -14.966 -4.779 -2.765 811 HB THR 102 HB THR 102 -16.838 -3.671 -3.863 812 HG1 THR 102 HG1 THR 102 -18.448 -3.915 -2.401 813 1HG2 THR 102 1HG2 THR 102 -15.944 -5.585 -5.093 814 2HG2 THR 102 2HG2 THR 102 -17.691 -5.497 -5.325 815 3HG2 THR 102 3HG2 THR 102 -17.010 -6.678 -4.209 816 H ILE 103 H ILE 103 -16.574 -5.620 0.026 817 HA ILE 103 HA ILE 103 -17.449 -4.463 1.893 818 HB ILE 103 HB ILE 103 -15.684 -3.058 2.808 819 1HG1 ILE 103 1HG1 ILE 103 -14.432 -3.061 0.052 820 2HG1 ILE 103 2HG1 ILE 103 -15.358 -1.707 0.702 821 1HG2 ILE 103 1HG2 ILE 103 -15.360 -5.592 2.381 822 2HG2 ILE 103 2HG2 ILE 103 -13.930 -4.634 2.763 823 3HG2 ILE 103 3HG2 ILE 103 -14.264 -5.091 1.093 824 1HD1 ILE 103 1HD1 ILE 103 -13.805 -1.471 2.542 825 2HD1 ILE 103 2HD1 ILE 103 -12.876 -1.509 1.043 826 3HD1 ILE 103 3HD1 ILE 103 -12.961 -2.944 2.065 827 H SER 104 H SER 104 -16.813 -1.530 2.325 828 HA SER 104 HA SER 104 -18.289 -0.142 0.197 829 1HB SER 104 1HB SER 104 -19.999 -1.382 1.570 830 2HB SER 104 2HB SER 104 -19.469 -0.467 2.981 831 HG SER 104 HG SER 104 -21.238 0.545 2.027 832 H TYR 105 H TYR 105 -19.038 2.136 1.483 833 HA TYR 105 HA TYR 105 -16.523 3.075 2.828 834 1HB TYR 105 1HB TYR 105 -18.342 4.740 1.059 835 2HB TYR 105 2HB TYR 105 -16.689 5.096 1.545 836 HD1 TYR 105 HD1 TYR 105 -18.478 4.322 -1.218 837 HD2 TYR 105 HD2 TYR 105 -15.139 2.770 0.994 838 HE1 TYR 105 HE1 TYR 105 -17.650 3.195 -3.264 839 HE2 TYR 105 HE2 TYR 105 -14.310 1.642 -1.055 840 HH TYR 105 HH TYR 105 -14.515 1.829 -3.468 841 H GLY 106 H GLY 106 -19.815 4.386 2.233 842 1HA GLY 106 1HA GLY 106 -21.476 4.915 3.853 843 2HA GLY 106 2HA GLY 106 -20.368 4.393 5.122 844 H ASP 107 H ASP 107 -21.006 6.415 6.224 845 HA ASP 107 HA ASP 107 -20.605 8.647 6.859 846 1HB ASP 107 1HB ASP 107 -18.326 7.795 6.919 847 2HB ASP 107 2HB ASP 107 -18.161 7.989 5.175 848 H ASP 108 H ASP 108 -18.917 9.100 3.779 849 HA ASP 108 HA ASP 108 -21.282 10.378 2.552 850 1HB ASP 108 1HB ASP 108 -19.742 11.850 4.244 851 2HB ASP 108 2HB ASP 108 -18.862 12.103 2.736 852 H TYR 109 H TYR 109 -19.182 8.201 1.993 853 HA TYR 109 HA TYR 109 -17.918 9.316 -0.464 854 1HB TYR 109 1HB TYR 109 -17.112 7.603 1.597 855 2HB TYR 109 2HB TYR 109 -17.416 6.514 0.242 856 HD1 TYR 109 HD1 TYR 109 -15.954 9.948 0.716 857 HD2 TYR 109 HD2 TYR 109 -15.556 6.063 -1.074 858 HE1 TYR 109 HE1 TYR 109 -13.815 10.646 -0.324 859 HE2 TYR 109 HE2 TYR 109 -13.417 6.762 -2.114 860 HH TYR 109 HH TYR 109 -11.572 8.869 -1.284 861 H TRP 110 H TRP 110 -19.331 9.195 -2.170 862 HA TRP 110 HA TRP 110 -20.786 8.280 -3.769 863 1HB TRP 110 1HB TRP 110 -19.041 6.676 -4.096 864 2HB TRP 110 2HB TRP 110 -19.402 5.854 -2.585 865 HD1 TRP 110 HD1 TRP 110 -21.388 4.157 -2.528 866 HE1 TRP 110 HE1 TRP 110 -22.791 3.034 -4.385 867 HE3 TRP 110 HE3 TRP 110 -20.080 7.068 -6.514 868 HZ2 TRP 110 HZ2 TRP 110 -23.287 3.331 -7.183 869 HZ3 TRP 110 HZ3 TRP 110 -21.030 6.627 -8.760 870 HH2 TRP 110 HH2 TRP 110 -22.631 4.764 -9.100 871 H LEU 111 H LEU 111 -21.108 5.666 -1.368 872 HA LEU 111 HA LEU 111 -23.957 5.578 -1.537 873 1HB LEU 111 1HB LEU 111 -22.327 3.805 -0.752 874 2HB LEU 111 2HB LEU 111 -22.149 4.716 0.747 875 HG LEU 111 HG LEU 111 -24.885 3.935 -0.240 876 1HD1 LEU 111 1HD1 LEU 111 -22.775 2.197 0.952 877 2HD1 LEU 111 2HD1 LEU 111 -24.094 1.774 -0.140 878 3HD1 LEU 111 3HD1 LEU 111 -24.414 2.015 1.578 879 1HD2 LEU 111 1HD2 LEU 111 -25.224 5.274 1.588 880 2HD2 LEU 111 2HD2 LEU 111 -23.615 4.963 2.241 881 3HD2 LEU 111 3HD2 LEU 111 -24.902 3.777 2.464 882 H SER 112 H SER 112 -21.870 6.885 1.076 883 HA SER 112 HA SER 112 -22.349 8.457 2.766 884 1HB SER 112 1HB SER 112 -22.525 10.015 0.985 885 2HB SER 112 2HB SER 112 -24.023 9.300 0.393 886 HG SER 112 HG SER 112 -23.586 11.040 2.522 887 H ARG 113 H ARG 113 -25.660 8.630 1.534 888 HA ARG 113 HA ARG 113 -26.634 7.589 4.126 889 1HB ARG 113 1HB ARG 113 -27.768 9.089 1.764 890 2HB ARG 113 2HB ARG 113 -28.844 8.375 2.966 891 1HG ARG 113 1HG ARG 113 -26.558 9.985 3.994 892 2HG ARG 113 2HG ARG 113 -27.868 10.871 3.215 893 1HD ARG 113 1HD ARG 113 -29.024 8.887 4.944 894 2HD ARG 113 2HD ARG 113 -27.830 9.823 5.863 895 HE ARG 113 HE ARG 113 -30.319 10.856 4.760 896 1HH1 ARG 113 1HH1 ARG 113 -27.014 11.628 5.533 897 2HH1 ARG 113 2HH1 ARG 113 -27.335 13.318 5.711 898 1HH2 ARG 113 1HH2 ARG 113 -30.711 13.053 4.997 899 2HH2 ARG 113 2HH2 ARG 113 -29.412 14.121 5.411 900 HA PRO 114 HA PRO 114 -27.265 3.612 2.229 901 1HB PRO 114 1HB PRO 114 -29.068 2.639 4.118 902 2HB PRO 114 2HB PRO 114 -27.304 2.585 4.287 903 1HG PRO 114 1HG PRO 114 -29.271 4.470 5.471 904 2HG PRO 114 2HG PRO 114 -27.772 3.825 6.154 905 1HD PRO 114 1HD PRO 114 -27.995 6.348 5.169 906 2HD PRO 114 2HD PRO 114 -26.476 5.429 5.144 907 H ARG 115 H ARG 115 -30.403 4.057 3.817 908 HA ARG 115 HA ARG 115 -32.573 4.064 2.880 909 1HB ARG 115 1HB ARG 115 -30.875 6.151 1.788 910 2HB ARG 115 2HB ARG 115 -32.100 5.683 0.610 911 1HG ARG 115 1HG ARG 115 -33.481 7.060 1.767 912 2HG ARG 115 2HG ARG 115 -33.541 5.765 2.962 913 1HD ARG 115 1HD ARG 115 -32.714 7.323 4.415 914 2HD ARG 115 2HD ARG 115 -31.168 7.086 3.579 915 HE ARG 115 HE ARG 115 -31.510 9.169 2.511 916 1HH1 ARG 115 1HH1 ARG 115 -34.512 7.914 3.752 917 2HH1 ARG 115 2HH1 ARG 115 -35.406 9.333 3.330 918 1HH2 ARG 115 1HH2 ARG 115 -32.693 10.999 1.973 919 2HH2 ARG 115 2HH2 ARG 115 -34.387 11.067 2.331 920 H LEU 116 H LEU 116 -31.654 1.689 2.206 921 HA LEU 116 HA LEU 116 -31.350 1.324 -0.693 922 1HB LEU 116 1HB LEU 116 -31.014 -0.147 1.804 923 2HB LEU 116 2HB LEU 116 -31.826 -1.135 0.590 924 HG LEU 116 HG LEU 116 -30.026 -0.593 -1.031 925 1HD1 LEU 116 1HD1 LEU 116 -27.982 0.532 -0.189 926 2HD1 LEU 116 2HD1 LEU 116 -28.788 0.816 1.354 927 3HD1 LEU 116 3HD1 LEU 116 -29.387 1.595 -0.111 928 1HD2 LEU 116 1HD2 LEU 116 -29.667 -2.633 0.111 929 2HD2 LEU 116 2HD2 LEU 116 -29.308 -1.816 1.633 930 3HD2 LEU 116 3HD2 LEU 116 -28.145 -1.764 0.309 931 H THR 117 H THR 117 -33.488 2.307 -1.270 932 HA THR 117 HA THR 117 -35.612 0.233 -1.265 933 HB THR 117 HB THR 117 -35.854 3.048 -0.139 934 HG1 THR 117 HG1 THR 117 -36.555 1.783 1.700 935 1HG2 THR 117 1HG2 THR 117 -37.855 2.548 -1.428 936 2HG2 THR 117 2HG2 THR 117 -38.239 2.402 0.288 937 3HG2 THR 117 3HG2 THR 117 -37.978 0.954 -0.685 938 H GLN 118 H GLN 118 -35.422 3.736 -2.000 939 HA GLN 118 HA GLN 118 -35.913 4.900 -3.994 940 1HB GLN 118 1HB GLN 118 -34.085 2.814 -4.459 941 2HB GLN 118 2HB GLN 118 -35.254 2.685 -5.774 942 1HG GLN 118 1HG GLN 118 -34.627 4.676 -6.698 943 2HG GLN 118 2HG GLN 118 -34.379 5.438 -5.126 944 1HE2 GLN 118 1HE2 GLN 118 -32.804 3.642 -7.705 945 2HE2 GLN 118 2HE2 GLN 118 -31.239 3.706 -7.052 946 H ASN 119 H ASN 119 -38.224 4.009 -2.957 947 HA ASN 119 HA ASN 119 -39.921 3.582 -5.252 948 1HB ASN 119 1HB ASN 119 -38.640 1.326 -4.556 949 2HB ASN 119 2HB ASN 119 -39.970 1.227 -3.402 950 1HD2 ASN 119 1HD2 ASN 119 -42.232 1.761 -4.545 951 2HD2 ASN 119 2HD2 ASN 119 -42.471 1.009 -6.048 952 1H GLY 201 1H GLY 201 -18.962 33.237 -19.797 953 2H GLY 201 2H GLY 201 -18.341 33.344 -18.220 954 3H GLY 201 3H GLY 201 -19.913 33.895 -18.554 955 1HA GLY 201 1HA GLY 201 -20.235 31.428 -19.355 956 2HA GLY 201 2HA GLY 201 -18.926 31.165 -18.203 957 H LYS 202 H LYS 202 -20.704 29.954 -17.036 958 HA LYS 202 HA LYS 202 -22.414 31.840 -15.445 959 1HB LYS 202 1HB LYS 202 -22.795 29.094 -16.617 960 2HB LYS 202 2HB LYS 202 -23.711 29.541 -15.177 961 1HG LYS 202 1HG LYS 202 -25.187 30.445 -16.653 962 2HG LYS 202 2HG LYS 202 -24.027 31.770 -16.752 963 1HD LYS 202 1HD LYS 202 -23.311 31.156 -18.831 964 2HD LYS 202 2HD LYS 202 -23.425 29.434 -18.469 965 1HE LYS 202 1HE LYS 202 -26.048 30.760 -18.531 966 2HE LYS 202 2HE LYS 202 -25.193 30.822 -20.083 967 1HZ LYS 202 1HZ LYS 202 -25.467 28.376 -18.412 968 2HZ LYS 202 2HZ LYS 202 -24.805 28.473 -19.973 969 3HZ LYS 202 3HZ LYS 202 -26.467 28.732 -19.738 970 H ALA 203 H ALA 203 -21.007 28.544 -15.186 971 HA ALA 203 HA ALA 203 -20.379 29.163 -12.318 972 1HB ALA 203 1HB ALA 203 -22.094 27.428 -12.696 973 2HB ALA 203 2HB ALA 203 -20.635 26.695 -12.031 974 3HB ALA 203 3HB ALA 203 -20.989 26.550 -13.752 975 HA PRO 204 HA PRO 204 -16.312 28.725 -14.413 976 1HB PRO 204 1HB PRO 204 -14.985 30.146 -12.422 977 2HB PRO 204 2HB PRO 204 -15.683 30.878 -13.878 978 1HG PRO 204 1HG PRO 204 -16.755 30.759 -11.108 979 2HG PRO 204 2HG PRO 204 -16.873 32.051 -12.310 980 1HD PRO 204 1HD PRO 204 -18.925 30.370 -11.733 981 2HD PRO 204 2HD PRO 204 -18.697 31.103 -13.335 982 H ARG 205 H ARG 205 -16.477 28.817 -10.827 983 HA ARG 205 HA ARG 205 -15.861 25.978 -10.586 984 1HB ARG 205 1HB ARG 205 -13.578 26.379 -9.641 985 2HB ARG 205 2HB ARG 205 -13.693 26.881 -11.327 986 1HG ARG 205 1HG ARG 205 -14.501 29.123 -9.838 987 2HG ARG 205 2HG ARG 205 -13.100 28.481 -8.980 988 1HD ARG 205 1HD ARG 205 -12.251 28.294 -11.582 989 2HD ARG 205 2HD ARG 205 -13.242 29.764 -11.639 990 HE ARG 205 HE ARG 205 -11.657 29.811 -9.259 991 1HH1 ARG 205 1HH1 ARG 205 -11.346 30.052 -12.719 992 2HH1 ARG 205 2HH1 ARG 205 -9.936 31.049 -12.633 993 1HH2 ARG 205 1HH2 ARG 205 -9.825 31.106 -9.174 994 2HH2 ARG 205 2HH2 ARG 205 -9.079 31.642 -10.642 995 H LYS 206 H LYS 206 -17.243 25.638 -8.874 996 HA LYS 206 HA LYS 206 -16.680 27.013 -6.322 997 1HB LYS 206 1HB LYS 206 -19.052 27.783 -6.156 998 2HB LYS 206 2HB LYS 206 -18.217 28.526 -7.521 999 1HG LYS 206 1HG LYS 206 -19.261 26.118 -8.525 1000 2HG LYS 206 2HG LYS 206 -20.547 26.794 -7.525 1001 1HD LYS 206 1HD LYS 206 -19.034 28.415 -9.588 1002 2HD LYS 206 2HD LYS 206 -20.544 27.575 -9.943 1003 1HE LYS 206 1HE LYS 206 -20.737 29.153 -7.488 1004 2HE LYS 206 2HE LYS 206 -20.339 30.152 -8.899 1005 1HZ LYS 206 1HZ LYS 206 -22.165 29.289 -10.089 1006 2HZ LYS 206 2HZ LYS 206 -22.782 29.649 -8.548 1007 3HZ LYS 206 3HZ LYS 206 -22.425 28.042 -8.965 1008 H GLN 207 H GLN 207 -16.467 24.257 -7.187 1009 HA GLN 207 HA GLN 207 -18.745 22.961 -5.736 1010 1HB GLN 207 1HB GLN 207 -16.965 22.305 -8.033 1011 2HB GLN 207 2HB GLN 207 -17.405 20.953 -6.990 1012 1HG GLN 207 1HG GLN 207 -19.644 21.080 -7.538 1013 2HG GLN 207 2HG GLN 207 -19.584 22.821 -7.815 1014 1HE2 GLN 207 1HE2 GLN 207 -19.808 19.869 -9.426 1015 2HE2 GLN 207 2HE2 GLN 207 -19.272 20.366 -10.957 1016 H LEU 208 H LEU 208 -15.198 22.610 -6.185 1017 HA LEU 208 HA LEU 208 -14.865 20.931 -3.852 1018 1HB LEU 208 1HB LEU 208 -13.271 22.248 -5.953 1019 2HB LEU 208 2HB LEU 208 -12.416 22.097 -4.418 1020 HG LEU 208 HG LEU 208 -13.390 19.633 -4.492 1021 1HD1 LEU 208 1HD1 LEU 208 -13.485 18.789 -6.817 1022 2HD1 LEU 208 2HD1 LEU 208 -13.271 20.433 -7.417 1023 3HD1 LEU 208 3HD1 LEU 208 -14.731 20.003 -6.527 1024 1HD2 LEU 208 1HD2 LEU 208 -10.954 20.572 -4.692 1025 2HD2 LEU 208 2HD2 LEU 208 -11.145 20.215 -6.409 1026 3HD2 LEU 208 3HD2 LEU 208 -11.279 18.920 -5.219 1027 H ALA 209 H ALA 209 -15.540 21.876 -1.914 1028 HA ALA 209 HA ALA 209 -14.072 24.340 -1.073 1029 1HB ALA 209 1HB ALA 209 -16.661 24.375 -1.949 1030 2HB ALA 209 2HB ALA 209 -16.030 25.505 -0.750 1031 3HB ALA 209 3HB ALA 209 -16.909 24.067 -0.230 1032 H THR 210 H THR 210 -15.369 24.557 1.437 1033 HA THR 210 HA THR 210 -13.937 22.684 3.032 1034 HB THR 210 HB THR 210 -14.706 24.879 3.803 1035 HG1 THR 210 HG1 THR 210 -14.719 23.928 5.656 1036 1HG2 THR 210 1HG2 THR 210 -16.765 25.596 3.246 1037 2HG2 THR 210 2HG2 THR 210 -17.467 24.376 4.309 1038 3HG2 THR 210 3HG2 THR 210 -17.161 23.998 2.614 1039 H LYS 211 H LYS 211 -14.405 20.509 2.501 1040 HA LYS 211 HA LYS 211 -17.050 19.527 3.435 1041 1HB LYS 211 1HB LYS 211 -16.037 19.668 0.660 1042 2HB LYS 211 2HB LYS 211 -16.668 18.085 1.116 1043 1HG LYS 211 1HG LYS 211 -18.362 20.286 2.045 1044 2HG LYS 211 2HG LYS 211 -18.192 20.254 0.290 1045 1HD LYS 211 1HD LYS 211 -19.558 18.469 0.150 1046 2HD LYS 211 2HD LYS 211 -18.549 17.568 1.282 1047 1HE LYS 211 1HE LYS 211 -20.272 19.686 2.473 1048 2HE LYS 211 2HE LYS 211 -21.101 18.242 1.862 1049 1HZ LYS 211 1HZ LYS 211 -20.391 17.787 4.085 1050 2HZ LYS 211 2HZ LYS 211 -18.819 18.343 3.766 1051 3HZ LYS 211 3HZ LYS 211 -19.376 16.910 3.044 1052 H ALA 212 H ALA 212 -14.147 18.310 1.708 1053 HA ALA 212 HA ALA 212 -12.770 16.450 2.180 1054 1HB ALA 212 1HB ALA 212 -13.424 16.812 5.079 1055 2HB ALA 212 2HB ALA 212 -12.735 18.194 4.227 1056 3HB ALA 212 3HB ALA 212 -11.849 16.671 4.299 1057 H ALA 213 H ALA 213 -14.062 14.730 1.367 1058 HA ALA 213 HA ALA 213 -15.768 13.331 3.403 1059 1HB ALA 213 1HB ALA 213 -16.229 14.271 0.711 1060 2HB ALA 213 2HB ALA 213 -17.376 13.514 1.815 1061 3HB ALA 213 3HB ALA 213 -16.391 12.515 0.747 1062 H ARG 214 H ARG 214 -15.346 11.126 3.706 1063 HA ARG 214 HA ARG 214 -13.456 9.766 1.849 1064 1HB ARG 214 1HB ARG 214 -13.034 10.565 4.711 1065 2HB ARG 214 2HB ARG 214 -12.327 9.047 4.158 1066 1HG ARG 214 1HG ARG 214 -11.308 10.328 2.233 1067 2HG ARG 214 2HG ARG 214 -11.859 11.812 3.010 1068 1HD ARG 214 1HD ARG 214 -10.233 9.821 4.587 1069 2HD ARG 214 2HD ARG 214 -9.425 10.976 3.509 1070 HE ARG 214 HE ARG 214 -10.810 11.637 5.993 1071 1HH1 ARG 214 1HH1 ARG 214 -9.921 12.761 2.820 1072 2HH1 ARG 214 2HH1 ARG 214 -9.998 14.429 3.270 1073 1HH2 ARG 214 1HH2 ARG 214 -10.903 13.809 6.552 1074 2HH2 ARG 214 2HH2 ARG 214 -10.549 15.021 5.366 1075 1HN MLZ 215 1HN MLZ 215 -13.057 7.426 3.082 1076 HA MLZ 215 HA MLZ 215 -15.755 6.238 3.187 1077 1HB MLZ 215 1HB MLZ 215 -12.951 5.073 3.382 1078 2HB MLZ 215 2HB MLZ 215 -14.427 4.140 3.137 1079 1HG MLZ 215 1HG MLZ 215 -13.806 6.392 1.254 1080 2HG MLZ 215 2HG MLZ 215 -14.710 4.907 0.959 1081 1HD MLZ 215 1HD MLZ 215 -11.814 5.416 0.757 1082 2HD MLZ 215 2HD MLZ 215 -12.225 3.931 1.614 1083 1HE MLZ 215 1HE MLZ 215 -13.865 4.272 -0.780 1084 2HE MLZ 215 2HE MLZ 215 -12.826 2.909 -0.323 1085 HZ MLZ 215 HZ MLZ 215 -10.910 4.089 -1.075 1086 1HCM MLZ 215 1HCM MLZ 215 -11.730 3.044 -2.919 1087 2HCM MLZ 215 2HCM MLZ 215 -11.727 4.718 -3.461 1088 3HCM MLZ 215 3HCM MLZ 215 -13.218 3.983 -2.885 1089 H SER 216 H SER 216 -16.788 6.234 5.151 1090 HA SER 216 HA SER 216 -17.146 5.849 7.456 1091 1HB SER 216 1HB SER 216 -15.821 7.298 8.761 1092 2HB SER 216 2HB SER 216 -14.368 6.969 7.816 1093 HG SER 216 HG SER 216 -16.026 8.963 7.519 1094 H ALA 217 H ALA 217 -15.704 5.007 9.530 1095 HA ALA 217 HA ALA 217 -14.684 2.365 8.659 1096 1HB ALA 217 1HB ALA 217 -12.503 2.891 9.016 1097 2HB ALA 217 2HB ALA 217 -12.879 3.591 10.591 1098 3HB ALA 217 3HB ALA 217 -13.006 4.577 9.134 1099 HA PRO 218 HA PRO 218 -16.530 1.054 12.420 1100 1HB PRO 218 1HB PRO 218 -14.703 -0.845 13.304 1101 2HB PRO 218 2HB PRO 218 -15.916 -1.138 12.045 1102 1HG PRO 218 1HG PRO 218 -13.017 -0.532 11.789 1103 2HG PRO 218 2HG PRO 218 -14.038 -1.599 10.815 1104 1HD PRO 218 1HD PRO 218 -13.246 0.867 9.992 1105 2HD PRO 218 2HD PRO 218 -14.772 0.117 9.479 1106 H ALA 219 H ALA 219 -16.499 1.795 14.536 1107 HA ALA 219 HA ALA 219 -14.267 3.462 15.407 1108 1HB ALA 219 1HB ALA 219 -15.943 3.265 17.539 1109 2HB ALA 219 2HB ALA 219 -17.023 2.715 16.258 1110 3HB ALA 219 3HB ALA 219 -16.276 4.310 16.157 1111 H THR 220 H THR 220 -12.881 1.273 15.204 1112 HA THR 220 HA THR 220 -11.625 -0.366 16.350 1113 HB THR 220 HB THR 220 -12.521 1.005 18.880 1114 HG1 THR 220 HG1 THR 220 -11.197 2.738 18.357 1115 1HG2 THR 220 1HG2 THR 220 -10.834 -0.709 19.112 1116 2HG2 THR 220 2HG2 THR 220 -10.035 0.851 19.303 1117 3HG2 THR 220 3HG2 THR 220 -9.893 -0.031 17.783 1118 H GLY 221 H GLY 221 -12.870 -2.255 16.049 1119 1HA GLY 221 1HA GLY 221 -13.739 -3.899 17.925 1120 2HA GLY 221 2HA GLY 221 -15.096 -2.772 17.944 1121 1H MET 1 1H MET 1 2.677 -9.879 5.396 1122 2H MET 1 2H MET 1 1.770 -8.917 6.462 1123 3H MET 1 3H MET 1 1.136 -10.389 5.897 1124 HA MET 1 HA MET 1 3.262 -9.930 7.894 1125 1HB MET 1 1HB MET 1 0.598 -11.285 7.598 1126 2HB MET 1 2HB MET 1 1.719 -11.880 8.821 1127 1HG MET 1 1HG MET 1 0.565 -10.258 10.033 1128 2HG MET 1 2HG MET 1 1.930 -9.317 9.432 1129 1HE MET 1 1HE MET 1 1.386 -7.001 7.618 1130 2HE MET 1 2HE MET 1 1.531 -7.360 9.339 1131 3HE MET 1 3HE MET 1 0.157 -6.427 8.746 1132 H PHE 2 H PHE 2 1.797 -12.995 6.869 1133 HA PHE 2 HA PHE 2 4.521 -13.906 6.004 1134 1HB PHE 2 1HB PHE 2 3.997 -16.015 7.219 1135 2HB PHE 2 2HB PHE 2 3.960 -14.624 8.302 1136 HD1 PHE 2 HD1 PHE 2 1.919 -17.112 6.495 1137 HD2 PHE 2 HD2 PHE 2 1.868 -13.801 9.232 1138 HE1 PHE 2 HE1 PHE 2 -0.429 -17.641 7.091 1139 HE2 PHE 2 HE2 PHE 2 -0.481 -14.330 9.828 1140 HZ PHE 2 HZ PHE 2 -1.630 -16.250 8.757 1141 H ASN 3 H ASN 3 4.535 -15.094 4.125 1142 HA ASN 3 HA ASN 3 2.024 -16.344 3.144 1143 1HB ASN 3 1HB ASN 3 2.357 -15.152 0.950 1144 2HB ASN 3 2HB ASN 3 1.993 -14.053 2.280 1145 1HD2 ASN 3 1HD2 ASN 3 4.286 -14.764 -0.190 1146 2HD2 ASN 3 2HD2 ASN 3 5.499 -13.691 0.317 1147 H ASP 4 H ASP 4 2.507 -17.767 1.223 1148 HA ASP 4 HA ASP 4 4.858 -19.373 1.658 1149 1HB ASP 4 1HB ASP 4 2.518 -19.930 0.686 1150 2HB ASP 4 2HB ASP 4 3.147 -19.303 -0.838 1151 H ARG 5 H ARG 5 6.174 -17.136 1.391 1152 HA ARG 5 HA ARG 5 7.866 -17.402 -0.902 1153 1HB ARG 5 1HB ARG 5 5.448 -16.281 -1.553 1154 2HB ARG 5 2HB ARG 5 6.369 -14.841 -1.135 1155 1HG ARG 5 1HG ARG 5 6.674 -15.227 -3.492 1156 2HG ARG 5 2HG ARG 5 8.185 -15.658 -2.691 1157 1HD ARG 5 1HD ARG 5 7.216 -18.057 -2.594 1158 2HD ARG 5 2HD ARG 5 6.066 -17.491 -3.817 1159 HE ARG 5 HE ARG 5 8.621 -16.619 -4.643 1160 1HH1 ARG 5 1HH1 ARG 5 6.964 -19.624 -4.050 1161 2HH1 ARG 5 2HH1 ARG 5 7.896 -20.494 -5.217 1162 1HH2 ARG 5 1HH2 ARG 5 9.816 -17.771 -6.152 1163 2HH2 ARG 5 2HH2 ARG 5 9.499 -19.455 -6.400 1164 H VAL 6 H VAL 6 6.481 -15.189 1.502 1165 HA VAL 6 HA VAL 6 9.186 -14.481 2.454 1166 HB VAL 6 HB VAL 6 7.243 -12.557 1.121 1167 1HG1 VAL 6 1HG1 VAL 6 9.662 -11.976 2.852 1168 2HG1 VAL 6 2HG1 VAL 6 8.006 -11.425 3.108 1169 3HG1 VAL 6 3HG1 VAL 6 8.947 -10.792 1.758 1170 1HG2 VAL 6 1HG2 VAL 6 10.009 -13.576 0.547 1171 2HG2 VAL 6 2HG2 VAL 6 9.532 -11.978 -0.023 1172 3HG2 VAL 6 3HG2 VAL 6 8.637 -13.404 -0.548 1173 H ILE 7 H ILE 7 8.964 -12.970 4.403 1174 HA ILE 7 HA ILE 7 6.287 -13.039 5.703 1175 HB ILE 7 HB ILE 7 7.427 -15.100 6.377 1176 1HG1 ILE 7 1HG1 ILE 7 7.730 -13.082 8.617 1177 2HG1 ILE 7 2HG1 ILE 7 6.172 -13.722 8.093 1178 1HG2 ILE 7 1HG2 ILE 7 9.692 -13.271 7.229 1179 2HG2 ILE 7 2HG2 ILE 7 9.724 -14.353 5.837 1180 3HG2 ILE 7 3HG2 ILE 7 9.633 -15.017 7.468 1181 1HD1 ILE 7 1HD1 ILE 7 8.478 -15.504 8.910 1182 2HD1 ILE 7 2HD1 ILE 7 6.787 -15.958 8.692 1183 3HD1 ILE 7 3HD1 ILE 7 7.259 -14.941 10.053 1184 H VAL 8 H VAL 8 6.030 -11.303 7.198 1185 HA VAL 8 HA VAL 8 8.027 -9.149 6.916 1186 HB VAL 8 HB VAL 8 5.311 -9.326 8.271 1187 1HG1 VAL 8 1HG1 VAL 8 7.357 -7.351 8.459 1188 2HG1 VAL 8 2HG1 VAL 8 5.705 -7.259 9.072 1189 3HG1 VAL 8 3HG1 VAL 8 6.075 -6.682 7.448 1190 1HG2 VAL 8 1HG2 VAL 8 5.408 -7.652 5.942 1191 2HG2 VAL 8 2HG2 VAL 8 4.449 -9.109 6.204 1192 3HG2 VAL 8 3HG2 VAL 8 6.073 -9.233 5.528 1193 H LYS 9 H LYS 9 9.758 -9.503 8.274 1194 HA LYS 9 HA LYS 9 9.160 -9.769 11.194 1195 1HB LYS 9 1HB LYS 9 11.551 -10.807 9.660 1196 2HB LYS 9 2HB LYS 9 11.187 -11.101 11.354 1197 1HG LYS 9 1HG LYS 9 8.908 -11.822 9.745 1198 2HG LYS 9 2HG LYS 9 10.345 -12.634 9.127 1199 1HD LYS 9 1HD LYS 9 10.436 -12.760 11.974 1200 2HD LYS 9 2HD LYS 9 8.823 -13.257 11.471 1201 1HE LYS 9 1HE LYS 9 10.085 -14.713 9.698 1202 2HE LYS 9 2HE LYS 9 11.484 -14.491 10.766 1203 1HZ LYS 9 1HZ LYS 9 8.794 -15.391 11.666 1204 2HZ LYS 9 2HZ LYS 9 10.197 -15.285 12.618 1205 3HZ LYS 9 3HZ LYS 9 10.099 -16.437 11.373 1206 H LYS 10 H LYS 10 11.305 -6.941 11.744 1207 HA LYS 10 HA LYS 10 10.378 -7.574 13.771 1208 1HB LYS 10 1HB LYS 10 8.134 -8.701 12.072 1209 2HB LYS 10 2HB LYS 10 8.036 -8.029 13.685 1210 1HG LYS 10 1HG LYS 10 7.840 -5.938 12.896 1211 2HG LYS 10 2HG LYS 10 9.223 -6.137 11.829 1212 1HD LYS 10 1HD LYS 10 7.426 -5.805 10.338 1213 2HD LYS 10 2HD LYS 10 7.621 -7.557 10.366 1214 1HE LYS 10 1HE LYS 10 5.826 -6.463 12.460 1215 2HE LYS 10 2HE LYS 10 5.227 -6.335 10.795 1216 1HZ LYS 10 1HZ LYS 10 4.633 -8.487 11.470 1217 2HZ LYS 10 2HZ LYS 10 6.115 -8.756 12.255 1218 3HZ LYS 10 3HZ LYS 10 6.047 -8.720 10.558 1219 H SER 11 H SER 11 12.307 -9.372 13.090 1220 HA SER 11 HA SER 11 11.108 -12.048 13.652 1221 1HB SER 11 1HB SER 11 13.198 -11.094 11.973 1222 2HB SER 11 2HB SER 11 13.957 -12.078 13.223 1223 HG SER 11 HG SER 11 12.849 -13.803 12.585 1224 HA PRO 12 HA PRO 12 14.055 -11.501 17.250 1225 1HB PRO 12 1HB PRO 12 16.033 -9.661 17.258 1226 2HB PRO 12 2HB PRO 12 16.167 -11.132 16.275 1227 1HG PRO 12 1HG PRO 12 15.561 -8.347 15.453 1228 2HG PRO 12 2HG PRO 12 16.419 -9.620 14.578 1229 1HD PRO 12 1HD PRO 12 13.721 -8.850 14.250 1230 2HD PRO 12 2HD PRO 12 14.528 -10.257 13.539 1231 H LEU 13 H LEU 13 11.734 -9.705 16.680 1232 HA LEU 13 HA LEU 13 10.533 -7.973 17.748 1233 1HB LEU 13 1HB LEU 13 12.292 -9.283 19.660 1234 2HB LEU 13 2HB LEU 13 12.062 -7.589 20.093 1235 HG LEU 13 HG LEU 13 9.698 -9.280 19.313 1236 1HD1 LEU 13 1HD1 LEU 13 10.541 -8.982 22.183 1237 2HD1 LEU 13 2HD1 LEU 13 11.202 -10.297 21.211 1238 3HD1 LEU 13 3HD1 LEU 13 9.460 -10.174 21.461 1239 1HD2 LEU 13 1HD2 LEU 13 10.220 -6.751 20.861 1240 2HD2 LEU 13 2HD2 LEU 13 8.728 -7.656 21.113 1241 3HD2 LEU 13 3HD2 LEU 13 9.112 -7.014 19.515 1242 H GLY 14 H GLY 14 12.247 -7.031 15.820 1243 1HA GLY 14 1HA GLY 14 13.570 -4.680 17.116 1244 2HA GLY 14 2HA GLY 14 14.151 -5.417 15.625 1245 H GLY 15 H GLY 15 13.674 -4.171 13.899 1246 1HA GLY 15 1HA GLY 15 11.317 -2.377 14.037 1247 2HA GLY 15 2HA GLY 15 12.642 -2.244 12.883 1248 H TYR 16 H TYR 16 11.190 -2.215 11.082 1249 HA TYR 16 HA TYR 16 9.702 -4.772 10.599 1250 1HB TYR 16 1HB TYR 16 9.223 -1.875 10.139 1251 2HB TYR 16 2HB TYR 16 8.669 -2.951 8.857 1252 HD1 TYR 16 HD1 TYR 16 8.755 -3.043 12.616 1253 HD2 TYR 16 HD2 TYR 16 6.431 -3.545 9.038 1254 HE1 TYR 16 HE1 TYR 16 6.777 -3.650 13.985 1255 HE2 TYR 16 HE2 TYR 16 4.454 -4.152 10.406 1256 HH TYR 16 HH TYR 16 4.627 -5.025 13.598 1257 H GLY 17 H GLY 17 10.969 -6.046 9.274 1258 1HA GLY 17 1HA GLY 17 11.973 -4.798 6.759 1259 2HA GLY 17 2HA GLY 17 13.064 -5.804 7.714 1260 H VAL 18 H VAL 18 12.657 -6.711 5.200 1261 HA VAL 18 HA VAL 18 10.412 -8.668 5.290 1262 HB VAL 18 HB VAL 18 12.388 -7.846 3.130 1263 1HG1 VAL 18 1HG1 VAL 18 11.012 -9.109 1.597 1264 2HG1 VAL 18 2HG1 VAL 18 9.841 -9.464 2.867 1265 3HG1 VAL 18 3HG1 VAL 18 11.451 -10.181 2.927 1266 1HG2 VAL 18 1HG2 VAL 18 9.556 -7.244 2.742 1267 2HG2 VAL 18 2HG2 VAL 18 10.955 -6.180 2.599 1268 3HG2 VAL 18 3HG2 VAL 18 10.215 -6.457 4.176 1269 H PHE 19 H PHE 19 10.817 -10.798 5.756 1270 HA PHE 19 HA PHE 19 13.677 -11.663 5.917 1271 1HB PHE 19 1HB PHE 19 11.199 -12.074 7.470 1272 2HB PHE 19 2HB PHE 19 12.140 -13.545 7.224 1273 HD1 PHE 19 HD1 PHE 19 13.233 -9.983 7.604 1274 HD2 PHE 19 HD2 PHE 19 13.278 -13.955 9.241 1275 HE1 PHE 19 HE1 PHE 19 14.826 -9.243 9.354 1276 HE2 PHE 19 HE2 PHE 19 14.872 -13.214 10.991 1277 HZ PHE 19 HZ PHE 19 15.645 -10.858 11.048 1278 H ALA 20 H ALA 20 14.356 -13.298 4.583 1279 HA ALA 20 HA ALA 20 12.380 -14.445 2.684 1280 1HB ALA 20 1HB ALA 20 15.201 -15.162 2.373 1281 2HB ALA 20 2HB ALA 20 14.979 -13.420 2.531 1282 3HB ALA 20 3HB ALA 20 14.143 -14.303 1.254 1283 H ARG 21 H ARG 21 11.419 -16.035 4.137 1284 HA ARG 21 HA ARG 21 12.837 -17.948 5.697 1285 1HB ARG 21 1HB ARG 21 10.203 -17.329 4.946 1286 2HB ARG 21 2HB ARG 21 10.449 -18.971 4.352 1287 1HG ARG 21 1HG ARG 21 10.731 -19.841 6.470 1288 2HG ARG 21 2HG ARG 21 11.415 -18.345 7.106 1289 1HD ARG 21 1HD ARG 21 9.012 -17.370 6.720 1290 2HD ARG 21 2HD ARG 21 8.518 -19.074 6.702 1291 HE ARG 21 HE ARG 21 9.514 -17.601 9.026 1292 1HH1 ARG 21 1HH1 ARG 21 9.211 -20.714 7.498 1293 2HH1 ARG 21 2HH1 ARG 21 9.327 -21.580 8.990 1294 1HH2 ARG 21 1HH2 ARG 21 9.662 -18.747 10.950 1295 2HH2 ARG 21 2HH2 ARG 21 9.581 -20.477 10.931 1296 H LYS 22 H LYS 22 12.257 -17.696 2.260 1297 HA LYS 22 HA LYS 22 13.120 -20.445 1.656 1298 1HB LYS 22 1HB LYS 22 12.672 -18.017 -0.132 1299 2HB LYS 22 2HB LYS 22 12.672 -19.702 -0.640 1300 1HG LYS 22 1HG LYS 22 10.765 -19.972 1.134 1301 2HG LYS 22 2HG LYS 22 10.608 -18.225 0.960 1302 1HD LYS 22 1HD LYS 22 9.101 -19.199 -0.631 1303 2HD LYS 22 2HD LYS 22 10.482 -18.608 -1.553 1304 1HE LYS 22 1HE LYS 22 11.192 -20.732 -2.094 1305 2HE LYS 22 2HE LYS 22 10.650 -21.414 -0.549 1306 1HZ LYS 22 1HZ LYS 22 9.185 -22.118 -2.338 1307 2HZ LYS 22 2HZ LYS 22 8.901 -20.503 -2.781 1308 3HZ LYS 22 3HZ LYS 22 8.350 -21.083 -1.283 1309 H SER 23 H SER 23 16.402 -19.517 0.212 1310 HA SER 23 HA SER 23 13.905 -21.116 -0.168 1311 1HB SER 23 1HB SER 23 16.410 -21.835 -1.564 1312 2HB SER 23 2HB SER 23 16.547 -21.808 0.194 1313 HG SER 23 HG SER 23 15.704 -23.787 -1.056 1314 H PHE 24 H PHE 24 15.974 -18.735 -1.634 1315 HA PHE 24 HA PHE 24 14.313 -18.858 -4.125 1316 1HB PHE 24 1HB PHE 24 15.604 -16.684 -2.479 1317 2HB PHE 24 2HB PHE 24 15.173 -16.376 -4.157 1318 HD1 PHE 24 HD1 PHE 24 12.677 -17.717 -4.590 1319 HD2 PHE 24 HD2 PHE 24 14.057 -15.697 -1.060 1320 HE1 PHE 24 HE1 PHE 24 10.329 -17.314 -3.900 1321 HE2 PHE 24 HE2 PHE 24 11.711 -15.294 -0.370 1322 HZ PHE 24 HZ PHE 24 9.847 -16.103 -1.789 1323 H GLU 25 H GLU 25 15.424 -18.598 -6.142 1324 HA GLU 25 HA GLU 25 18.276 -19.393 -6.087 1325 1HB GLU 25 1HB GLU 25 16.049 -19.963 -7.658 1326 2HB GLU 25 2HB GLU 25 16.980 -18.860 -8.672 1327 1HG GLU 25 1HG GLU 25 18.963 -20.265 -8.444 1328 2HG GLU 25 2HG GLU 25 18.115 -21.329 -7.323 1329 H LYS 26 H LYS 26 19.029 -18.140 -8.545 1330 HA LYS 26 HA LYS 26 19.698 -15.467 -7.555 1331 1HB LYS 26 1HB LYS 26 21.213 -17.030 -8.826 1332 2HB LYS 26 2HB LYS 26 20.195 -16.788 -10.246 1333 1HG LYS 26 1HG LYS 26 20.650 -14.360 -10.154 1334 2HG LYS 26 2HG LYS 26 21.674 -14.608 -8.740 1335 1HD LYS 26 1HD LYS 26 23.328 -15.715 -9.973 1336 2HD LYS 26 2HD LYS 26 22.211 -16.149 -11.267 1337 1HE LYS 26 1HE LYS 26 22.347 -14.048 -12.265 1338 2HE LYS 26 2HE LYS 26 22.732 -13.236 -10.736 1339 1HZ LYS 26 1HZ LYS 26 24.863 -14.414 -10.716 1340 2HZ LYS 26 2HZ LYS 26 24.716 -13.444 -12.103 1341 3HZ LYS 26 3HZ LYS 26 24.496 -15.125 -12.215 1342 H GLY 27 H GLY 27 16.959 -16.661 -9.083 1343 1HA GLY 27 1HA GLY 27 16.131 -13.961 -9.863 1344 2HA GLY 27 2HA GLY 27 16.270 -15.092 -11.209 1345 H GLU 28 H GLU 28 14.825 -14.933 -7.932 1346 HA GLU 28 HA GLU 28 12.502 -16.490 -9.023 1347 1HB GLU 28 1HB GLU 28 14.080 -16.532 -6.481 1348 2HB GLU 28 2HB GLU 28 12.353 -16.872 -6.361 1349 1HG GLU 28 1HG GLU 28 12.819 -18.471 -8.399 1350 2HG GLU 28 2HG GLU 28 14.485 -18.400 -7.825 1351 H LEU 29 H LEU 29 10.694 -15.233 -9.193 1352 HA LEU 29 HA LEU 29 10.412 -12.572 -8.321 1353 1HB LEU 29 1HB LEU 29 9.006 -13.774 -9.986 1354 2HB LEU 29 2HB LEU 29 8.290 -14.722 -8.682 1355 HG LEU 29 HG LEU 29 7.623 -12.487 -7.624 1356 1HD1 LEU 29 1HD1 LEU 29 7.998 -11.422 -10.424 1357 2HD1 LEU 29 2HD1 LEU 29 9.256 -11.247 -9.200 1358 3HD1 LEU 29 3HD1 LEU 29 7.669 -10.521 -8.943 1359 1HD2 LEU 29 1HD2 LEU 29 6.022 -13.967 -8.790 1360 2HD2 LEU 29 2HD2 LEU 29 6.449 -13.214 -10.326 1361 3HD2 LEU 29 3HD2 LEU 29 5.640 -12.269 -9.076 1362 H VAL 30 H VAL 30 10.127 -11.711 -6.312 1363 HA VAL 30 HA VAL 30 9.425 -13.543 -4.059 1364 HB VAL 30 HB VAL 30 10.602 -10.737 -4.144 1365 1HG1 VAL 30 1HG1 VAL 30 11.194 -11.150 -1.810 1366 2HG1 VAL 30 2HG1 VAL 30 10.498 -12.768 -1.894 1367 3HG1 VAL 30 3HG1 VAL 30 9.454 -11.352 -2.018 1368 1HG2 VAL 30 1HG2 VAL 30 12.157 -12.248 -5.181 1369 2HG2 VAL 30 2HG2 VAL 30 11.874 -13.477 -3.949 1370 3HG2 VAL 30 3HG2 VAL 30 12.723 -11.990 -3.531 1371 H GLU 31 H GLU 31 7.099 -13.326 -4.971 1372 HA GLU 31 HA GLU 31 4.921 -12.455 -4.719 1373 1HB GLU 31 1HB GLU 31 5.757 -12.580 -2.342 1374 2HB GLU 31 2HB GLU 31 6.278 -10.902 -2.484 1375 1HG GLU 31 1HG GLU 31 4.072 -10.992 -1.428 1376 2HG GLU 31 2HG GLU 31 3.938 -10.248 -3.021 1377 H GLU 32 H GLU 32 3.658 -10.396 -4.939 1378 HA GLU 32 HA GLU 32 5.152 -7.955 -5.635 1379 1HB GLU 32 1HB GLU 32 4.267 -8.015 -7.984 1380 2HB GLU 32 2HB GLU 32 5.374 -9.346 -7.646 1381 1HG GLU 32 1HG GLU 32 3.645 -10.925 -7.535 1382 2HG GLU 32 2HG GLU 32 2.418 -9.701 -7.207 1383 H CYS 33 H CYS 33 3.690 -6.134 -5.952 1384 HA CYS 33 HA CYS 33 0.797 -6.640 -5.478 1385 1HB CYS 33 1HB CYS 33 2.795 -5.691 -3.561 1386 2HB CYS 33 2HB CYS 33 1.462 -4.550 -3.738 1387 HG CYS 33 HG CYS 33 0.968 -7.562 -3.035 1388 H LEU 34 H LEU 34 0.096 -3.958 -4.987 1389 HA LEU 34 HA LEU 34 0.643 -2.765 -7.655 1390 1HB LEU 34 1HB LEU 34 -1.434 -2.554 -5.495 1391 2HB LEU 34 2HB LEU 34 -1.246 -1.206 -6.614 1392 HG LEU 34 HG LEU 34 -2.938 -2.842 -7.411 1393 1HD1 LEU 34 1HD1 LEU 34 -2.328 -2.372 -9.535 1394 2HD1 LEU 34 2HD1 LEU 34 -0.849 -3.322 -9.400 1395 3HD1 LEU 34 3HD1 LEU 34 -0.877 -1.650 -8.840 1396 1HD2 LEU 34 1HD2 LEU 34 -1.482 -4.784 -6.367 1397 2HD2 LEU 34 2HD2 LEU 34 -0.721 -4.789 -7.958 1398 3HD2 LEU 34 3HD2 LEU 34 -2.453 -5.086 -7.808 1399 H CYS 35 H CYS 35 0.538 -0.186 -7.435 1400 HA CYS 35 HA CYS 35 2.086 0.789 -5.102 1401 1HB CYS 35 1HB CYS 35 3.060 0.366 -7.878 1402 2HB CYS 35 2HB CYS 35 3.503 1.908 -7.148 1403 HG CYS 35 HG CYS 35 5.304 0.553 -6.087 1404 H ILE 36 H ILE 36 2.458 3.317 -5.557 1405 HA ILE 36 HA ILE 36 -0.136 4.341 -6.661 1406 HB ILE 36 HB ILE 36 1.701 5.531 -4.551 1407 1HG1 ILE 36 1HG1 ILE 36 -0.805 3.831 -4.290 1408 2HG1 ILE 36 2HG1 ILE 36 0.816 3.417 -3.734 1409 1HG2 ILE 36 1HG2 ILE 36 0.258 7.165 -5.699 1410 2HG2 ILE 36 2HG2 ILE 36 -0.288 6.923 -4.040 1411 3HG2 ILE 36 3HG2 ILE 36 -1.154 6.159 -5.373 1412 1HD1 ILE 36 1HD1 ILE 36 -1.200 4.820 -2.302 1413 2HD1 ILE 36 2HD1 ILE 36 0.092 5.972 -2.637 1414 3HD1 ILE 36 3HD1 ILE 36 0.448 4.472 -1.782 1415 H VAL 37 H VAL 37 -0.041 5.965 -8.204 1416 HA VAL 37 HA VAL 37 2.700 6.895 -8.998 1417 HB VAL 37 HB VAL 37 0.185 6.500 -10.665 1418 1HG1 VAL 37 1HG1 VAL 37 1.682 6.780 -12.574 1419 2HG1 VAL 37 2HG1 VAL 37 3.067 6.949 -11.496 1420 3HG1 VAL 37 3HG1 VAL 37 1.813 8.189 -11.521 1421 1HG2 VAL 37 1HG2 VAL 37 2.007 4.582 -9.614 1422 2HG2 VAL 37 2HG2 VAL 37 2.346 4.731 -11.338 1423 3HG2 VAL 37 3HG2 VAL 37 0.722 4.317 -10.793 1424 H ARG 38 H ARG 38 2.922 9.009 -8.359 1425 HA ARG 38 HA ARG 38 0.755 10.925 -9.062 1426 1HB ARG 38 1HB ARG 38 0.377 10.133 -6.742 1427 2HB ARG 38 2HB ARG 38 2.026 10.592 -6.318 1428 1HG ARG 38 1HG ARG 38 0.482 12.352 -5.613 1429 2HG ARG 38 2HG ARG 38 1.492 12.947 -6.929 1430 1HD ARG 38 1HD ARG 38 -0.411 13.464 -8.054 1431 2HD ARG 38 2HD ARG 38 -0.763 11.728 -8.152 1432 HE ARG 38 HE ARG 38 -1.439 12.617 -5.532 1433 1HH1 ARG 38 1HH1 ARG 38 -2.459 13.026 -8.835 1434 2HH1 ARG 38 2HH1 ARG 38 -4.104 13.336 -8.404 1435 1HH2 ARG 38 1HH2 ARG 38 -3.581 13.022 -4.998 1436 2HH2 ARG 38 2HH2 ARG 38 -4.737 13.334 -6.249 1437 H HIS 39 H HIS 39 1.551 13.174 -9.053 1438 HA HIS 39 HA HIS 39 4.232 13.425 -10.100 1439 1HB HIS 39 1HB HIS 39 2.063 15.354 -9.218 1440 2HB HIS 39 2HB HIS 39 3.567 15.897 -9.961 1441 HD1 HIS 39 HD1 HIS 39 1.025 16.457 -11.502 1442 HD2 HIS 39 HD2 HIS 39 3.170 12.911 -11.952 1443 HE1 HIS 39 HE1 HIS 39 0.388 15.516 -13.766 1444 H ASN 40 H ASN 40 5.442 15.552 -9.068 1445 HA ASN 40 HA ASN 40 6.301 14.665 -6.392 1446 1HB ASN 40 1HB ASN 40 7.194 16.936 -8.211 1447 2HB ASN 40 2HB ASN 40 8.087 16.321 -6.820 1448 1HD2 ASN 40 1HD2 ASN 40 8.353 16.218 -10.023 1449 2HD2 ASN 40 2HD2 ASN 40 8.862 14.618 -10.270 1450 H ASP 41 H ASP 41 7.025 17.681 -5.920 1451 HA ASP 41 HA ASP 41 6.095 19.497 -4.746 1452 1HB ASP 41 1HB ASP 41 4.566 19.098 -6.927 1453 2HB ASP 41 2HB ASP 41 3.359 18.742 -5.692 1454 H ASP 42 H ASP 42 3.144 19.247 -3.811 1455 HA ASP 42 HA ASP 42 3.488 18.529 -1.164 1456 1HB ASP 42 1HB ASP 42 1.168 18.298 -3.090 1457 2HB ASP 42 2HB ASP 42 0.968 17.920 -1.379 1458 H TRP 43 H TRP 43 3.156 16.338 -3.899 1459 HA TRP 43 HA TRP 43 2.461 13.945 -2.503 1460 1HB TRP 43 1HB TRP 43 2.395 14.165 -4.934 1461 2HB TRP 43 2HB TRP 43 4.125 14.503 -4.989 1462 HD1 TRP 43 HD1 TRP 43 5.605 12.498 -5.466 1463 HE1 TRP 43 HE1 TRP 43 5.372 9.939 -5.275 1464 HE3 TRP 43 HE3 TRP 43 0.977 12.191 -3.330 1465 HZ2 TRP 43 HZ2 TRP 43 3.475 8.016 -4.340 1466 HZ3 TRP 43 HZ3 TRP 43 -0.016 9.983 -2.801 1467 HH2 TRP 43 HH2 TRP 43 1.225 7.899 -3.304 1468 H GLY 44 H GLY 44 5.704 15.087 -3.539 1469 1HA GLY 44 1HA GLY 44 7.193 13.084 -2.197 1470 2HA GLY 44 2HA GLY 44 7.821 14.679 -2.614 1471 H THR 45 H THR 45 5.844 16.135 -1.026 1472 HA THR 45 HA THR 45 7.221 16.139 1.512 1473 HB THR 45 HB THR 45 4.576 17.345 0.616 1474 HG1 THR 45 HG1 THR 45 6.242 18.061 -0.663 1475 1HG2 THR 45 1HG2 THR 45 5.549 17.184 3.179 1476 2HG2 THR 45 2HG2 THR 45 4.484 18.462 2.595 1477 3HG2 THR 45 3HG2 THR 45 6.229 18.718 2.635 1478 H ALA 46 H ALA 46 3.699 15.659 1.028 1479 HA ALA 46 HA ALA 46 3.171 14.438 3.506 1480 1HB ALA 46 1HB ALA 46 1.364 15.142 2.127 1481 2HB ALA 46 2HB ALA 46 1.246 13.382 2.111 1482 3HB ALA 46 3HB ALA 46 1.961 14.231 0.740 1483 H LEU 47 H LEU 47 3.783 12.773 0.384 1484 HA LEU 47 HA LEU 47 4.146 10.210 1.816 1485 1HB LEU 47 1HB LEU 47 4.206 11.036 -1.113 1486 2HB LEU 47 2HB LEU 47 4.344 9.372 -0.555 1487 HG LEU 47 HG LEU 47 2.055 9.636 -1.120 1488 1HD1 LEU 47 1HD1 LEU 47 1.067 8.946 0.824 1489 2HD1 LEU 47 2HD1 LEU 47 1.684 10.320 1.742 1490 3HD1 LEU 47 3HD1 LEU 47 2.732 8.946 1.405 1491 1HD2 LEU 47 1HD2 LEU 47 2.400 12.259 -0.988 1492 2HD2 LEU 47 2HD2 LEU 47 1.674 12.049 0.605 1493 3HD2 LEU 47 3HD2 LEU 47 0.791 11.552 -0.838 1494 H GLU 48 H GLU 48 6.135 12.056 2.538 1495 HA GLU 48 HA GLU 48 8.509 11.846 0.897 1496 1HB GLU 48 1HB GLU 48 9.565 12.768 2.972 1497 2HB GLU 48 2HB GLU 48 8.103 13.645 2.522 1498 1HG GLU 48 1HG GLU 48 7.406 13.263 4.642 1499 2HG GLU 48 2HG GLU 48 7.141 11.597 4.129 1500 H ASP 49 H ASP 49 6.922 9.511 2.775 1501 HA ASP 49 HA ASP 49 9.479 8.006 3.196 1502 1HB ASP 49 1HB ASP 49 7.698 8.840 5.070 1503 2HB ASP 49 2HB ASP 49 6.975 7.287 4.648 1504 H TYR 50 H TYR 50 9.493 5.828 2.517 1505 HA TYR 50 HA TYR 50 8.887 3.988 1.165 1506 1HB TYR 50 1HB TYR 50 6.082 4.883 1.928 1507 2HB TYR 50 2HB TYR 50 6.588 3.253 1.494 1508 HD1 TYR 50 HD1 TYR 50 5.276 4.502 4.140 1509 HD2 TYR 50 HD2 TYR 50 9.217 3.195 3.035 1510 HE1 TYR 50 HE1 TYR 50 5.788 4.030 6.520 1511 HE2 TYR 50 HE2 TYR 50 9.727 2.723 5.416 1512 HH TYR 50 HH TYR 50 7.901 2.154 7.608 1513 H LEU 51 H LEU 51 9.242 6.550 -0.151 1514 HA LEU 51 HA LEU 51 7.246 6.296 -2.380 1515 1HB LEU 51 1HB LEU 51 7.444 8.363 -0.698 1516 2HB LEU 51 2HB LEU 51 8.751 8.825 -1.788 1517 HG LEU 51 HG LEU 51 7.104 8.487 -3.703 1518 1HD1 LEU 51 1HD1 LEU 51 5.199 7.420 -3.095 1519 2HD1 LEU 51 2HD1 LEU 51 4.691 8.978 -2.442 1520 3HD1 LEU 51 3HD1 LEU 51 5.446 7.784 -1.387 1521 1HD2 LEU 51 1HD2 LEU 51 7.671 10.684 -2.206 1522 2HD2 LEU 51 2HD2 LEU 51 5.923 10.598 -1.987 1523 3HD2 LEU 51 3HD2 LEU 51 6.604 10.717 -3.610 1524 H PHE 52 H PHE 52 8.199 5.632 -4.255 1525 HA PHE 52 HA PHE 52 11.144 5.958 -4.589 1526 1HB PHE 52 1HB PHE 52 8.963 4.256 -5.817 1527 2HB PHE 52 2HB PHE 52 10.557 4.365 -6.564 1528 HD1 PHE 52 HD1 PHE 52 12.586 3.637 -5.298 1529 HD2 PHE 52 HD2 PHE 52 8.611 3.023 -3.788 1530 HE1 PHE 52 HE1 PHE 52 13.459 1.977 -3.675 1531 HE2 PHE 52 HE2 PHE 52 9.484 1.363 -2.166 1532 HZ PHE 52 HZ PHE 52 11.908 0.840 -2.109 1533 H SER 53 H SER 53 11.933 7.426 -6.072 1534 HA SER 53 HA SER 53 9.967 9.032 -7.607 1535 1HB SER 53 1HB SER 53 11.796 10.601 -7.758 1536 2HB SER 53 2HB SER 53 11.827 9.949 -6.121 1537 HG SER 53 HG SER 53 13.388 8.415 -6.910 1538 H ARG 54 H ARG 54 9.659 8.712 -9.754 1539 HA ARG 54 HA ARG 54 11.594 6.984 -11.229 1540 1HB ARG 54 1HB ARG 54 9.253 6.229 -11.066 1541 2HB ARG 54 2HB ARG 54 8.689 7.778 -11.685 1542 1HG ARG 54 1HG ARG 54 8.677 6.059 -13.453 1543 2HG ARG 54 2HG ARG 54 9.821 7.340 -13.833 1544 1HD ARG 54 1HD ARG 54 11.603 5.828 -12.710 1545 2HD ARG 54 2HD ARG 54 10.399 4.537 -12.853 1546 HE ARG 54 HE ARG 54 11.835 5.803 -15.066 1547 1HH1 ARG 54 1HH1 ARG 54 8.933 4.154 -14.078 1548 2HH1 ARG 54 2HH1 ARG 54 8.580 3.588 -15.674 1549 1HH2 ARG 54 1HH2 ARG 54 11.357 5.056 -17.128 1550 2HH2 ARG 54 2HH2 ARG 54 9.941 4.093 -17.389 1551 H LYS 55 H LYS 55 11.777 7.645 -13.647 1552 HA LYS 55 HA LYS 55 12.568 10.454 -13.781 1553 1HB LYS 55 1HB LYS 55 12.537 8.071 -15.649 1554 2HB LYS 55 2HB LYS 55 13.072 9.660 -16.196 1555 1HG LYS 55 1HG LYS 55 14.372 9.234 -13.732 1556 2HG LYS 55 2HG LYS 55 14.501 7.707 -14.605 1557 1HD LYS 55 1HD LYS 55 15.006 10.192 -16.167 1558 2HD LYS 55 2HD LYS 55 16.234 9.732 -14.987 1559 1HE LYS 55 1HE LYS 55 17.004 8.151 -16.416 1560 2HE LYS 55 2HE LYS 55 15.409 7.374 -16.417 1561 1HZ LYS 55 1HZ LYS 55 16.125 9.783 -18.013 1562 2HZ LYS 55 2HZ LYS 55 14.653 8.937 -18.066 1563 3HZ LYS 55 3HZ LYS 55 16.074 8.204 -18.637 1564 H ASN 56 H ASN 56 10.412 11.391 -13.431 1565 HA ASN 56 HA ASN 56 8.438 11.036 -15.621 1566 1HB ASN 56 1HB ASN 56 8.452 13.498 -15.999 1567 2HB ASN 56 2HB ASN 56 9.756 13.659 -14.823 1568 1HD2 ASN 56 1HD2 ASN 56 11.789 13.737 -15.784 1569 2HD2 ASN 56 2HD2 ASN 56 12.207 12.996 -17.252 1570 H MET 57 H MET 57 8.811 10.758 -12.517 1571 HA MET 57 HA MET 57 7.045 12.675 -11.284 1572 1HB MET 57 1HB MET 57 5.044 11.204 -11.184 1573 2HB MET 57 2HB MET 57 5.474 11.568 -12.854 1574 1HG MET 57 1HG MET 57 6.977 9.309 -12.315 1575 2HG MET 57 2HG MET 57 5.477 8.997 -11.442 1576 1HE MET 57 1HE MET 57 2.815 9.728 -14.227 1577 2HE MET 57 2HE MET 57 3.670 11.040 -13.416 1578 3HE MET 57 3HE MET 57 3.150 9.626 -12.499 1579 H SER 58 H SER 58 5.814 10.970 -9.398 1580 HA SER 58 HA SER 58 8.052 9.374 -8.226 1581 1HB SER 58 1HB SER 58 6.584 11.762 -7.093 1582 2HB SER 58 2HB SER 58 7.333 10.578 -6.021 1583 HG SER 58 HG SER 58 9.297 10.941 -7.167 1584 H ALA 59 H ALA 59 7.178 7.381 -7.832 1585 HA ALA 59 HA ALA 59 4.265 7.213 -7.161 1586 1HB ALA 59 1HB ALA 59 5.026 4.687 -7.791 1587 2HB ALA 59 2HB ALA 59 6.259 5.589 -8.671 1588 3HB ALA 59 3HB ALA 59 4.551 5.865 -9.014 1589 H MET 60 H MET 60 3.629 5.784 -5.438 1590 HA MET 60 HA MET 60 5.658 5.532 -3.287 1591 1HB MET 60 1HB MET 60 3.090 6.382 -3.336 1592 2HB MET 60 2HB MET 60 2.810 4.674 -2.997 1593 1HG MET 60 1HG MET 60 3.678 4.822 -0.899 1594 2HG MET 60 2HG MET 60 4.971 5.908 -1.408 1595 1HE MET 60 1HE MET 60 1.965 6.704 1.308 1596 2HE MET 60 2HE MET 60 3.652 7.189 1.477 1597 3HE MET 60 3HE MET 60 3.254 5.547 0.971 1598 H ALA 61 H ALA 61 5.245 3.402 -1.909 1599 HA ALA 61 HA ALA 61 5.710 1.124 -3.715 1600 1HB ALA 61 1HB ALA 61 5.429 0.678 -0.807 1601 2HB ALA 61 2HB ALA 61 6.594 1.935 -1.224 1602 3HB ALA 61 3HB ALA 61 6.787 0.305 -1.868 1603 H LEU 62 H LEU 62 4.480 -0.762 -1.721 1604 HA LEU 62 HA LEU 62 1.941 -1.144 -2.952 1605 1HB LEU 62 1HB LEU 62 0.997 -0.427 -0.384 1606 2HB LEU 62 2HB LEU 62 2.079 0.878 -0.873 1607 HG LEU 62 HG LEU 62 0.806 0.687 -3.168 1608 1HD1 LEU 62 1HD1 LEU 62 -0.471 -1.337 -1.816 1609 2HD1 LEU 62 2HD1 LEU 62 -1.126 -0.500 -3.224 1610 3HD1 LEU 62 3HD1 LEU 62 -1.590 0.009 -1.600 1611 1HD2 LEU 62 1HD2 LEU 62 0.773 2.584 -1.468 1612 2HD2 LEU 62 2HD2 LEU 62 -0.678 1.841 -0.796 1613 3HD2 LEU 62 3HD2 LEU 62 -0.679 2.430 -2.458 1614 H GLY 63 H GLY 63 3.338 -3.184 -2.689 1615 1HA GLY 63 1HA GLY 63 2.224 -4.799 -0.538 1616 2HA GLY 63 2HA GLY 63 3.387 -5.348 -1.744 1617 H PHE 64 H PHE 64 5.399 -5.763 -0.981 1618 HA PHE 64 HA PHE 64 6.124 -4.867 1.750 1619 1HB PHE 64 1HB PHE 64 7.340 -6.749 -0.305 1620 2HB PHE 64 2HB PHE 64 8.024 -6.485 1.298 1621 HD1 PHE 64 HD1 PHE 64 5.949 -6.460 3.175 1622 HD2 PHE 64 HD2 PHE 64 6.142 -8.735 -0.463 1623 HE1 PHE 64 HE1 PHE 64 4.361 -8.112 4.123 1624 HE2 PHE 64 HE2 PHE 64 4.554 -10.387 0.486 1625 HZ PHE 64 HZ PHE 64 3.664 -10.075 2.779 1626 H GLY 65 H GLY 65 6.067 -2.877 -0.455 1627 1HA GLY 65 1HA GLY 65 8.916 -2.375 -1.037 1628 2HA GLY 65 2HA GLY 65 7.554 -1.470 -1.687 1629 H ALA 66 H ALA 66 6.469 -1.320 1.190 1630 HA ALA 66 HA ALA 66 7.895 1.187 1.832 1631 1HB ALA 66 1HB ALA 66 5.483 1.208 1.764 1632 2HB ALA 66 2HB ALA 66 5.937 1.336 3.464 1633 3HB ALA 66 3HB ALA 66 5.384 -0.207 2.812 1634 H ILE 67 H ILE 67 7.797 -2.085 3.013 1635 HA ILE 67 HA ILE 67 8.821 -1.255 5.678 1636 HB ILE 67 HB ILE 67 8.734 -3.839 6.013 1637 1HG1 ILE 67 1HG1 ILE 67 7.280 -5.080 4.556 1638 2HG1 ILE 67 2HG1 ILE 67 6.905 -3.647 3.607 1639 1HG2 ILE 67 1HG2 ILE 67 7.131 -2.553 7.139 1640 2HG2 ILE 67 2HG2 ILE 67 6.147 -3.649 6.168 1641 3HG2 ILE 67 3HG2 ILE 67 6.396 -1.985 5.640 1642 1HD1 ILE 67 1HD1 ILE 67 9.035 -3.602 2.612 1643 2HD1 ILE 67 2HD1 ILE 67 8.685 -5.327 2.699 1644 3HD1 ILE 67 3HD1 ILE 67 9.752 -4.584 3.889 1645 H PHE 68 H PHE 68 10.180 -1.917 2.678 1646 HA PHE 68 HA PHE 68 12.389 -3.586 3.234 1647 1HB PHE 68 1HB PHE 68 11.784 -1.304 1.378 1648 2HB PHE 68 2HB PHE 68 13.439 -1.905 1.449 1649 HD1 PHE 68 HD1 PHE 68 10.774 -2.147 -0.557 1650 HD2 PHE 68 HD2 PHE 68 13.181 -4.751 1.865 1651 HE1 PHE 68 HE1 PHE 68 10.141 -4.068 -1.993 1652 HE2 PHE 68 HE2 PHE 68 12.549 -6.672 0.430 1653 HZ PHE 68 HZ PHE 68 11.029 -6.331 -1.499 1654 H ASN 69 H ASN 69 14.496 -3.158 4.014 1655 HA ASN 69 HA ASN 69 14.821 -0.566 5.496 1656 1HB ASN 69 1HB ASN 69 15.952 -3.338 6.045 1657 2HB ASN 69 2HB ASN 69 16.155 -1.922 7.076 1658 1HD2 ASN 69 1HD2 ASN 69 14.967 -4.088 8.287 1659 2HD2 ASN 69 2HD2 ASN 69 13.299 -3.833 8.478 1660 H HIS 70 H HIS 70 17.523 -0.738 6.050 1661 HA HIS 70 HA HIS 70 18.724 -0.635 3.310 1662 1HB HIS 70 1HB HIS 70 18.739 1.437 4.669 1663 2HB HIS 70 2HB HIS 70 19.562 0.581 5.974 1664 HD1 HIS 70 HD1 HIS 70 20.104 1.711 2.396 1665 HD2 HIS 70 HD2 HIS 70 22.333 0.318 5.632 1666 HE1 HIS 70 HE1 HIS 70 22.540 1.972 1.753 1667 H SER 71 H SER 71 20.771 -1.679 2.972 1668 HA SER 71 HA SER 71 22.000 -3.245 5.132 1669 1HB SER 71 1HB SER 71 20.447 -4.494 2.837 1670 2HB SER 71 2HB SER 71 21.542 -5.403 3.879 1671 HG SER 71 HG SER 71 19.878 -5.578 5.130 1672 H LYS 72 H LYS 72 24.090 -4.013 4.514 1673 HA LYS 72 HA LYS 72 25.292 -2.591 2.256 1674 1HB LYS 72 1HB LYS 72 26.105 -3.321 4.724 1675 2HB LYS 72 2HB LYS 72 26.737 -4.692 3.813 1676 1HG LYS 72 1HG LYS 72 28.519 -3.320 3.440 1677 2HG LYS 72 2HG LYS 72 27.480 -2.610 2.205 1678 1HD LYS 72 1HD LYS 72 26.628 -1.314 4.477 1679 2HD LYS 72 2HD LYS 72 28.354 -1.499 4.789 1680 1HE LYS 72 1HE LYS 72 28.699 0.281 3.423 1681 2HE LYS 72 2HE LYS 72 28.135 -0.722 2.073 1682 1HZ LYS 72 1HZ LYS 72 25.866 -0.135 2.607 1683 2HZ LYS 72 2HZ LYS 72 26.766 1.287 2.375 1684 3HZ LYS 72 3HZ LYS 72 26.374 0.778 3.947 1685 H ASP 73 H ASP 73 23.821 -5.671 2.640 1686 HA ASP 73 HA ASP 73 25.082 -6.569 0.075 1687 1HB ASP 73 1HB ASP 73 24.709 -7.990 2.718 1688 2HB ASP 73 2HB ASP 73 24.880 -8.904 1.219 1689 HA PRO 74 HA PRO 74 20.370 -6.623 0.130 1690 1HB PRO 74 1HB PRO 74 20.801 -5.500 -2.586 1691 2HB PRO 74 2HB PRO 74 19.709 -4.945 -1.305 1692 1HG PRO 74 1HG PRO 74 21.949 -3.617 -1.973 1693 2HG PRO 74 2HG PRO 74 21.314 -3.646 -0.322 1694 1HD PRO 74 1HD PRO 74 23.638 -5.096 -1.483 1695 2HD PRO 74 2HD PRO 74 23.406 -4.452 0.156 1696 H ASN 75 H ASN 75 20.084 -8.830 -0.170 1697 HA ASN 75 HA ASN 75 21.297 -10.252 -2.425 1698 1HB ASN 75 1HB ASN 75 20.098 -12.164 -1.363 1699 2HB ASN 75 2HB ASN 75 21.022 -11.238 -0.181 1700 1HD2 ASN 75 1HD2 ASN 75 19.184 -12.487 1.174 1701 2HD2 ASN 75 2HD2 ASN 75 17.777 -11.581 1.459 1702 H ALA 76 H ALA 76 18.501 -8.351 -2.091 1703 HA ALA 76 HA ALA 76 17.384 -9.525 -4.586 1704 1HB ALA 76 1HB ALA 76 15.734 -8.941 -2.105 1705 2HB ALA 76 2HB ALA 76 16.360 -10.545 -2.484 1706 3HB ALA 76 3HB ALA 76 15.203 -9.772 -3.567 1707 H ARG 77 H ARG 77 16.149 -7.998 -5.795 1708 HA ARG 77 HA ARG 77 16.188 -5.191 -4.734 1709 1HB ARG 77 1HB ARG 77 17.686 -6.261 -6.795 1710 2HB ARG 77 2HB ARG 77 16.300 -5.593 -7.657 1711 1HG ARG 77 1HG ARG 77 16.662 -3.443 -6.361 1712 2HG ARG 77 2HG ARG 77 18.177 -4.134 -5.779 1713 1HD ARG 77 1HD ARG 77 19.222 -3.753 -7.769 1714 2HD ARG 77 2HD ARG 77 17.836 -4.354 -8.699 1715 HE ARG 77 HE ARG 77 17.029 -2.131 -8.812 1716 1HH1 ARG 77 1HH1 ARG 77 19.403 -2.460 -6.287 1717 2HH1 ARG 77 2HH1 ARG 77 19.433 -0.766 -5.943 1718 1HH2 ARG 77 1HH2 ARG 77 17.086 0.065 -8.347 1719 2HH2 ARG 77 2HH2 ARG 77 18.132 0.655 -7.099 1720 H HIS 78 H HIS 78 14.771 -4.079 -6.931 1721 HA HIS 78 HA HIS 78 12.167 -5.558 -6.853 1722 1HB HIS 78 1HB HIS 78 11.115 -3.302 -6.524 1723 2HB HIS 78 2HB HIS 78 12.166 -3.768 -5.188 1724 HD1 HIS 78 HD1 HIS 78 13.364 -1.717 -4.440 1725 HD2 HIS 78 HD2 HIS 78 13.130 -1.918 -8.598 1726 HE1 HIS 78 HE1 HIS 78 14.663 0.268 -5.326 1727 H GLU 79 H GLU 79 10.643 -4.726 -8.585 1728 HA GLU 79 HA GLU 79 12.034 -3.513 -10.929 1729 1HB GLU 79 1HB GLU 79 12.281 -5.954 -11.091 1730 2HB GLU 79 2HB GLU 79 10.550 -6.167 -10.837 1731 1HG GLU 79 1HG GLU 79 10.956 -6.331 -13.210 1732 2HG GLU 79 2HG GLU 79 10.165 -4.783 -12.916 1733 H LEU 80 H LEU 80 10.633 -2.267 -12.189 1734 HA LEU 80 HA LEU 80 7.809 -2.074 -11.225 1735 1HB LEU 80 1HB LEU 80 9.646 -0.215 -12.779 1736 2HB LEU 80 2HB LEU 80 7.975 0.170 -12.368 1737 HG LEU 80 HG LEU 80 10.154 -0.492 -10.363 1738 1HD1 LEU 80 1HD1 LEU 80 9.143 2.119 -9.999 1739 2HD1 LEU 80 2HD1 LEU 80 9.454 1.959 -11.728 1740 3HD1 LEU 80 3HD1 LEU 80 10.751 1.671 -10.568 1741 1HD2 LEU 80 1HD2 LEU 80 8.265 0.620 -8.879 1742 2HD2 LEU 80 2HD2 LEU 80 8.184 -1.095 -9.284 1743 3HD2 LEU 80 3HD2 LEU 80 7.214 0.071 -10.185 1744 H THR 81 H THR 81 6.095 -2.228 -12.732 1745 HA THR 81 HA THR 81 6.484 -3.886 -15.038 1746 HB THR 81 HB THR 81 4.055 -2.929 -15.450 1747 HG1 THR 81 HG1 THR 81 3.252 -1.795 -13.777 1748 1HG2 THR 81 1HG2 THR 81 4.397 -4.242 -12.773 1749 2HG2 THR 81 2HG2 THR 81 4.928 -5.099 -14.221 1750 3HG2 THR 81 3HG2 THR 81 3.242 -4.607 -14.055 1751 H ALA 82 H ALA 82 5.352 -0.475 -14.973 1752 HA ALA 82 HA ALA 82 7.190 0.336 -17.076 1753 1HB ALA 82 1HB ALA 82 5.791 0.157 -18.925 1754 2HB ALA 82 2HB ALA 82 4.326 0.321 -17.957 1755 3HB ALA 82 3HB ALA 82 5.197 -1.212 -17.985 1756 H GLY 83 H GLY 83 4.008 0.980 -15.570 1757 1HA GLY 83 1HA GLY 83 4.729 3.884 -15.576 1758 2HA GLY 83 2HA GLY 83 3.069 3.295 -15.660 1759 H LEU 84 H LEU 84 5.684 2.126 -13.546 1760 HA LEU 84 HA LEU 84 5.741 1.933 -11.189 1761 1HB LEU 84 1HB LEU 84 4.272 4.570 -11.580 1762 2HB LEU 84 2HB LEU 84 5.054 4.064 -10.083 1763 HG LEU 84 HG LEU 84 6.581 4.169 -12.684 1764 1HD1 LEU 84 1HD1 LEU 84 5.401 6.396 -11.397 1765 2HD1 LEU 84 2HD1 LEU 84 6.630 6.421 -12.662 1766 3HD1 LEU 84 3HD1 LEU 84 7.111 6.427 -10.965 1767 1HD2 LEU 84 1HD2 LEU 84 8.464 3.976 -11.340 1768 2HD2 LEU 84 2HD2 LEU 84 7.300 3.058 -10.384 1769 3HD2 LEU 84 3HD2 LEU 84 7.676 4.725 -9.951 1770 H LYS 85 H LYS 85 3.672 0.412 -12.285 1771 HA LYS 85 HA LYS 85 1.316 0.995 -10.530 1772 1HB LYS 85 1HB LYS 85 1.689 -0.586 -13.097 1773 2HB LYS 85 2HB LYS 85 0.169 -0.519 -12.206 1774 1HG LYS 85 1HG LYS 85 0.057 1.897 -12.488 1775 2HG LYS 85 2HG LYS 85 1.648 1.915 -13.248 1776 1HD LYS 85 1HD LYS 85 0.851 0.753 -15.171 1777 2HD LYS 85 2HD LYS 85 -0.654 0.307 -14.368 1778 1HE LYS 85 1HE LYS 85 -1.633 2.276 -14.948 1779 2HE LYS 85 2HE LYS 85 -0.228 3.209 -14.398 1780 1HZ LYS 85 1HZ LYS 85 0.922 2.268 -16.444 1781 2HZ LYS 85 2HZ LYS 85 -0.248 3.468 -16.720 1782 3HZ LYS 85 3HZ LYS 85 -0.624 1.834 -16.995 1783 H ARG 86 H ARG 86 2.430 -2.047 -12.027 1784 HA ARG 86 HA ARG 86 1.963 -3.451 -9.473 1785 1HB ARG 86 1HB ARG 86 2.351 -4.071 -12.357 1786 2HB ARG 86 2HB ARG 86 2.897 -5.311 -11.228 1787 1HG ARG 86 1HG ARG 86 0.735 -5.982 -11.162 1788 2HG ARG 86 2HG ARG 86 0.448 -4.547 -10.179 1789 1HD ARG 86 1HD ARG 86 -1.078 -4.104 -11.861 1790 2HD ARG 86 2HD ARG 86 0.358 -3.432 -12.656 1791 HE ARG 86 HE ARG 86 0.329 -5.288 -14.121 1792 1HH1 ARG 86 1HH1 ARG 86 -1.522 -5.957 -11.249 1793 2HH1 ARG 86 2HH1 ARG 86 -2.082 -7.485 -11.833 1794 1HH2 ARG 86 1HH2 ARG 86 -0.411 -7.277 -14.856 1795 2HH2 ARG 86 2HH2 ARG 86 -1.459 -8.229 -13.859 1796 H MET 87 H MET 87 3.588 -3.858 -8.039 1797 HA MET 87 HA MET 87 6.403 -3.361 -8.886 1798 1HB MET 87 1HB MET 87 4.797 -2.692 -6.674 1799 2HB MET 87 2HB MET 87 5.909 -3.918 -6.066 1800 1HG MET 87 1HG MET 87 6.850 -1.558 -7.706 1801 2HG MET 87 2HG MET 87 6.728 -1.493 -5.947 1802 1HE MET 87 1HE MET 87 8.867 -0.625 -6.601 1803 2HE MET 87 2HE MET 87 10.263 -1.508 -7.218 1804 3HE MET 87 3HE MET 87 9.925 -1.490 -5.487 1805 H ARG 88 H ARG 88 7.553 -5.175 -9.440 1806 HA ARG 88 HA ARG 88 6.843 -7.765 -8.106 1807 1HB ARG 88 1HB ARG 88 8.327 -7.215 -10.703 1808 2HB ARG 88 2HB ARG 88 7.774 -8.787 -10.131 1809 1HG ARG 88 1HG ARG 88 5.435 -8.010 -10.235 1810 2HG ARG 88 2HG ARG 88 5.983 -6.432 -10.801 1811 1HD ARG 88 1HD ARG 88 5.620 -7.387 -12.871 1812 2HD ARG 88 2HD ARG 88 7.240 -8.057 -12.598 1813 HE ARG 88 HE ARG 88 5.106 -9.638 -11.370 1814 1HH1 ARG 88 1HH1 ARG 88 6.959 -9.045 -14.256 1815 2HH1 ARG 88 2HH1 ARG 88 6.693 -10.633 -14.886 1816 1HH2 ARG 88 1HH2 ARG 88 4.774 -11.694 -12.208 1817 2HH2 ARG 88 2HH2 ARG 88 5.466 -12.123 -13.737 1818 H ILE 89 H ILE 89 8.274 -8.191 -6.465 1819 HA ILE 89 HA ILE 89 11.011 -7.081 -6.548 1820 HB ILE 89 HB ILE 89 9.479 -8.768 -4.534 1821 1HG1 ILE 89 1HG1 ILE 89 10.189 -5.867 -4.210 1822 2HG1 ILE 89 2HG1 ILE 89 8.783 -6.309 -5.178 1823 1HG2 ILE 89 1HG2 ILE 89 11.418 -8.969 -3.410 1824 2HG2 ILE 89 2HG2 ILE 89 11.582 -7.213 -3.377 1825 3HG2 ILE 89 3HG2 ILE 89 12.261 -8.138 -4.717 1826 1HD1 ILE 89 1HD1 ILE 89 9.224 -7.379 -2.383 1827 2HD1 ILE 89 2HD1 ILE 89 7.738 -7.409 -3.334 1828 3HD1 ILE 89 3HD1 ILE 89 8.345 -5.882 -2.692 1829 H PHE 90 H PHE 90 12.846 -8.319 -6.921 1830 HA PHE 90 HA PHE 90 12.450 -11.267 -7.325 1831 1HB PHE 90 1HB PHE 90 13.634 -9.098 -9.024 1832 2HB PHE 90 2HB PHE 90 14.371 -10.698 -9.108 1833 HD1 PHE 90 HD1 PHE 90 12.996 -12.677 -9.772 1834 HD2 PHE 90 HD2 PHE 90 11.464 -8.667 -9.953 1835 HE1 PHE 90 HE1 PHE 90 11.157 -13.446 -11.247 1836 HE2 PHE 90 HE2 PHE 90 9.625 -9.436 -11.428 1837 HZ PHE 90 HZ PHE 90 9.471 -11.826 -12.075 1838 H THR 91 H THR 91 14.802 -12.300 -7.480 1839 HA THR 91 HA THR 91 16.415 -11.168 -5.217 1840 HB THR 91 HB THR 91 17.114 -13.715 -5.176 1841 HG1 THR 91 HG1 THR 91 15.890 -15.006 -6.306 1842 1HG2 THR 91 1HG2 THR 91 14.277 -13.025 -4.390 1843 2HG2 THR 91 2HG2 THR 91 15.676 -12.402 -3.517 1844 3HG2 THR 91 3HG2 THR 91 15.383 -14.140 -3.588 1845 H ILE 92 H ILE 92 17.906 -9.962 -6.482 1846 HA ILE 92 HA ILE 92 19.116 -10.633 -8.911 1847 HB ILE 92 HB ILE 92 20.969 -9.176 -8.053 1848 1HG1 ILE 92 1HG1 ILE 92 19.457 -9.448 -5.436 1849 2HG1 ILE 92 2HG1 ILE 92 21.066 -10.086 -5.769 1850 1HG2 ILE 92 1HG2 ILE 92 18.692 -8.303 -8.818 1851 2HG2 ILE 92 2HG2 ILE 92 19.618 -7.221 -7.778 1852 3HG2 ILE 92 3HG2 ILE 92 18.281 -8.156 -7.110 1853 1HD1 ILE 92 1HD1 ILE 92 21.736 -8.102 -4.852 1854 2HD1 ILE 92 2HD1 ILE 92 20.211 -7.298 -5.223 1855 3HD1 ILE 92 3HD1 ILE 92 21.432 -7.495 -6.480 1856 H LYS 93 H LYS 93 19.957 -11.789 -5.653 1857 HA LYS 93 HA LYS 93 21.783 -13.782 -6.952 1858 1HB LYS 93 1HB LYS 93 23.209 -13.484 -4.891 1859 2HB LYS 93 2HB LYS 93 23.096 -12.029 -5.881 1860 1HG LYS 93 1HG LYS 93 22.179 -10.884 -4.174 1861 2HG LYS 93 2HG LYS 93 20.916 -12.100 -3.986 1862 1HD LYS 93 1HD LYS 93 21.917 -12.491 -1.976 1863 2HD LYS 93 2HD LYS 93 23.075 -13.411 -2.935 1864 1HE LYS 93 1HE LYS 93 24.661 -11.664 -2.920 1865 2HE LYS 93 2HE LYS 93 23.442 -10.440 -2.519 1866 1HZ LYS 93 1HZ LYS 93 23.153 -11.391 -0.370 1867 2HZ LYS 93 2HZ LYS 93 24.826 -11.198 -0.591 1868 3HZ LYS 93 3HZ LYS 93 24.120 -12.734 -0.754 1869 HA PRO 94 HA PRO 94 19.479 -16.953 -5.002 1870 1HB PRO 94 1HB PRO 94 22.108 -17.999 -4.017 1871 2HB PRO 94 2HB PRO 94 20.835 -18.836 -4.926 1872 1HG PRO 94 1HG PRO 94 23.101 -18.029 -6.093 1873 2HG PRO 94 2HG PRO 94 21.550 -18.005 -6.944 1874 1HD PRO 94 1HD PRO 94 23.141 -15.753 -5.849 1875 2HD PRO 94 2HD PRO 94 22.028 -15.790 -7.233 1876 H ILE 95 H ILE 95 18.451 -16.945 -3.048 1877 HA ILE 95 HA ILE 95 19.904 -15.793 -0.692 1878 HB ILE 95 HB ILE 95 17.061 -15.727 -1.716 1879 1HG1 ILE 95 1HG1 ILE 95 18.908 -13.553 -0.709 1880 2HG1 ILE 95 2HG1 ILE 95 18.740 -14.007 -2.405 1881 1HG2 ILE 95 1HG2 ILE 95 17.919 -15.728 1.087 1882 2HG2 ILE 95 2HG2 ILE 95 16.298 -15.877 0.410 1883 3HG2 ILE 95 3HG2 ILE 95 17.011 -14.282 0.646 1884 1HD1 ILE 95 1HD1 ILE 95 16.797 -12.610 -0.609 1885 2HD1 ILE 95 2HD1 ILE 95 16.154 -13.661 -1.871 1886 3HD1 ILE 95 3HD1 ILE 95 17.185 -12.296 -2.300 1887 H ALA 96 H ALA 96 19.782 -16.932 1.277 1888 HA ALA 96 HA ALA 96 18.940 -19.775 1.056 1889 1HB ALA 96 1HB ALA 96 20.651 -18.135 2.948 1890 2HB ALA 96 2HB ALA 96 21.190 -19.363 1.803 1891 3HB ALA 96 3HB ALA 96 20.285 -19.835 3.241 1892 H ILE 97 H ILE 97 17.909 -20.733 3.058 1893 HA ILE 97 HA ILE 97 15.492 -19.358 3.771 1894 HB ILE 97 HB ILE 97 16.974 -21.732 4.957 1895 1HG1 ILE 97 1HG1 ILE 97 14.514 -21.866 3.241 1896 2HG1 ILE 97 2HG1 ILE 97 16.085 -21.627 2.477 1897 1HG2 ILE 97 1HG2 ILE 97 15.387 -21.825 6.551 1898 2HG2 ILE 97 2HG2 ILE 97 14.136 -21.865 5.308 1899 3HG2 ILE 97 3HG2 ILE 97 14.697 -20.319 5.946 1900 1HD1 ILE 97 1HD1 ILE 97 16.668 -23.643 4.221 1901 2HD1 ILE 97 2HD1 ILE 97 16.188 -23.905 2.544 1902 3HD1 ILE 97 3HD1 ILE 97 14.989 -24.018 3.832 1903 H GLY 98 H GLY 98 15.633 -17.475 4.961 1904 1HA GLY 98 1HA GLY 98 15.718 -16.656 7.299 1905 2HA GLY 98 2HA GLY 98 17.184 -17.614 7.513 1906 H GLU 99 H GLU 99 16.429 -15.607 4.694 1907 HA GLU 99 HA GLU 99 18.918 -14.053 5.240 1908 1HB GLU 99 1HB GLU 99 17.365 -15.005 2.900 1909 2HB GLU 99 2HB GLU 99 18.046 -13.388 2.720 1910 1HG GLU 99 1HG GLU 99 19.591 -15.880 3.502 1911 2HG GLU 99 2HG GLU 99 19.632 -15.100 1.921 1912 H GLU 100 H GLU 100 18.840 -11.696 4.992 1913 HA GLU 100 HA GLU 100 16.192 -10.576 5.786 1914 1HB GLU 100 1HB GLU 100 18.779 -10.299 6.742 1915 2HB GLU 100 2HB GLU 100 18.575 -8.839 5.773 1916 1HG GLU 100 1HG GLU 100 16.517 -9.745 7.800 1917 2HG GLU 100 2HG GLU 100 17.846 -8.665 8.219 1918 H ILE 101 H ILE 101 15.034 -9.915 4.008 1919 HA ILE 101 HA ILE 101 16.420 -8.831 1.628 1920 HB ILE 101 HB ILE 101 13.468 -9.211 2.258 1921 1HG1 ILE 101 1HG1 ILE 101 15.321 -11.074 0.747 1922 2HG1 ILE 101 2HG1 ILE 101 14.872 -11.305 2.437 1923 1HG2 ILE 101 1HG2 ILE 101 14.643 -7.842 0.177 1924 2HG2 ILE 101 2HG2 ILE 101 13.046 -8.586 0.115 1925 3HG2 ILE 101 3HG2 ILE 101 14.448 -9.456 -0.507 1926 1HD1 ILE 101 1HD1 ILE 101 12.638 -10.846 0.527 1927 2HD1 ILE 101 2HD1 ILE 101 12.722 -11.923 1.921 1928 3HD1 ILE 101 3HD1 ILE 101 13.475 -12.393 0.397 1929 H THR 102 H THR 102 16.879 -6.676 1.574 1930 HA THR 102 HA THR 102 14.926 -4.762 2.795 1931 HB THR 102 HB THR 102 16.781 -3.648 3.916 1932 HG1 THR 102 HG1 THR 102 18.410 -3.892 2.474 1933 1HG2 THR 102 1HG2 THR 102 15.872 -5.563 5.136 1934 2HG2 THR 102 2HG2 THR 102 17.615 -5.472 5.393 1935 3HG2 THR 102 3HG2 THR 102 16.952 -6.655 4.268 1936 H ILE 103 H ILE 103 16.590 -5.610 0.033 1937 HA ILE 103 HA ILE 103 17.467 -4.445 -1.831 1938 HB ILE 103 HB ILE 103 15.710 -3.044 -2.770 1939 1HG1 ILE 103 1HG1 ILE 103 14.422 -3.045 -0.030 1940 2HG1 ILE 103 2HG1 ILE 103 15.355 -1.692 -0.669 1941 1HG2 ILE 103 1HG2 ILE 103 15.384 -5.578 -2.344 1942 2HG2 ILE 103 2HG2 ILE 103 13.958 -4.622 -2.745 1943 3HG2 ILE 103 3HG2 ILE 103 14.272 -5.077 -1.071 1944 1HD1 ILE 103 1HD1 ILE 103 13.823 -1.452 -2.530 1945 2HD1 ILE 103 2HD1 ILE 103 12.875 -1.491 -1.043 1946 3HD1 ILE 103 3HD1 ILE 103 12.969 -2.924 -2.067 1947 H SER 104 H SER 104 16.831 -1.514 -2.274 1948 HA SER 104 HA SER 104 18.278 -0.123 -0.128 1949 1HB SER 104 1HB SER 104 20.007 -1.359 -1.478 1950 2HB SER 104 2HB SER 104 19.494 -0.447 -2.898 1951 HG SER 104 HG SER 104 21.249 0.569 -1.922 1952 H TYR 105 H TYR 105 19.039 2.157 -1.406 1953 HA TYR 105 HA TYR 105 16.540 3.091 -2.783 1954 1HB TYR 105 1HB TYR 105 18.335 4.761 -0.994 1955 2HB TYR 105 2HB TYR 105 16.688 5.114 -1.501 1956 HD1 TYR 105 HD1 TYR 105 18.443 4.345 1.285 1957 HD2 TYR 105 HD2 TYR 105 15.134 2.786 -0.968 1958 HE1 TYR 105 HE1 TYR 105 17.590 3.218 3.321 1959 HE2 TYR 105 HE2 TYR 105 14.280 1.658 1.071 1960 HH TYR 105 HH TYR 105 14.454 1.848 3.486 1961 H GLY 106 H GLY 106 19.824 4.402 -2.153 1962 1HA GLY 106 1HA GLY 106 21.503 4.938 -3.749 1963 2HA GLY 106 2HA GLY 106 20.413 4.413 -5.031 1964 H ASP 107 H ASP 107 21.061 6.436 -6.127 1965 HA ASP 107 HA ASP 107 20.664 8.665 -6.768 1966 1HB ASP 107 1HB ASP 107 18.387 7.810 -6.856 1967 2HB ASP 107 2HB ASP 107 18.200 8.005 -5.115 1968 H ASP 108 H ASP 108 18.937 9.119 -3.710 1969 HA ASP 108 HA ASP 108 21.285 10.401 -2.454 1970 1HB ASP 108 1HB ASP 108 19.764 11.869 -4.167 1971 2HB ASP 108 2HB ASP 108 18.865 12.123 -2.671 1972 H TYR 109 H TYR 109 19.194 8.218 -1.914 1973 HA TYR 109 HA TYR 109 17.884 9.338 0.519 1974 1HB TYR 109 1HB TYR 109 17.106 7.621 -1.549 1975 2HB TYR 109 2HB TYR 109 17.395 6.536 -0.189 1976 HD1 TYR 109 HD1 TYR 109 15.935 9.965 -0.686 1977 HD2 TYR 109 HD2 TYR 109 15.520 6.082 1.102 1978 HE1 TYR 109 HE1 TYR 109 13.781 10.661 0.327 1979 HE2 TYR 109 HE2 TYR 109 13.367 6.777 2.115 1980 HH TYR 109 HH TYR 109 11.530 8.881 1.259 1981 H TRP 110 H TRP 110 19.276 9.221 2.244 1982 HA TRP 110 HA TRP 110 20.712 8.308 3.862 1983 1HB TRP 110 1HB TRP 110 18.965 6.702 4.168 1984 2HB TRP 110 2HB TRP 110 19.347 5.879 2.662 1985 HD1 TRP 110 HD1 TRP 110 21.336 4.185 2.631 1986 HE1 TRP 110 HE1 TRP 110 22.717 3.066 4.507 1987 HE3 TRP 110 HE3 TRP 110 19.973 7.097 6.599 1988 HZ2 TRP 110 HZ2 TRP 110 23.178 3.366 7.311 1989 HZ3 TRP 110 HZ3 TRP 110 20.896 6.660 8.857 1990 HH2 TRP 110 HH2 TRP 110 22.495 4.800 9.218 1991 H LEU 111 H LEU 111 21.068 5.692 1.466 1992 HA LEU 111 HA LEU 111 23.915 5.609 1.672 1993 1HB LEU 111 1HB LEU 111 22.298 3.833 0.868 1994 2HB LEU 111 2HB LEU 111 22.137 4.743 -0.634 1995 HG LEU 111 HG LEU 111 24.861 3.967 0.389 1996 1HD1 LEU 111 1HD1 LEU 111 22.770 2.225 -0.829 1997 2HD1 LEU 111 2HD1 LEU 111 24.075 1.805 0.280 1998 3HD1 LEU 111 3HD1 LEU 111 24.416 2.044 -1.434 1999 1HD2 LEU 111 1HD2 LEU 111 25.221 5.304 -1.437 2000 2HD2 LEU 111 2HD2 LEU 111 23.622 4.990 -2.110 2001 3HD2 LEU 111 3HD2 LEU 111 24.913 3.806 -2.315 2002 H SER 112 H SER 112 21.859 6.910 -0.969 2003 HA SER 112 HA SER 112 22.357 8.482 -2.653 2004 1HB SER 112 1HB SER 112 22.508 10.042 -0.872 2005 2HB SER 112 2HB SER 112 23.999 9.330 -0.260 2006 HG SER 112 HG SER 112 23.587 11.067 -2.396 2007 H ARG 113 H ARG 113 25.651 8.661 -1.378 2008 HA ARG 113 HA ARG 113 26.662 7.618 -3.961 2009 1HB ARG 113 1HB ARG 113 27.762 9.122 -1.584 2010 2HB ARG 113 2HB ARG 113 28.854 8.410 -2.771 2011 1HG ARG 113 1HG ARG 113 26.578 10.015 -3.830 2012 2HG ARG 113 2HG ARG 113 27.878 10.904 -3.035 2013 1HD ARG 113 1HD ARG 113 29.058 8.920 -4.748 2014 2HD ARG 113 2HD ARG 113 27.875 9.854 -5.683 2015 HE ARG 113 HE ARG 113 30.348 10.892 -4.550 2016 1HH1 ARG 113 1HH1 ARG 113 27.051 11.658 -5.364 2017 2HH1 ARG 113 2HH1 ARG 113 27.372 13.348 -5.540 2018 1HH2 ARG 113 1HH2 ARG 113 30.740 13.089 -4.783 2019 2HH2 ARG 113 2HH2 ARG 113 29.444 14.155 -5.214 2020 HA PRO 114 HA PRO 114 27.273 3.645 -2.051 2021 1HB PRO 114 1HB PRO 114 29.101 2.673 -3.916 2022 2HB PRO 114 2HB PRO 114 27.340 2.616 -4.107 2023 1HG PRO 114 1HG PRO 114 29.318 4.503 -5.268 2024 2HG PRO 114 2HG PRO 114 27.829 3.856 -5.968 2025 1HD PRO 114 1HD PRO 114 28.037 6.379 -4.984 2026 2HD PRO 114 2HD PRO 114 26.518 5.458 -4.977 2027 H ARG 115 H ARG 115 30.430 4.094 -3.600 2028 HA ARG 115 HA ARG 115 32.588 4.104 -2.635 2029 1HB ARG 115 1HB ARG 115 30.873 6.190 -1.566 2030 2HB ARG 115 2HB ARG 115 32.084 5.725 -0.372 2031 1HG ARG 115 1HG ARG 115 33.478 7.103 -1.513 2032 2HG ARG 115 2HG ARG 115 33.555 5.807 -2.707 2033 1HD ARG 115 1HD ARG 115 32.744 7.362 -4.171 2034 2HD ARG 115 2HD ARG 115 31.187 7.124 -3.354 2035 HE ARG 115 HE ARG 115 31.513 9.208 -2.284 2036 1HH1 ARG 115 1HH1 ARG 115 34.532 7.957 -3.486 2037 2HH1 ARG 115 2HH1 ARG 115 35.419 9.377 -3.054 2038 1HH2 ARG 115 1HH2 ARG 115 32.687 11.040 -1.733 2039 2HH2 ARG 115 2HH2 ARG 115 34.384 11.111 -2.069 2040 H LEU 116 H LEU 116 31.665 1.729 -1.971 2041 HA LEU 116 HA LEU 116 31.324 1.365 0.924 2042 1HB LEU 116 1HB LEU 116 31.022 -0.108 -1.575 2043 2HB LEU 116 2HB LEU 116 31.821 -1.094 -0.350 2044 HG LEU 116 HG LEU 116 30.000 -0.553 1.248 2045 1HD1 LEU 116 1HD1 LEU 116 27.965 0.568 0.379 2046 2HD1 LEU 116 2HD1 LEU 116 28.789 0.852 -1.154 2047 3HD1 LEU 116 3HD1 LEU 116 29.369 1.633 0.318 2048 1HD2 LEU 116 1HD2 LEU 116 29.657 -2.595 0.102 2049 2HD2 LEU 116 2HD2 LEU 116 29.317 -1.780 -1.424 2050 3HD2 LEU 116 3HD2 LEU 116 28.136 -1.728 -0.115 2051 H THR 117 H THR 117 33.454 2.353 1.528 2052 HA THR 117 HA THR 117 35.580 0.282 1.551 2053 HB THR 117 HB THR 117 35.832 3.096 0.426 2054 HG1 THR 117 HG1 THR 117 36.559 1.831 -1.403 2055 1HG2 THR 117 1HG2 THR 117 37.818 2.601 1.741 2056 2HG2 THR 117 2HG2 THR 117 38.223 2.453 0.030 2057 3HG2 THR 117 3HG2 THR 117 37.953 1.005 1.000 2058 H GLN 118 H GLN 118 35.376 3.785 2.281 2059 HA GLN 118 HA GLN 118 35.840 4.952 4.279 2060 1HB GLN 118 1HB GLN 118 34.009 2.863 4.724 2061 2HB GLN 118 2HB GLN 118 35.162 2.737 6.053 2062 1HG GLN 118 1HG GLN 118 34.520 4.728 6.967 2063 2HG GLN 118 2HG GLN 118 34.291 5.488 5.392 2064 1HE2 GLN 118 1HE2 GLN 118 32.686 3.692 7.952 2065 2HE2 GLN 118 2HE2 GLN 118 31.129 3.753 7.279 2066 H ASN 119 H ASN 119 38.166 4.063 3.273 2067 HA ASN 119 HA ASN 119 39.834 3.640 5.589 2068 1HB ASN 119 1HB ASN 119 38.565 1.382 4.879 2069 2HB ASN 119 2HB ASN 119 39.910 1.284 3.742 2070 1HD2 ASN 119 1HD2 ASN 119 42.157 1.823 4.913 2071 2HD2 ASN 119 2HD2 ASN 119 42.377 1.072 6.419 2072 1H GLY 201 1H GLY 201 18.649 33.276 19.844 2073 2H GLY 201 2H GLY 201 18.048 33.381 18.259 2074 3H GLY 201 3H GLY 201 19.615 33.934 18.611 2075 1HA GLY 201 1HA GLY 201 19.929 31.468 19.420 2076 2HA GLY 201 2HA GLY 201 18.636 31.203 18.250 2077 H LYS 202 H LYS 202 20.431 29.993 17.108 2078 HA LYS 202 HA LYS 202 22.157 31.880 15.536 2079 1HB LYS 202 1HB LYS 202 22.529 29.136 16.716 2080 2HB LYS 202 2HB LYS 202 23.461 29.584 15.287 2081 1HG LYS 202 1HG LYS 202 24.918 30.491 16.780 2082 2HG LYS 202 2HG LYS 202 23.755 31.814 16.864 2083 1HD LYS 202 1HD LYS 202 23.012 31.201 18.934 2084 2HD LYS 202 2HD LYS 202 23.134 29.478 18.575 2085 1HE LYS 202 1HE LYS 202 25.754 30.809 18.668 2086 2HE LYS 202 2HE LYS 202 24.879 30.871 20.210 2087 1HZ LYS 202 1HZ LYS 202 25.178 28.424 18.545 2088 2HZ LYS 202 2HZ LYS 202 24.496 28.521 20.097 2089 3HZ LYS 202 3HZ LYS 202 26.161 28.783 19.883 2090 H ALA 203 H ALA 203 20.759 28.582 15.263 2091 HA ALA 203 HA ALA 203 20.166 29.198 12.386 2092 1HB ALA 203 1HB ALA 203 21.879 27.466 12.787 2093 2HB ALA 203 2HB ALA 203 20.429 26.730 12.104 2094 3HB ALA 203 3HB ALA 203 20.761 26.587 13.831 2095 HA PRO 204 HA PRO 204 16.074 28.756 14.430 2096 1HB PRO 204 1HB PRO 204 14.770 30.173 12.422 2097 2HB PRO 204 2HB PRO 204 15.448 30.907 13.886 2098 1HG PRO 204 1HG PRO 204 16.556 30.787 11.130 2099 2HG PRO 204 2HG PRO 204 16.656 32.081 12.332 2100 1HD PRO 204 1HD PRO 204 18.717 30.401 11.782 2101 2HD PRO 204 2HD PRO 204 18.468 31.136 13.380 2102 H ARG 205 H ARG 205 16.284 28.845 10.846 2103 HA ARG 205 HA ARG 205 15.676 26.004 10.601 2104 1HB ARG 205 1HB ARG 205 13.404 26.401 9.626 2105 2HB ARG 205 2HB ARG 205 13.497 26.905 11.314 2106 1HG ARG 205 1HG ARG 205 14.320 29.147 9.832 2107 2HG ARG 205 2HG ARG 205 12.931 28.502 8.958 2108 1HD ARG 205 1HD ARG 205 12.049 28.316 11.549 2109 2HD ARG 205 2HD ARG 205 13.038 29.788 11.617 2110 HE ARG 205 HE ARG 205 11.482 29.830 9.218 2111 1HH1 ARG 205 1HH1 ARG 205 11.128 30.073 12.672 2112 2HH1 ARG 205 2HH1 ARG 205 9.717 31.068 12.568 2113 1HH2 ARG 205 1HH2 ARG 205 9.650 31.122 9.108 2114 2HH2 ARG 205 2HH2 ARG 205 8.884 31.658 10.566 2115 H LYS 206 H LYS 206 17.079 25.666 8.906 2116 HA LYS 206 HA LYS 206 16.546 27.037 6.346 2117 1HB LYS 206 1HB LYS 206 18.919 27.811 6.210 2118 2HB LYS 206 2HB LYS 206 18.065 28.553 7.563 2119 1HG LYS 206 1HG LYS 206 19.100 26.148 8.582 2120 2HG LYS 206 2HG LYS 206 20.398 26.825 7.598 2121 1HD LYS 206 1HD LYS 206 18.857 28.446 9.640 2122 2HD LYS 206 2HD LYS 206 20.363 27.608 10.015 2123 1HE LYS 206 1HE LYS 206 20.585 29.184 7.561 2124 2HE LYS 206 2HE LYS 206 20.168 30.183 8.966 2125 1HZ LYS 206 1HZ LYS 206 21.980 29.325 10.179 2126 2HZ LYS 206 2HZ LYS 206 22.616 29.684 8.646 2127 3HZ LYS 206 3HZ LYS 206 22.256 28.077 9.061 2128 H GLN 207 H GLN 207 16.327 24.281 7.211 2129 HA GLN 207 HA GLN 207 18.624 22.988 5.790 2130 1HB GLN 207 1HB GLN 207 16.817 22.331 8.064 2131 2HB GLN 207 2HB GLN 207 17.272 20.979 7.028 2132 1HG GLN 207 1HG GLN 207 19.503 21.110 7.604 2133 2HG GLN 207 2HG GLN 207 19.437 22.851 7.880 2134 1HE2 GLN 207 1HE2 GLN 207 19.646 19.900 9.496 2135 2HE2 GLN 207 2HE2 GLN 207 19.089 20.398 11.020 2136 H LEU 208 H LEU 208 15.073 22.631 6.194 2137 HA LEU 208 HA LEU 208 14.771 20.950 3.858 2138 1HB LEU 208 1HB LEU 208 13.149 22.267 5.939 2139 2HB LEU 208 2HB LEU 208 12.314 22.113 4.393 2140 HG LEU 208 HG LEU 208 13.291 19.651 4.482 2141 1HD1 LEU 208 1HD1 LEU 208 13.357 18.809 6.808 2142 2HD1 LEU 208 2HD1 LEU 208 13.133 20.453 7.404 2143 3HD1 LEU 208 3HD1 LEU 208 14.605 20.024 6.533 2144 1HD2 LEU 208 1HD2 LEU 208 10.851 20.586 4.650 2145 2HD2 LEU 208 2HD2 LEU 208 11.021 20.231 6.370 2146 3HD2 LEU 208 3HD2 LEU 208 11.172 18.935 5.182 2147 H ALA 209 H ALA 209 15.469 21.895 1.929 2148 HA ALA 209 HA ALA 209 14.009 24.356 1.067 2149 1HB ALA 209 1HB ALA 209 16.586 24.395 1.975 2150 2HB ALA 209 2HB ALA 209 15.968 25.523 0.768 2151 3HB ALA 209 3HB ALA 209 16.856 24.086 0.260 2152 H THR 210 H THR 210 15.337 24.572 -1.426 2153 HA THR 210 HA THR 210 13.927 22.696 -3.037 2154 HB THR 210 HB THR 210 14.703 24.892 -3.801 2155 HG1 THR 210 HG1 THR 210 14.740 23.939 -5.653 2156 1HG2 THR 210 1HG2 THR 210 16.754 25.612 -3.219 2157 2HG2 THR 210 2HG2 THR 210 17.471 24.393 -4.272 2158 3HG2 THR 210 3HG2 THR 210 17.144 24.015 -2.580 2159 H LYS 211 H LYS 211 14.393 20.523 -2.499 2160 HA LYS 211 HA LYS 211 17.051 19.544 -3.399 2161 1HB LYS 211 1HB LYS 211 16.002 19.685 -0.637 2162 2HB LYS 211 2HB LYS 211 16.641 18.103 -1.084 2163 1HG LYS 211 1HG LYS 211 18.344 20.306 -1.993 2164 2HG LYS 211 2HG LYS 211 18.152 20.274 -0.240 2165 1HD LYS 211 1HD LYS 211 19.518 18.492 -0.082 2166 2HD LYS 211 2HD LYS 211 18.525 17.588 -1.225 2167 1HE LYS 211 1HE LYS 211 20.260 19.708 -2.397 2168 2HE LYS 211 2HE LYS 211 21.083 18.266 -1.773 2169 1HZ LYS 211 1HZ LYS 211 20.402 17.808 -4.006 2170 2HZ LYS 211 2HZ LYS 211 18.824 18.361 -3.707 2171 3HZ LYS 211 3HZ LYS 211 19.375 16.931 -2.976 2172 H ALA 212 H ALA 212 14.128 18.323 -1.707 2173 HA ALA 212 HA ALA 212 12.760 16.461 -2.196 2174 1HB ALA 212 1HB ALA 212 13.449 16.822 -5.085 2175 2HB ALA 212 2HB ALA 212 12.748 18.203 -4.244 2176 3HB ALA 212 3HB ALA 212 11.864 16.679 -4.326 2177 H ALA 213 H ALA 213 14.043 14.743 -1.364 2178 HA ALA 213 HA ALA 213 15.777 13.345 -3.378 2179 1HB ALA 213 1HB ALA 213 16.202 14.288 -0.681 2180 2HB ALA 213 2HB ALA 213 17.365 13.532 -1.770 2181 3HB ALA 213 3HB ALA 213 16.368 12.533 -0.713 2182 H ARG 214 H ARG 214 15.362 11.139 -3.684 2183 HA ARG 214 HA ARG 214 13.452 9.779 -1.850 2184 1HB ARG 214 1HB ARG 214 13.064 10.574 -4.717 2185 2HB ARG 214 2HB ARG 214 12.352 9.055 -4.172 2186 1HG ARG 214 1HG ARG 214 11.307 10.337 -2.260 2187 2HG ARG 214 2HG ARG 214 11.866 11.821 -3.033 2188 1HD ARG 214 1HD ARG 214 10.263 9.826 -4.628 2189 2HD ARG 214 2HD ARG 214 9.439 10.981 -3.562 2190 HE ARG 214 HE ARG 214 10.854 11.641 -6.028 2191 1HH1 ARG 214 1HH1 ARG 214 9.924 12.768 -2.868 2192 2HH1 ARG 214 2HH1 ARG 214 10.004 14.435 -3.318 2193 1HH2 ARG 214 1HH2 ARG 214 10.951 13.813 -6.588 2194 2HH2 ARG 214 2HH2 ARG 214 10.581 15.026 -5.408 2195 1HN MLZ 215 1HN MLZ 215 13.073 7.437 -3.086 2196 HA MLZ 215 HA MLZ 215 15.772 6.253 -3.156 2197 1HB MLZ 215 1HB MLZ 215 12.972 5.084 -3.385 2198 2HB MLZ 215 2HB MLZ 215 14.446 4.153 -3.121 2199 1HG MLZ 215 1HG MLZ 215 13.799 6.405 -1.247 2200 2HG MLZ 215 2HG MLZ 215 14.701 4.922 -0.939 2201 1HD MLZ 215 1HD MLZ 215 11.802 5.427 -0.775 2202 2HD MLZ 215 2HD MLZ 215 12.226 3.941 -1.625 2203 1HE MLZ 215 1HE MLZ 215 13.836 4.287 0.789 2204 2HE MLZ 215 2HE MLZ 215 12.804 2.922 0.320 2205 HZ MLZ 215 HZ MLZ 215 10.877 4.100 1.047 2206 1HCM MLZ 215 1HCM MLZ 215 11.675 3.057 2.898 2207 2HCM MLZ 215 2HCM MLZ 215 11.661 4.735 3.439 2208 3HCM MLZ 215 3HCM MLZ 215 13.164 4.000 2.882 2209 H SER 216 H SER 216 16.831 6.249 -5.106 2210 HA SER 216 HA SER 216 17.217 5.861 -7.407 2211 1HB SER 216 1HB SER 216 15.906 7.308 -8.729 2212 2HB SER 216 2HB SER 216 14.443 6.977 -7.802 2213 HG SER 216 HG SER 216 16.093 8.974 -7.486 2214 H ALA 217 H ALA 217 15.803 5.016 -9.498 2215 HA ALA 217 HA ALA 217 14.776 2.373 -8.638 2216 1HB ALA 217 1HB ALA 217 12.599 2.896 -9.022 2217 2HB ALA 217 2HB ALA 217 12.994 3.595 -10.593 2218 3HB ALA 217 3HB ALA 217 13.101 4.583 -9.136 2219 HA PRO 218 HA PRO 218 16.671 1.062 -12.374 2220 1HB PRO 218 1HB PRO 218 14.859 -0.840 -13.279 2221 2HB PRO 218 2HB PRO 218 16.056 -1.130 -12.005 2222 1HG PRO 218 1HG PRO 218 13.153 -0.529 -11.786 2223 2HG PRO 218 2HG PRO 218 14.163 -1.593 -10.798 2224 1HD PRO 218 1HD PRO 218 13.357 0.872 -9.987 2225 2HD PRO 218 2HD PRO 218 14.878 0.125 -9.455 2226 H ALA 219 H ALA 219 16.666 1.801 -14.490 2227 HA ALA 219 HA ALA 219 14.443 3.464 -15.391 2228 1HB ALA 219 1HB ALA 219 16.145 3.268 -17.501 2229 2HB ALA 219 2HB ALA 219 17.210 2.721 -16.206 2230 3HB ALA 219 3HB ALA 219 16.459 4.314 -16.117 2231 H THR 220 H THR 220 13.057 1.273 -15.204 2232 HA THR 220 HA THR 220 11.818 -0.369 -16.364 2233 HB THR 220 HB THR 220 12.744 1.002 -18.883 2234 HG1 THR 220 HG1 THR 220 11.411 2.733 -18.379 2235 1HG2 THR 220 1HG2 THR 220 11.063 -0.715 -19.135 2236 2HG2 THR 220 2HG2 THR 220 10.263 0.844 -19.338 2237 3HG2 THR 220 3HG2 THR 220 10.103 -0.038 -17.819 2238 H GLY 221 H GLY 221 13.062 -2.254 -16.043 2239 1HA GLY 221 1HA GLY 221 13.959 -3.901 -17.911 2240 2HA GLY 221 2HA GLY 221 15.313 -2.771 -17.912 2241 1HN SAH 301 1HN SAH 301 -11.910 -0.986 -8.456 2242 2HN SAH 301 2HN SAH 301 -10.885 -0.395 -9.677 2243 HA SAH 301 HA SAH 301 -10.766 1.738 -8.255 2244 1HB SAH 301 1HB SAH 301 -11.915 -0.407 -6.443 2245 2HB SAH 301 2HB SAH 301 -11.125 1.038 -5.813 2246 1HG SAH 301 1HG SAH 301 -13.803 0.848 -6.463 2247 2HG SAH 301 2HG SAH 301 -13.113 1.610 -7.895 2248 1H5* SAH 301 1H5* SAH 301 -15.089 2.178 -5.643 2249 2H5* SAH 301 2H5* SAH 301 -14.710 3.479 -4.515 2250 H4* SAH 301 H4* SAH 301 -14.591 4.960 -6.557 2251 H3* SAH 301 H3* SAH 301 -16.764 4.027 -4.906 2252 *HO3 SAH 301 *HO3 SAH 301 -15.895 6.152 -4.989 2253 H2* SAH 301 H2* SAH 301 -18.322 3.441 -6.399 2254 *HO2 SAH 301 *HO2 SAH 301 -18.631 5.110 -8.218 2255 H1* SAH 301 H1* SAH 301 -17.068 4.030 -8.920 2256 H8 SAH 301 H8 SAH 301 -15.864 0.897 -7.262 2257 1HN6 SAH 301 1HN6 SAH 301 -19.754 -2.203 -8.784 2258 2HN6 SAH 301 2HN6 SAH 301 -21.040 -1.717 -7.703 2259 H2 SAH 301 H2 SAH 301 -21.487 2.447 -9.890 2260 1HN SAH 302 1HN SAH 302 11.789 -0.964 8.443 2261 2HN SAH 302 2HN SAH 302 10.750 -0.376 9.652 2262 HA SAH 302 HA SAH 302 10.652 1.757 8.229 2263 1HB SAH 302 1HB SAH 302 11.820 -0.391 6.433 2264 2HB SAH 302 2HB SAH 302 11.036 1.052 5.791 2265 1HG SAH 302 1HG SAH 302 13.707 0.867 6.473 2266 2HG SAH 302 2HG SAH 302 13.001 1.630 7.897 2267 1H5* SAH 302 1H5* SAH 302 15.001 2.199 5.669 2268 2H5* SAH 302 2H5* SAH 302 14.634 3.499 4.535 2269 H4* SAH 302 H4* SAH 302 14.487 4.981 6.574 2270 H3* SAH 302 H3* SAH 302 16.682 4.049 4.951 2271 *HO3 SAH 302 *HO3 SAH 302 15.809 6.175 5.023 2272 H2* SAH 302 H2* SAH 302 18.223 3.468 6.464 2273 *HO2 SAH 302 *HO2 SAH 302 18.507 5.138 8.285 2274 H1* SAH 302 H1* SAH 302 16.937 4.057 8.969 2275 H8 SAH 302 H8 SAH 302 15.758 0.921 7.298 2276 1HN6 SAH 302 1HN6 SAH 302 19.633 -2.172 8.872 2277 2HN6 SAH 302 2HN6 SAH 302 20.931 -1.685 7.807 2278 H2 SAH 302 H2 SAH 302 21.345 2.482 9.996 Start of MODEL 16 1 1H MET 1 1H MET 1 0.699 -11.944 -7.706 2 2H MET 1 2H MET 1 0.941 -11.516 -6.080 3 3H MET 1 3H MET 1 1.632 -10.579 -7.317 4 HA MET 1 HA MET 1 -0.457 -9.653 -6.221 5 1HB MET 1 1HB MET 1 0.643 -9.741 -8.865 6 2HB MET 1 2HB MET 1 -1.113 -9.672 -9.016 7 1HG MET 1 1HG MET 1 0.435 -7.824 -7.187 8 2HG MET 1 2HG MET 1 0.082 -7.417 -8.866 9 1HE MET 1 1HE MET 1 -2.346 -5.119 -7.165 10 2HE MET 1 2HE MET 1 -0.700 -5.387 -7.739 11 3HE MET 1 3HE MET 1 -1.115 -5.728 -6.059 12 H PHE 2 H PHE 2 -0.707 -12.756 -6.442 13 HA PHE 2 HA PHE 2 -3.601 -12.845 -6.341 14 1HB PHE 2 1HB PHE 2 -3.823 -14.255 -8.425 15 2HB PHE 2 2HB PHE 2 -3.344 -12.591 -8.750 16 HD1 PHE 2 HD1 PHE 2 -2.322 -16.101 -8.835 17 HD2 PHE 2 HD2 PHE 2 -0.987 -12.048 -9.320 18 HE1 PHE 2 HE1 PHE 2 -0.275 -16.911 -9.977 19 HE2 PHE 2 HE2 PHE 2 1.059 -12.857 -10.460 20 HZ PHE 2 HZ PHE 2 1.416 -15.288 -10.789 21 H ASN 3 H ASN 3 -3.936 -14.433 -4.852 22 HA ASN 3 HA ASN 3 -2.094 -16.802 -4.871 23 1HB ASN 3 1HB ASN 3 -2.557 -16.809 -2.388 24 2HB ASN 3 2HB ASN 3 -1.733 -15.352 -2.941 25 1HD2 ASN 3 1HD2 ASN 3 -2.818 -14.542 -0.793 26 2HD2 ASN 3 2HD2 ASN 3 -4.382 -13.898 -0.937 27 H ASP 4 H ASP 4 -3.138 -18.808 -4.015 28 HA ASP 4 HA ASP 4 -5.465 -19.573 -5.348 29 1HB ASP 4 1HB ASP 4 -5.465 -21.440 -3.709 30 2HB ASP 4 2HB ASP 4 -3.824 -21.057 -4.229 31 H ARG 5 H ARG 5 -5.206 -17.779 -2.339 32 HA ARG 5 HA ARG 5 -7.931 -18.263 -1.451 33 1HB ARG 5 1HB ARG 5 -5.999 -17.615 -0.007 34 2HB ARG 5 2HB ARG 5 -5.951 -16.047 -0.806 35 1HG ARG 5 1HG ARG 5 -7.876 -15.306 0.213 36 2HG ARG 5 2HG ARG 5 -8.559 -16.928 0.329 37 1HD ARG 5 1HD ARG 5 -7.968 -16.238 2.573 38 2HD ARG 5 2HD ARG 5 -6.762 -17.423 2.054 39 HE ARG 5 HE ARG 5 -5.934 -14.796 1.249 40 1HH1 ARG 5 1HH1 ARG 5 -6.269 -16.813 4.066 41 2HH1 ARG 5 2HH1 ARG 5 -5.002 -16.010 4.927 42 1HH2 ARG 5 1HH2 ARG 5 -4.294 -13.770 2.386 43 2HH2 ARG 5 2HH2 ARG 5 -3.891 -14.300 3.985 44 H VAL 6 H VAL 6 -6.317 -15.541 -3.136 45 HA VAL 6 HA VAL 6 -8.904 -14.807 -4.375 46 HB VAL 6 HB VAL 6 -8.641 -12.452 -3.491 47 1HG1 VAL 6 1HG1 VAL 6 -10.111 -14.251 -2.444 48 2HG1 VAL 6 2HG1 VAL 6 -9.641 -12.932 -1.371 49 3HG1 VAL 6 3HG1 VAL 6 -8.823 -14.490 -1.264 50 1HG2 VAL 6 1HG2 VAL 6 -6.193 -12.700 -2.984 51 2HG2 VAL 6 2HG2 VAL 6 -6.626 -13.743 -1.629 52 3HG2 VAL 6 3HG2 VAL 6 -7.127 -12.053 -1.635 53 H ILE 7 H ILE 7 -8.406 -12.602 -5.676 54 HA ILE 7 HA ILE 7 -5.628 -12.507 -6.697 55 HB ILE 7 HB ILE 7 -6.673 -14.327 -7.960 56 1HG1 ILE 7 1HG1 ILE 7 -6.641 -11.786 -9.616 57 2HG1 ILE 7 2HG1 ILE 7 -5.220 -12.742 -9.203 58 1HG2 ILE 7 1HG2 ILE 7 -9.008 -12.812 -7.583 59 2HG2 ILE 7 2HG2 ILE 7 -8.868 -14.324 -8.481 60 3HG2 ILE 7 3HG2 ILE 7 -8.721 -12.781 -9.323 61 1HD1 ILE 7 1HD1 ILE 7 -7.501 -13.439 -11.032 62 2HD1 ILE 7 2HD1 ILE 7 -6.584 -14.725 -10.246 63 3HD1 ILE 7 3HD1 ILE 7 -5.766 -13.585 -11.315 64 H VAL 8 H VAL 8 -5.219 -10.532 -7.847 65 HA VAL 8 HA VAL 8 -7.251 -8.422 -7.360 66 HB VAL 8 HB VAL 8 -4.352 -8.370 -8.277 67 1HG1 VAL 8 1HG1 VAL 8 -4.435 -5.985 -7.915 68 2HG1 VAL 8 2HG1 VAL 8 -6.069 -6.089 -7.259 69 3HG1 VAL 8 3HG1 VAL 8 -5.786 -6.399 -8.972 70 1HG2 VAL 8 1HG2 VAL 8 -5.671 -7.894 -5.589 71 2HG2 VAL 8 2HG2 VAL 8 -3.981 -7.529 -5.939 72 3HG2 VAL 8 3HG2 VAL 8 -4.555 -9.195 -6.001 73 H LYS 9 H LYS 9 -8.606 -7.894 -8.998 74 HA LYS 9 HA LYS 9 -7.629 -8.154 -11.803 75 1HB LYS 9 1HB LYS 9 -10.166 -8.902 -10.463 76 2HB LYS 9 2HB LYS 9 -10.163 -8.589 -12.186 77 1HG LYS 9 1HG LYS 9 -8.366 -10.280 -12.451 78 2HG LYS 9 2HG LYS 9 -8.428 -10.600 -10.720 79 1HD LYS 9 1HD LYS 9 -10.346 -11.814 -10.890 80 2HD LYS 9 2HD LYS 9 -11.037 -10.734 -12.100 81 1HE LYS 9 1HE LYS 9 -9.472 -11.731 -13.796 82 2HE LYS 9 2HE LYS 9 -8.965 -12.897 -12.564 83 1HZ LYS 9 1HZ LYS 9 -11.779 -12.421 -13.403 84 2HZ LYS 9 2HZ LYS 9 -11.246 -13.591 -12.293 85 3HZ LYS 9 3HZ LYS 9 -10.828 -13.724 -13.934 86 H LYS 10 H LYS 10 -9.009 -4.892 -12.532 87 HA LYS 10 HA LYS 10 -8.137 -5.786 -14.502 88 1HB LYS 10 1HB LYS 10 -6.479 -6.589 -12.230 89 2HB LYS 10 2HB LYS 10 -6.309 -7.681 -13.604 90 1HG LYS 10 1HG LYS 10 -6.190 -4.676 -13.914 91 2HG LYS 10 2HG LYS 10 -4.753 -5.640 -13.571 92 1HD LYS 10 1HD LYS 10 -6.612 -6.022 -15.940 93 2HD LYS 10 2HD LYS 10 -5.010 -5.287 -16.000 94 1HE LYS 10 1HE LYS 10 -4.157 -7.504 -14.962 95 2HE LYS 10 2HE LYS 10 -5.729 -8.171 -15.442 96 1HZ LYS 10 1HZ LYS 10 -4.065 -8.385 -17.219 97 2HZ LYS 10 2HZ LYS 10 -3.863 -6.699 -17.235 98 3HZ LYS 10 3HZ LYS 10 -5.352 -7.380 -17.688 99 H SER 11 H SER 11 -10.521 -6.842 -14.240 100 HA SER 11 HA SER 11 -10.244 -9.817 -14.380 101 1HB SER 11 1HB SER 11 -12.341 -9.859 -13.422 102 2HB SER 11 2HB SER 11 -11.913 -8.225 -12.922 103 HG SER 11 HG SER 11 -13.949 -8.324 -13.967 104 HA PRO 12 HA PRO 12 -11.484 -10.144 -18.591 105 1HB PRO 12 1HB PRO 12 -14.300 -10.916 -18.044 106 2HB PRO 12 2HB PRO 12 -13.030 -11.828 -18.878 107 1HG PRO 12 1HG PRO 12 -13.890 -12.472 -16.415 108 2HG PRO 12 2HG PRO 12 -12.219 -12.724 -16.936 109 1HD PRO 12 1HD PRO 12 -13.348 -10.635 -15.142 110 2HD PRO 12 2HD PRO 12 -11.761 -11.433 -15.097 111 H LEU 13 H LEU 13 -14.082 -8.659 -16.650 112 HA LEU 13 HA LEU 13 -14.999 -7.018 -18.918 113 1HB LEU 13 1HB LEU 13 -15.718 -7.402 -16.006 114 2HB LEU 13 2HB LEU 13 -16.441 -6.097 -16.947 115 HG LEU 13 HG LEU 13 -16.496 -8.625 -18.397 116 1HD1 LEU 13 1HD1 LEU 13 -18.260 -9.648 -16.925 117 2HD1 LEU 13 2HD1 LEU 13 -17.843 -8.466 -15.685 118 3HD1 LEU 13 3HD1 LEU 13 -16.650 -9.656 -16.206 119 1HD2 LEU 13 1HD2 LEU 13 -18.601 -7.864 -19.005 120 2HD2 LEU 13 2HD2 LEU 13 -17.843 -6.338 -18.548 121 3HD2 LEU 13 3HD2 LEU 13 -18.918 -7.161 -17.418 122 H GLY 14 H GLY 14 -12.820 -6.722 -16.202 123 1HA GLY 14 1HA GLY 14 -11.114 -4.912 -16.382 124 2HA GLY 14 2HA GLY 14 -12.411 -3.848 -16.926 125 H GLY 15 H GLY 15 -11.896 -2.397 -15.144 126 1HA GLY 15 1HA GLY 15 -12.465 -1.515 -13.036 127 2HA GLY 15 2HA GLY 15 -13.459 -2.947 -12.765 128 H TYR 16 H TYR 16 -11.273 -1.471 -11.133 129 HA TYR 16 HA TYR 16 -9.361 -3.723 -10.749 130 1HB TYR 16 1HB TYR 16 -9.347 -0.833 -10.569 131 2HB TYR 16 2HB TYR 16 -8.809 -1.527 -9.041 132 HD1 TYR 16 HD1 TYR 16 -7.146 -3.605 -9.314 133 HD2 TYR 16 HD2 TYR 16 -7.764 -0.529 -12.248 134 HE1 TYR 16 HE1 TYR 16 -4.947 -4.133 -10.331 135 HE2 TYR 16 HE2 TYR 16 -5.565 -1.057 -13.265 136 HH TYR 16 HH TYR 16 -3.914 -2.646 -13.348 137 H GLY 17 H GLY 17 -11.328 -4.931 -9.769 138 1HA GLY 17 1HA GLY 17 -11.697 -4.132 -6.907 139 2HA GLY 17 2HA GLY 17 -12.870 -5.083 -7.820 140 H VAL 18 H VAL 18 -12.336 -6.436 -5.679 141 HA VAL 18 HA VAL 18 -9.908 -8.117 -6.153 142 HB VAL 18 HB VAL 18 -11.832 -7.804 -3.820 143 1HG1 VAL 18 1HG1 VAL 18 -10.309 -10.027 -4.366 144 2HG1 VAL 18 2HG1 VAL 18 -10.775 -9.515 -2.745 145 3HG1 VAL 18 3HG1 VAL 18 -9.198 -9.066 -3.391 146 1HG2 VAL 18 1HG2 VAL 18 -9.124 -6.690 -4.504 147 2HG2 VAL 18 2HG2 VAL 18 -9.593 -6.896 -2.816 148 3HG2 VAL 18 3HG2 VAL 18 -10.540 -5.849 -3.874 149 H PHE 19 H PHE 19 -10.127 -10.376 -6.442 150 HA PHE 19 HA PHE 19 -12.907 -11.300 -7.073 151 1HB PHE 19 1HB PHE 19 -10.356 -11.395 -8.422 152 2HB PHE 19 2HB PHE 19 -10.913 -13.041 -8.121 153 HD1 PHE 19 HD1 PHE 19 -12.753 -13.965 -9.325 154 HD2 PHE 19 HD2 PHE 19 -11.884 -9.767 -9.604 155 HE1 PHE 19 HE1 PHE 19 -14.383 -13.751 -11.181 156 HE2 PHE 19 HE2 PHE 19 -13.515 -9.554 -11.460 157 HZ PHE 19 HZ PHE 19 -14.765 -11.546 -12.249 158 H ALA 20 H ALA 20 -13.717 -12.821 -5.696 159 HA ALA 20 HA ALA 20 -11.954 -13.994 -3.644 160 1HB ALA 20 1HB ALA 20 -14.697 -14.899 -3.610 161 2HB ALA 20 2HB ALA 20 -14.659 -13.165 -3.929 162 3HB ALA 20 3HB ALA 20 -13.889 -13.812 -2.480 163 H ARG 21 H ARG 21 -10.736 -15.530 -4.934 164 HA ARG 21 HA ARG 21 -11.844 -17.502 -6.670 165 1HB ARG 21 1HB ARG 21 -9.369 -16.725 -5.726 166 2HB ARG 21 2HB ARG 21 -9.573 -18.295 -4.950 167 1HG ARG 21 1HG ARG 21 -8.993 -19.272 -6.893 168 2HG ARG 21 2HG ARG 21 -10.466 -18.620 -7.612 169 1HD ARG 21 1HD ARG 21 -9.253 -17.171 -8.865 170 2HD ARG 21 2HD ARG 21 -8.436 -16.549 -7.418 171 HE ARG 21 HE ARG 21 -6.645 -18.032 -7.867 172 1HH1 ARG 21 1HH1 ARG 21 -9.502 -18.970 -9.622 173 2HH1 ARG 21 2HH1 ARG 21 -8.686 -20.214 -10.504 174 1HH2 ARG 21 1HH2 ARG 21 -5.608 -19.652 -9.024 175 2HH2 ARG 21 2HH2 ARG 21 -6.498 -20.599 -10.169 176 H LYS 22 H LYS 22 -11.861 -17.182 -3.203 177 HA LYS 22 HA LYS 22 -12.593 -20.009 -2.734 178 1HB LYS 22 1HB LYS 22 -11.461 -17.765 -1.327 179 2HB LYS 22 2HB LYS 22 -12.884 -18.314 -0.448 180 1HG LYS 22 1HG LYS 22 -11.932 -20.329 0.089 181 2HG LYS 22 2HG LYS 22 -11.075 -20.446 -1.447 182 1HD LYS 22 1HD LYS 22 -9.654 -18.458 -0.514 183 2HD LYS 22 2HD LYS 22 -10.282 -18.968 1.053 184 1HE LYS 22 1HE LYS 22 -8.946 -20.896 -0.873 185 2HE LYS 22 2HE LYS 22 -8.064 -20.039 0.405 186 1HZ LYS 22 1HZ LYS 22 -9.397 -21.000 2.058 187 2HZ LYS 22 2HZ LYS 22 -9.066 -22.291 1.005 188 3HZ LYS 22 3HZ LYS 22 -10.576 -21.514 0.948 189 H SER 23 H SER 23 -16.019 -19.249 -1.547 190 HA SER 23 HA SER 23 -13.512 -20.786 -1.051 191 1HB SER 23 1HB SER 23 -15.508 -22.049 -1.633 192 2HB SER 23 2HB SER 23 -15.179 -22.323 0.078 193 HG SER 23 HG SER 23 -17.191 -21.716 0.246 194 H PHE 24 H PHE 24 -15.545 -18.370 0.375 195 HA PHE 24 HA PHE 24 -13.932 -18.542 2.885 196 1HB PHE 24 1HB PHE 24 -15.475 -16.363 1.445 197 2HB PHE 24 2HB PHE 24 -14.808 -16.133 3.061 198 HD1 PHE 24 HD1 PHE 24 -14.168 -15.423 -0.225 199 HD2 PHE 24 HD2 PHE 24 -12.243 -17.235 3.161 200 HE1 PHE 24 HE1 PHE 24 -11.951 -14.910 -1.210 201 HE2 PHE 24 HE2 PHE 24 -10.025 -16.720 2.174 202 HZ PHE 24 HZ PHE 24 -9.880 -15.559 -0.006 203 H GLU 25 H GLU 25 -15.078 -18.042 4.922 204 HA GLU 25 HA GLU 25 -17.848 -19.152 4.932 205 1HB GLU 25 1HB GLU 25 -15.487 -19.458 6.495 206 2HB GLU 25 2HB GLU 25 -16.675 -18.661 7.527 207 1HG GLU 25 1HG GLU 25 -16.858 -21.124 7.683 208 2HG GLU 25 2HG GLU 25 -18.322 -20.416 7.001 209 H LYS 26 H LYS 26 -18.693 -18.015 7.369 210 HA LYS 26 HA LYS 26 -19.199 -15.217 6.503 211 1HB LYS 26 1HB LYS 26 -21.025 -16.836 7.107 212 2HB LYS 26 2HB LYS 26 -20.386 -16.887 8.747 213 1HG LYS 26 1HG LYS 26 -20.660 -14.369 8.826 214 2HG LYS 26 2HG LYS 26 -21.530 -14.489 7.297 215 1HD LYS 26 1HD LYS 26 -23.248 -15.840 8.278 216 2HD LYS 26 2HD LYS 26 -22.308 -16.078 9.752 217 1HE LYS 26 1HE LYS 26 -23.125 -14.158 10.643 218 2HE LYS 26 2HE LYS 26 -22.665 -13.240 9.197 219 1HZ LYS 26 1HZ LYS 26 -24.624 -13.903 8.090 220 2HZ LYS 26 2HZ LYS 26 -25.134 -13.434 9.641 221 3HZ LYS 26 3HZ LYS 26 -24.991 -15.082 9.256 222 H GLY 27 H GLY 27 -17.334 -14.075 7.167 223 1HA GLY 27 1HA GLY 27 -16.499 -12.636 8.945 224 2HA GLY 27 2HA GLY 27 -16.994 -13.858 10.117 225 H GLU 28 H GLU 28 -14.911 -13.802 7.194 226 HA GLU 28 HA GLU 28 -12.782 -15.126 8.844 227 1HB GLU 28 1HB GLU 28 -14.306 -16.108 6.637 228 2HB GLU 28 2HB GLU 28 -12.658 -15.858 6.062 229 1HG GLU 28 1HG GLU 28 -11.850 -17.120 8.096 230 2HG GLU 28 2HG GLU 28 -13.534 -17.513 8.445 231 H LEU 29 H LEU 29 -10.996 -13.830 8.879 232 HA LEU 29 HA LEU 29 -10.617 -11.473 7.365 233 1HB LEU 29 1HB LEU 29 -9.468 -12.507 9.497 234 2HB LEU 29 2HB LEU 29 -8.341 -13.201 8.332 235 HG LEU 29 HG LEU 29 -7.512 -11.033 9.161 236 1HD1 LEU 29 1HD1 LEU 29 -7.440 -11.856 6.631 237 2HD1 LEU 29 2HD1 LEU 29 -6.820 -10.269 7.089 238 3HD1 LEU 29 3HD1 LEU 29 -8.429 -10.417 6.382 239 1HD2 LEU 29 1HD2 LEU 29 -9.326 -9.261 7.842 240 2HD2 LEU 29 2HD2 LEU 29 -8.952 -9.354 9.563 241 3HD2 LEU 29 3HD2 LEU 29 -10.265 -10.321 8.892 242 H VAL 30 H VAL 30 -9.884 -11.124 5.297 243 HA VAL 30 HA VAL 30 -9.042 -13.503 3.701 244 HB VAL 30 HB VAL 30 -10.070 -10.727 2.999 245 1HG1 VAL 30 1HG1 VAL 30 -9.234 -13.060 1.259 246 2HG1 VAL 30 2HG1 VAL 30 -8.632 -11.403 1.202 247 3HG1 VAL 30 3HG1 VAL 30 -10.278 -11.763 0.678 248 1HG2 VAL 30 1HG2 VAL 30 -11.463 -12.893 3.932 249 2HG2 VAL 30 2HG2 VAL 30 -11.540 -13.156 2.190 250 3HG2 VAL 30 3HG2 VAL 30 -12.147 -11.652 2.883 251 H GLU 31 H GLU 31 -8.092 -10.158 4.484 252 HA GLU 31 HA GLU 31 -5.265 -10.790 4.169 253 1HB GLU 31 1HB GLU 31 -6.514 -10.452 1.830 254 2HB GLU 31 2HB GLU 31 -6.284 -8.748 2.221 255 1HG GLU 31 1HG GLU 31 -4.050 -8.851 1.841 256 2HG GLU 31 2HG GLU 31 -3.891 -10.385 2.698 257 H GLU 32 H GLU 32 -3.921 -8.949 4.787 258 HA GLU 32 HA GLU 32 -5.305 -6.483 5.683 259 1HB GLU 32 1HB GLU 32 -4.449 -6.820 7.992 260 2HB GLU 32 2HB GLU 32 -5.517 -8.141 7.518 261 1HG GLU 32 1HG GLU 32 -3.544 -9.506 6.908 262 2HG GLU 32 2HG GLU 32 -2.484 -8.188 7.405 263 H CYS 33 H CYS 33 -3.814 -4.732 5.988 264 HA CYS 33 HA CYS 33 -0.923 -5.276 5.602 265 1HB CYS 33 1HB CYS 33 -2.762 -4.526 3.538 266 2HB CYS 33 2HB CYS 33 -1.687 -3.162 3.834 267 HG CYS 33 HG CYS 33 -0.842 -5.886 2.678 268 H LEU 34 H LEU 34 -0.204 -2.597 5.055 269 HA LEU 34 HA LEU 34 -0.782 -1.354 7.695 270 1HB LEU 34 1HB LEU 34 1.434 -1.614 5.853 271 2HB LEU 34 2HB LEU 34 1.152 0.086 6.224 272 HG LEU 34 HG LEU 34 2.708 -0.967 7.841 273 1HD1 LEU 34 1HD1 LEU 34 0.042 -0.337 9.124 274 2HD1 LEU 34 2HD1 LEU 34 1.139 0.890 8.493 275 3HD1 LEU 34 3HD1 LEU 34 1.641 -0.133 9.839 276 1HD2 LEU 34 1HD2 LEU 34 0.321 -2.667 8.607 277 2HD2 LEU 34 2HD2 LEU 34 1.911 -2.693 9.368 278 3HD2 LEU 34 3HD2 LEU 34 1.720 -3.253 7.707 279 H CYS 35 H CYS 35 -0.740 1.182 7.531 280 HA CYS 35 HA CYS 35 -2.084 2.227 5.101 281 1HB CYS 35 1HB CYS 35 -3.304 1.675 7.767 282 2HB CYS 35 2HB CYS 35 -3.748 3.205 7.011 283 HG CYS 35 HG CYS 35 -5.252 1.005 6.263 284 H ILE 36 H ILE 36 -1.936 4.557 4.984 285 HA ILE 36 HA ILE 36 0.173 5.700 6.743 286 HB ILE 36 HB ILE 36 -1.330 6.844 4.363 287 1HG1 ILE 36 1HG1 ILE 36 1.444 5.647 4.367 288 2HG1 ILE 36 2HG1 ILE 36 0.013 4.687 3.998 289 1HG2 ILE 36 1HG2 ILE 36 0.378 8.505 4.274 290 2HG2 ILE 36 2HG2 ILE 36 1.379 7.639 5.438 291 3HG2 ILE 36 3HG2 ILE 36 -0.110 8.421 5.967 292 1HD1 ILE 36 1HD1 ILE 36 -0.513 6.025 2.091 293 2HD1 ILE 36 2HD1 ILE 36 1.221 5.721 1.990 294 3HD1 ILE 36 3HD1 ILE 36 0.631 7.280 2.568 295 H VAL 37 H VAL 37 -0.222 7.527 8.093 296 HA VAL 37 HA VAL 37 -3.116 8.234 8.467 297 HB VAL 37 HB VAL 37 -0.925 7.909 10.548 298 1HG1 VAL 37 1HG1 VAL 37 -3.612 9.040 10.589 299 2HG1 VAL 37 2HG1 VAL 37 -2.355 9.104 11.824 300 3HG1 VAL 37 3HG1 VAL 37 -3.440 7.716 11.741 301 1HG2 VAL 37 1HG2 VAL 37 -1.655 5.780 9.410 302 2HG2 VAL 37 2HG2 VAL 37 -3.290 6.102 9.986 303 3HG2 VAL 37 3HG2 VAL 37 -1.987 5.821 11.141 304 H ARG 38 H ARG 38 -3.206 10.310 7.639 305 HA ARG 38 HA ARG 38 -1.309 12.310 8.804 306 1HB ARG 38 1HB ARG 38 -2.191 11.986 5.915 307 2HB ARG 38 2HB ARG 38 -1.229 13.333 6.515 308 1HG ARG 38 1HG ARG 38 -0.379 10.444 6.821 309 2HG ARG 38 2HG ARG 38 0.095 11.441 5.446 310 1HD ARG 38 1HD ARG 38 1.017 13.126 7.115 311 2HD ARG 38 2HD ARG 38 0.755 11.903 8.373 312 HE ARG 38 HE ARG 38 2.091 10.571 6.298 313 1HH1 ARG 38 1HH1 ARG 38 2.688 13.311 8.361 314 2HH1 ARG 38 2HH1 ARG 38 4.404 13.101 8.328 315 1HH2 ARG 38 1HH2 ARG 38 4.320 10.319 6.271 316 2HH2 ARG 38 2HH2 ARG 38 5.324 11.420 7.154 317 H HIS 39 H HIS 39 -2.222 14.503 8.832 318 HA HIS 39 HA HIS 39 -5.051 14.568 9.446 319 1HB HIS 39 1HB HIS 39 -2.890 16.662 9.037 320 2HB HIS 39 2HB HIS 39 -4.513 17.054 9.604 321 HD1 HIS 39 HD1 HIS 39 -2.840 17.807 11.747 322 HD2 HIS 39 HD2 HIS 39 -3.591 13.747 11.169 323 HE1 HIS 39 HE1 HIS 39 -2.295 16.659 13.938 324 H ASN 40 H ASN 40 -6.381 16.453 8.331 325 HA ASN 40 HA ASN 40 -6.837 15.732 5.597 326 1HB ASN 40 1HB ASN 40 -8.421 17.622 5.722 327 2HB ASN 40 2HB ASN 40 -8.475 16.690 7.218 328 1HD2 ASN 40 1HD2 ASN 40 -9.356 19.291 7.434 329 2HD2 ASN 40 2HD2 ASN 40 -8.203 20.257 8.219 330 H ASP 41 H ASP 41 -7.099 18.754 4.855 331 HA ASP 41 HA ASP 41 -5.815 20.397 3.762 332 1HB ASP 41 1HB ASP 41 -4.433 19.731 6.028 333 2HB ASP 41 2HB ASP 41 -3.241 19.340 4.789 334 H ASP 42 H ASP 42 -3.031 19.930 2.852 335 HA ASP 42 HA ASP 42 -3.382 19.033 0.263 336 1HB ASP 42 1HB ASP 42 -1.042 18.828 2.179 337 2HB ASP 42 2HB ASP 42 -0.883 18.461 0.462 338 H TRP 43 H TRP 43 -2.816 16.996 3.118 339 HA TRP 43 HA TRP 43 -2.257 14.530 1.831 340 1HB TRP 43 1HB TRP 43 -2.040 14.909 4.229 341 2HB TRP 43 2HB TRP 43 -3.762 15.252 4.369 342 HD1 TRP 43 HD1 TRP 43 -5.006 13.303 5.385 343 HE1 TRP 43 HE1 TRP 43 -4.847 10.734 5.274 344 HE3 TRP 43 HE3 TRP 43 -0.981 12.801 2.279 345 HZ2 TRP 43 HZ2 TRP 43 -3.229 8.731 4.035 346 HZ3 TRP 43 HZ3 TRP 43 -0.156 10.549 1.652 347 HH2 TRP 43 HH2 TRP 43 -1.273 8.516 2.524 348 H GLY 44 H GLY 44 -5.440 15.722 2.991 349 1HA GLY 44 1HA GLY 44 -6.970 13.610 1.861 350 2HA GLY 44 2HA GLY 44 -7.610 15.199 2.278 351 H THR 45 H THR 45 -5.674 16.545 0.431 352 HA THR 45 HA THR 45 -7.336 16.374 -1.974 353 HB THR 45 HB THR 45 -4.813 17.919 -1.267 354 HG1 THR 45 HG1 THR 45 -7.491 18.816 -1.384 355 1HG2 THR 45 1HG2 THR 45 -4.861 18.825 -3.337 356 2HG2 THR 45 2HG2 THR 45 -6.605 19.076 -3.258 357 3HG2 THR 45 3HG2 THR 45 -5.962 17.518 -3.780 358 H ALA 46 H ALA 46 -3.772 16.194 -1.589 359 HA ALA 46 HA ALA 46 -3.064 15.177 -4.065 360 1HB ALA 46 1HB ALA 46 -1.589 15.817 -2.128 361 2HB ALA 46 2HB ALA 46 -1.097 14.307 -2.894 362 3HB ALA 46 3HB ALA 46 -1.982 14.275 -1.369 363 H LEU 47 H LEU 47 -4.035 13.195 -1.237 364 HA LEU 47 HA LEU 47 -4.107 10.776 -2.945 365 1HB LEU 47 1HB LEU 47 -4.364 11.427 -0.002 366 2HB LEU 47 2HB LEU 47 -4.771 9.822 -0.604 367 HG LEU 47 HG LEU 47 -2.446 9.838 0.139 368 1HD1 LEU 47 1HD1 LEU 47 -1.900 9.931 -2.747 369 2HD1 LEU 47 2HD1 LEU 47 -3.322 8.973 -2.331 370 3HD1 LEU 47 3HD1 LEU 47 -1.756 8.583 -1.618 371 1HD2 LEU 47 1HD2 LEU 47 -0.912 11.464 -0.396 372 2HD2 LEU 47 2HD2 LEU 47 -2.377 12.437 -0.518 373 3HD2 LEU 47 3HD2 LEU 47 -1.634 11.776 -1.974 374 H GLU 48 H GLU 48 -6.136 13.052 -3.219 375 HA GLU 48 HA GLU 48 -8.639 12.225 -2.097 376 1HB GLU 48 1HB GLU 48 -9.544 13.742 -3.864 377 2HB GLU 48 2HB GLU 48 -8.186 14.464 -3.007 378 1HG GLU 48 1HG GLU 48 -7.216 14.790 -5.015 379 2HG GLU 48 2HG GLU 48 -7.022 13.043 -5.127 380 H ASP 49 H ASP 49 -8.502 9.847 -2.503 381 HA ASP 49 HA ASP 49 -10.050 9.055 -4.804 382 1HB ASP 49 1HB ASP 49 -7.510 9.601 -5.488 383 2HB ASP 49 2HB ASP 49 -7.270 7.946 -4.926 384 H TYR 50 H TYR 50 -7.444 7.755 -2.697 385 HA TYR 50 HA TYR 50 -9.349 5.575 -1.891 386 1HB TYR 50 1HB TYR 50 -6.356 5.194 -2.021 387 2HB TYR 50 2HB TYR 50 -7.625 3.981 -2.132 388 HD1 TYR 50 HD1 TYR 50 -9.049 3.865 -4.254 389 HD2 TYR 50 HD2 TYR 50 -5.492 6.262 -3.951 390 HE1 TYR 50 HE1 TYR 50 -8.931 4.010 -6.726 391 HE2 TYR 50 HE2 TYR 50 -5.378 6.404 -6.422 392 HH TYR 50 HH TYR 50 -7.326 4.445 -8.468 393 H LEU 51 H LEU 51 -9.325 7.792 -0.330 394 HA LEU 51 HA LEU 51 -7.360 7.270 1.866 395 1HB LEU 51 1HB LEU 51 -8.659 9.613 0.614 396 2HB LEU 51 2HB LEU 51 -8.585 9.686 2.374 397 HG LEU 51 HG LEU 51 -6.201 9.081 0.601 398 1HD1 LEU 51 1HD1 LEU 51 -6.365 11.305 0.120 399 2HD1 LEU 51 2HD1 LEU 51 -5.700 11.507 1.741 400 3HD1 LEU 51 3HD1 LEU 51 -7.440 11.620 1.482 401 1HD2 LEU 51 1HD2 LEU 51 -5.153 9.932 2.900 402 2HD2 LEU 51 2HD2 LEU 51 -5.604 8.245 2.672 403 3HD2 LEU 51 3HD2 LEU 51 -6.683 9.334 3.540 404 H PHE 52 H PHE 52 -8.242 6.042 3.475 405 HA PHE 52 HA PHE 52 -11.148 6.152 4.052 406 1HB PHE 52 1HB PHE 52 -8.770 4.498 4.935 407 2HB PHE 52 2HB PHE 52 -10.325 4.366 5.757 408 HD1 PHE 52 HD1 PHE 52 -8.763 4.220 2.358 409 HD2 PHE 52 HD2 PHE 52 -12.016 2.986 4.877 410 HE1 PHE 52 HE1 PHE 52 -9.581 2.714 0.565 411 HE2 PHE 52 HE2 PHE 52 -12.834 1.481 3.084 412 HZ PHE 52 HZ PHE 52 -11.616 1.345 0.928 413 H SER 53 H SER 53 -11.775 7.816 5.398 414 HA SER 53 HA SER 53 -9.811 8.785 7.434 415 1HB SER 53 1HB SER 53 -10.808 10.266 5.600 416 2HB SER 53 2HB SER 53 -12.355 10.097 6.429 417 HG SER 53 HG SER 53 -10.476 11.815 6.961 418 H ARG 54 H ARG 54 -10.284 8.597 9.586 419 HA ARG 54 HA ARG 54 -12.989 7.545 10.331 420 1HB ARG 54 1HB ARG 54 -10.562 6.415 10.694 421 2HB ARG 54 2HB ARG 54 -10.627 7.399 12.156 422 1HG ARG 54 1HG ARG 54 -12.363 6.188 13.054 423 2HG ARG 54 2HG ARG 54 -13.073 5.841 11.477 424 1HD ARG 54 1HD ARG 54 -12.013 3.837 11.392 425 2HD ARG 54 2HD ARG 54 -10.448 4.607 11.719 426 HE ARG 54 HE ARG 54 -12.198 3.371 13.708 427 1HH1 ARG 54 1HH1 ARG 54 -9.788 5.814 13.122 428 2HH1 ARG 54 2HH1 ARG 54 -9.266 5.850 14.770 429 1HH2 ARG 54 1HH2 ARG 54 -11.502 3.435 15.841 430 2HH2 ARG 54 2HH2 ARG 54 -10.227 4.515 16.299 431 H LYS 55 H LYS 55 -13.202 8.129 12.920 432 HA LYS 55 HA LYS 55 -13.467 11.020 12.980 433 1HB LYS 55 1HB LYS 55 -13.905 8.769 14.976 434 2HB LYS 55 2HB LYS 55 -14.340 10.445 15.308 435 1HG LYS 55 1HG LYS 55 -15.385 9.805 12.742 436 2HG LYS 55 2HG LYS 55 -15.813 8.478 13.822 437 1HD LYS 55 1HD LYS 55 -16.817 10.025 15.406 438 2HD LYS 55 2HD LYS 55 -16.265 11.408 14.462 439 1HE LYS 55 1HE LYS 55 -17.626 10.170 12.520 440 2HE LYS 55 2HE LYS 55 -18.515 9.513 13.907 441 1HZ LYS 55 1HZ LYS 55 -18.811 11.737 14.758 442 2HZ LYS 55 2HZ LYS 55 -19.395 11.680 13.164 443 3HZ LYS 55 3HZ LYS 55 -17.889 12.393 13.491 444 H ASN 56 H ASN 56 -11.081 11.352 12.688 445 HA ASN 56 HA ASN 56 -9.202 10.711 14.784 446 1HB ASN 56 1HB ASN 56 -10.664 12.257 16.016 447 2HB ASN 56 2HB ASN 56 -9.116 13.045 15.713 448 1HD2 ASN 56 1HD2 ASN 56 -12.540 13.208 15.093 449 2HD2 ASN 56 2HD2 ASN 56 -12.503 14.583 14.098 450 H MET 57 H MET 57 -9.427 10.835 11.818 451 HA MET 57 HA MET 57 -8.032 13.086 10.727 452 1HB MET 57 1HB MET 57 -5.745 11.974 10.579 453 2HB MET 57 2HB MET 57 -6.210 12.466 12.204 454 1HG MET 57 1HG MET 57 -7.154 9.777 11.583 455 2HG MET 57 2HG MET 57 -5.403 9.908 11.412 456 1HE MET 57 1HE MET 57 -3.760 10.340 13.148 457 2HE MET 57 2HE MET 57 -4.072 10.978 14.762 458 3HE MET 57 3HE MET 57 -4.399 11.972 13.342 459 H SER 58 H SER 58 -6.482 11.968 8.765 460 HA SER 58 HA SER 58 -8.366 10.082 7.387 461 1HB SER 58 1HB SER 58 -6.439 12.028 6.092 462 2HB SER 58 2HB SER 58 -7.867 11.278 5.379 463 HG SER 58 HG SER 58 -7.727 13.595 6.578 464 H ALA 59 H ALA 59 -7.328 8.489 5.972 465 HA ALA 59 HA ALA 59 -4.392 8.151 6.258 466 1HB ALA 59 1HB ALA 59 -6.565 6.532 7.527 467 2HB ALA 59 2HB ALA 59 -4.945 6.892 8.128 468 3HB ALA 59 3HB ALA 59 -5.175 5.648 6.898 469 H MET 60 H MET 60 -3.514 6.814 4.584 470 HA MET 60 HA MET 60 -5.331 6.383 2.276 471 1HB MET 60 1HB MET 60 -2.439 6.739 2.813 472 2HB MET 60 2HB MET 60 -2.810 5.624 1.502 473 1HG MET 60 1HG MET 60 -3.910 8.441 1.740 474 2HG MET 60 2HG MET 60 -2.556 7.975 0.712 475 1HE MET 60 1HE MET 60 -2.411 6.839 -0.977 476 2HE MET 60 2HE MET 60 -3.584 7.033 -2.280 477 3HE MET 60 3HE MET 60 -3.457 5.493 -1.430 478 H ALA 61 H ALA 61 -5.409 4.305 1.185 479 HA ALA 61 HA ALA 61 -5.363 2.040 3.056 480 1HB ALA 61 1HB ALA 61 -6.014 1.091 0.543 481 2HB ALA 61 2HB ALA 61 -6.450 2.795 0.414 482 3HB ALA 61 3HB ALA 61 -7.171 1.793 1.674 483 H LEU 62 H LEU 62 -3.259 1.353 3.448 484 HA LEU 62 HA LEU 62 -1.169 0.350 3.038 485 1HB LEU 62 1HB LEU 62 -0.825 1.363 0.343 486 2HB LEU 62 2HB LEU 62 -1.501 2.612 1.381 487 HG LEU 62 HG LEU 62 0.996 0.985 1.966 488 1HD1 LEU 62 1HD1 LEU 62 0.487 3.630 0.723 489 2HD1 LEU 62 2HD1 LEU 62 1.874 2.558 0.545 490 3HD1 LEU 62 3HD1 LEU 62 1.743 3.604 1.956 491 1HD2 LEU 62 1HD2 LEU 62 1.087 2.922 3.768 492 2HD2 LEU 62 2HD2 LEU 62 0.153 1.458 4.078 493 3HD2 LEU 62 3HD2 LEU 62 -0.660 2.924 3.531 494 H GLY 63 H GLY 63 -2.511 -1.711 2.832 495 1HA GLY 63 1HA GLY 63 -1.613 -3.230 0.588 496 2HA GLY 63 2HA GLY 63 -2.820 -3.770 1.752 497 H PHE 64 H PHE 64 -4.588 -4.415 0.619 498 HA PHE 64 HA PHE 64 -5.306 -3.082 -1.919 499 1HB PHE 64 1HB PHE 64 -6.492 -5.406 -0.354 500 2HB PHE 64 2HB PHE 64 -6.938 -4.961 -2.002 501 HD1 PHE 64 HD1 PHE 64 -4.609 -6.775 0.063 502 HD2 PHE 64 HD2 PHE 64 -5.103 -4.940 -3.790 503 HE1 PHE 64 HE1 PHE 64 -2.704 -8.100 -0.813 504 HE2 PHE 64 HE2 PHE 64 -3.198 -6.265 -4.665 505 HZ PHE 64 HZ PHE 64 -1.998 -7.845 -3.177 506 H GLY 65 H GLY 65 -5.595 -1.390 0.381 507 1HA GLY 65 1HA GLY 65 -8.409 -1.410 1.180 508 2HA GLY 65 2HA GLY 65 -7.216 -0.195 1.626 509 H ALA 66 H ALA 66 -6.480 0.002 -1.340 510 HA ALA 66 HA ALA 66 -8.493 2.070 -1.984 511 1HB ALA 66 1HB ALA 66 -5.838 1.181 -3.161 512 2HB ALA 66 2HB ALA 66 -6.134 2.604 -2.162 513 3HB ALA 66 3HB ALA 66 -6.778 2.528 -3.802 514 H ILE 67 H ILE 67 -6.962 -0.658 -3.749 515 HA ILE 67 HA ILE 67 -8.519 -0.636 -6.063 516 HB ILE 67 HB ILE 67 -7.975 -3.097 -6.102 517 1HG1 ILE 67 1HG1 ILE 67 -6.321 -3.353 -3.868 518 2HG1 ILE 67 2HG1 ILE 67 -7.777 -2.583 -3.238 519 1HG2 ILE 67 1HG2 ILE 67 -5.961 -0.985 -5.402 520 2HG2 ILE 67 2HG2 ILE 67 -6.215 -1.819 -6.936 521 3HG2 ILE 67 3HG2 ILE 67 -5.426 -2.654 -5.597 522 1HD1 ILE 67 1HD1 ILE 67 -8.647 -4.585 -5.043 523 2HD1 ILE 67 2HD1 ILE 67 -8.803 -4.585 -3.287 524 3HD1 ILE 67 3HD1 ILE 67 -7.393 -5.323 -4.047 525 H PHE 68 H PHE 68 -9.527 -1.580 -2.845 526 HA PHE 68 HA PHE 68 -11.631 -3.347 -3.282 527 1HB PHE 68 1HB PHE 68 -10.951 -1.168 -1.386 528 2HB PHE 68 2HB PHE 68 -12.650 -1.629 -1.400 529 HD1 PHE 68 HD1 PHE 68 -12.487 -4.533 -2.009 530 HD2 PHE 68 HD2 PHE 68 -10.093 -2.094 0.588 531 HE1 PHE 68 HE1 PHE 68 -11.939 -6.527 -0.641 532 HE2 PHE 68 HE2 PHE 68 -9.543 -4.086 1.956 533 HZ PHE 68 HZ PHE 68 -10.465 -6.303 1.342 534 H ASN 69 H ASN 69 -13.377 -3.236 -4.617 535 HA ASN 69 HA ASN 69 -14.268 -0.601 -5.652 536 1HB ASN 69 1HB ASN 69 -14.462 -3.495 -6.377 537 2HB ASN 69 2HB ASN 69 -15.772 -2.449 -6.926 538 1HD2 ASN 69 1HD2 ASN 69 -13.842 -3.677 -8.726 539 2HD2 ASN 69 2HD2 ASN 69 -12.945 -2.425 -9.442 540 H HIS 70 H HIS 70 -16.780 -0.473 -5.918 541 HA HIS 70 HA HIS 70 -18.001 -1.102 -3.265 542 1HB HIS 70 1HB HIS 70 -17.918 1.250 -4.025 543 2HB HIS 70 2HB HIS 70 -18.762 0.806 -5.509 544 HD1 HIS 70 HD1 HIS 70 -19.509 -0.166 -1.895 545 HD2 HIS 70 HD2 HIS 70 -21.335 1.743 -5.119 546 HE1 HIS 70 HE1 HIS 70 -21.884 0.339 -1.176 547 H SER 71 H SER 71 -20.078 -2.135 -3.201 548 HA SER 71 HA SER 71 -21.222 -3.115 -5.762 549 1HB SER 71 1HB SER 71 -20.807 -5.375 -5.279 550 2HB SER 71 2HB SER 71 -19.347 -4.615 -4.651 551 HG SER 71 HG SER 71 -20.799 -6.150 -3.299 552 H LYS 72 H LYS 72 -23.451 -3.384 -5.603 553 HA LYS 72 HA LYS 72 -24.940 -2.230 -3.504 554 1HB LYS 72 1HB LYS 72 -25.676 -4.460 -5.439 555 2HB LYS 72 2HB LYS 72 -26.828 -3.429 -4.589 556 1HG LYS 72 1HG LYS 72 -25.129 -1.589 -5.749 557 2HG LYS 72 2HG LYS 72 -25.207 -2.856 -6.973 558 1HD LYS 72 1HD LYS 72 -27.440 -2.511 -7.380 559 2HD LYS 72 2HD LYS 72 -27.783 -2.072 -5.707 560 1HE LYS 72 1HE LYS 72 -26.802 0.140 -6.036 561 2HE LYS 72 2HE LYS 72 -26.289 -0.300 -7.676 562 1HZ LYS 72 1HZ LYS 72 -29.092 -0.302 -6.671 563 2HZ LYS 72 2HZ LYS 72 -28.604 -0.735 -8.239 564 3HZ LYS 72 3HZ LYS 72 -28.422 0.867 -7.706 565 H ASP 73 H ASP 73 -23.555 -5.435 -3.767 566 HA ASP 73 HA ASP 73 -24.837 -6.153 -1.149 567 1HB ASP 73 1HB ASP 73 -24.667 -8.506 -2.016 568 2HB ASP 73 2HB ASP 73 -25.687 -7.482 -3.028 569 HA PRO 74 HA PRO 74 -20.220 -5.899 -0.676 570 1HB PRO 74 1HB PRO 74 -20.428 -5.071 1.982 571 2HB PRO 74 2HB PRO 74 -20.262 -3.981 0.594 572 1HG PRO 74 1HG PRO 74 -22.684 -4.742 2.132 573 2HG PRO 74 2HG PRO 74 -22.265 -3.200 1.374 574 1HD PRO 74 1HD PRO 74 -24.061 -4.936 0.313 575 2HD PRO 74 2HD PRO 74 -23.066 -3.847 -0.677 576 H ASN 75 H ASN 75 -19.947 -8.166 -0.651 577 HA ASN 75 HA ASN 75 -21.065 -9.836 1.470 578 1HB ASN 75 1HB ASN 75 -18.989 -10.284 -0.707 579 2HB ASN 75 2HB ASN 75 -19.693 -11.567 0.275 580 1HD2 ASN 75 1HD2 ASN 75 -21.877 -12.224 -0.192 581 2HD2 ASN 75 2HD2 ASN 75 -22.742 -11.633 -1.527 582 H ALA 76 H ALA 76 -18.187 -7.943 1.077 583 HA ALA 76 HA ALA 76 -17.101 -9.135 3.599 584 1HB ALA 76 1HB ALA 76 -14.861 -9.035 2.550 585 2HB ALA 76 2HB ALA 76 -15.575 -8.376 1.078 586 3HB ALA 76 3HB ALA 76 -15.949 -10.026 1.578 587 H ARG 77 H ARG 77 -15.368 -7.595 4.530 588 HA ARG 77 HA ARG 77 -15.751 -4.749 3.771 589 1HB ARG 77 1HB ARG 77 -17.313 -5.984 5.702 590 2HB ARG 77 2HB ARG 77 -16.023 -5.258 6.661 591 1HG ARG 77 1HG ARG 77 -16.442 -3.081 5.551 592 2HG ARG 77 2HG ARG 77 -17.756 -3.814 4.632 593 1HD ARG 77 1HD ARG 77 -18.751 -4.479 6.926 594 2HD ARG 77 2HD ARG 77 -17.609 -3.306 7.611 595 HE ARG 77 HE ARG 77 -18.891 -1.574 6.626 596 1HH1 ARG 77 1HH1 ARG 77 -19.655 -4.653 5.194 597 2HH1 ARG 77 2HH1 ARG 77 -20.959 -4.016 4.253 598 1HH2 ARG 77 1HH2 ARG 77 -20.588 -0.770 5.395 599 2HH2 ARG 77 2HH2 ARG 77 -21.485 -1.835 4.364 600 H HIS 78 H HIS 78 -14.531 -3.652 6.061 601 HA HIS 78 HA HIS 78 -11.845 -4.992 6.112 602 1HB HIS 78 1HB HIS 78 -10.931 -2.650 6.037 603 2HB HIS 78 2HB HIS 78 -11.833 -3.083 4.614 604 HD1 HIS 78 HD1 HIS 78 -14.136 -1.949 4.209 605 HD2 HIS 78 HD2 HIS 78 -12.193 -0.690 7.676 606 HE1 HIS 78 HE1 HIS 78 -15.383 0.098 5.026 607 H GLU 79 H GLU 79 -10.505 -3.485 7.830 608 HA GLU 79 HA GLU 79 -12.219 -2.761 10.061 609 1HB GLU 79 1HB GLU 79 -11.489 -5.338 9.943 610 2HB GLU 79 2HB GLU 79 -10.023 -4.705 10.686 611 1HG GLU 79 1HG GLU 79 -11.342 -3.713 12.501 612 2HG GLU 79 2HG GLU 79 -12.832 -4.280 11.747 613 H LEU 80 H LEU 80 -10.784 -1.931 11.961 614 HA LEU 80 HA LEU 80 -8.152 -0.896 11.000 615 1HB LEU 80 1HB LEU 80 -10.664 0.550 11.590 616 2HB LEU 80 2HB LEU 80 -9.235 1.240 12.352 617 HG LEU 80 HG LEU 80 -9.044 0.443 9.478 618 1HD1 LEU 80 1HD1 LEU 80 -10.027 3.193 10.065 619 2HD1 LEU 80 2HD1 LEU 80 -11.216 1.893 10.135 620 3HD1 LEU 80 3HD1 LEU 80 -10.307 2.178 8.651 621 1HD2 LEU 80 1HD2 LEU 80 -7.050 1.396 9.988 622 2HD2 LEU 80 2HD2 LEU 80 -7.696 2.170 11.436 623 3HD2 LEU 80 3HD2 LEU 80 -7.916 2.927 9.858 624 H THR 81 H THR 81 -6.649 -1.307 12.574 625 HA THR 81 HA THR 81 -7.203 -2.440 15.091 626 HB THR 81 HB THR 81 -5.054 -2.523 13.908 627 HG1 THR 81 HG1 THR 81 -4.766 -2.901 16.019 628 1HG2 THR 81 1HG2 THR 81 -3.894 -0.651 13.330 629 2HG2 THR 81 2HG2 THR 81 -4.333 0.196 14.813 630 3HG2 THR 81 3HG2 THR 81 -5.479 0.105 13.479 631 H ALA 82 H ALA 82 -5.944 -1.058 17.071 632 HA ALA 82 HA ALA 82 -7.908 0.825 17.956 633 1HB ALA 82 1HB ALA 82 -5.825 -0.631 19.006 634 2HB ALA 82 2HB ALA 82 -6.686 0.633 19.885 635 3HB ALA 82 3HB ALA 82 -5.169 1.006 19.066 636 H GLY 83 H GLY 83 -8.079 2.440 16.255 637 1HA GLY 83 1HA GLY 83 -7.604 4.761 15.816 638 2HA GLY 83 2HA GLY 83 -5.981 4.525 16.465 639 H LEU 84 H LEU 84 -6.551 5.771 13.941 640 HA LEU 84 HA LEU 84 -6.355 4.121 11.656 641 1HB LEU 84 1HB LEU 84 -5.899 6.889 12.468 642 2HB LEU 84 2HB LEU 84 -4.775 6.399 11.203 643 HG LEU 84 HG LEU 84 -6.646 5.638 9.806 644 1HD1 LEU 84 1HD1 LEU 84 -8.785 6.849 11.358 645 2HD1 LEU 84 2HD1 LEU 84 -8.016 5.536 12.248 646 3HD1 LEU 84 3HD1 LEU 84 -8.700 5.235 10.650 647 1HD2 LEU 84 1HD2 LEU 84 -7.828 8.203 10.390 648 2HD2 LEU 84 2HD2 LEU 84 -6.804 7.745 9.030 649 3HD2 LEU 84 3HD2 LEU 84 -6.074 8.313 10.530 650 H LYS 85 H LYS 85 -4.881 2.429 11.616 651 HA LYS 85 HA LYS 85 -2.007 3.127 11.638 652 1HB LYS 85 1HB LYS 85 -3.494 1.766 13.790 653 2HB LYS 85 2HB LYS 85 -2.064 0.882 13.259 654 1HG LYS 85 1HG LYS 85 -2.034 3.827 13.961 655 2HG LYS 85 2HG LYS 85 -1.645 2.553 15.117 656 1HD LYS 85 1HD LYS 85 0.416 2.260 14.235 657 2HD LYS 85 2HD LYS 85 -0.219 2.218 12.590 658 1HE LYS 85 1HE LYS 85 -0.485 4.903 13.471 659 2HE LYS 85 2HE LYS 85 1.149 4.380 13.918 660 1HZ LYS 85 1HZ LYS 85 -0.033 3.736 11.280 661 2HZ LYS 85 2HZ LYS 85 1.603 3.707 11.736 662 3HZ LYS 85 3HZ LYS 85 0.802 5.192 11.538 663 H ARG 86 H ARG 86 -4.241 0.316 11.679 664 HA ARG 86 HA ARG 86 -2.852 -0.691 9.220 665 1HB ARG 86 1HB ARG 86 -3.132 -1.815 11.917 666 2HB ARG 86 2HB ARG 86 -3.698 -2.923 10.666 667 1HG ARG 86 1HG ARG 86 -1.604 -3.193 9.775 668 2HG ARG 86 2HG ARG 86 -1.137 -1.526 10.109 669 1HD ARG 86 1HD ARG 86 -0.369 -2.030 12.229 670 2HD ARG 86 2HD ARG 86 -1.570 -3.314 12.467 671 HE ARG 86 HE ARG 86 0.308 -3.933 10.329 672 1HH1 ARG 86 1HH1 ARG 86 -0.200 -3.970 13.773 673 2HH1 ARG 86 2HH1 ARG 86 0.920 -5.262 14.035 674 1HH2 ARG 86 1HH2 ARG 86 1.755 -5.609 10.694 675 2HH2 ARG 86 2HH2 ARG 86 2.019 -6.185 12.306 676 H MET 87 H MET 87 -4.269 -2.408 8.112 677 HA MET 87 HA MET 87 -7.183 -1.978 8.620 678 1HB MET 87 1HB MET 87 -5.535 -0.983 6.437 679 2HB MET 87 2HB MET 87 -6.819 -2.025 5.824 680 1HG MET 87 1HG MET 87 -8.344 -0.656 7.462 681 2HG MET 87 2HG MET 87 -7.045 0.535 7.389 682 1HE MET 87 1HE MET 87 -8.946 -1.942 5.614 683 2HE MET 87 2HE MET 87 -8.569 -1.643 3.918 684 3HE MET 87 3HE MET 87 -10.053 -0.997 4.618 685 H ARG 88 H ARG 88 -8.317 -3.879 8.444 686 HA ARG 88 HA ARG 88 -6.905 -6.228 7.221 687 1HB ARG 88 1HB ARG 88 -9.025 -6.063 9.396 688 2HB ARG 88 2HB ARG 88 -8.211 -7.534 8.866 689 1HG ARG 88 1HG ARG 88 -6.303 -7.040 10.013 690 2HG ARG 88 2HG ARG 88 -6.409 -5.319 9.641 691 1HD ARG 88 1HD ARG 88 -7.142 -4.996 11.766 692 2HD ARG 88 2HD ARG 88 -8.616 -5.881 11.327 693 HE ARG 88 HE ARG 88 -6.622 -7.825 11.767 694 1HH1 ARG 88 1HH1 ARG 88 -8.244 -5.329 13.573 695 2HH1 ARG 88 2HH1 ARG 88 -8.085 -6.164 15.079 696 1HH2 ARG 88 1HH2 ARG 88 -6.430 -8.889 13.735 697 2HH2 ARG 88 2HH2 ARG 88 -7.067 -8.163 15.173 698 H ILE 89 H ILE 89 -8.656 -7.959 6.560 699 HA ILE 89 HA ILE 89 -11.027 -6.617 5.316 700 HB ILE 89 HB ILE 89 -9.012 -8.510 4.048 701 1HG1 ILE 89 1HG1 ILE 89 -9.757 -5.674 3.288 702 2HG1 ILE 89 2HG1 ILE 89 -8.376 -6.074 4.309 703 1HG2 ILE 89 1HG2 ILE 89 -11.522 -7.269 2.879 704 2HG2 ILE 89 2HG2 ILE 89 -11.328 -8.971 3.299 705 3HG2 ILE 89 3HG2 ILE 89 -10.361 -8.267 2.003 706 1HD1 ILE 89 1HD1 ILE 89 -7.145 -6.809 2.548 707 2HD1 ILE 89 2HD1 ILE 89 -8.310 -5.930 1.557 708 3HD1 ILE 89 3HD1 ILE 89 -8.515 -7.660 1.834 709 H PHE 90 H PHE 90 -12.731 -7.650 6.308 710 HA PHE 90 HA PHE 90 -12.496 -10.578 6.874 711 1HB PHE 90 1HB PHE 90 -14.121 -8.267 7.953 712 2HB PHE 90 2HB PHE 90 -14.579 -9.932 8.301 713 HD1 PHE 90 HD1 PHE 90 -13.172 -11.367 9.690 714 HD2 PHE 90 HD2 PHE 90 -12.050 -7.310 8.833 715 HE1 PHE 90 HE1 PHE 90 -11.471 -11.457 11.493 716 HE2 PHE 90 HE2 PHE 90 -10.349 -7.400 10.636 717 HZ PHE 90 HZ PHE 90 -10.060 -9.473 11.965 718 H THR 91 H THR 91 -14.781 -11.679 6.730 719 HA THR 91 HA THR 91 -16.138 -10.777 4.209 720 HB THR 91 HB THR 91 -16.534 -13.364 4.051 721 HG1 THR 91 HG1 THR 91 -15.216 -14.582 5.251 722 1HG2 THR 91 1HG2 THR 91 -14.620 -11.646 3.022 723 2HG2 THR 91 2HG2 THR 91 -14.895 -13.305 2.490 724 3HG2 THR 91 3HG2 THR 91 -13.652 -12.959 3.693 725 H ILE 92 H ILE 92 -17.716 -9.654 5.590 726 HA ILE 92 HA ILE 92 -19.177 -10.675 7.738 727 HB ILE 92 HB ILE 92 -20.902 -9.066 6.981 728 1HG1 ILE 92 1HG1 ILE 92 -19.291 -8.905 4.417 729 2HG1 ILE 92 2HG1 ILE 92 -20.807 -9.794 4.571 730 1HG2 ILE 92 1HG2 ILE 92 -19.526 -7.385 7.584 731 2HG2 ILE 92 2HG2 ILE 92 -18.618 -7.518 6.077 732 3HG2 ILE 92 3HG2 ILE 92 -18.186 -8.525 7.459 733 1HD1 ILE 92 1HD1 ILE 92 -21.984 -7.894 4.301 734 2HD1 ILE 92 2HD1 ILE 92 -20.471 -7.026 4.039 735 3HD1 ILE 92 3HD1 ILE 92 -21.145 -7.152 5.664 736 H LYS 93 H LYS 93 -19.403 -11.588 4.355 737 HA LYS 93 HA LYS 93 -21.531 -13.557 5.105 738 1HB LYS 93 1HB LYS 93 -21.343 -11.804 2.627 739 2HB LYS 93 2HB LYS 93 -22.572 -13.039 2.893 740 1HG LYS 93 1HG LYS 93 -22.513 -11.394 5.216 741 2HG LYS 93 2HG LYS 93 -22.545 -10.323 3.815 742 1HD LYS 93 1HD LYS 93 -24.384 -12.130 3.021 743 2HD LYS 93 2HD LYS 93 -24.590 -12.267 4.767 744 1HE LYS 93 1HE LYS 93 -24.598 -9.609 3.298 745 2HE LYS 93 2HE LYS 93 -26.070 -10.510 3.710 746 1HZ LYS 93 1HZ LYS 93 -25.461 -8.931 5.466 747 2HZ LYS 93 2HZ LYS 93 -23.950 -9.688 5.632 748 3HZ LYS 93 3HZ LYS 93 -25.370 -10.534 6.021 749 HA PRO 94 HA PRO 94 -18.689 -16.540 3.463 750 1HB PRO 94 1HB PRO 94 -21.236 -17.778 2.548 751 2HB PRO 94 2HB PRO 94 -19.846 -18.529 3.349 752 1HG PRO 94 1HG PRO 94 -21.999 -17.933 4.698 753 2HG PRO 94 2HG PRO 94 -20.428 -17.666 5.404 754 1HD PRO 94 1HD PRO 94 -22.392 -15.709 4.329 755 2HD PRO 94 2HD PRO 94 -21.242 -15.542 5.673 756 H ILE 95 H ILE 95 -17.869 -17.112 1.331 757 HA ILE 95 HA ILE 95 -19.345 -15.863 -0.961 758 HB ILE 95 HB ILE 95 -16.390 -15.765 -0.253 759 1HG1 ILE 95 1HG1 ILE 95 -18.508 -13.603 -0.472 760 2HG1 ILE 95 2HG1 ILE 95 -17.828 -14.222 1.032 761 1HG2 ILE 95 1HG2 ILE 95 -16.792 -14.011 -2.337 762 2HG2 ILE 95 2HG2 ILE 95 -17.840 -15.357 -2.787 763 3HG2 ILE 95 3HG2 ILE 95 -16.121 -15.634 -2.506 764 1HD1 ILE 95 1HD1 ILE 95 -15.590 -13.462 0.345 765 2HD1 ILE 95 2HD1 ILE 95 -16.728 -12.114 0.346 766 3HD1 ILE 95 3HD1 ILE 95 -16.253 -12.867 -1.178 767 H ALA 96 H ALA 96 -19.122 -16.964 -2.955 768 HA ALA 96 HA ALA 96 -18.229 -19.787 -2.731 769 1HB ALA 96 1HB ALA 96 -19.680 -18.276 -4.935 770 2HB ALA 96 2HB ALA 96 -20.490 -19.084 -3.592 771 3HB ALA 96 3HB ALA 96 -19.574 -20.030 -4.766 772 H ILE 97 H ILE 97 -16.858 -20.707 -4.431 773 HA ILE 97 HA ILE 97 -14.562 -19.138 -5.093 774 HB ILE 97 HB ILE 97 -15.694 -21.724 -6.224 775 1HG1 ILE 97 1HG1 ILE 97 -13.419 -21.466 -4.274 776 2HG1 ILE 97 2HG1 ILE 97 -15.085 -21.415 -3.696 777 1HG2 ILE 97 1HG2 ILE 97 -13.996 -21.676 -7.700 778 2HG2 ILE 97 2HG2 ILE 97 -12.863 -21.664 -6.349 779 3HG2 ILE 97 3HG2 ILE 97 -13.428 -20.143 -7.040 780 1HD1 ILE 97 1HD1 ILE 97 -15.415 -23.631 -4.094 781 2HD1 ILE 97 2HD1 ILE 97 -13.654 -23.722 -4.091 782 3HD1 ILE 97 3HD1 ILE 97 -14.527 -23.584 -5.617 783 H GLY 98 H GLY 98 -14.732 -17.387 -6.463 784 1HA GLY 98 1HA GLY 98 -14.712 -16.848 -8.906 785 2HA GLY 98 2HA GLY 98 -16.170 -17.828 -9.049 786 H GLU 99 H GLU 99 -15.685 -15.693 -6.311 787 HA GLU 99 HA GLU 99 -17.963 -14.028 -7.312 788 1HB GLU 99 1HB GLU 99 -16.841 -14.757 -4.599 789 2HB GLU 99 2HB GLU 99 -17.997 -13.440 -4.783 790 1HG GLU 99 1HG GLU 99 -18.421 -16.341 -5.554 791 2HG GLU 99 2HG GLU 99 -19.190 -15.491 -4.218 792 H GLU 100 H GLU 100 -17.754 -11.708 -6.100 793 HA GLU 100 HA GLU 100 -14.979 -10.706 -6.655 794 1HB GLU 100 1HB GLU 100 -17.175 -10.166 -8.116 795 2HB GLU 100 2HB GLU 100 -17.387 -8.940 -6.866 796 1HG GLU 100 1HG GLU 100 -14.672 -8.795 -7.523 797 2HG GLU 100 2HG GLU 100 -15.483 -9.015 -9.073 798 H ILE 101 H ILE 101 -14.033 -9.905 -4.828 799 HA ILE 101 HA ILE 101 -15.686 -9.353 -2.446 800 HB ILE 101 HB ILE 101 -12.694 -9.312 -2.985 801 1HG1 ILE 101 1HG1 ILE 101 -14.418 -11.398 -1.619 802 2HG1 ILE 101 2HG1 ILE 101 -13.831 -11.522 -3.277 803 1HG2 ILE 101 1HG2 ILE 101 -12.350 -9.062 -0.678 804 2HG2 ILE 101 2HG2 ILE 101 -13.991 -9.576 -0.283 805 3HG2 ILE 101 3HG2 ILE 101 -13.710 -7.979 -0.976 806 1HD1 ILE 101 1HD1 ILE 101 -11.557 -11.621 -2.572 807 2HD1 ILE 101 2HD1 ILE 101 -12.426 -12.698 -1.478 808 3HD1 ILE 101 3HD1 ILE 101 -11.962 -11.083 -0.942 809 H THR 102 H THR 102 -16.237 -7.325 -1.809 810 HA THR 102 HA THR 102 -14.643 -4.967 -2.613 811 HB THR 102 HB THR 102 -16.996 -4.036 -3.436 812 HG1 THR 102 HG1 THR 102 -18.373 -5.623 -3.206 813 1HG2 THR 102 1HG2 THR 102 -15.708 -6.029 -5.280 814 2HG2 THR 102 2HG2 THR 102 -14.788 -4.628 -4.731 815 3HG2 THR 102 3HG2 THR 102 -16.288 -4.401 -5.633 816 H ILE 103 H ILE 103 -14.961 -3.252 -1.136 817 HA ILE 103 HA ILE 103 -16.765 -3.866 1.168 818 HB ILE 103 HB ILE 103 -15.246 -2.285 2.352 819 1HG1 ILE 103 1HG1 ILE 103 -13.160 -2.100 0.408 820 2HG1 ILE 103 2HG1 ILE 103 -14.646 -1.504 -0.332 821 1HG2 ILE 103 1HG2 ILE 103 -13.430 -3.774 2.498 822 2HG2 ILE 103 2HG2 ILE 103 -13.515 -4.190 0.786 823 3HG2 ILE 103 3HG2 ILE 103 -14.735 -4.800 1.904 824 1HD1 ILE 103 1HD1 ILE 103 -13.378 -0.567 2.256 825 2HD1 ILE 103 2HD1 ILE 103 -14.998 -0.095 1.742 826 3HD1 ILE 103 3HD1 ILE 103 -13.597 0.365 0.775 827 H SER 104 H SER 104 -17.938 -2.009 2.124 828 HA SER 104 HA SER 104 -19.002 -0.216 0.013 829 1HB SER 104 1HB SER 104 -20.488 -1.566 1.470 830 2HB SER 104 2HB SER 104 -19.813 -0.771 2.892 831 HG SER 104 HG SER 104 -21.851 0.084 1.938 832 H TYR 105 H TYR 105 -19.799 1.979 1.415 833 HA TYR 105 HA TYR 105 -17.258 3.120 2.534 834 1HB TYR 105 1HB TYR 105 -19.382 4.377 0.755 835 2HB TYR 105 2HB TYR 105 -17.957 5.212 1.372 836 HD1 TYR 105 HD1 TYR 105 -19.124 3.988 -1.531 837 HD2 TYR 105 HD2 TYR 105 -15.788 3.349 1.099 838 HE1 TYR 105 HE1 TYR 105 -17.792 3.115 -3.432 839 HE2 TYR 105 HE2 TYR 105 -14.457 2.476 -0.802 840 HH TYR 105 HH TYR 105 -14.697 1.587 -2.956 841 H GLY 106 H GLY 106 -20.653 4.221 2.228 842 1HA GLY 106 1HA GLY 106 -22.216 4.570 4.006 843 2HA GLY 106 2HA GLY 106 -20.936 4.221 5.168 844 H ASP 107 H ASP 107 -21.938 6.259 6.150 845 HA ASP 107 HA ASP 107 -21.764 8.552 6.651 846 1HB ASP 107 1HB ASP 107 -19.430 7.906 6.861 847 2HB ASP 107 2HB ASP 107 -19.203 8.010 5.118 848 H ASP 108 H ASP 108 -19.975 8.987 3.631 849 HA ASP 108 HA ASP 108 -22.402 10.256 2.422 850 1HB ASP 108 1HB ASP 108 -20.523 11.693 3.667 851 2HB ASP 108 2HB ASP 108 -19.688 11.499 2.126 852 H TYR 109 H TYR 109 -19.139 8.919 1.897 853 HA TYR 109 HA TYR 109 -18.876 9.051 -0.869 854 1HB TYR 109 1HB TYR 109 -17.985 7.365 1.356 855 2HB TYR 109 2HB TYR 109 -18.024 6.486 -0.173 856 HD1 TYR 109 HD1 TYR 109 -17.342 10.103 0.521 857 HD2 TYR 109 HD2 TYR 109 -15.793 6.360 -0.910 858 HE1 TYR 109 HE1 TYR 109 -15.252 11.237 -0.184 859 HE2 TYR 109 HE2 TYR 109 -13.704 7.495 -1.616 860 HH TYR 109 HH TYR 109 -12.521 9.928 -0.654 861 H TRP 110 H TRP 110 -20.316 8.503 -2.434 862 HA TRP 110 HA TRP 110 -21.982 7.332 -3.613 863 1HB TRP 110 1HB TRP 110 -20.172 5.635 -3.452 864 2HB TRP 110 2HB TRP 110 -20.834 5.087 -1.913 865 HD1 TRP 110 HD1 TRP 110 -23.101 3.733 -1.948 866 HE1 TRP 110 HE1 TRP 110 -24.366 2.510 -3.834 867 HE3 TRP 110 HE3 TRP 110 -20.730 5.702 -6.017 868 HZ2 TRP 110 HZ2 TRP 110 -24.370 2.386 -6.693 869 HZ3 TRP 110 HZ3 TRP 110 -21.382 5.016 -8.307 870 HH2 TRP 110 HH2 TRP 110 -23.197 3.363 -8.650 871 H LEU 111 H LEU 111 -24.035 5.994 -3.257 872 HA LEU 111 HA LEU 111 -25.638 7.113 -1.192 873 1HB LEU 111 1HB LEU 111 -25.792 5.137 -3.342 874 2HB LEU 111 2HB LEU 111 -26.793 4.677 -1.965 875 HG LEU 111 HG LEU 111 -26.995 7.528 -2.613 876 1HD1 LEU 111 1HD1 LEU 111 -27.978 7.403 -4.738 877 2HD1 LEU 111 2HD1 LEU 111 -28.270 5.669 -4.606 878 3HD1 LEU 111 3HD1 LEU 111 -26.635 6.268 -4.882 879 1HD2 LEU 111 1HD2 LEU 111 -28.454 5.929 -1.140 880 2HD2 LEU 111 2HD2 LEU 111 -29.207 5.489 -2.673 881 3HD2 LEU 111 3HD2 LEU 111 -29.256 7.161 -2.114 882 H SER 112 H SER 112 -26.975 5.229 0.169 883 HA SER 112 HA SER 112 -25.160 3.273 1.413 884 1HB SER 112 1HB SER 112 -25.232 5.931 2.309 885 2HB SER 112 2HB SER 112 -26.254 5.059 3.452 886 HG SER 112 HG SER 112 -24.532 3.565 3.707 887 H ARG 113 H ARG 113 -28.255 5.034 1.622 888 HA ARG 113 HA ARG 113 -29.710 3.347 3.269 889 1HB ARG 113 1HB ARG 113 -30.157 5.445 1.460 890 2HB ARG 113 2HB ARG 113 -31.285 4.167 1.011 891 1HG ARG 113 1HG ARG 113 -32.597 4.884 2.702 892 2HG ARG 113 2HG ARG 113 -31.387 4.225 3.803 893 1HD ARG 113 1HD ARG 113 -31.222 7.026 2.639 894 2HD ARG 113 2HD ARG 113 -31.925 6.663 4.227 895 HE ARG 113 HE ARG 113 -29.416 5.355 4.109 896 1HH1 ARG 113 1HH1 ARG 113 -30.689 8.595 4.057 897 2HH1 ARG 113 2HH1 ARG 113 -29.275 9.279 4.781 898 1HH2 ARG 113 1HH2 ARG 113 -27.593 6.268 5.048 899 2HH2 ARG 113 2HH2 ARG 113 -27.535 7.974 5.339 900 HA PRO 114 HA PRO 114 -30.886 0.752 -0.716 901 1HB PRO 114 1HB PRO 114 -28.262 1.041 -2.104 902 2HB PRO 114 2HB PRO 114 -29.896 1.009 -2.789 903 1HG PRO 114 1HG PRO 114 -28.450 3.271 -2.579 904 2HG PRO 114 2HG PRO 114 -30.215 3.248 -2.462 905 1HD PRO 114 1HD PRO 114 -28.192 3.612 -0.320 906 2HD PRO 114 2HD PRO 114 -29.854 4.206 -0.409 907 H ARG 115 H ARG 115 -30.645 -0.873 0.897 908 HA ARG 115 HA ARG 115 -27.921 -1.942 1.424 909 1HB ARG 115 1HB ARG 115 -30.432 -1.648 2.813 910 2HB ARG 115 2HB ARG 115 -29.985 -3.354 2.797 911 1HG ARG 115 1HG ARG 115 -28.724 -2.763 4.610 912 2HG ARG 115 2HG ARG 115 -27.580 -2.226 3.380 913 1HD ARG 115 1HD ARG 115 -29.113 -0.011 3.511 914 2HD ARG 115 2HD ARG 115 -29.335 -0.607 5.167 915 HE ARG 115 HE ARG 115 -26.560 -0.772 4.342 916 1HH1 ARG 115 1HH1 ARG 115 -29.029 1.398 5.490 917 2HH1 ARG 115 2HH1 ARG 115 -27.894 2.484 6.211 918 1HH2 ARG 115 1HH2 ARG 115 -25.106 0.655 5.287 919 2HH2 ARG 115 2HH2 ARG 115 -25.689 2.070 6.098 920 H LEU 116 H LEU 116 -30.943 -2.781 -0.174 921 HA LEU 116 HA LEU 116 -31.522 -4.616 -1.534 922 1HB LEU 116 1HB LEU 116 -28.635 -4.075 -1.803 923 2HB LEU 116 2HB LEU 116 -29.095 -5.709 -2.282 924 HG LEU 116 HG LEU 116 -31.079 -4.343 -3.484 925 1HD1 LEU 116 1HD1 LEU 116 -30.628 -2.158 -3.933 926 2HD1 LEU 116 2HD1 LEU 116 -28.907 -2.465 -4.164 927 3HD1 LEU 116 3HD1 LEU 116 -29.557 -2.267 -2.536 928 1HD2 LEU 116 1HD2 LEU 116 -29.708 -5.864 -4.710 929 2HD2 LEU 116 2HD2 LEU 116 -28.264 -4.884 -4.452 930 3HD2 LEU 116 3HD2 LEU 116 -29.537 -4.313 -5.532 931 H THR 117 H THR 117 -28.525 -6.168 -0.460 932 HA THR 117 HA THR 117 -29.757 -8.606 0.295 933 HB THR 117 HB THR 117 -27.209 -7.297 1.321 934 HG1 THR 117 HG1 THR 117 -26.345 -7.842 -0.528 935 1HG2 THR 117 1HG2 THR 117 -26.476 -9.733 1.443 936 2HG2 THR 117 2HG2 THR 117 -28.169 -10.166 1.204 937 3HG2 THR 117 3HG2 THR 117 -27.686 -9.249 2.631 938 H GLN 118 H GLN 118 -30.128 -9.471 2.468 939 HA GLN 118 HA GLN 118 -31.081 -9.325 4.626 940 1HB GLN 118 1HB GLN 118 -28.691 -7.691 4.406 941 2HB GLN 118 2HB GLN 118 -29.800 -6.990 5.585 942 1HG GLN 118 1HG GLN 118 -30.012 -9.344 6.568 943 2HG GLN 118 2HG GLN 118 -28.629 -9.779 5.564 944 1HE2 GLN 118 1HE2 GLN 118 -27.209 -7.250 5.790 945 2HE2 GLN 118 2HE2 GLN 118 -26.668 -7.109 7.393 946 H ASN 119 H ASN 119 -32.122 -7.531 6.187 947 HA ASN 119 HA ASN 119 -33.919 -5.898 4.450 948 1HB ASN 119 1HB ASN 119 -34.642 -7.713 6.169 949 2HB ASN 119 2HB ASN 119 -34.228 -6.516 7.396 950 1HD2 ASN 119 1HD2 ASN 119 -36.898 -7.269 7.256 951 2HD2 ASN 119 2HD2 ASN 119 -37.828 -6.024 6.571 952 1H GLY 201 1H GLY 201 -28.567 24.488 -19.207 953 2H GLY 201 2H GLY 201 -27.701 25.848 -18.670 954 3H GLY 201 3H GLY 201 -29.397 25.825 -18.568 955 1HA GLY 201 1HA GLY 201 -29.330 24.068 -16.939 956 2HA GLY 201 2HA GLY 201 -27.573 24.015 -17.078 957 H LYS 202 H LYS 202 -29.953 25.150 -15.138 958 HA LYS 202 HA LYS 202 -28.305 27.503 -14.267 959 1HB LYS 202 1HB LYS 202 -30.477 28.511 -13.612 960 2HB LYS 202 2HB LYS 202 -30.469 28.095 -15.325 961 1HG LYS 202 1HG LYS 202 -31.347 25.789 -13.909 962 2HG LYS 202 2HG LYS 202 -32.244 27.163 -13.264 963 1HD LYS 202 1HD LYS 202 -32.165 27.533 -16.066 964 2HD LYS 202 2HD LYS 202 -32.552 25.832 -15.811 965 1HE LYS 202 1HE LYS 202 -34.392 26.478 -14.283 966 2HE LYS 202 2HE LYS 202 -34.004 28.189 -14.549 967 1HZ LYS 202 1HZ LYS 202 -34.200 27.672 -16.992 968 2HZ LYS 202 2HZ LYS 202 -35.662 27.635 -16.128 969 3HZ LYS 202 3HZ LYS 202 -34.890 26.184 -16.553 970 H ALA 203 H ALA 203 -28.099 24.701 -13.342 971 HA ALA 203 HA ALA 203 -29.338 24.753 -10.644 972 1HB ALA 203 1HB ALA 203 -27.733 22.480 -10.944 973 2HB ALA 203 2HB ALA 203 -28.313 22.806 -12.577 974 3HB ALA 203 3HB ALA 203 -29.465 22.567 -11.263 975 HA PRO 204 HA PRO 204 -25.796 25.773 -8.269 976 1HB PRO 204 1HB PRO 204 -25.472 22.999 -7.233 977 2HB PRO 204 2HB PRO 204 -25.733 24.507 -6.339 978 1HG PRO 204 1HG PRO 204 -27.662 22.666 -6.640 979 2HG PRO 204 2HG PRO 204 -28.009 24.399 -6.566 980 1HD PRO 204 1HD PRO 204 -28.015 22.565 -8.905 981 2HD PRO 204 2HD PRO 204 -29.008 24.002 -8.588 982 H ARG 205 H ARG 205 -23.411 25.323 -8.029 983 HA ARG 205 HA ARG 205 -22.346 23.418 -10.072 984 1HB ARG 205 1HB ARG 205 -22.697 25.984 -10.688 985 2HB ARG 205 2HB ARG 205 -21.198 26.180 -9.781 986 1HG ARG 205 1HG ARG 205 -20.232 25.710 -11.799 987 2HG ARG 205 2HG ARG 205 -20.552 24.040 -11.328 988 1HD ARG 205 1HD ARG 205 -22.958 25.063 -12.472 989 2HD ARG 205 2HD ARG 205 -21.627 25.474 -13.569 990 HE ARG 205 HE ARG 205 -21.437 22.756 -12.520 991 1HH1 ARG 205 1HH1 ARG 205 -22.848 24.789 -14.968 992 2HH1 ARG 205 2HH1 ARG 205 -23.055 23.486 -16.086 993 1HH2 ARG 205 1HH2 ARG 205 -21.717 21.081 -13.989 994 2HH2 ARG 205 2HH2 ARG 205 -22.421 21.403 -15.538 995 H LYS 206 H LYS 206 -21.170 25.897 -7.754 996 HA LYS 206 HA LYS 206 -18.858 24.252 -7.037 997 1HB LYS 206 1HB LYS 206 -19.346 26.890 -7.131 998 2HB LYS 206 2HB LYS 206 -19.784 26.616 -5.445 999 1HG LYS 206 1HG LYS 206 -17.466 25.222 -5.546 1000 2HG LYS 206 2HG LYS 206 -17.127 26.451 -6.765 1001 1HD LYS 206 1HD LYS 206 -18.102 27.027 -3.950 1002 2HD LYS 206 2HD LYS 206 -16.427 27.169 -4.484 1003 1HE LYS 206 1HE LYS 206 -16.825 29.172 -5.498 1004 2HE LYS 206 2HE LYS 206 -18.332 28.588 -6.229 1005 1HZ LYS 206 1HZ LYS 206 -18.880 30.220 -4.576 1006 2HZ LYS 206 2HZ LYS 206 -17.919 29.446 -3.410 1007 3HZ LYS 206 3HZ LYS 206 -19.335 28.698 -3.976 1008 H GLN 207 H GLN 207 -18.516 23.273 -4.972 1009 HA GLN 207 HA GLN 207 -20.862 22.142 -3.707 1010 1HB GLN 207 1HB GLN 207 -17.879 22.174 -3.278 1011 2HB GLN 207 2HB GLN 207 -18.924 21.455 -2.053 1012 1HG GLN 207 1HG GLN 207 -19.950 20.034 -3.847 1013 2HG GLN 207 2HG GLN 207 -18.763 20.679 -4.980 1014 1HE2 GLN 207 1HE2 GLN 207 -18.893 17.871 -4.270 1015 2HE2 GLN 207 2HE2 GLN 207 -17.463 17.480 -3.443 1016 H LEU 208 H LEU 208 -21.920 22.830 -1.860 1017 HA LEU 208 HA LEU 208 -20.691 24.682 0.042 1018 1HB LEU 208 1HB LEU 208 -21.410 25.984 -2.080 1019 2HB LEU 208 2HB LEU 208 -23.065 25.672 -1.558 1020 HG LEU 208 HG LEU 208 -21.867 26.568 0.764 1021 1HD1 LEU 208 1HD1 LEU 208 -19.835 27.311 -0.192 1022 2HD1 LEU 208 2HD1 LEU 208 -20.820 28.772 -0.106 1023 3HD1 LEU 208 3HD1 LEU 208 -20.639 27.919 -1.639 1024 1HD2 LEU 208 1HD2 LEU 208 -23.068 28.732 0.199 1025 2HD2 LEU 208 2HD2 LEU 208 -24.053 27.277 0.053 1026 3HD2 LEU 208 3HD2 LEU 208 -23.397 28.046 -1.392 1027 H ALA 209 H ALA 209 -21.715 22.244 0.648 1028 HA ALA 209 HA ALA 209 -24.236 22.925 2.102 1029 1HB ALA 209 1HB ALA 209 -25.160 21.720 0.341 1030 2HB ALA 209 2HB ALA 209 -24.743 20.380 1.410 1031 3HB ALA 209 3HB ALA 209 -23.681 20.799 0.065 1032 H THR 210 H THR 210 -22.356 19.915 1.690 1033 HA THR 210 HA THR 210 -21.564 20.077 4.570 1034 HB THR 210 HB THR 210 -22.217 17.588 4.613 1035 HG1 THR 210 HG1 THR 210 -22.402 17.233 2.426 1036 1HG2 THR 210 1HG2 THR 210 -23.703 19.922 5.042 1037 2HG2 THR 210 2HG2 THR 210 -24.101 18.306 5.628 1038 3HG2 THR 210 3HG2 THR 210 -24.774 18.882 4.103 1039 H LYS 211 H LYS 211 -19.579 19.018 5.023 1040 HA LYS 211 HA LYS 211 -17.981 18.289 2.610 1041 1HB LYS 211 1HB LYS 211 -17.572 19.660 5.165 1042 2HB LYS 211 2HB LYS 211 -16.330 18.445 4.862 1043 1HG LYS 211 1HG LYS 211 -17.132 20.345 2.673 1044 2HG LYS 211 2HG LYS 211 -16.000 20.870 3.919 1045 1HD LYS 211 1HD LYS 211 -14.951 18.438 3.292 1046 2HD LYS 211 2HD LYS 211 -15.629 18.904 1.732 1047 1HE LYS 211 1HE LYS 211 -14.281 21.168 2.950 1048 2HE LYS 211 2HE LYS 211 -13.182 19.782 2.820 1049 1HZ LYS 211 1HZ LYS 211 -13.422 21.219 0.760 1050 2HZ LYS 211 2HZ LYS 211 -14.994 20.593 0.616 1051 3HZ LYS 211 3HZ LYS 211 -13.655 19.551 0.539 1052 H ALA 212 H ALA 212 -18.739 17.138 5.909 1053 HA ALA 212 HA ALA 212 -18.555 14.981 6.854 1054 1HB ALA 212 1HB ALA 212 -18.779 13.327 4.625 1055 2HB ALA 212 2HB ALA 212 -19.517 14.835 4.083 1056 3HB ALA 212 3HB ALA 212 -20.132 14.019 5.521 1057 H ALA 213 H ALA 213 -17.413 12.635 5.944 1058 HA ALA 213 HA ALA 213 -14.542 13.422 5.661 1059 1HB ALA 213 1HB ALA 213 -14.097 11.492 6.937 1060 2HB ALA 213 2HB ALA 213 -15.586 10.698 6.425 1061 3HB ALA 213 3HB ALA 213 -15.647 12.015 7.596 1062 H ARG 214 H ARG 214 -13.635 10.844 4.841 1063 HA ARG 214 HA ARG 214 -14.474 10.914 1.989 1064 1HB ARG 214 1HB ARG 214 -12.109 9.962 3.587 1065 2HB ARG 214 2HB ARG 214 -12.367 9.316 1.967 1066 1HG ARG 214 1HG ARG 214 -11.315 11.165 1.204 1067 2HG ARG 214 2HG ARG 214 -12.767 12.056 1.659 1068 1HD ARG 214 1HD ARG 214 -11.290 11.691 4.053 1069 2HD ARG 214 2HD ARG 214 -10.131 12.224 2.821 1070 HE ARG 214 HE ARG 214 -12.339 13.804 3.880 1071 1HH1 ARG 214 1HH1 ARG 214 -10.375 13.169 1.076 1072 2HH1 ARG 214 2HH1 ARG 214 -10.632 14.741 0.403 1073 1HH2 ARG 214 1HH2 ARG 214 -12.658 15.838 2.986 1074 2HH2 ARG 214 2HH2 ARG 214 -11.915 16.243 1.475 1075 1HN MLZ 215 1HN MLZ 215 -13.141 7.994 3.456 1076 HA MLZ 215 HA MLZ 215 -15.657 6.579 2.696 1077 1HB MLZ 215 1HB MLZ 215 -12.858 5.590 3.356 1078 2HB MLZ 215 2HB MLZ 215 -14.167 4.603 2.710 1079 1HG MLZ 215 1HG MLZ 215 -13.278 7.089 1.261 1080 2HG MLZ 215 2HG MLZ 215 -14.112 5.675 0.620 1081 1HD MLZ 215 1HD MLZ 215 -11.214 5.926 1.436 1082 2HD MLZ 215 2HD MLZ 215 -11.994 4.354 1.250 1083 1HE MLZ 215 1HE MLZ 215 -10.899 5.995 -0.807 1084 2HE MLZ 215 2HE MLZ 215 -12.657 5.964 -1.035 1085 HZ MLZ 215 HZ MLZ 215 -12.423 3.480 -0.507 1086 1HCM MLZ 215 1HCM MLZ 215 -11.935 2.969 -2.835 1087 2HCM MLZ 215 2HCM MLZ 215 -11.342 4.614 -3.032 1088 3HCM MLZ 215 3HCM MLZ 215 -13.040 4.328 -2.668 1089 H SER 216 H SER 216 -17.006 5.907 4.304 1090 HA SER 216 HA SER 216 -17.780 5.276 6.439 1091 1HB SER 216 1HB SER 216 -16.638 7.690 6.599 1092 2HB SER 216 2HB SER 216 -17.220 6.864 8.044 1093 HG SER 216 HG SER 216 -14.931 7.742 7.915 1094 H ALA 217 H ALA 217 -17.020 4.168 8.541 1095 HA ALA 217 HA ALA 217 -15.253 1.970 7.866 1096 1HB ALA 217 1HB ALA 217 -14.095 4.396 8.772 1097 2HB ALA 217 2HB ALA 217 -13.285 2.841 8.582 1098 3HB ALA 217 3HB ALA 217 -14.005 3.276 10.131 1099 HA PRO 218 HA PRO 218 -17.563 0.235 11.184 1100 1HB PRO 218 1HB PRO 218 -15.864 -1.771 11.996 1101 2HB PRO 218 2HB PRO 218 -16.802 -1.842 10.495 1102 1HG PRO 218 1HG PRO 218 -13.950 -1.126 10.881 1103 2HG PRO 218 2HG PRO 218 -14.700 -2.120 9.630 1104 1HD PRO 218 1HD PRO 218 -13.974 0.450 9.247 1105 2HD PRO 218 2HD PRO 218 -15.330 -0.298 8.402 1106 H ALA 219 H ALA 219 -17.600 0.149 13.531 1107 HA ALA 219 HA ALA 219 -17.046 0.990 15.668 1108 1HB ALA 219 1HB ALA 219 -14.326 0.816 15.813 1109 2HB ALA 219 2HB ALA 219 -14.631 -0.194 14.401 1110 3HB ALA 219 3HB ALA 219 -15.390 -0.584 15.944 1111 H THR 220 H THR 220 -17.705 3.157 14.509 1112 HA THR 220 HA THR 220 -15.487 5.001 13.936 1113 HB THR 220 HB THR 220 -17.574 6.572 13.809 1114 HG1 THR 220 HG1 THR 220 -18.988 5.321 14.984 1115 1HG2 THR 220 1HG2 THR 220 -17.761 4.195 11.974 1116 2HG2 THR 220 2HG2 THR 220 -16.332 5.227 11.933 1117 3HG2 THR 220 3HG2 THR 220 -17.922 5.908 11.588 1118 H GLY 221 H GLY 221 -15.070 6.924 15.204 1119 1HA GLY 221 1HA GLY 221 -14.767 8.100 17.212 1120 2HA GLY 221 2HA GLY 221 -16.403 7.591 17.631 1121 1H MET 1 1H MET 1 -0.829 -11.925 7.544 1122 2H MET 1 2H MET 1 -1.050 -11.499 5.915 1123 3H MET 1 3H MET 1 -1.754 -10.559 7.141 1124 HA MET 1 HA MET 1 0.351 -9.640 6.070 1125 1HB MET 1 1HB MET 1 -0.782 -9.722 8.700 1126 2HB MET 1 2HB MET 1 0.971 -9.656 8.873 1127 1HG MET 1 1HG MET 1 -0.549 -7.808 7.023 1128 2HG MET 1 2HG MET 1 -0.217 -7.399 8.706 1129 1HE MET 1 1HE MET 1 2.237 -5.108 7.033 1130 2HE MET 1 2HE MET 1 0.583 -5.372 7.587 1131 3HE MET 1 3HE MET 1 1.018 -5.716 5.913 1132 H PHE 2 H PHE 2 0.591 -12.742 6.298 1133 HA PHE 2 HA PHE 2 3.486 -12.837 6.232 1134 1HB PHE 2 1HB PHE 2 3.680 -14.244 8.323 1135 2HB PHE 2 2HB PHE 2 3.197 -12.579 8.639 1136 HD1 PHE 2 HD1 PHE 2 2.170 -16.088 8.715 1137 HD2 PHE 2 HD2 PHE 2 0.837 -12.031 9.178 1138 HE1 PHE 2 HE1 PHE 2 0.107 -16.893 9.831 1139 HE2 PHE 2 HE2 PHE 2 -1.225 -12.835 10.293 1140 HZ PHE 2 HZ PHE 2 -1.590 -15.266 10.620 1141 H ASN 3 H ASN 3 3.837 -14.427 4.750 1142 HA ASN 3 HA ASN 3 1.990 -16.793 4.748 1143 1HB ASN 3 1HB ASN 3 2.485 -16.803 2.272 1144 2HB ASN 3 2HB ASN 3 1.657 -15.344 2.814 1145 1HD2 ASN 3 1HD2 ASN 3 2.770 -14.539 0.677 1146 2HD2 ASN 3 2HD2 ASN 3 4.334 -13.897 0.841 1147 H ASP 4 H ASP 4 3.041 -18.802 3.907 1148 HA ASP 4 HA ASP 4 5.350 -19.570 5.271 1149 1HB ASP 4 1HB ASP 4 5.367 -21.438 3.634 1150 2HB ASP 4 2HB ASP 4 3.720 -21.052 4.133 1151 H ARG 5 H ARG 5 5.132 -17.779 2.257 1152 HA ARG 5 HA ARG 5 7.867 -18.269 1.403 1153 1HB ARG 5 1HB ARG 5 5.953 -17.618 -0.063 1154 2HB ARG 5 2HB ARG 5 5.896 -16.048 0.738 1155 1HG ARG 5 1HG ARG 5 7.838 -15.314 -0.264 1156 2HG ARG 5 2HG ARG 5 8.520 -16.937 -0.369 1157 1HD ARG 5 1HD ARG 5 7.957 -16.249 -2.623 1158 2HD ARG 5 2HD ARG 5 6.737 -17.436 -2.126 1159 HE ARG 5 HE ARG 5 5.912 -14.802 -1.325 1160 1HH1 ARG 5 1HH1 ARG 5 6.277 -16.822 -4.136 1161 2HH1 ARG 5 2HH1 ARG 5 5.023 -16.017 -5.013 1162 1HH2 ARG 5 1HH2 ARG 5 4.288 -13.772 -2.483 1163 2HH2 ARG 5 2HH2 ARG 5 3.904 -14.303 -4.087 1164 H VAL 6 H VAL 6 6.238 -15.541 3.065 1165 HA VAL 6 HA VAL 6 8.809 -14.814 4.336 1166 HB VAL 6 HB VAL 6 8.563 -12.457 3.447 1167 1HG1 VAL 6 1HG1 VAL 6 10.042 -14.260 2.420 1168 2HG1 VAL 6 2HG1 VAL 6 9.589 -12.942 1.340 1169 3HG1 VAL 6 3HG1 VAL 6 8.769 -14.498 1.225 1170 1HG2 VAL 6 1HG2 VAL 6 6.122 -12.701 2.909 1171 2HG2 VAL 6 2HG2 VAL 6 6.569 -13.747 1.561 1172 3HG2 VAL 6 3HG2 VAL 6 7.074 -12.057 1.571 1173 H ILE 7 H ILE 7 8.300 -12.604 5.628 1174 HA ILE 7 HA ILE 7 5.510 -12.504 6.615 1175 HB ILE 7 HB ILE 7 6.538 -14.324 7.892 1176 1HG1 ILE 7 1HG1 ILE 7 6.487 -11.780 9.545 1177 2HG1 ILE 7 2HG1 ILE 7 5.069 -12.735 9.115 1178 1HG2 ILE 7 1HG2 ILE 7 8.878 -12.813 7.543 1179 2HG2 ILE 7 2HG2 ILE 7 8.724 -14.324 8.441 1180 3HG2 ILE 7 3HG2 ILE 7 8.568 -12.780 9.279 1181 1HD1 ILE 7 1HD1 ILE 7 7.326 -13.433 10.973 1182 2HD1 ILE 7 2HD1 ILE 7 6.417 -14.719 10.179 1183 3HD1 ILE 7 3HD1 ILE 7 5.588 -13.576 11.235 1184 H VAL 8 H VAL 8 5.090 -10.526 7.758 1185 HA VAL 8 HA VAL 8 7.132 -8.421 7.294 1186 HB VAL 8 HB VAL 8 4.222 -8.362 8.175 1187 1HG1 VAL 8 1HG1 VAL 8 4.315 -5.977 7.811 1188 2HG1 VAL 8 2HG1 VAL 8 5.956 -6.085 7.175 1189 3HG1 VAL 8 3HG1 VAL 8 5.651 -6.392 8.884 1190 1HG2 VAL 8 1HG2 VAL 8 5.576 -7.890 5.502 1191 2HG2 VAL 8 2HG2 VAL 8 3.883 -7.522 5.831 1192 3HG2 VAL 8 3HG2 VAL 8 4.452 -9.190 5.901 1193 H LYS 9 H LYS 9 8.467 -7.893 8.949 1194 HA LYS 9 HA LYS 9 7.440 -8.143 11.746 1195 1HB LYS 9 1HB LYS 9 10.026 -8.902 10.425 1196 2HB LYS 9 2HB LYS 9 9.983 -8.588 12.156 1197 1HG LYS 9 1HG LYS 9 8.180 -10.274 12.400 1198 2HG LYS 9 2HG LYS 9 8.264 -10.597 10.670 1199 1HD LYS 9 1HD LYS 9 10.176 -11.815 10.866 1200 2HD LYS 9 2HD LYS 9 10.855 -10.734 12.083 1201 1HE LYS 9 1HE LYS 9 9.266 -11.728 13.763 1202 2HE LYS 9 2HE LYS 9 8.770 -12.898 12.527 1203 1HZ LYS 9 1HZ LYS 9 11.576 -12.422 13.398 1204 2HZ LYS 9 2HZ LYS 9 11.055 -13.591 12.282 1205 3HZ LYS 9 3HZ LYS 9 10.617 -13.723 13.918 1206 H LYS 10 H LYS 10 8.833 -4.887 12.484 1207 HA LYS 10 HA LYS 10 7.934 -5.777 14.443 1208 1HB LYS 10 1HB LYS 10 6.302 -6.580 12.152 1209 2HB LYS 10 2HB LYS 10 6.113 -7.670 13.525 1210 1HG LYS 10 1HG LYS 10 5.996 -4.665 13.830 1211 2HG LYS 10 2HG LYS 10 4.561 -5.626 13.470 1212 1HD LYS 10 1HD LYS 10 6.389 -6.009 15.862 1213 2HD LYS 10 2HD LYS 10 4.788 -5.271 15.902 1214 1HE LYS 10 1HE LYS 10 3.945 -7.488 14.855 1215 2HE LYS 10 2HE LYS 10 5.509 -8.157 15.356 1216 1HZ LYS 10 1HZ LYS 10 3.823 -8.366 17.111 1217 2HZ LYS 10 2HZ LYS 10 3.624 -6.680 17.123 1218 3HZ LYS 10 3HZ LYS 10 5.105 -7.363 17.595 1219 H SER 11 H SER 11 10.318 -6.839 14.213 1220 HA SER 11 HA SER 11 10.034 -9.813 14.353 1221 1HB SER 11 1HB SER 11 12.143 -9.861 13.420 1222 2HB SER 11 2HB SER 11 11.725 -8.227 12.914 1223 HG SER 11 HG SER 11 13.747 -8.328 13.984 1224 HA PRO 12 HA PRO 12 11.220 -10.137 18.579 1225 1HB PRO 12 1HB PRO 12 14.041 -10.916 18.068 1226 2HB PRO 12 2HB PRO 12 12.759 -11.825 18.887 1227 1HG PRO 12 1HG PRO 12 13.649 -12.473 16.435 1228 2HG PRO 12 2HG PRO 12 11.971 -12.721 16.936 1229 1HD PRO 12 1HD PRO 12 13.127 -10.636 15.154 1230 2HD PRO 12 2HD PRO 12 11.539 -11.431 15.090 1231 H LEU 13 H LEU 13 13.846 -8.661 16.669 1232 HA LEU 13 HA LEU 13 14.737 -7.019 18.947 1233 1HB LEU 13 1HB LEU 13 15.491 -7.407 16.045 1234 2HB LEU 13 2HB LEU 13 16.205 -6.103 16.993 1235 HG LEU 13 HG LEU 13 16.237 -8.629 18.446 1236 1HD1 LEU 13 1HD1 LEU 13 18.018 -9.657 16.998 1237 2HD1 LEU 13 2HD1 LEU 13 17.618 -8.475 15.751 1238 3HD1 LEU 13 3HD1 LEU 13 16.417 -9.663 16.258 1239 1HD2 LEU 13 1HD2 LEU 13 18.336 -7.872 19.079 1240 2HD2 LEU 13 2HD2 LEU 13 17.587 -6.345 18.612 1241 3HD2 LEU 13 3HD2 LEU 13 18.675 -7.171 17.497 1242 H GLY 14 H GLY 14 12.593 -6.721 16.202 1243 1HA GLY 14 1HA GLY 14 10.888 -4.908 16.359 1244 2HA GLY 14 2HA GLY 14 12.180 -3.846 16.918 1245 H GLY 15 H GLY 15 11.691 -2.396 15.129 1246 1HA GLY 15 1HA GLY 15 12.288 -1.517 13.027 1247 2HA GLY 15 2HA GLY 15 13.282 -2.951 12.771 1248 H TYR 16 H TYR 16 11.120 -1.473 11.110 1249 HA TYR 16 HA TYR 16 9.208 -3.721 10.704 1250 1HB TYR 16 1HB TYR 16 9.204 -0.832 10.522 1251 2HB TYR 16 2HB TYR 16 8.683 -1.525 8.987 1252 HD1 TYR 16 HD1 TYR 16 7.012 -3.600 9.241 1253 HD2 TYR 16 HD2 TYR 16 7.600 -0.523 12.180 1254 HE1 TYR 16 HE1 TYR 16 4.799 -4.123 10.231 1255 HE2 TYR 16 HE2 TYR 16 5.387 -1.046 13.169 1256 HH TYR 16 HH TYR 16 3.731 -2.631 13.233 1257 H GLY 17 H GLY 17 11.185 -4.934 9.751 1258 1HA GLY 17 1HA GLY 17 11.591 -4.139 6.893 1259 2HA GLY 17 2HA GLY 17 12.750 -5.092 7.822 1260 H VAL 18 H VAL 18 12.233 -6.442 5.684 1261 HA VAL 18 HA VAL 18 9.804 -8.123 6.120 1262 HB VAL 18 HB VAL 18 11.759 -7.815 3.811 1263 1HG1 VAL 18 1HG1 VAL 18 10.225 -10.034 4.340 1264 2HG1 VAL 18 2HG1 VAL 18 10.713 -9.524 2.724 1265 3HG1 VAL 18 3HG1 VAL 18 9.128 -9.072 3.350 1266 1HG2 VAL 18 1HG2 VAL 18 9.044 -6.695 4.459 1267 2HG2 VAL 18 2HG2 VAL 18 9.534 -6.903 2.778 1268 3HG2 VAL 18 3HG2 VAL 18 10.470 -5.857 3.847 1269 H PHE 19 H PHE 19 10.016 -10.379 6.417 1270 HA PHE 19 HA PHE 19 12.787 -11.310 7.082 1271 1HB PHE 19 1HB PHE 19 10.218 -11.398 8.398 1272 2HB PHE 19 2HB PHE 19 10.776 -13.045 8.106 1273 HD1 PHE 19 HD1 PHE 19 12.598 -13.972 9.334 1274 HD2 PHE 19 HD2 PHE 19 11.734 -9.772 9.598 1275 HE1 PHE 19 HE1 PHE 19 14.206 -13.759 11.210 1276 HE2 PHE 19 HE2 PHE 19 13.342 -9.559 11.474 1277 HZ PHE 19 HZ PHE 19 14.578 -11.553 12.280 1278 H ALA 20 H ALA 20 13.611 -12.833 5.716 1279 HA ALA 20 HA ALA 20 11.871 -14.005 3.643 1280 1HB ALA 20 1HB ALA 20 14.613 -14.916 3.644 1281 2HB ALA 20 2HB ALA 20 14.574 -13.181 3.961 1282 3HB ALA 20 3HB ALA 20 13.821 -13.829 2.503 1283 H ARG 21 H ARG 21 10.633 -15.537 4.920 1284 HA ARG 21 HA ARG 21 11.716 -17.510 6.671 1285 1HB ARG 21 1HB ARG 21 9.255 -16.729 5.695 1286 2HB ARG 21 2HB ARG 21 9.465 -18.301 4.924 1287 1HG ARG 21 1HG ARG 21 8.859 -19.274 6.861 1288 2HG ARG 21 2HG ARG 21 10.323 -18.624 7.597 1289 1HD ARG 21 1HD ARG 21 9.098 -17.171 8.833 1290 2HD ARG 21 2HD ARG 21 8.301 -16.549 7.376 1291 HE ARG 21 HE ARG 21 6.501 -18.029 7.803 1292 1HH1 ARG 21 1HH1 ARG 21 9.334 -18.970 9.595 1293 2HH1 ARG 21 2HH1 ARG 21 8.504 -20.211 10.468 1294 1HH2 ARG 21 1HH2 ARG 21 5.447 -19.646 8.948 1295 2HH2 ARG 21 2HH2 ARG 21 6.320 -20.593 10.106 1296 H LYS 22 H LYS 22 11.777 -17.194 3.205 1297 HA LYS 22 HA LYS 22 12.509 -20.023 2.747 1298 1HB LYS 22 1HB LYS 22 11.399 -17.778 1.324 1299 2HB LYS 22 2HB LYS 22 12.832 -18.330 0.463 1300 1HG LYS 22 1HG LYS 22 11.883 -20.345 -0.083 1301 2HG LYS 22 2HG LYS 22 11.007 -20.458 1.442 1302 1HD LYS 22 1HD LYS 22 9.601 -18.468 0.489 1303 2HD LYS 22 2HD LYS 22 10.249 -18.981 -1.069 1304 1HE LYS 22 1HE LYS 22 8.884 -20.904 0.842 1305 2HE LYS 22 2HE LYS 22 8.020 -20.047 -0.448 1306 1HZ LYS 22 1HZ LYS 22 9.372 -21.012 -2.083 1307 2HZ LYS 22 2HZ LYS 22 9.026 -22.302 -1.033 1308 3HZ LYS 22 3HZ LYS 22 10.536 -21.528 -0.958 1309 H SER 23 H SER 23 15.952 -19.271 1.603 1310 HA SER 23 HA SER 23 13.447 -20.805 1.077 1311 1HB SER 23 1HB SER 23 15.434 -22.069 1.685 1312 2HB SER 23 2HB SER 23 15.126 -22.345 -0.029 1313 HG SER 23 HG SER 23 17.141 -21.742 -0.172 1314 H PHE 24 H PHE 24 15.502 -18.392 -0.326 1315 HA PHE 24 HA PHE 24 13.922 -18.565 -2.856 1316 1HB PHE 24 1HB PHE 24 15.451 -16.387 -1.399 1317 2HB PHE 24 2HB PHE 24 14.805 -16.158 -3.023 1318 HD1 PHE 24 HD1 PHE 24 14.127 -15.443 0.253 1319 HD2 PHE 24 HD2 PHE 24 12.239 -17.254 -3.154 1320 HE1 PHE 24 HE1 PHE 24 11.900 -14.923 1.211 1321 HE2 PHE 24 HE2 PHE 24 10.011 -16.733 -2.196 1322 HZ PHE 24 HZ PHE 24 9.847 -15.565 -0.013 1323 H GLU 25 H GLU 25 15.094 -18.068 -4.879 1324 HA GLU 25 HA GLU 25 17.862 -19.184 -4.853 1325 1HB GLU 25 1HB GLU 25 15.520 -19.487 -6.445 1326 2HB GLU 25 2HB GLU 25 16.722 -18.694 -7.463 1327 1HG GLU 25 1HG GLU 25 16.903 -21.157 -7.614 1328 2HG GLU 25 2HG GLU 25 18.360 -20.451 -6.914 1329 H LYS 26 H LYS 26 18.740 -18.052 -7.279 1330 HA LYS 26 HA LYS 26 19.241 -15.254 -6.411 1331 1HB LYS 26 1HB LYS 26 21.071 -16.877 -6.991 1332 2HB LYS 26 2HB LYS 26 20.451 -16.929 -8.641 1333 1HG LYS 26 1HG LYS 26 20.733 -14.411 -8.717 1334 2HG LYS 26 2HG LYS 26 21.582 -14.531 -7.176 1335 1HD LYS 26 1HD LYS 26 23.311 -15.885 -8.135 1336 2HD LYS 26 2HD LYS 26 22.389 -16.124 -9.620 1337 1HE LYS 26 1HE LYS 26 23.221 -14.206 -10.502 1338 2HE LYS 26 2HE LYS 26 22.744 -13.286 -9.062 1339 1HZ LYS 26 1HZ LYS 26 24.688 -13.952 -7.931 1340 2HZ LYS 26 2HZ LYS 26 25.218 -13.486 -9.475 1341 3HZ LYS 26 3HZ LYS 26 25.067 -15.133 -9.091 1342 H GLY 27 H GLY 27 17.386 -14.108 -7.099 1343 1HA GLY 27 1HA GLY 27 16.577 -12.670 -8.889 1344 2HA GLY 27 2HA GLY 27 17.084 -13.894 -10.054 1345 H GLU 28 H GLU 28 14.964 -13.831 -7.158 1346 HA GLU 28 HA GLU 28 12.854 -15.153 -8.832 1347 1HB GLU 28 1HB GLU 28 14.348 -16.135 -6.605 1348 2HB GLU 28 2HB GLU 28 12.693 -15.882 -6.051 1349 1HG GLU 28 1HG GLU 28 11.909 -17.144 -8.094 1350 2HG GLU 28 2HG GLU 28 13.596 -17.540 -8.421 1351 H LEU 29 H LEU 29 11.071 -13.853 -8.891 1352 HA LEU 29 HA LEU 29 10.678 -11.494 -7.384 1353 1HB LEU 29 1HB LEU 29 9.554 -12.527 -9.529 1354 2HB LEU 29 2HB LEU 29 8.410 -13.218 -8.378 1355 HG LEU 29 HG LEU 29 7.596 -11.050 -9.220 1356 1HD1 LEU 29 1HD1 LEU 29 7.491 -11.869 -6.690 1357 2HD1 LEU 29 2HD1 LEU 29 6.880 -10.282 -7.158 1358 3HD1 LEU 29 3HD1 LEU 29 8.479 -10.432 -6.431 1359 1HD2 LEU 29 1HD2 LEU 29 9.398 -9.280 -7.881 1360 2HD2 LEU 29 2HD2 LEU 29 9.045 -9.374 -9.606 1361 3HD2 LEU 29 3HD2 LEU 29 10.347 -10.344 -8.918 1362 H VAL 30 H VAL 30 9.919 -11.141 -5.327 1363 HA VAL 30 HA VAL 30 9.053 -13.516 -3.738 1364 HB VAL 30 HB VAL 30 10.077 -10.742 -3.026 1365 1HG1 VAL 30 1HG1 VAL 30 9.215 -13.071 -1.295 1366 2HG1 VAL 30 2HG1 VAL 30 8.616 -11.413 -1.247 1367 3HG1 VAL 30 3HG1 VAL 30 10.253 -11.775 -0.702 1368 1HG2 VAL 30 1HG2 VAL 30 11.477 -12.911 -3.940 1369 2HG2 VAL 30 2HG2 VAL 30 11.532 -13.173 -2.197 1370 3HG2 VAL 30 3HG2 VAL 30 12.150 -11.670 -2.883 1371 H GLU 31 H GLU 31 8.119 -10.170 -4.538 1372 HA GLU 31 HA GLU 31 5.287 -10.797 -4.258 1373 1HB GLU 31 1HB GLU 31 6.507 -10.458 -1.903 1374 2HB GLU 31 2HB GLU 31 6.285 -8.754 -2.298 1375 1HG GLU 31 1HG GLU 31 4.047 -8.853 -1.946 1376 2HG GLU 31 2HG GLU 31 3.896 -10.387 -2.804 1377 H GLU 32 H GLU 32 3.955 -8.954 -4.894 1378 HA GLU 32 HA GLU 32 5.355 -6.492 -5.775 1379 1HB GLU 32 1HB GLU 32 4.527 -6.829 -8.094 1380 2HB GLU 32 2HB GLU 32 5.586 -8.152 -7.605 1381 1HG GLU 32 1HG GLU 32 3.604 -9.512 -7.018 1382 2HG GLU 32 2HG GLU 32 2.553 -8.192 -7.530 1383 H CYS 33 H CYS 33 3.871 -4.738 -6.102 1384 HA CYS 33 HA CYS 33 0.973 -5.278 -5.753 1385 1HB CYS 33 1HB CYS 33 2.789 -4.528 -3.665 1386 2HB CYS 33 2HB CYS 33 1.721 -3.159 -3.973 1387 HG CYS 33 HG CYS 33 0.855 -5.882 -2.827 1388 H LEU 34 H LEU 34 0.254 -2.594 -5.215 1389 HA LEU 34 HA LEU 34 0.875 -1.358 -7.849 1390 1HB LEU 34 1HB LEU 34 -1.372 -1.610 -6.035 1391 2HB LEU 34 2HB LEU 34 -1.083 0.089 -6.405 1392 HG LEU 34 HG LEU 34 -2.626 -0.961 -8.040 1393 1HD1 LEU 34 1HD1 LEU 34 0.063 -0.339 -9.289 1394 2HD1 LEU 34 2HD1 LEU 34 -1.039 0.891 -8.674 1395 3HD1 LEU 34 3HD1 LEU 34 -1.526 -0.132 -10.025 1396 1HD2 LEU 34 1HD2 LEU 34 -0.227 -2.667 -8.773 1397 2HD2 LEU 34 2HD2 LEU 34 -1.807 -2.691 -9.555 1398 3HD2 LEU 34 3HD2 LEU 34 -1.638 -3.250 -7.890 1399 H CYS 35 H CYS 35 0.828 1.180 -7.688 1400 HA CYS 35 HA CYS 35 2.143 2.227 -5.242 1401 1HB CYS 35 1HB CYS 35 3.396 1.668 -7.892 1402 2HB CYS 35 2HB CYS 35 3.834 3.198 -7.133 1403 HG CYS 35 HG CYS 35 5.324 0.996 -6.364 1404 H ILE 36 H ILE 36 1.989 4.557 -5.132 1405 HA ILE 36 HA ILE 36 -0.087 5.702 -6.918 1406 HB ILE 36 HB ILE 36 1.390 6.845 -4.520 1407 1HG1 ILE 36 1HG1 ILE 36 -1.387 5.653 -4.557 1408 2HG1 ILE 36 2HG1 ILE 36 0.038 4.691 -4.170 1409 1HG2 ILE 36 1HG2 ILE 36 -0.316 8.510 -4.453 1410 2HG2 ILE 36 2HG2 ILE 36 -1.305 7.644 -5.630 1411 3HG2 ILE 36 3HG2 ILE 36 0.193 8.423 -6.140 1412 1HD1 ILE 36 1HD1 ILE 36 0.542 6.030 -2.256 1413 2HD1 ILE 36 2HD1 ILE 36 -1.194 5.730 -2.177 1414 3HD1 ILE 36 3HD1 ILE 36 -0.593 7.286 -2.749 1415 H VAL 37 H VAL 37 0.329 7.527 -8.264 1416 HA VAL 37 HA VAL 37 3.229 8.227 -8.603 1417 HB VAL 37 HB VAL 37 1.063 7.904 -10.713 1418 1HG1 VAL 37 1HG1 VAL 37 3.754 9.030 -10.719 1419 2HG1 VAL 37 2HG1 VAL 37 2.513 9.094 -11.970 1420 3HG1 VAL 37 3HG1 VAL 37 3.593 7.704 -11.871 1421 1HG2 VAL 37 1HG2 VAL 37 1.776 5.775 -9.561 1422 2HG2 VAL 37 2HG2 VAL 37 3.419 6.093 -10.117 1423 3HG2 VAL 37 3HG2 VAL 37 2.130 5.813 -11.288 1424 H ARG 38 H ARG 38 3.313 10.303 -7.775 1425 HA ARG 38 HA ARG 38 1.435 12.306 -8.966 1426 1HB ARG 38 1HB ARG 38 2.280 11.983 -6.065 1427 2HB ARG 38 2HB ARG 38 1.328 13.332 -6.680 1428 1HG ARG 38 1HG ARG 38 0.476 10.444 -6.993 1429 2HG ARG 38 2HG ARG 38 -0.013 11.443 -5.625 1430 1HD ARG 38 1HD ARG 38 -0.910 13.129 -7.307 1431 2HD ARG 38 2HD ARG 38 -0.635 11.904 -8.560 1432 HE ARG 38 HE ARG 38 -1.999 10.576 -6.502 1433 1HH1 ARG 38 1HH1 ARG 38 -2.565 13.315 -8.574 1434 2HH1 ARG 38 2HH1 ARG 38 -4.282 13.109 -8.562 1435 1HH2 ARG 38 1HH2 ARG 38 -4.230 10.328 -6.502 1436 2HH2 ARG 38 2HH2 ARG 38 -5.220 11.431 -7.398 1437 H HIS 39 H HIS 39 2.352 14.497 -8.985 1438 HA HIS 39 HA HIS 39 5.190 14.556 -9.563 1439 1HB HIS 39 1HB HIS 39 3.027 16.655 -9.183 1440 2HB HIS 39 2HB HIS 39 4.658 17.043 -9.731 1441 HD1 HIS 39 HD1 HIS 39 3.014 17.797 -11.895 1442 HD2 HIS 39 HD2 HIS 39 3.749 13.736 -11.304 1443 HE1 HIS 39 HE1 HIS 39 2.494 16.648 -14.091 1444 H ASN 40 H ASN 40 6.508 16.439 -8.434 1445 HA ASN 40 HA ASN 40 6.929 15.720 -5.693 1446 1HB ASN 40 1HB ASN 40 8.518 17.607 -5.800 1447 2HB ASN 40 2HB ASN 40 8.589 16.673 -7.294 1448 1HD2 ASN 40 1HD2 ASN 40 9.477 19.272 -7.502 1449 2HD2 ASN 40 2HD2 ASN 40 8.336 20.240 -8.303 1450 H ASP 41 H ASP 41 7.187 18.743 -4.952 1451 HA ASP 41 HA ASP 41 5.893 20.390 -3.876 1452 1HB ASP 41 1HB ASP 41 4.538 19.724 -6.159 1453 2HB ASP 41 2HB ASP 41 3.329 19.337 -4.934 1454 H ASP 42 H ASP 42 3.097 19.929 -3.001 1455 HA ASP 42 HA ASP 42 3.413 19.035 -0.407 1456 1HB ASP 42 1HB ASP 42 1.098 18.831 -2.352 1457 2HB ASP 42 2HB ASP 42 0.916 18.467 -0.636 1458 H TRP 43 H TRP 43 2.879 16.995 -3.265 1459 HA TRP 43 HA TRP 43 2.298 14.532 -1.984 1460 1HB TRP 43 1HB TRP 43 2.113 14.909 -4.385 1461 2HB TRP 43 2HB TRP 43 3.838 15.248 -4.503 1462 HD1 TRP 43 HD1 TRP 43 5.091 13.296 -5.502 1463 HE1 TRP 43 HE1 TRP 43 4.925 10.727 -5.390 1464 HE3 TRP 43 HE3 TRP 43 1.026 12.805 -2.447 1465 HZ2 TRP 43 HZ2 TRP 43 3.288 8.729 -4.170 1466 HZ3 TRP 43 HZ3 TRP 43 0.187 10.556 -1.827 1467 HH2 TRP 43 HH2 TRP 43 1.312 8.519 -2.683 1468 H GLY 44 H GLY 44 5.499 15.716 -3.105 1469 1HA GLY 44 1HA GLY 44 7.011 13.602 -1.954 1470 2HA GLY 44 2HA GLY 44 7.659 15.190 -2.364 1471 H THR 45 H THR 45 5.703 16.540 -0.543 1472 HA THR 45 HA THR 45 7.334 16.371 1.881 1473 HB THR 45 HB THR 45 4.823 17.919 1.142 1474 HG1 THR 45 HG1 THR 45 7.501 18.811 1.292 1475 1HG2 THR 45 1HG2 THR 45 4.846 18.828 3.212 1476 2HG2 THR 45 2HG2 THR 45 6.592 19.076 3.154 1477 3HG2 THR 45 3HG2 THR 45 5.939 17.521 3.670 1478 H ALA 46 H ALA 46 3.774 16.197 1.451 1479 HA ALA 46 HA ALA 46 3.034 15.184 3.920 1480 1HB ALA 46 1HB ALA 46 1.584 15.825 1.965 1481 2HB ALA 46 2HB ALA 46 1.080 14.316 2.726 1482 3HB ALA 46 3HB ALA 46 1.984 14.281 1.212 1483 H LEU 47 H LEU 47 4.039 13.196 1.107 1484 HA LEU 47 HA LEU 47 4.083 10.780 2.821 1485 1HB LEU 47 1HB LEU 47 4.377 11.427 -0.120 1486 2HB LEU 47 2HB LEU 47 4.774 9.821 0.488 1487 HG LEU 47 HG LEU 47 2.459 9.841 -0.284 1488 1HD1 LEU 47 1HD1 LEU 47 1.876 9.938 2.594 1489 2HD1 LEU 47 2HD1 LEU 47 3.301 8.978 2.197 1490 3HD1 LEU 47 3HD1 LEU 47 1.745 8.590 1.465 1491 1HD2 LEU 47 1HD2 LEU 47 0.922 11.472 0.229 1492 2HD2 LEU 47 2HD2 LEU 47 2.388 12.442 0.368 1493 3HD2 LEU 47 3HD2 LEU 47 1.624 11.784 1.816 1494 H GLU 48 H GLU 48 6.110 13.050 3.116 1495 HA GLU 48 HA GLU 48 8.628 12.219 2.026 1496 1HB GLU 48 1HB GLU 48 9.515 13.737 3.804 1497 2HB GLU 48 2HB GLU 48 8.167 14.460 2.929 1498 1HG GLU 48 1HG GLU 48 7.171 14.787 4.926 1499 2HG GLU 48 2HG GLU 48 6.975 13.038 5.037 1500 H ASP 49 H ASP 49 8.480 9.841 2.433 1501 HA ASP 49 HA ASP 49 9.997 9.049 4.755 1502 1HB ASP 49 1HB ASP 49 7.451 9.600 5.406 1503 2HB ASP 49 2HB ASP 49 7.214 7.946 4.843 1504 H TYR 50 H TYR 50 7.416 7.751 2.617 1505 HA TYR 50 HA TYR 50 9.327 5.567 1.838 1506 1HB TYR 50 1HB TYR 50 6.331 5.193 1.929 1507 2HB TYR 50 2HB TYR 50 7.596 3.977 2.058 1508 HD1 TYR 50 HD1 TYR 50 8.991 3.862 4.192 1509 HD2 TYR 50 HD2 TYR 50 5.445 6.264 3.847 1510 HE1 TYR 50 HE1 TYR 50 8.845 4.008 6.666 1511 HE2 TYR 50 HE2 TYR 50 5.301 6.409 6.316 1512 HH TYR 50 HH TYR 50 7.219 4.446 8.389 1513 H LEU 51 H LEU 51 9.328 7.783 0.272 1514 HA LEU 51 HA LEU 51 7.387 7.261 -1.945 1515 1HB LEU 51 1HB LEU 51 8.676 9.604 -0.682 1516 2HB LEU 51 2HB LEU 51 8.624 9.674 -2.443 1517 HG LEU 51 HG LEU 51 6.216 9.076 -0.699 1518 1HD1 LEU 51 1HD1 LEU 51 6.379 11.301 -0.219 1519 2HD1 LEU 51 2HD1 LEU 51 5.735 11.502 -1.848 1520 3HD1 LEU 51 3HD1 LEU 51 7.473 11.611 -1.567 1521 1HD2 LEU 51 1HD2 LEU 51 5.199 9.928 -3.013 1522 2HD2 LEU 51 2HD2 LEU 51 5.645 8.240 -2.778 1523 3HD2 LEU 51 3HD2 LEU 51 6.737 9.327 -3.632 1524 H PHE 52 H PHE 52 8.286 6.029 -3.544 1525 HA PHE 52 HA PHE 52 11.200 6.135 -4.083 1526 1HB PHE 52 1HB PHE 52 8.831 4.483 -4.995 1527 2HB PHE 52 2HB PHE 52 10.396 4.348 -5.797 1528 HD1 PHE 52 HD1 PHE 52 8.791 4.208 -2.418 1529 HD2 PHE 52 HD2 PHE 52 12.074 2.966 -4.895 1530 HE1 PHE 52 HE1 PHE 52 9.584 2.703 -0.613 1531 HE2 PHE 52 HE2 PHE 52 12.866 1.461 -3.090 1532 HZ PHE 52 HZ PHE 52 11.621 1.329 -0.949 1533 H SER 53 H SER 53 11.846 7.797 -5.422 1534 HA SER 53 HA SER 53 9.912 8.767 -7.485 1535 1HB SER 53 1HB SER 53 10.889 10.247 -5.641 1536 2HB SER 53 2HB SER 53 12.446 10.074 -6.449 1537 HG SER 53 HG SER 53 10.577 11.795 -7.007 1538 H ARG 54 H ARG 54 10.411 8.577 -9.629 1539 HA ARG 54 HA ARG 54 13.124 7.520 -10.345 1540 1HB ARG 54 1HB ARG 54 10.698 6.389 -10.732 1541 2HB ARG 54 2HB ARG 54 10.783 7.371 -12.194 1542 1HG ARG 54 1HG ARG 54 12.529 6.158 -13.069 1543 2HG ARG 54 2HG ARG 54 13.219 5.811 -11.484 1544 1HD ARG 54 1HD ARG 54 12.154 3.809 -11.411 1545 2HD ARG 54 2HD ARG 54 10.595 4.580 -11.758 1546 HE ARG 54 HE ARG 54 12.367 3.340 -13.723 1547 1HH1 ARG 54 1HH1 ARG 54 9.956 5.789 -13.170 1548 2HH1 ARG 54 2HH1 ARG 54 9.454 5.824 -14.825 1549 1HH2 ARG 54 1HH2 ARG 54 11.699 3.404 -15.864 1550 2HH2 ARG 54 2HH2 ARG 54 10.432 4.485 -16.340 1551 H LYS 55 H LYS 55 13.374 8.095 -12.925 1552 HA LYS 55 HA LYS 55 13.650 10.989 -12.997 1553 1HB LYS 55 1HB LYS 55 14.101 8.733 -14.979 1554 2HB LYS 55 2HB LYS 55 14.544 10.408 -15.306 1555 1HG LYS 55 1HG LYS 55 15.554 9.769 -12.725 1556 2HG LYS 55 2HG LYS 55 15.995 8.440 -13.797 1557 1HD LYS 55 1HD LYS 55 17.021 9.984 -15.370 1558 2HD LYS 55 2HD LYS 55 16.459 11.368 -14.434 1559 1HE LYS 55 1HE LYS 55 17.793 10.130 -12.474 1560 2HE LYS 55 2HE LYS 55 18.698 9.469 -13.849 1561 1HZ LYS 55 1HZ LYS 55 19.009 11.692 -14.698 1562 2HZ LYS 55 2HZ LYS 55 19.574 11.636 -13.097 1563 3HZ LYS 55 3HZ LYS 55 18.073 12.352 -13.444 1564 H ASN 56 H ASN 56 11.251 11.326 -12.720 1565 HA ASN 56 HA ASN 56 9.399 10.685 -14.843 1566 1HB ASN 56 1HB ASN 56 10.881 12.226 -16.059 1567 2HB ASN 56 2HB ASN 56 9.330 13.018 -15.776 1568 1HD2 ASN 56 1HD2 ASN 56 12.746 13.176 -15.114 1569 2HD2 ASN 56 2HD2 ASN 56 12.699 14.552 -14.122 1570 H MET 57 H MET 57 9.570 10.812 -11.881 1571 HA MET 57 HA MET 57 8.181 13.068 -10.806 1572 1HB MET 57 1HB MET 57 5.891 11.960 -10.684 1573 2HB MET 57 2HB MET 57 6.377 12.449 -12.304 1574 1HG MET 57 1HG MET 57 7.309 9.759 -11.669 1575 2HG MET 57 2HG MET 57 5.557 9.893 -11.520 1576 1HE MET 57 1HE MET 57 3.936 10.326 -13.277 1577 2HE MET 57 2HE MET 57 4.271 10.962 -14.888 1578 3HE MET 57 3HE MET 57 4.581 11.957 -13.465 1579 H SER 58 H SER 58 6.606 11.954 -8.862 1580 HA SER 58 HA SER 58 8.469 10.066 -7.458 1581 1HB SER 58 1HB SER 58 6.530 12.017 -6.190 1582 2HB SER 58 2HB SER 58 7.947 11.265 -5.458 1583 HG SER 58 HG SER 58 7.827 13.581 -6.661 1584 H ALA 59 H ALA 59 7.410 8.477 -6.054 1585 HA ALA 59 HA ALA 59 4.478 8.143 -6.375 1586 1HB ALA 59 1HB ALA 59 6.664 6.520 -7.615 1587 2HB ALA 59 2HB ALA 59 5.053 6.882 -8.236 1588 3HB ALA 59 3HB ALA 59 5.264 5.639 -7.003 1589 H MET 60 H MET 60 3.577 6.811 -4.710 1590 HA MET 60 HA MET 60 5.362 6.376 -2.380 1591 1HB MET 60 1HB MET 60 2.479 6.740 -2.955 1592 2HB MET 60 2HB MET 60 2.830 5.626 -1.638 1593 1HG MET 60 1HG MET 60 3.940 8.440 -1.865 1594 2HG MET 60 2HG MET 60 2.572 7.978 -0.854 1595 1HE MET 60 1HE MET 60 2.402 6.842 0.835 1596 2HE MET 60 2HE MET 60 3.559 7.036 2.152 1597 3HE MET 60 3HE MET 60 3.440 5.495 1.302 1598 H ALA 61 H ALA 61 5.419 4.297 -1.289 1599 HA ALA 61 HA ALA 61 5.399 2.031 -3.153 1600 1HB ALA 61 1HB ALA 61 6.014 1.086 -0.633 1601 2HB ALA 61 2HB ALA 61 6.452 2.789 -0.501 1602 3HB ALA 61 3HB ALA 61 7.187 1.784 -1.750 1603 H LEU 62 H LEU 62 3.296 1.350 -3.576 1604 HA LEU 62 HA LEU 62 1.199 0.352 -3.191 1605 1HB LEU 62 1HB LEU 62 0.822 1.366 -0.504 1606 2HB LEU 62 2HB LEU 62 1.514 2.615 -1.531 1607 HG LEU 62 HG LEU 62 -0.978 0.993 -2.146 1608 1HD1 LEU 62 1HD1 LEU 62 -0.478 3.637 -0.899 1609 2HD1 LEU 62 2HD1 LEU 62 -1.867 2.566 -0.733 1610 3HD1 LEU 62 3HD1 LEU 62 -1.721 3.612 -2.145 1611 1HD2 LEU 62 1HD2 LEU 62 -1.043 2.928 -3.951 1612 2HD2 LEU 62 2HD2 LEU 62 -0.108 1.462 -4.248 1613 3HD2 LEU 62 3HD2 LEU 62 0.701 2.927 -3.692 1614 H GLY 63 H GLY 63 2.535 -1.710 -2.965 1615 1HA GLY 63 1HA GLY 63 1.605 -3.226 -0.731 1616 2HA GLY 63 2HA GLY 63 2.826 -3.769 -1.879 1617 H PHE 64 H PHE 64 4.578 -4.416 -0.723 1618 HA PHE 64 HA PHE 64 5.267 -3.082 1.822 1619 1HB PHE 64 1HB PHE 64 6.468 -5.411 0.276 1620 2HB PHE 64 2HB PHE 64 6.894 -4.964 1.928 1621 HD1 PHE 64 HD1 PHE 64 4.587 -6.777 -0.163 1622 HD2 PHE 64 HD2 PHE 64 5.036 -4.938 3.693 1623 HE1 PHE 64 HE1 PHE 64 2.668 -8.096 0.690 1624 HE2 PHE 64 HE2 PHE 64 3.118 -6.258 4.546 1625 HZ PHE 64 HZ PHE 64 1.934 -7.837 3.044 1626 H GLY 65 H GLY 65 5.587 -1.393 -0.475 1627 1HA GLY 65 1HA GLY 65 8.412 -1.419 -1.238 1628 2HA GLY 65 2HA GLY 65 7.227 -0.203 -1.702 1629 H ALA 66 H ALA 66 6.454 -0.002 1.256 1630 HA ALA 66 HA ALA 66 8.463 2.063 1.922 1631 1HB ALA 66 1HB ALA 66 5.792 1.181 3.066 1632 2HB ALA 66 2HB ALA 66 6.103 2.602 2.069 1633 3HB ALA 66 3HB ALA 66 6.726 2.527 3.717 1634 H ILE 67 H ILE 67 6.904 -0.660 3.671 1635 HA ILE 67 HA ILE 67 8.432 -0.638 6.004 1636 HB ILE 67 HB ILE 67 7.882 -3.098 6.039 1637 1HG1 ILE 67 1HG1 ILE 67 6.256 -3.353 3.784 1638 2HG1 ILE 67 2HG1 ILE 67 7.722 -2.587 3.172 1639 1HG2 ILE 67 1HG2 ILE 67 5.882 -0.983 5.311 1640 2HG2 ILE 67 2HG2 ILE 67 6.114 -1.816 6.848 1641 3HG2 ILE 67 3HG2 ILE 67 5.341 -2.651 5.501 1642 1HD1 ILE 67 1HD1 ILE 67 8.565 -4.588 4.991 1643 2HD1 ILE 67 2HD1 ILE 67 8.743 -4.591 3.236 1644 3HD1 ILE 67 3HD1 ILE 67 7.322 -5.325 3.979 1645 H PHE 68 H PHE 68 9.478 -1.587 2.800 1646 HA PHE 68 HA PHE 68 11.573 -3.358 3.265 1647 1HB PHE 68 1HB PHE 68 10.921 -1.179 1.359 1648 2HB PHE 68 2HB PHE 68 12.619 -1.644 1.395 1649 HD1 PHE 68 HD1 PHE 68 12.443 -4.547 2.005 1650 HD2 PHE 68 HD2 PHE 68 10.087 -2.106 -0.625 1651 HE1 PHE 68 HE1 PHE 68 11.908 -6.542 0.632 1652 HE2 PHE 68 HE2 PHE 68 9.550 -4.099 -1.998 1653 HZ PHE 68 HZ PHE 68 10.460 -6.316 -1.370 1654 H ASN 69 H ASN 69 13.302 -3.249 4.623 1655 HA ASN 69 HA ASN 69 14.185 -0.614 5.666 1656 1HB ASN 69 1HB ASN 69 14.365 -3.507 6.397 1657 2HB ASN 69 2HB ASN 69 15.670 -2.464 6.960 1658 1HD2 ASN 69 1HD2 ASN 69 13.716 -3.684 8.738 1659 2HD2 ASN 69 2HD2 ASN 69 12.813 -2.432 9.443 1660 H HIS 70 H HIS 70 16.695 -0.492 5.964 1661 HA HIS 70 HA HIS 70 17.947 -1.126 3.327 1662 1HB HIS 70 1HB HIS 70 17.859 1.227 4.083 1663 2HB HIS 70 2HB HIS 70 18.684 0.784 5.578 1664 HD1 HIS 70 HD1 HIS 70 19.474 -0.194 1.974 1665 HD2 HIS 70 HD2 HIS 70 21.263 1.715 5.219 1666 HE1 HIS 70 HE1 HIS 70 21.859 0.306 1.285 1667 H SER 71 H SER 71 20.024 -2.162 3.290 1668 HA SER 71 HA SER 71 21.133 -3.142 5.866 1669 1HB SER 71 1HB SER 71 20.722 -5.402 5.380 1670 2HB SER 71 2HB SER 71 19.269 -4.640 4.734 1671 HG SER 71 HG SER 71 20.734 -6.179 3.401 1672 H LYS 72 H LYS 72 23.363 -3.416 5.736 1673 HA LYS 72 HA LYS 72 24.881 -2.266 3.654 1674 1HB LYS 72 1HB LYS 72 25.588 -4.496 5.600 1675 2HB LYS 72 2HB LYS 72 26.752 -3.469 4.764 1676 1HG LYS 72 1HG LYS 72 25.043 -1.624 5.900 1677 2HG LYS 72 2HG LYS 72 25.102 -2.889 7.127 1678 1HD LYS 72 1HD LYS 72 27.331 -2.549 7.562 1679 2HD LYS 72 2HD LYS 72 27.696 -2.111 5.893 1680 1HE LYS 72 1HE LYS 72 26.716 0.102 6.207 1681 2HE LYS 72 2HE LYS 72 26.181 -0.335 7.841 1682 1HZ LYS 72 1HZ LYS 72 28.996 -0.343 6.871 1683 2HZ LYS 72 2HZ LYS 72 28.488 -0.774 8.434 1684 3HZ LYS 72 3HZ LYS 72 28.315 0.828 7.896 1685 H ASP 73 H ASP 73 23.486 -5.469 3.903 1686 HA ASP 73 HA ASP 73 24.799 -6.192 1.302 1687 1HB ASP 73 1HB ASP 73 24.614 -8.543 2.170 1688 2HB ASP 73 2HB ASP 73 25.623 -7.521 3.193 1689 HA PRO 74 HA PRO 74 20.189 -5.930 0.770 1690 1HB PRO 74 1HB PRO 74 20.433 -5.104 -1.885 1691 2HB PRO 74 2HB PRO 74 20.251 -4.013 -0.501 1692 1HG PRO 74 1HG PRO 74 22.691 -4.780 -2.008 1693 2HG PRO 74 2HG PRO 74 22.265 -3.237 -1.256 1694 1HD PRO 74 1HD PRO 74 24.045 -4.975 -0.171 1695 2HD PRO 74 2HD PRO 74 23.040 -3.884 0.806 1696 H ASN 75 H ASN 75 19.913 -8.196 0.745 1697 HA ASN 75 HA ASN 75 21.054 -9.871 -1.360 1698 1HB ASN 75 1HB ASN 75 18.949 -10.312 0.791 1699 2HB ASN 75 2HB ASN 75 19.664 -11.598 -0.181 1700 1HD2 ASN 75 1HD2 ASN 75 21.840 -12.258 0.314 1701 2HD2 ASN 75 2HD2 ASN 75 22.689 -11.667 1.660 1702 H ALA 76 H ALA 76 18.175 -7.971 -1.006 1703 HA ALA 76 HA ALA 76 17.118 -9.164 -3.540 1704 1HB ALA 76 1HB ALA 76 14.865 -9.058 -2.519 1705 2HB ALA 76 2HB ALA 76 15.563 -8.400 -1.039 1706 3HB ALA 76 3HB ALA 76 15.939 -10.051 -1.532 1707 H ARG 77 H ARG 77 15.400 -7.622 -4.494 1708 HA ARG 77 HA ARG 77 15.779 -4.776 -3.734 1709 1HB ARG 77 1HB ARG 77 17.363 -6.015 -5.643 1710 2HB ARG 77 2HB ARG 77 16.086 -5.289 -6.619 1711 1HG ARG 77 1HG ARG 77 16.495 -3.111 -5.506 1712 2HG ARG 77 2HG ARG 77 17.797 -3.846 -4.570 1713 1HD ARG 77 1HD ARG 77 18.819 -4.515 -6.850 1714 2HD ARG 77 2HD ARG 77 17.688 -3.341 -7.551 1715 HE ARG 77 HE ARG 77 18.961 -1.610 -6.552 1716 1HH1 ARG 77 1HH1 ARG 77 19.701 -4.689 -5.107 1717 2HH1 ARG 77 2HH1 ARG 77 20.994 -4.053 -4.150 1718 1HH2 ARG 77 1HH2 ARG 77 20.644 -0.808 -5.300 1719 2HH2 ARG 77 2HH2 ARG 77 21.525 -1.874 -4.257 1720 H HIS 78 H HIS 78 14.590 -3.680 -6.039 1721 HA HIS 78 HA HIS 78 11.903 -5.015 -6.120 1722 1HB HIS 78 1HB HIS 78 10.991 -2.670 -6.050 1723 2HB HIS 78 2HB HIS 78 11.874 -3.105 -4.590 1724 HD1 HIS 78 HD1 HIS 78 14.176 -1.971 -4.192 1725 HD2 HIS 78 HD2 HIS 78 12.276 -0.716 -7.684 1726 HE1 HIS 78 HE1 HIS 78 15.438 0.070 -4.999 1727 H GLU 79 H GLU 79 10.592 -3.499 -7.864 1728 HA GLU 79 HA GLU 79 12.331 -2.783 -10.120 1729 1HB GLU 79 1HB GLU 79 11.596 -5.360 -9.956 1730 2HB GLU 79 2HB GLU 79 10.137 -4.729 -10.720 1731 1HG GLU 79 1HG GLU 79 11.483 -3.743 -12.520 1732 2HG GLU 79 2HG GLU 79 12.961 -4.312 -11.746 1733 H LEU 80 H LEU 80 10.920 -1.956 -11.990 1734 HA LEU 80 HA LEU 80 8.278 -0.916 -11.061 1735 1HB LEU 80 1HB LEU 80 10.805 0.521 -11.623 1736 2HB LEU 80 2HB LEU 80 9.385 1.216 -12.403 1737 HG LEU 80 HG LEU 80 9.155 0.423 -9.530 1738 1HD1 LEU 80 1HD1 LEU 80 10.150 3.171 -10.108 1739 2HD1 LEU 80 2HD1 LEU 80 11.337 1.868 -10.161 1740 3HD1 LEU 80 3HD1 LEU 80 10.410 2.157 -8.689 1741 1HD2 LEU 80 1HD2 LEU 80 7.167 1.380 -10.065 1742 2HD2 LEU 80 2HD2 LEU 80 7.830 2.152 -11.506 1743 3HD2 LEU 80 3HD2 LEU 80 8.035 2.909 -9.926 1744 H THR 81 H THR 81 6.795 -1.326 -12.656 1745 HA THR 81 HA THR 81 7.396 -2.478 -15.169 1746 HB THR 81 HB THR 81 5.216 -2.540 -14.006 1747 HG1 THR 81 HG1 THR 81 4.953 -2.920 -16.120 1748 1HG2 THR 81 1HG2 THR 81 4.044 -0.663 -13.445 1749 2HG2 THR 81 2HG2 THR 81 4.504 0.186 -14.921 1750 3HG2 THR 81 3HG2 THR 81 5.629 0.101 -13.567 1751 H ALA 82 H ALA 82 6.149 -1.081 -17.160 1752 HA ALA 82 HA ALA 82 8.126 0.798 -18.022 1753 1HB ALA 82 1HB ALA 82 6.053 -0.654 -19.098 1754 2HB ALA 82 2HB ALA 82 6.928 0.607 -19.966 1755 3HB ALA 82 3HB ALA 82 5.402 0.984 -19.167 1756 H GLY 83 H GLY 83 8.279 2.415 -16.321 1757 1HA GLY 83 1HA GLY 83 7.803 4.737 -15.890 1758 2HA GLY 83 2HA GLY 83 6.188 4.504 -16.559 1759 H LEU 84 H LEU 84 6.728 5.751 -14.030 1760 HA LEU 84 HA LEU 84 6.502 4.103 -11.748 1761 1HB LEU 84 1HB LEU 84 6.061 6.872 -12.566 1762 2HB LEU 84 2HB LEU 84 4.919 6.385 -11.315 1763 HG LEU 84 HG LEU 84 6.771 5.623 -9.894 1764 1HD1 LEU 84 1HD1 LEU 84 8.932 6.829 -11.420 1765 2HD1 LEU 84 2HD1 LEU 84 8.171 5.516 -12.318 1766 3HD1 LEU 84 3HD1 LEU 84 8.835 5.216 -10.712 1767 1HD2 LEU 84 1HD2 LEU 84 7.965 8.184 -10.466 1768 2HD2 LEU 84 2HD2 LEU 84 6.923 7.730 -9.118 1769 3HD2 LEU 84 3HD2 LEU 84 6.213 8.298 -10.628 1770 H LYS 85 H LYS 85 5.024 2.414 -11.720 1771 HA LYS 85 HA LYS 85 2.151 3.119 -11.781 1772 1HB LYS 85 1HB LYS 85 3.663 1.753 -13.913 1773 2HB LYS 85 2HB LYS 85 2.224 0.872 -13.399 1774 1HG LYS 85 1HG LYS 85 2.207 3.817 -14.107 1775 2HG LYS 85 2HG LYS 85 1.830 2.541 -15.264 1776 1HD LYS 85 1HD LYS 85 -0.241 2.253 -14.407 1777 2HD LYS 85 2HD LYS 85 0.373 2.211 -12.755 1778 1HE LYS 85 1HE LYS 85 0.656 4.896 -13.635 1779 2HE LYS 85 2HE LYS 85 -0.974 4.375 -14.103 1780 1HZ LYS 85 1HZ LYS 85 0.173 3.732 -11.448 1781 2HZ LYS 85 2HZ LYS 85 -1.457 3.706 -11.926 1782 3HZ LYS 85 3HZ LYS 85 -0.656 5.189 -11.719 1783 H ARG 86 H ARG 86 4.380 0.303 -11.791 1784 HA ARG 86 HA ARG 86 2.957 -0.698 -9.349 1785 1HB ARG 86 1HB ARG 86 3.270 -1.826 -12.040 1786 2HB ARG 86 2HB ARG 86 3.817 -2.934 -10.782 1787 1HG ARG 86 1HG ARG 86 1.712 -3.198 -9.916 1788 2HG ARG 86 2HG ARG 86 1.252 -1.531 -10.259 1789 1HD ARG 86 1HD ARG 86 0.510 -2.036 -12.387 1790 2HD ARG 86 2HD ARG 86 1.712 -3.322 -12.609 1791 HE ARG 86 HE ARG 86 -0.194 -3.936 -10.494 1792 1HH1 ARG 86 1HH1 ARG 86 0.357 -3.977 -13.931 1793 2HH1 ARG 86 2HH1 ARG 86 -0.762 -5.267 -14.206 1794 1HH2 ARG 86 1HH2 ARG 86 -1.640 -5.609 -10.875 1795 2HH2 ARG 86 2HH2 ARG 86 -1.885 -6.186 -12.490 1796 H MET 87 H MET 87 4.358 -2.416 -8.221 1797 HA MET 87 HA MET 87 7.279 -1.993 -8.693 1798 1HB MET 87 1HB MET 87 5.605 -0.992 -6.532 1799 2HB MET 87 2HB MET 87 6.879 -2.037 -5.902 1800 1HG MET 87 1HG MET 87 8.427 -0.672 -7.522 1801 2HG MET 87 2HG MET 87 7.129 0.521 -7.466 1802 1HE MET 87 1HE MET 87 9.003 -1.957 -5.665 1803 2HE MET 87 2HE MET 87 8.605 -1.656 -3.974 1804 3HE MET 87 3HE MET 87 10.100 -1.014 -4.656 1805 H ARG 88 H ARG 88 8.406 -3.896 -8.500 1806 HA ARG 88 HA ARG 88 6.974 -6.240 -7.292 1807 1HB ARG 88 1HB ARG 88 9.122 -6.082 -9.441 1808 2HB ARG 88 2HB ARG 88 8.298 -7.552 -8.920 1809 1HG ARG 88 1HG ARG 88 6.406 -7.055 -10.091 1810 2HG ARG 88 2HG ARG 88 6.511 -5.334 -9.720 1811 1HD ARG 88 1HD ARG 88 7.270 -5.015 -11.836 1812 2HD ARG 88 2HD ARG 88 8.736 -5.902 -11.379 1813 HE ARG 88 HE ARG 88 6.745 -7.843 -11.841 1814 1HH1 ARG 88 1HH1 ARG 88 8.394 -5.352 -13.628 1815 2HH1 ARG 88 2HH1 ARG 88 8.254 -6.188 -15.135 1816 1HH2 ARG 88 1HH2 ARG 88 6.576 -8.908 -13.809 1817 2HH2 ARG 88 2HH2 ARG 88 7.233 -8.185 -15.240 1818 H ILE 89 H ILE 89 8.714 -7.975 -6.608 1819 HA ILE 89 HA ILE 89 11.071 -6.636 -5.336 1820 HB ILE 89 HB ILE 89 9.037 -8.524 -4.091 1821 1HG1 ILE 89 1HG1 ILE 89 9.778 -5.689 -3.325 1822 2HG1 ILE 89 2HG1 ILE 89 8.409 -6.087 -4.362 1823 1HG2 ILE 89 1HG2 ILE 89 11.534 -7.286 -2.892 1824 2HG2 ILE 89 2HG2 ILE 89 11.342 -8.988 -3.313 1825 3HG2 ILE 89 3HG2 ILE 89 10.361 -8.281 -2.030 1826 1HD1 ILE 89 1HD1 ILE 89 7.155 -6.817 -2.616 1827 2HD1 ILE 89 2HD1 ILE 89 8.309 -5.940 -1.612 1828 3HD1 ILE 89 3HD1 ILE 89 8.514 -7.670 -1.884 1829 H PHE 90 H PHE 90 12.785 -7.673 -6.305 1830 HA PHE 90 HA PHE 90 12.552 -10.601 -6.872 1831 1HB PHE 90 1HB PHE 90 14.195 -8.294 -7.932 1832 2HB PHE 90 2HB PHE 90 14.654 -9.962 -8.273 1833 HD1 PHE 90 HD1 PHE 90 13.261 -11.395 -9.677 1834 HD2 PHE 90 HD2 PHE 90 12.137 -7.335 -8.839 1835 HE1 PHE 90 HE1 PHE 90 11.583 -11.483 -11.501 1836 HE2 PHE 90 HE2 PHE 90 10.459 -7.423 -10.663 1837 HZ PHE 90 HZ PHE 90 10.182 -9.497 -11.994 1838 H THR 91 H THR 91 14.832 -11.707 -6.697 1839 HA THR 91 HA THR 91 16.160 -10.805 -4.160 1840 HB THR 91 HB THR 91 16.549 -13.393 -3.994 1841 HG1 THR 91 HG1 THR 91 15.243 -14.609 -5.210 1842 1HG2 THR 91 1HG2 THR 91 14.625 -11.670 -2.991 1843 2HG2 THR 91 2HG2 THR 91 14.890 -13.329 -2.454 1844 3HG2 THR 91 3HG2 THR 91 13.664 -12.982 -3.673 1845 H ILE 92 H ILE 92 17.758 -9.686 -5.523 1846 HA ILE 92 HA ILE 92 19.243 -10.712 -7.650 1847 HB ILE 92 HB ILE 92 20.962 -9.107 -6.874 1848 1HG1 ILE 92 1HG1 ILE 92 19.319 -8.939 -4.331 1849 2HG1 ILE 92 2HG1 ILE 92 20.834 -9.832 -4.464 1850 1HG2 ILE 92 1HG2 ILE 92 19.596 -7.423 -7.496 1851 2HG2 ILE 92 2HG2 ILE 92 18.670 -7.553 -6.000 1852 3HG2 ILE 92 3HG2 ILE 92 18.253 -8.561 -7.386 1853 1HD1 ILE 92 1HD1 ILE 92 22.012 -7.933 -4.182 1854 2HD1 ILE 92 2HD1 ILE 92 20.497 -7.062 -3.939 1855 3HD1 ILE 92 3HD1 ILE 92 21.191 -7.192 -5.556 1856 H LYS 93 H LYS 93 19.425 -11.622 -4.264 1857 HA LYS 93 HA LYS 93 21.558 -13.596 -4.985 1858 1HB LYS 93 1HB LYS 93 21.342 -11.840 -2.512 1859 2HB LYS 93 2HB LYS 93 22.573 -13.078 -2.761 1860 1HG LYS 93 1HG LYS 93 22.546 -11.436 -5.086 1861 2HG LYS 93 2HG LYS 93 22.562 -10.363 -3.686 1862 1HD LYS 93 1HD LYS 93 24.387 -12.173 -2.867 1863 2HD LYS 93 2HD LYS 93 24.615 -12.313 -4.610 1864 1HE LYS 93 1HE LYS 93 24.610 -9.652 -3.144 1865 2HE LYS 93 2HE LYS 93 26.085 -10.556 -3.536 1866 1HZ LYS 93 1HZ LYS 93 25.501 -8.978 -5.301 1867 2HZ LYS 93 2HZ LYS 93 23.991 -9.733 -5.486 1868 3HZ LYS 93 3HZ LYS 93 25.414 -10.582 -5.856 1869 HA PRO 94 HA PRO 94 18.661 -16.557 -3.361 1870 1HB PRO 94 1HB PRO 94 21.219 -17.817 -2.418 1871 2HB PRO 94 2HB PRO 94 19.840 -18.566 -3.247 1872 1HG PRO 94 1HG PRO 94 22.041 -17.987 -4.577 1873 2HG PRO 94 2HG PRO 94 20.456 -17.707 -5.304 1874 1HD PRO 94 1HD PRO 94 22.405 -15.747 -4.194 1875 2HD PRO 94 2HD PRO 94 21.273 -15.575 -5.554 1876 H ILE 95 H ILE 95 17.843 -17.139 -1.253 1877 HA ILE 95 HA ILE 95 19.291 -15.891 1.056 1878 HB ILE 95 HB ILE 95 16.346 -15.789 0.310 1879 1HG1 ILE 95 1HG1 ILE 95 18.465 -13.630 0.554 1880 2HG1 ILE 95 2HG1 ILE 95 17.803 -14.250 -0.959 1881 1HG2 ILE 95 1HG2 ILE 95 16.725 -14.033 2.396 1882 2HG2 ILE 95 2HG2 ILE 95 17.765 -15.380 2.859 1883 3HG2 ILE 95 3HG2 ILE 95 16.049 -15.654 2.559 1884 1HD1 ILE 95 1HD1 ILE 95 15.558 -13.483 -0.300 1885 2HD1 ILE 95 2HD1 ILE 95 16.699 -12.138 -0.289 1886 3HD1 ILE 95 3HD1 ILE 95 16.203 -12.887 1.229 1887 H ALA 96 H ALA 96 19.041 -16.990 3.048 1888 HA ALA 96 HA ALA 96 18.145 -19.811 2.816 1889 1HB ALA 96 1HB ALA 96 19.574 -18.304 5.037 1890 2HB ALA 96 2HB ALA 96 20.397 -19.113 3.703 1891 3HB ALA 96 3HB ALA 96 19.465 -20.056 4.866 1892 H ILE 97 H ILE 97 16.751 -20.726 4.498 1893 HA ILE 97 HA ILE 97 14.450 -19.152 5.130 1894 HB ILE 97 HB ILE 97 15.564 -21.739 6.278 1895 1HG1 ILE 97 1HG1 ILE 97 13.313 -21.479 4.299 1896 2HG1 ILE 97 2HG1 ILE 97 14.986 -21.432 3.742 1897 1HG2 ILE 97 1HG2 ILE 97 13.846 -21.687 7.733 1898 2HG2 ILE 97 2HG2 ILE 97 12.731 -21.674 6.367 1899 3HG2 ILE 97 3HG2 ILE 97 13.290 -20.153 7.064 1900 1HD1 ILE 97 1HD1 ILE 97 15.307 -23.649 4.147 1901 2HD1 ILE 97 2HD1 ILE 97 13.546 -23.735 4.121 1902 3HD1 ILE 97 3HD1 ILE 97 14.400 -23.599 5.659 1903 H GLY 98 H GLY 98 14.606 -17.401 6.501 1904 1HA GLY 98 1HA GLY 98 14.557 -16.858 8.942 1905 2HA GLY 98 2HA GLY 98 16.011 -17.842 9.105 1906 H GLU 99 H GLU 99 15.567 -15.709 6.360 1907 HA GLU 99 HA GLU 99 17.834 -14.045 7.388 1908 1HB GLU 99 1HB GLU 99 16.742 -14.774 4.659 1909 2HB GLU 99 2HB GLU 99 17.900 -13.462 4.859 1910 1HG GLU 99 1HG GLU 99 18.310 -16.364 5.643 1911 2HG GLU 99 2HG GLU 99 19.095 -15.517 4.311 1912 H GLU 100 H GLU 100 17.644 -11.728 6.171 1913 HA GLU 100 HA GLU 100 14.864 -10.720 6.689 1914 1HB GLU 100 1HB GLU 100 17.043 -10.183 8.177 1915 2HB GLU 100 2HB GLU 100 17.273 -8.959 6.928 1916 1HG GLU 100 1HG GLU 100 14.550 -8.807 7.551 1917 2HG GLU 100 2HG GLU 100 15.341 -9.028 9.111 1918 H ILE 101 H ILE 101 13.942 -9.920 4.849 1919 HA ILE 101 HA ILE 101 15.626 -9.372 2.487 1920 HB ILE 101 HB ILE 101 12.628 -9.325 2.988 1921 1HG1 ILE 101 1HG1 ILE 101 14.365 -11.416 1.646 1922 2HG1 ILE 101 2HG1 ILE 101 13.757 -11.537 3.297 1923 1HG2 ILE 101 1HG2 ILE 101 12.314 -9.077 0.677 1924 2HG2 ILE 101 2HG2 ILE 101 13.958 -9.595 0.303 1925 3HG2 ILE 101 3HG2 ILE 101 13.672 -7.996 0.991 1926 1HD1 ILE 101 1HD1 ILE 101 11.492 -11.633 2.563 1927 2HD1 ILE 101 2HD1 ILE 101 12.373 -12.712 1.482 1928 3HD1 ILE 101 3HD1 ILE 101 11.918 -11.097 0.938 1929 H THR 102 H THR 102 16.192 -7.347 1.853 1930 HA THR 102 HA THR 102 14.590 -4.986 2.636 1931 HB THR 102 HB THR 102 16.934 -4.057 3.488 1932 HG1 THR 102 HG1 THR 102 18.311 -5.647 3.277 1933 1HG2 THR 102 1HG2 THR 102 15.619 -6.046 5.317 1934 2HG2 THR 102 2HG2 THR 102 14.709 -4.643 4.755 1935 3HG2 THR 102 3HG2 THR 102 16.196 -4.419 5.676 1936 H ILE 103 H ILE 103 14.930 -3.272 1.162 1937 HA ILE 103 HA ILE 103 16.762 -3.892 -1.118 1938 HB ILE 103 HB ILE 103 15.261 -2.309 -2.324 1939 1HG1 ILE 103 1HG1 ILE 103 13.151 -2.118 -0.406 1940 2HG1 ILE 103 2HG1 ILE 103 14.629 -1.524 0.351 1941 1HG2 ILE 103 1HG2 ILE 103 13.444 -3.794 -2.490 1942 2HG2 ILE 103 2HG2 ILE 103 13.507 -4.209 -0.777 1943 3HG2 ILE 103 3HG2 ILE 103 14.740 -4.823 -1.880 1944 1HD1 ILE 103 1HD1 ILE 103 13.395 -0.587 -2.253 1945 2HD1 ILE 103 2HD1 ILE 103 15.010 -0.118 -1.719 1946 3HD1 ILE 103 3HD1 ILE 103 13.597 0.346 -0.770 1947 H SER 104 H SER 104 17.950 -2.038 -2.062 1948 HA SER 104 HA SER 104 18.991 -0.245 0.061 1949 1HB SER 104 1HB SER 104 20.493 -1.600 -1.377 1950 2HB SER 104 2HB SER 104 19.838 -0.805 -2.808 1951 HG SER 104 HG SER 104 21.865 0.047 -1.829 1952 H TYR 105 H TYR 105 19.810 1.947 -1.334 1953 HA TYR 105 HA TYR 105 17.285 3.092 -2.486 1954 1HB TYR 105 1HB TYR 105 19.390 4.347 -0.682 1955 2HB TYR 105 2HB TYR 105 17.974 5.184 -1.317 1956 HD1 TYR 105 HD1 TYR 105 19.102 3.960 1.602 1957 HD2 TYR 105 HD2 TYR 105 15.799 3.325 -1.070 1958 HE1 TYR 105 HE1 TYR 105 17.745 3.092 3.486 1959 HE2 TYR 105 HE2 TYR 105 14.442 2.457 0.815 1960 HH TYR 105 HH TYR 105 14.653 1.569 2.974 1961 H GLY 106 H GLY 106 20.679 4.187 -2.138 1962 1HA GLY 106 1HA GLY 106 22.265 4.530 -3.897 1963 2HA GLY 106 2HA GLY 106 20.999 4.183 -5.074 1964 H ASP 107 H ASP 107 22.017 6.218 -6.046 1965 HA ASP 107 HA ASP 107 21.856 8.511 -6.552 1966 1HB ASP 107 1HB ASP 107 19.522 7.869 -6.790 1967 2HB ASP 107 2HB ASP 107 19.271 7.975 -5.050 1968 H ASP 108 H ASP 108 20.028 8.952 -3.555 1969 HA ASP 108 HA ASP 108 22.441 10.218 -2.316 1970 1HB ASP 108 1HB ASP 108 20.582 11.657 -3.587 1971 2HB ASP 108 2HB ASP 108 19.727 11.466 -2.056 1972 H TYR 109 H TYR 109 19.170 8.888 -1.831 1973 HA TYR 109 HA TYR 109 18.871 9.026 0.930 1974 1HB TYR 109 1HB TYR 109 18.007 7.336 -1.303 1975 2HB TYR 109 2HB TYR 109 18.025 6.460 0.227 1976 HD1 TYR 109 HD1 TYR 109 17.358 10.076 -0.480 1977 HD2 TYR 109 HD2 TYR 109 15.784 6.338 0.936 1978 HE1 TYR 109 HE1 TYR 109 15.261 11.215 0.198 1979 HE2 TYR 109 HE2 TYR 109 13.689 7.478 1.614 1980 HH TYR 109 HH TYR 109 12.523 9.912 0.635 1981 H TRP 110 H TRP 110 20.290 8.476 2.515 1982 HA TRP 110 HA TRP 110 21.940 7.301 3.716 1983 1HB TRP 110 1HB TRP 110 20.130 5.607 3.533 1984 2HB TRP 110 2HB TRP 110 20.811 5.054 2.004 1985 HD1 TRP 110 HD1 TRP 110 23.075 3.695 2.068 1986 HE1 TRP 110 HE1 TRP 110 24.312 2.474 3.973 1987 HE3 TRP 110 HE3 TRP 110 20.654 5.676 6.105 1988 HZ2 TRP 110 HZ2 TRP 110 24.279 2.354 6.831 1989 HZ3 TRP 110 HZ3 TRP 110 21.276 4.992 8.404 1990 HH2 TRP 110 HH2 TRP 110 23.084 3.335 8.772 1991 H LEU 111 H LEU 111 23.995 5.959 3.387 1992 HA LEU 111 HA LEU 111 25.626 7.073 1.341 1993 1HB LEU 111 1HB LEU 111 25.749 5.098 3.495 1994 2HB LEU 111 2HB LEU 111 26.766 4.635 2.131 1995 HG LEU 111 HG LEU 111 26.965 7.486 2.779 1996 1HD1 LEU 111 1HD1 LEU 111 27.921 7.361 4.916 1997 2HD1 LEU 111 2HD1 LEU 111 28.212 5.627 4.790 1998 3HD1 LEU 111 3HD1 LEU 111 26.575 6.230 5.044 1999 1HD2 LEU 111 1HD2 LEU 111 28.440 5.883 1.326 2000 2HD2 LEU 111 2HD2 LEU 111 29.173 5.443 2.868 2001 3HD2 LEU 111 3HD2 LEU 111 29.233 7.114 2.309 2002 H SER 112 H SER 112 26.976 5.184 -0.001 2003 HA SER 112 HA SER 112 25.173 3.230 -1.265 2004 1HB SER 112 1HB SER 112 25.262 5.887 -2.163 2005 2HB SER 112 2HB SER 112 26.296 5.012 -3.292 2006 HG SER 112 HG SER 112 24.575 3.521 -3.568 2007 H ARG 113 H ARG 113 28.276 4.984 -1.439 2008 HA ARG 113 HA ARG 113 29.753 3.288 -3.098 2009 1HB ARG 113 1HB ARG 113 30.173 5.391 -1.254 2010 2HB ARG 113 2HB ARG 113 31.293 4.110 -0.789 2011 1HG ARG 113 1HG ARG 113 32.629 4.826 -2.462 2012 2HG ARG 113 2HG ARG 113 31.433 4.169 -3.579 2013 1HD ARG 113 1HD ARG 113 31.257 6.971 -2.419 2014 2HD ARG 113 2HD ARG 113 31.980 6.604 -3.997 2015 HE ARG 113 HE ARG 113 29.468 5.301 -3.910 2016 1HH1 ARG 113 1HH1 ARG 113 30.745 8.539 -3.845 2017 2HH1 ARG 113 2HH1 ARG 113 29.342 9.225 -4.588 2018 1HH2 ARG 113 1HH2 ARG 113 27.657 6.216 -4.873 2019 2HH2 ARG 113 2HH2 ARG 113 27.607 7.923 -5.166 2020 HA PRO 114 HA PRO 114 30.867 0.702 0.937 2021 1HB PRO 114 1HB PRO 114 28.226 0.995 2.292 2022 2HB PRO 114 2HB PRO 114 29.851 0.961 2.998 2023 1HG PRO 114 1HG PRO 114 28.414 3.224 2.772 2024 2HG PRO 114 2HG PRO 114 30.179 3.198 2.675 2025 1HD PRO 114 1HD PRO 114 28.177 3.572 0.526 2026 2HD PRO 114 2HD PRO 114 29.844 4.165 0.640 2027 H ARG 115 H ARG 115 30.644 -0.925 -0.677 2028 HA ARG 115 HA ARG 115 27.924 -1.990 -1.237 2029 1HB ARG 115 1HB ARG 115 30.453 -1.702 -2.594 2030 2HB ARG 115 2HB ARG 115 30.002 -3.407 -2.582 2031 1HG ARG 115 1HG ARG 115 28.765 -2.817 -4.411 2032 2HG ARG 115 2HG ARG 115 27.607 -2.275 -3.196 2033 1HD ARG 115 1HD ARG 115 29.146 -0.063 -3.310 2034 2HD ARG 115 2HD ARG 115 29.388 -0.662 -4.962 2035 HE ARG 115 HE ARG 115 26.602 -0.820 -4.173 2036 1HH1 ARG 115 1HH1 ARG 115 29.090 1.343 -5.292 2037 2HH1 ARG 115 2HH1 ARG 115 27.966 2.431 -6.028 2038 1HH2 ARG 115 1HH2 ARG 115 25.163 0.609 -5.137 2039 2HH2 ARG 115 2HH2 ARG 115 25.759 2.021 -5.943 2040 H LEU 116 H LEU 116 30.924 -2.833 0.400 2041 HA LEU 116 HA LEU 116 31.482 -4.668 1.770 2042 1HB LEU 116 1HB LEU 116 28.593 -4.121 2.002 2043 2HB LEU 116 2HB LEU 116 29.044 -5.755 2.488 2044 HG LEU 116 HG LEU 116 31.015 -4.392 3.714 2045 1HD1 LEU 116 1HD1 LEU 116 30.563 -2.206 4.155 2046 2HD1 LEU 116 2HD1 LEU 116 28.838 -2.509 4.364 2047 3HD1 LEU 116 3HD1 LEU 116 29.509 -2.314 2.745 2048 1HD2 LEU 116 1HD2 LEU 116 29.626 -5.908 4.924 2049 2HD2 LEU 116 2HD2 LEU 116 28.188 -4.926 4.646 2050 3HD2 LEU 116 3HD2 LEU 116 29.447 -4.356 5.742 2051 H THR 117 H THR 117 28.496 -6.215 0.659 2052 HA THR 117 HA THR 117 29.733 -8.656 -0.077 2053 HB THR 117 HB THR 117 27.200 -7.344 -1.136 2054 HG1 THR 117 HG1 THR 117 26.312 -7.885 0.702 2055 1HG2 THR 117 1HG2 THR 117 26.465 -9.778 -1.265 2056 2HG2 THR 117 2HG2 THR 117 28.153 -10.214 -1.005 2057 3HG2 THR 117 3HG2 THR 117 27.690 -9.298 -2.439 2058 H GLN 118 H GLN 118 30.129 -9.524 -2.244 2059 HA GLN 118 HA GLN 118 31.110 -9.382 -4.390 2060 1HB GLN 118 1HB GLN 118 28.721 -7.744 -4.203 2061 2HB GLN 118 2HB GLN 118 29.846 -7.046 -5.368 2062 1HG GLN 118 1HG GLN 118 30.065 -9.402 -6.346 2063 2HG GLN 118 2HG GLN 118 28.668 -9.832 -5.359 2064 1HE2 GLN 118 1HE2 GLN 118 27.257 -7.301 -5.606 2065 2HE2 GLN 118 2HE2 GLN 118 26.736 -7.161 -7.215 2066 H ASN 119 H ASN 119 32.174 -7.592 -5.940 2067 HA ASN 119 HA ASN 119 33.952 -5.961 -4.182 2068 1HB ASN 119 1HB ASN 119 34.693 -7.779 -5.890 2069 2HB ASN 119 2HB ASN 119 34.296 -6.583 -7.123 2070 1HD2 ASN 119 1HD2 ASN 119 36.964 -7.341 -6.949 2071 2HD2 ASN 119 2HD2 ASN 119 37.886 -6.097 -6.254 2072 1H GLY 201 1H GLY 201 28.362 24.462 19.374 2073 2H GLY 201 2H GLY 201 27.506 25.822 18.824 2074 3H GLY 201 3H GLY 201 29.202 25.796 18.743 2075 1HA GLY 201 1HA GLY 201 29.152 24.037 17.115 2076 2HA GLY 201 2HA GLY 201 27.393 23.989 17.232 2077 H LYS 202 H LYS 202 29.801 25.116 15.322 2078 HA LYS 202 HA LYS 202 28.168 27.471 14.427 2079 1HB LYS 202 1HB LYS 202 30.350 28.475 13.799 2080 2HB LYS 202 2HB LYS 202 30.320 28.061 15.512 2081 1HG LYS 202 1HG LYS 202 31.211 25.751 14.109 2082 2HG LYS 202 2HG LYS 202 32.119 27.123 13.475 2083 1HD LYS 202 1HD LYS 202 32.005 27.496 16.274 2084 2HD LYS 202 2HD LYS 202 32.392 25.794 16.026 2085 1HE LYS 202 1HE LYS 202 34.253 26.435 14.520 2086 2HE LYS 202 2HE LYS 202 33.865 28.146 14.780 2087 1HZ LYS 202 1HZ LYS 202 34.029 27.632 17.226 2088 2HZ LYS 202 2HZ LYS 202 35.501 27.591 16.380 2089 3HZ LYS 202 3HZ LYS 202 34.721 26.142 16.797 2090 H ALA 203 H ALA 203 27.968 24.668 13.503 2091 HA ALA 203 HA ALA 203 29.241 24.716 10.820 2092 1HB ALA 203 1HB ALA 203 27.628 22.446 11.102 2093 2HB ALA 203 2HB ALA 203 28.188 22.773 12.742 2094 3HB ALA 203 3HB ALA 203 29.356 22.530 11.443 2095 HA PRO 204 HA PRO 204 25.731 25.740 8.400 2096 1HB PRO 204 1HB PRO 204 25.416 22.965 7.363 2097 2HB PRO 204 2HB PRO 204 25.691 24.472 6.471 2098 1HG PRO 204 1HG PRO 204 27.612 22.628 6.798 2099 2HG PRO 204 2HG PRO 204 27.963 24.360 6.726 2100 1HD PRO 204 1HD PRO 204 27.936 22.528 9.067 2101 2HD PRO 204 2HD PRO 204 28.936 23.963 8.761 2102 H ARG 205 H ARG 205 23.349 25.294 8.130 2103 HA ARG 205 HA ARG 205 22.254 23.393 10.162 2104 1HB ARG 205 1HB ARG 205 22.603 25.959 10.779 2105 2HB ARG 205 2HB ARG 205 21.116 26.157 9.853 2106 1HG ARG 205 1HG ARG 205 20.124 25.691 11.859 2107 2HG ARG 205 2HG ARG 205 20.445 24.021 11.394 2108 1HD ARG 205 1HD ARG 205 22.840 25.040 12.567 2109 2HD ARG 205 2HD ARG 205 21.495 25.455 13.647 2110 HE ARG 205 HE ARG 205 21.313 22.736 12.599 2111 1HH1 ARG 205 1HH1 ARG 205 22.697 24.769 15.062 2112 2HH1 ARG 205 2HH1 ARG 205 22.888 23.467 16.184 2113 1HH2 ARG 205 1HH2 ARG 205 21.572 21.062 14.073 2114 2HH2 ARG 205 2HH2 ARG 205 22.257 21.384 15.631 2115 H LYS 206 H LYS 206 21.112 25.872 7.827 2116 HA LYS 206 HA LYS 206 18.806 24.231 7.082 2117 1HB LYS 206 1HB LYS 206 19.299 26.868 7.180 2118 2HB LYS 206 2HB LYS 206 19.757 26.591 5.500 2119 1HG LYS 206 1HG LYS 206 17.435 25.203 5.573 2120 2HG LYS 206 2HG LYS 206 17.083 26.433 6.786 2121 1HD LYS 206 1HD LYS 206 18.095 27.004 3.983 2122 2HD LYS 206 2HD LYS 206 16.413 27.150 4.496 2123 1HE LYS 206 1HE LYS 206 16.803 29.153 5.512 2124 2HE LYS 206 2HE LYS 206 18.299 28.567 6.263 2125 1HZ LYS 206 1HZ LYS 206 18.871 30.196 4.616 2126 2HZ LYS 206 2HZ LYS 206 17.924 29.422 3.438 2127 3HZ LYS 206 3HZ LYS 206 19.331 28.673 4.022 2128 H GLN 207 H GLN 207 18.489 23.251 5.014 2129 HA GLN 207 HA GLN 207 20.848 22.114 3.780 2130 1HB GLN 207 1HB GLN 207 17.871 22.151 3.313 2131 2HB GLN 207 2HB GLN 207 18.930 21.428 2.102 2132 1HG GLN 207 1HG GLN 207 19.931 20.007 3.911 2133 2HG GLN 207 2HG GLN 207 18.730 20.656 5.028 2134 1HE2 GLN 207 1HE2 GLN 207 18.864 17.847 4.323 2135 2HE2 GLN 207 2HE2 GLN 207 17.444 17.458 3.478 2136 H LEU 208 H LEU 208 21.931 22.798 1.945 2137 HA LEU 208 HA LEU 208 20.730 24.649 0.027 2138 1HB LEU 208 1HB LEU 208 21.424 25.952 2.156 2139 2HB LEU 208 2HB LEU 208 23.085 25.636 1.654 2140 HG LEU 208 HG LEU 208 21.918 26.532 -0.683 2141 1HD1 LEU 208 1HD1 LEU 208 19.876 27.280 0.246 2142 2HD1 LEU 208 2HD1 LEU 208 20.864 28.739 0.171 2143 3HD1 LEU 208 3HD1 LEU 208 20.663 27.889 1.703 2144 1HD2 LEU 208 1HD2 LEU 208 23.116 28.695 -0.105 2145 2HD2 LEU 208 2HD2 LEU 208 24.097 27.238 0.055 2146 3HD2 LEU 208 3HD2 LEU 208 23.424 28.010 1.491 2147 H ALA 209 H ALA 209 21.756 22.209 -0.564 2148 HA ALA 209 HA ALA 209 24.297 22.883 -1.987 2149 1HB ALA 209 1HB ALA 209 25.196 21.678 -0.214 2150 2HB ALA 209 2HB ALA 209 24.790 20.338 -1.285 2151 3HB ALA 209 3HB ALA 209 23.712 20.761 0.045 2152 H THR 210 H THR 210 22.405 19.878 -1.595 2153 HA THR 210 HA THR 210 21.651 20.038 -4.486 2154 HB THR 210 HB THR 210 22.299 17.547 -4.518 2155 HG1 THR 210 HG1 THR 210 22.455 17.195 -2.328 2156 1HG2 THR 210 1HG2 THR 210 23.795 19.878 -4.930 2157 2HG2 THR 210 2HG2 THR 210 24.197 18.261 -5.509 2158 3HG2 THR 210 3HG2 THR 210 24.852 18.837 -3.976 2159 H LYS 211 H LYS 211 19.670 18.982 -4.963 2160 HA LYS 211 HA LYS 211 18.039 18.259 -2.568 2161 1HB LYS 211 1HB LYS 211 17.665 19.628 -5.131 2162 2HB LYS 211 2HB LYS 211 16.417 18.416 -4.842 2163 1HG LYS 211 1HG LYS 211 17.196 20.317 -2.644 2164 2HG LYS 211 2HG LYS 211 16.080 20.842 -3.905 2165 1HD LYS 211 1HD LYS 211 15.018 18.414 -3.290 2166 2HD LYS 211 2HD LYS 211 15.677 18.880 -1.722 2167 1HE LYS 211 1HE LYS 211 14.350 21.145 -2.958 2168 2HE LYS 211 2HE LYS 211 13.246 19.761 -2.840 2169 1HZ LYS 211 1HZ LYS 211 13.463 21.200 -0.779 2170 2HZ LYS 211 2HZ LYS 211 15.032 20.571 -0.615 2171 3HZ LYS 211 3HZ LYS 211 13.690 19.532 -0.554 2172 H ALA 212 H ALA 212 18.837 17.103 -5.857 2173 HA ALA 212 HA ALA 212 18.660 14.946 -6.802 2174 1HB ALA 212 1HB ALA 212 18.853 13.294 -4.568 2175 2HB ALA 212 2HB ALA 212 19.587 14.800 -4.019 2176 3HB ALA 212 3HB ALA 212 20.218 13.981 -5.448 2177 H ALA 213 H ALA 213 17.502 12.602 -5.904 2178 HA ALA 213 HA ALA 213 14.629 13.396 -5.658 2179 1HB ALA 213 1HB ALA 213 14.197 11.465 -6.937 2180 2HB ALA 213 2HB ALA 213 15.678 10.669 -6.405 2181 3HB ALA 213 3HB ALA 213 15.756 11.984 -7.577 2182 H ARG 214 H ARG 214 13.708 10.820 -4.847 2183 HA ARG 214 HA ARG 214 14.511 10.892 -1.984 2184 1HB ARG 214 1HB ARG 214 12.164 9.942 -3.611 2185 2HB ARG 214 2HB ARG 214 12.400 9.298 -1.987 2186 1HG ARG 214 1HG ARG 214 11.342 11.150 -1.239 2187 2HG ARG 214 2HG ARG 214 12.802 12.037 -1.677 2188 1HD ARG 214 1HD ARG 214 11.354 11.672 -4.090 2189 2HD ARG 214 2HD ARG 214 10.181 12.209 -2.872 2190 HE ARG 214 HE ARG 214 12.405 13.784 -3.905 2191 1HH1 ARG 214 1HH1 ARG 214 10.404 13.156 -1.125 2192 2HH1 ARG 214 2HH1 ARG 214 10.656 14.728 -0.451 2193 1HH2 ARG 214 1HH2 ARG 214 12.717 15.818 -3.010 2194 2HH2 ARG 214 2HH2 ARG 214 11.955 16.226 -1.508 2195 1HN MLZ 215 1HN MLZ 215 13.197 7.973 -3.470 2196 HA MLZ 215 HA MLZ 215 15.695 6.553 -2.671 2197 1HB MLZ 215 1HB MLZ 215 12.902 5.570 -3.366 2198 2HB MLZ 215 2HB MLZ 215 14.200 4.581 -2.703 2199 1HG MLZ 215 1HG MLZ 215 13.298 7.070 -1.268 2200 2HG MLZ 215 2HG MLZ 215 14.121 5.654 -0.614 2201 1HD MLZ 215 1HD MLZ 215 11.234 5.910 -1.466 2202 2HD MLZ 215 2HD MLZ 215 12.008 4.338 -1.270 2203 1HE MLZ 215 1HE MLZ 215 10.891 5.982 0.772 2204 2HE MLZ 215 2HE MLZ 215 12.646 5.949 1.022 2205 HZ MLZ 215 HZ MLZ 215 12.414 3.464 0.495 2206 1HCM MLZ 215 1HCM MLZ 215 11.894 2.954 2.812 2207 2HCM MLZ 215 2HCM MLZ 215 11.301 4.604 3.002 2208 3HCM MLZ 215 3HCM MLZ 215 13.006 4.314 2.660 2209 H SER 216 H SER 216 17.062 5.878 -4.262 2210 HA SER 216 HA SER 216 17.861 5.242 -6.387 2211 1HB SER 216 1HB SER 216 16.726 7.659 -6.564 2212 2HB SER 216 2HB SER 216 17.325 6.830 -8.000 2213 HG SER 216 HG SER 216 15.036 7.713 -7.900 2214 H ALA 217 H ALA 217 17.126 4.134 -8.496 2215 HA ALA 217 HA ALA 217 15.345 1.940 -7.841 2216 1HB ALA 217 1HB ALA 217 14.204 4.367 -8.764 2217 2HB ALA 217 2HB ALA 217 13.389 2.814 -8.583 2218 3HB ALA 217 3HB ALA 217 14.129 3.246 -10.124 2219 HA PRO 218 HA PRO 218 17.694 0.197 -11.128 2220 1HB PRO 218 1HB PRO 218 16.000 -1.805 -11.962 2221 2HB PRO 218 2HB PRO 218 16.931 -1.888 -10.455 2222 1HG PRO 218 1HG PRO 218 14.072 -1.161 -10.876 2223 2HG PRO 218 2HG PRO 218 14.807 -2.152 -9.608 2224 1HD PRO 218 1HD PRO 218 14.072 0.430 -9.231 2225 2HD PRO 218 2HD PRO 218 15.428 -0.324 -8.367 2226 H ALA 219 H ALA 219 17.761 0.108 -13.475 2227 HA ALA 219 HA ALA 219 17.235 0.948 -15.619 2228 1HB ALA 219 1HB ALA 219 14.517 0.779 -15.799 2229 2HB ALA 219 2HB ALA 219 14.802 -0.230 -14.381 2230 3HB ALA 219 3HB ALA 219 15.580 -0.623 -15.914 2231 H THR 220 H THR 220 17.884 3.115 -14.454 2232 HA THR 220 HA THR 220 15.662 4.963 -13.912 2233 HB THR 220 HB THR 220 17.751 6.531 -13.759 2234 HG1 THR 220 HG1 THR 220 19.177 5.276 -14.916 2235 1HG2 THR 220 1HG2 THR 220 17.910 4.155 -11.920 2236 2HG2 THR 220 2HG2 THR 220 16.483 5.191 -11.898 2237 3HG2 THR 220 3HG2 THR 220 18.069 5.869 -11.534 2238 H GLY 221 H GLY 221 15.265 6.886 -15.186 2239 1HA GLY 221 1HA GLY 221 14.990 8.060 -17.198 2240 2HA GLY 221 2HA GLY 221 16.630 7.548 -17.597 2241 1HN SAH 301 1HN SAH 301 -10.898 -0.457 -8.130 2242 2HN SAH 301 2HN SAH 301 -9.516 0.281 -7.471 2243 HA SAH 301 HA SAH 301 -11.987 1.568 -8.466 2244 1HB SAH 301 1HB SAH 301 -11.054 0.707 -6.017 2245 2HB SAH 301 2HB SAH 301 -10.565 2.402 -6.022 2246 1HG SAH 301 1HG SAH 301 -13.039 1.570 -5.274 2247 2HG SAH 301 2HG SAH 301 -13.315 1.853 -6.992 2248 1H5* SAH 301 1H5* SAH 301 -14.989 3.048 -5.668 2249 2H5* SAH 301 2H5* SAH 301 -14.799 4.584 -4.822 2250 H4* SAH 301 H4* SAH 301 -14.301 5.415 -7.263 2251 H3* SAH 301 H3* SAH 301 -16.567 5.330 -5.459 2252 *HO3 SAH 301 *HO3 SAH 301 -16.893 7.382 -6.404 2253 H2* SAH 301 H2* SAH 301 -18.216 4.618 -6.794 2254 *HO2 SAH 301 *HO2 SAH 301 -17.308 6.831 -8.144 2255 H1* SAH 301 H1* SAH 301 -16.868 4.242 -9.313 2256 H8 SAH 301 H8 SAH 301 -16.324 1.585 -6.711 2257 1HN6 SAH 301 1HN6 SAH 301 -20.372 -1.621 -9.901 2258 2HN6 SAH 301 2HN6 SAH 301 -19.862 -1.518 -8.231 2259 H2 SAH 301 H2 SAH 301 -20.889 2.758 -11.033 2260 1HN SAH 302 1HN SAH 302 10.784 -0.460 8.100 2261 2HN SAH 302 2HN SAH 302 9.414 0.280 7.423 2262 HA SAH 302 HA SAH 302 11.878 1.555 8.451 2263 1HB SAH 302 1HB SAH 302 10.969 0.701 5.990 2264 2HB SAH 302 2HB SAH 302 10.483 2.397 5.987 2265 1HG SAH 302 1HG SAH 302 12.965 1.559 5.269 2266 2HG SAH 302 2HG SAH 302 13.221 1.843 6.991 2267 1H5* SAH 302 1H5* SAH 302 14.914 3.032 5.688 2268 2H5* SAH 302 2H5* SAH 302 14.738 4.567 4.837 2269 H4* SAH 302 H4* SAH 302 14.210 5.404 7.271 2270 H3* SAH 302 H3* SAH 302 16.498 5.312 5.495 2271 *HO3 SAH 302 *HO3 SAH 302 16.817 7.364 6.444 2272 H2* SAH 302 H2* SAH 302 18.129 4.598 6.852 2273 *HO2 SAH 302 *HO2 SAH 302 17.208 6.814 8.188 2274 H1* SAH 302 H1* SAH 302 16.749 4.228 9.354 2275 H8 SAH 302 H8 SAH 302 16.232 1.568 6.745 2276 1HN6 SAH 302 1HN6 SAH 302 20.233 -1.642 9.992 2277 2HN6 SAH 302 2HN6 SAH 302 19.745 -1.540 8.316 2278 H2 SAH 302 H2 SAH 302 20.745 2.738 11.126 Start of MODEL 17 1 1H MET 1 1H MET 1 -0.899 -12.748 -7.775 2 2H MET 1 2H MET 1 -0.099 -12.254 -6.360 3 3H MET 1 3H MET 1 0.054 -11.343 -7.785 4 HA MET 1 HA MET 1 -1.498 -10.352 -6.119 5 1HB MET 1 1HB MET 1 -1.522 -10.610 -8.891 6 2HB MET 1 2HB MET 1 -3.186 -10.959 -8.441 7 1HG MET 1 1HG MET 1 -2.948 -8.567 -8.805 8 2HG MET 1 2HG MET 1 -3.181 -8.866 -7.088 9 1HE MET 1 1HE MET 1 -1.824 -7.004 -5.658 10 2HE MET 1 2HE MET 1 -2.553 -6.443 -7.162 11 3HE MET 1 3HE MET 1 -0.926 -5.924 -6.723 12 H PHE 2 H PHE 2 -1.531 -13.327 -5.572 13 HA PHE 2 HA PHE 2 -4.477 -13.574 -5.070 14 1HB PHE 2 1HB PHE 2 -4.108 -16.036 -5.480 15 2HB PHE 2 2HB PHE 2 -3.804 -15.040 -6.903 16 HD1 PHE 2 HD1 PHE 2 -1.508 -14.597 -7.669 17 HD2 PHE 2 HD2 PHE 2 -2.293 -17.147 -4.303 18 HE1 PHE 2 HE1 PHE 2 0.811 -15.467 -7.788 19 HE2 PHE 2 HE2 PHE 2 0.026 -18.017 -4.421 20 HZ PHE 2 HZ PHE 2 1.578 -17.178 -6.164 21 H ASN 3 H ASN 3 -4.981 -14.078 -2.964 22 HA ASN 3 HA ASN 3 -2.705 -14.690 -1.114 23 1HB ASN 3 1HB ASN 3 -5.072 -12.937 -1.103 24 2HB ASN 3 2HB ASN 3 -4.885 -13.857 0.390 25 1HD2 ASN 3 1HD2 ASN 3 -3.261 -11.495 -1.732 26 2HD2 ASN 3 2HD2 ASN 3 -2.133 -10.980 -0.574 27 H ASP 4 H ASP 4 -3.966 -16.806 -2.596 28 HA ASP 4 HA ASP 4 -4.972 -18.909 -2.260 29 1HB ASP 4 1HB ASP 4 -4.053 -18.065 0.504 30 2HB ASP 4 2HB ASP 4 -4.644 -19.689 0.150 31 H ARG 5 H ARG 5 -5.977 -17.815 0.951 32 HA ARG 5 HA ARG 5 -8.641 -18.666 0.742 33 1HB ARG 5 1HB ARG 5 -7.428 -16.348 2.293 34 2HB ARG 5 2HB ARG 5 -8.971 -17.115 2.671 35 1HG ARG 5 1HG ARG 5 -7.421 -19.313 2.594 36 2HG ARG 5 2HG ARG 5 -6.198 -18.132 3.064 37 1HD ARG 5 1HD ARG 5 -8.847 -18.160 4.498 38 2HD ARG 5 2HD ARG 5 -7.586 -19.324 4.949 39 HE ARG 5 HE ARG 5 -6.237 -16.904 4.769 40 1HH1 ARG 5 1HH1 ARG 5 -9.029 -18.051 6.503 41 2HH1 ARG 5 2HH1 ARG 5 -8.786 -16.969 7.830 42 1HH2 ARG 5 1HH2 ARG 5 -5.942 -15.509 6.503 43 2HH2 ARG 5 2HH2 ARG 5 -7.052 -15.540 7.832 44 H VAL 6 H VAL 6 -7.245 -15.502 -0.114 45 HA VAL 6 HA VAL 6 -9.793 -14.890 -1.573 46 HB VAL 6 HB VAL 6 -8.153 -13.099 0.258 47 1HG1 VAL 6 1HG1 VAL 6 -9.056 -11.922 -1.759 48 2HG1 VAL 6 2HG1 VAL 6 -9.780 -11.355 -0.253 49 3HG1 VAL 6 3HG1 VAL 6 -10.674 -12.455 -1.302 50 1HG2 VAL 6 1HG2 VAL 6 -10.265 -13.032 1.570 51 2HG2 VAL 6 2HG2 VAL 6 -9.610 -14.664 1.455 52 3HG2 VAL 6 3HG2 VAL 6 -10.978 -14.189 0.449 53 H ILE 7 H ILE 7 -9.464 -13.822 -3.563 54 HA ILE 7 HA ILE 7 -6.586 -13.363 -4.305 55 HB ILE 7 HB ILE 7 -7.726 -15.328 -5.348 56 1HG1 ILE 7 1HG1 ILE 7 -7.329 -13.138 -7.397 57 2HG1 ILE 7 2HG1 ILE 7 -5.984 -13.902 -6.550 58 1HG2 ILE 7 1HG2 ILE 7 -9.840 -15.182 -6.109 59 2HG2 ILE 7 2HG2 ILE 7 -9.417 -13.823 -7.156 60 3HG2 ILE 7 3HG2 ILE 7 -9.891 -13.535 -5.480 61 1HD1 ILE 7 1HD1 ILE 7 -6.173 -15.830 -7.743 62 2HD1 ILE 7 2HD1 ILE 7 -7.070 -14.836 -8.890 63 3HD1 ILE 7 3HD1 ILE 7 -7.936 -15.797 -7.692 64 H VAL 8 H VAL 8 -6.329 -11.702 -6.081 65 HA VAL 8 HA VAL 8 -8.183 -9.420 -5.586 66 HB VAL 8 HB VAL 8 -5.426 -9.639 -6.853 67 1HG1 VAL 8 1HG1 VAL 8 -5.397 -7.301 -7.046 68 2HG1 VAL 8 2HG1 VAL 8 -6.713 -7.093 -5.892 69 3HG1 VAL 8 3HG1 VAL 8 -7.052 -7.689 -7.517 70 1HG2 VAL 8 1HG2 VAL 8 -6.285 -8.552 -4.154 71 2HG2 VAL 8 2HG2 VAL 8 -4.632 -8.658 -4.761 72 3HG2 VAL 8 3HG2 VAL 8 -5.538 -10.130 -4.408 73 H LYS 9 H LYS 9 -9.593 -8.810 -7.159 74 HA LYS 9 HA LYS 9 -8.964 -9.428 -9.999 75 1HB LYS 9 1HB LYS 9 -11.482 -10.163 -8.478 76 2HB LYS 9 2HB LYS 9 -11.297 -10.322 -10.223 77 1HG LYS 9 1HG LYS 9 -9.074 -11.633 -9.413 78 2HG LYS 9 2HG LYS 9 -10.122 -11.954 -8.036 79 1HD LYS 9 1HD LYS 9 -11.902 -12.652 -9.728 80 2HD LYS 9 2HD LYS 9 -10.624 -12.617 -10.943 81 1HE LYS 9 1HE LYS 9 -9.309 -14.154 -9.312 82 2HE LYS 9 2HE LYS 9 -10.882 -14.433 -8.541 83 1HZ LYS 9 1HZ LYS 9 -10.250 -14.774 -11.431 84 2HZ LYS 9 2HZ LYS 9 -11.790 -14.967 -10.741 85 3HZ LYS 9 3HZ LYS 9 -10.532 -16.027 -10.320 86 H LYS 10 H LYS 10 -10.691 -6.354 -10.762 87 HA LYS 10 HA LYS 10 -9.679 -7.177 -12.691 88 1HB LYS 10 1HB LYS 10 -7.942 -7.326 -10.480 89 2HB LYS 10 2HB LYS 10 -7.722 -8.836 -11.348 90 1HG LYS 10 1HG LYS 10 -7.591 -6.069 -12.576 91 2HG LYS 10 2HG LYS 10 -6.201 -7.092 -12.212 92 1HD LYS 10 1HD LYS 10 -6.523 -8.376 -14.055 93 2HD LYS 10 2HD LYS 10 -8.267 -8.444 -13.807 94 1HE LYS 10 1HE LYS 10 -7.946 -7.220 -15.854 95 2HE LYS 10 2HE LYS 10 -8.308 -5.993 -14.625 96 1HZ LYS 10 1HZ LYS 10 -5.823 -5.948 -14.222 97 2HZ LYS 10 2HZ LYS 10 -6.348 -5.261 -15.684 98 3HZ LYS 10 3HZ LYS 10 -5.656 -6.812 -15.675 99 H SER 11 H SER 11 -11.925 -8.520 -12.276 100 HA SER 11 HA SER 11 -11.295 -11.438 -12.337 101 1HB SER 11 1HB SER 11 -13.091 -11.464 -10.950 102 2HB SER 11 2HB SER 11 -13.286 -9.728 -11.158 103 HG SER 11 HG SER 11 -14.937 -10.101 -12.365 104 HA PRO 12 HA PRO 12 -12.458 -12.116 -16.515 105 1HB PRO 12 1HB PRO 12 -15.049 -13.395 -15.779 106 2HB PRO 12 2HB PRO 12 -13.699 -14.054 -16.720 107 1HG PRO 12 1HG PRO 12 -14.212 -14.822 -14.196 108 2HG PRO 12 2HG PRO 12 -12.573 -14.752 -14.854 109 1HD PRO 12 1HD PRO 12 -13.913 -12.944 -12.929 110 2HD PRO 12 2HD PRO 12 -12.194 -13.357 -13.089 111 H LEU 13 H LEU 13 -14.793 -10.632 -14.394 112 HA LEU 13 HA LEU 13 -16.316 -9.505 -16.694 113 1HB LEU 13 1HB LEU 13 -16.723 -10.047 -13.802 114 2HB LEU 13 2HB LEU 13 -17.493 -8.580 -14.406 115 HG LEU 13 HG LEU 13 -19.001 -10.535 -14.604 116 1HD1 LEU 13 1HD1 LEU 13 -18.238 -8.724 -16.674 117 2HD1 LEU 13 2HD1 LEU 13 -19.809 -9.484 -16.421 118 3HD1 LEU 13 3HD1 LEU 13 -18.597 -10.278 -17.427 119 1HD2 LEU 13 1HD2 LEU 13 -18.379 -12.515 -15.566 120 2HD2 LEU 13 2HD2 LEU 13 -16.755 -11.964 -15.153 121 3HD2 LEU 13 3HD2 LEU 13 -17.380 -11.724 -16.785 122 H GLY 14 H GLY 14 -14.247 -8.531 -13.975 123 1HA GLY 14 1HA GLY 14 -12.771 -6.542 -14.548 124 2HA GLY 14 2HA GLY 14 -14.251 -5.754 -15.091 125 H GLY 15 H GLY 15 -12.844 -4.430 -13.191 126 1HA GLY 15 1HA GLY 15 -13.641 -3.266 -11.228 127 2HA GLY 15 2HA GLY 15 -14.617 -4.678 -10.821 128 H TYR 16 H TYR 16 -11.864 -3.017 -9.966 129 HA TYR 16 HA TYR 16 -10.209 -5.344 -9.215 130 1HB TYR 16 1HB TYR 16 -9.928 -2.540 -9.684 131 2HB TYR 16 2HB TYR 16 -9.423 -2.836 -8.022 132 HD1 TYR 16 HD1 TYR 16 -8.118 -5.298 -7.884 133 HD2 TYR 16 HD2 TYR 16 -8.167 -2.570 -11.201 134 HE1 TYR 16 HE1 TYR 16 -5.983 -6.257 -8.704 135 HE2 TYR 16 HE2 TYR 16 -6.032 -3.528 -12.021 136 HH TYR 16 HH TYR 16 -4.028 -5.396 -10.175 137 H GLY 17 H GLY 17 -12.341 -6.020 -7.899 138 1HA GLY 17 1HA GLY 17 -12.225 -4.811 -5.167 139 2HA GLY 17 2HA GLY 17 -13.591 -5.739 -5.790 140 H VAL 18 H VAL 18 -13.150 -7.015 -3.689 141 HA VAL 18 HA VAL 18 -10.784 -8.818 -3.928 142 HB VAL 18 HB VAL 18 -12.884 -8.405 -1.769 143 1HG1 VAL 18 1HG1 VAL 18 -11.642 -10.662 -1.903 144 2HG1 VAL 18 2HG1 VAL 18 -11.571 -9.797 -0.368 145 3HG1 VAL 18 3HG1 VAL 18 -10.196 -9.748 -1.473 146 1HG2 VAL 18 1HG2 VAL 18 -11.211 -7.096 -0.625 147 2HG2 VAL 18 2HG2 VAL 18 -11.365 -6.454 -2.260 148 3HG2 VAL 18 3HG2 VAL 18 -10.000 -7.490 -1.845 149 H PHE 19 H PHE 19 -11.060 -10.880 -4.722 150 HA PHE 19 HA PHE 19 -13.814 -11.811 -5.307 151 1HB PHE 19 1HB PHE 19 -11.205 -12.054 -6.441 152 2HB PHE 19 2HB PHE 19 -11.742 -13.676 -6.002 153 HD1 PHE 19 HD1 PHE 19 -12.730 -14.805 -7.772 154 HD2 PHE 19 HD2 PHE 19 -13.437 -10.592 -7.322 155 HE1 PHE 19 HE1 PHE 19 -14.242 -14.849 -9.736 156 HE2 PHE 19 HE2 PHE 19 -14.950 -10.636 -9.287 157 HZ PHE 19 HZ PHE 19 -15.351 -12.766 -10.496 158 H ALA 20 H ALA 20 -14.834 -13.207 -3.965 159 HA ALA 20 HA ALA 20 -13.387 -14.348 -1.666 160 1HB ALA 20 1HB ALA 20 -16.014 -13.449 -2.348 161 2HB ALA 20 2HB ALA 20 -15.436 -13.980 -0.769 162 3HB ALA 20 3HB ALA 20 -16.143 -15.147 -1.888 163 H ARG 21 H ARG 21 -12.106 -16.006 -2.667 164 HA ARG 21 HA ARG 21 -13.209 -18.064 -4.383 165 1HB ARG 21 1HB ARG 21 -10.734 -17.181 -3.653 166 2HB ARG 21 2HB ARG 21 -10.874 -18.632 -2.668 167 1HG ARG 21 1HG ARG 21 -11.033 -20.044 -4.513 168 2HG ARG 21 2HG ARG 21 -11.634 -18.761 -5.564 169 1HD ARG 21 1HD ARG 21 -9.514 -17.988 -6.047 170 2HD ARG 21 2HD ARG 21 -8.887 -18.406 -4.441 171 HE ARG 21 HE ARG 21 -9.514 -20.862 -5.560 172 1HH1 ARG 21 1HH1 ARG 21 -7.586 -18.137 -6.551 173 2HH1 ARG 21 2HH1 ARG 21 -6.489 -19.108 -7.470 174 1HH2 ARG 21 1HH2 ARG 21 -8.077 -22.100 -6.760 175 2HH2 ARG 21 2HH2 ARG 21 -6.763 -21.335 -7.589 176 H LYS 22 H LYS 22 -13.131 -17.488 -0.956 177 HA LYS 22 HA LYS 22 -14.082 -20.256 -0.368 178 1HB LYS 22 1HB LYS 22 -12.515 -18.124 0.934 179 2HB LYS 22 2HB LYS 22 -13.684 -18.875 2.007 180 1HG LYS 22 1HG LYS 22 -12.422 -20.725 2.185 181 2HG LYS 22 2HG LYS 22 -12.371 -20.899 0.429 182 1HD LYS 22 1HD LYS 22 -10.605 -19.059 0.436 183 2HD LYS 22 2HD LYS 22 -10.549 -19.252 2.186 184 1HE LYS 22 1HE LYS 22 -8.805 -20.596 0.930 185 2HE LYS 22 2HE LYS 22 -9.862 -21.589 1.949 186 1HZ LYS 22 1HZ LYS 22 -10.634 -20.980 -0.834 187 2HZ LYS 22 2HZ LYS 22 -11.070 -22.308 0.132 188 3HZ LYS 22 3HZ LYS 22 -9.512 -22.219 -0.537 189 H SER 23 H SER 23 -17.072 -18.899 1.383 190 HA SER 23 HA SER 23 -14.752 -20.785 1.595 191 1HB SER 23 1HB SER 23 -17.180 -21.510 1.101 192 2HB SER 23 2HB SER 23 -16.372 -22.329 2.440 193 HG SER 23 HG SER 23 -18.603 -21.353 2.717 194 H PHE 24 H PHE 24 -16.873 -18.581 3.396 195 HA PHE 24 HA PHE 24 -15.034 -18.884 5.749 196 1HB PHE 24 1HB PHE 24 -16.249 -16.405 4.480 197 2HB PHE 24 2HB PHE 24 -15.330 -16.394 5.985 198 HD1 PHE 24 HD1 PHE 24 -15.026 -15.693 2.638 199 HD2 PHE 24 HD2 PHE 24 -13.055 -17.970 5.701 200 HE1 PHE 24 HE1 PHE 24 -12.910 -15.598 1.347 201 HE2 PHE 24 HE2 PHE 24 -10.939 -17.875 4.410 202 HZ PHE 24 HZ PHE 24 -10.867 -16.689 2.233 203 H GLU 25 H GLU 25 -16.019 -18.243 7.823 204 HA GLU 25 HA GLU 25 -18.959 -18.791 7.876 205 1HB GLU 25 1HB GLU 25 -16.713 -19.774 9.266 206 2HB GLU 25 2HB GLU 25 -17.577 -18.782 10.434 207 1HG GLU 25 1HG GLU 25 -19.678 -20.019 9.589 208 2HG GLU 25 2HG GLU 25 -18.557 -21.179 8.892 209 H LYS 26 H LYS 26 -19.408 -17.724 10.483 210 HA LYS 26 HA LYS 26 -19.302 -14.807 9.853 211 1HB LYS 26 1HB LYS 26 -21.496 -15.930 10.224 212 2HB LYS 26 2HB LYS 26 -20.979 -16.406 11.808 213 1HG LYS 26 1HG LYS 26 -20.909 -14.158 12.577 214 2HG LYS 26 2HG LYS 26 -21.001 -13.525 10.938 215 1HD LYS 26 1HD LYS 26 -23.278 -14.704 10.784 216 2HD LYS 26 2HD LYS 26 -23.175 -14.889 12.537 217 1HE LYS 26 1HE LYS 26 -22.550 -12.161 11.625 218 2HE LYS 26 2HE LYS 26 -24.212 -12.669 11.265 219 1HZ LYS 26 1HZ LYS 26 -22.851 -12.987 13.894 220 2HZ LYS 26 2HZ LYS 26 -24.458 -13.406 13.542 221 3HZ LYS 26 3HZ LYS 26 -23.984 -11.775 13.535 222 H GLY 27 H GLY 27 -17.305 -14.147 10.667 223 1HA GLY 27 1HA GLY 27 -16.496 -13.102 12.820 224 2HA GLY 27 2HA GLY 27 -16.832 -14.659 13.577 225 H GLU 28 H GLU 28 -15.399 -14.276 10.365 226 HA GLU 28 HA GLU 28 -12.881 -15.492 11.455 227 1HB GLU 28 1HB GLU 28 -14.564 -15.897 9.002 228 2HB GLU 28 2HB GLU 28 -12.831 -16.199 8.884 229 1HG GLU 28 1HG GLU 28 -13.021 -17.692 10.893 230 2HG GLU 28 2HG GLU 28 -14.769 -17.482 10.830 231 H LEU 29 H LEU 29 -10.929 -14.527 10.845 232 HA LEU 29 HA LEU 29 -11.078 -11.820 9.708 233 1HB LEU 29 1HB LEU 29 -9.645 -12.397 11.635 234 2HB LEU 29 2HB LEU 29 -8.784 -13.581 10.652 235 HG LEU 29 HG LEU 29 -8.571 -11.350 9.088 236 1HD1 LEU 29 1HD1 LEU 29 -7.916 -9.497 10.612 237 2HD1 LEU 29 2HD1 LEU 29 -8.459 -10.459 11.986 238 3HD1 LEU 29 3HD1 LEU 29 -9.621 -9.915 10.776 239 1HD2 LEU 29 1HD2 LEU 29 -6.473 -12.136 9.335 240 2HD2 LEU 29 2HD2 LEU 29 -6.895 -12.914 10.860 241 3HD2 LEU 29 3HD2 LEU 29 -6.373 -11.230 10.844 242 H VAL 30 H VAL 30 -10.470 -11.265 7.630 243 HA VAL 30 HA VAL 30 -9.905 -13.472 5.737 244 HB VAL 30 HB VAL 30 -10.414 -10.495 5.369 245 1HG1 VAL 30 1HG1 VAL 30 -10.302 -10.830 3.126 246 2HG1 VAL 30 2HG1 VAL 30 -11.118 -12.391 3.229 247 3HG1 VAL 30 3HG1 VAL 30 -9.386 -12.278 3.543 248 1HG2 VAL 30 1HG2 VAL 30 -12.343 -12.804 5.020 249 2HG2 VAL 30 2HG2 VAL 30 -12.714 -11.080 4.972 250 3HG2 VAL 30 3HG2 VAL 30 -12.249 -11.841 6.494 251 H GLU 31 H GLU 31 -8.585 -10.168 6.190 252 HA GLU 31 HA GLU 31 -5.823 -11.184 6.126 253 1HB GLU 31 1HB GLU 31 -5.305 -9.946 4.035 254 2HB GLU 31 2HB GLU 31 -6.546 -11.167 3.751 255 1HG GLU 31 1HG GLU 31 -8.034 -8.965 4.507 256 2HG GLU 31 2HG GLU 31 -6.725 -8.239 3.574 257 H GLU 32 H GLU 32 -4.335 -9.565 6.863 258 HA GLU 32 HA GLU 32 -5.545 -6.930 7.590 259 1HB GLU 32 1HB GLU 32 -5.548 -8.273 9.566 260 2HB GLU 32 2HB GLU 32 -3.975 -8.971 9.190 261 1HG GLU 32 1HG GLU 32 -2.948 -6.732 9.504 262 2HG GLU 32 2HG GLU 32 -4.519 -6.098 9.995 263 H CYS 33 H CYS 33 -4.201 -5.186 7.174 264 HA CYS 33 HA CYS 33 -1.320 -5.702 6.575 265 1HB CYS 33 1HB CYS 33 -3.463 -4.458 4.839 266 2HB CYS 33 2HB CYS 33 -1.759 -4.077 4.587 267 HG CYS 33 HG CYS 33 -1.385 -6.731 4.286 268 H LEU 34 H LEU 34 -0.283 -3.359 6.171 269 HA LEU 34 HA LEU 34 -1.034 -1.743 8.539 270 1HB LEU 34 1HB LEU 34 1.288 -1.980 6.634 271 2HB LEU 34 2HB LEU 34 1.138 -0.540 7.639 272 HG LEU 34 HG LEU 34 1.001 -1.985 9.655 273 1HD1 LEU 34 1HD1 LEU 34 0.115 -4.029 8.891 274 2HD1 LEU 34 2HD1 LEU 34 1.806 -4.418 9.205 275 3HD1 LEU 34 3HD1 LEU 34 1.260 -4.129 7.553 276 1HD2 LEU 34 1HD2 LEU 34 3.183 -1.151 9.135 277 2HD2 LEU 34 2HD2 LEU 34 3.385 -2.308 7.819 278 3HD2 LEU 34 3HD2 LEU 34 3.393 -2.865 9.492 279 H CYS 35 H CYS 35 -0.950 0.708 8.211 280 HA CYS 35 HA CYS 35 -1.875 1.589 5.520 281 1HB CYS 35 1HB CYS 35 -3.358 1.929 8.155 282 2HB CYS 35 2HB CYS 35 -3.834 2.687 6.638 283 HG CYS 35 HG CYS 35 -4.630 0.475 5.741 284 H ILE 36 H ILE 36 -2.046 4.061 5.505 285 HA ILE 36 HA ILE 36 0.225 5.178 7.088 286 HB ILE 36 HB ILE 36 -1.365 6.220 4.720 287 1HG1 ILE 36 1HG1 ILE 36 1.493 5.293 4.652 288 2HG1 ILE 36 2HG1 ILE 36 0.191 4.105 4.557 289 1HG2 ILE 36 1HG2 ILE 36 -0.349 8.024 6.066 290 2HG2 ILE 36 2HG2 ILE 36 0.469 7.859 4.512 291 3HG2 ILE 36 3HG2 ILE 36 1.214 7.212 5.973 292 1HD1 ILE 36 1HD1 ILE 36 -0.002 6.515 2.805 293 2HD1 ILE 36 2HD1 ILE 36 -0.528 4.860 2.498 294 3HD1 ILE 36 3HD1 ILE 36 1.180 5.282 2.367 295 H VAL 37 H VAL 37 -0.126 7.417 8.008 296 HA VAL 37 HA VAL 37 -2.975 8.013 8.665 297 HB VAL 37 HB VAL 37 -0.699 7.650 10.651 298 1HG1 VAL 37 1HG1 VAL 37 -2.020 9.068 11.852 299 2HG1 VAL 37 2HG1 VAL 37 -3.023 7.635 12.081 300 3HG1 VAL 37 3HG1 VAL 37 -3.420 8.796 10.814 301 1HG2 VAL 37 1HG2 VAL 37 -1.277 5.464 10.106 302 2HG2 VAL 37 2HG2 VAL 37 -2.942 5.895 9.714 303 3HG2 VAL 37 3HG2 VAL 37 -2.431 5.796 11.399 304 H ARG 38 H ARG 38 -3.203 10.127 8.069 305 HA ARG 38 HA ARG 38 -1.184 12.101 9.014 306 1HB ARG 38 1HB ARG 38 -2.149 11.650 6.174 307 2HB ARG 38 2HB ARG 38 -1.315 13.118 6.676 308 1HG ARG 38 1HG ARG 38 -0.209 10.307 6.952 309 2HG ARG 38 2HG ARG 38 0.241 11.450 5.688 310 1HD ARG 38 1HD ARG 38 0.869 13.061 7.610 311 2HD ARG 38 2HD ARG 38 0.793 11.630 8.657 312 HE ARG 38 HE ARG 38 2.824 12.157 6.627 313 1HH1 ARG 38 1HH1 ARG 38 1.036 9.693 8.317 314 2HH1 ARG 38 2HH1 ARG 38 2.252 8.488 8.073 315 1HH2 ARG 38 1HH2 ARG 38 4.388 10.575 6.324 316 2HH2 ARG 38 2HH2 ARG 38 4.137 8.981 6.953 317 H HIS 39 H HIS 39 -2.142 14.080 9.561 318 HA HIS 39 HA HIS 39 -4.897 14.237 10.150 319 1HB HIS 39 1HB HIS 39 -2.609 16.149 9.802 320 2HB HIS 39 2HB HIS 39 -4.226 16.813 10.031 321 HD1 HIS 39 HD1 HIS 39 -3.990 17.595 12.444 322 HD2 HIS 39 HD2 HIS 39 -2.937 13.592 11.945 323 HE1 HIS 39 HE1 HIS 39 -3.694 16.637 14.769 324 H ASN 40 H ASN 40 -5.954 16.546 9.127 325 HA ASN 40 HA ASN 40 -6.497 15.777 6.305 326 1HB ASN 40 1HB ASN 40 -8.329 16.013 7.968 327 2HB ASN 40 2HB ASN 40 -7.865 17.694 8.230 328 1HD2 ASN 40 1HD2 ASN 40 -10.189 18.097 7.431 329 2HD2 ASN 40 2HD2 ASN 40 -10.441 18.190 5.755 330 H ASP 41 H ASP 41 -5.432 16.891 4.741 331 HA ASP 41 HA ASP 41 -5.362 19.763 4.592 332 1HB ASP 41 1HB ASP 41 -3.618 18.838 6.442 333 2HB ASP 41 2HB ASP 41 -2.605 18.676 5.008 334 H ASP 42 H ASP 42 -2.593 19.563 3.231 335 HA ASP 42 HA ASP 42 -3.366 19.110 0.560 336 1HB ASP 42 1HB ASP 42 -0.684 18.609 1.914 337 2HB ASP 42 2HB ASP 42 -0.920 18.905 0.192 338 H TRP 43 H TRP 43 -2.240 16.841 3.021 339 HA TRP 43 HA TRP 43 -1.986 14.500 1.368 340 1HB TRP 43 1HB TRP 43 -1.037 14.470 3.551 341 2HB TRP 43 2HB TRP 43 -2.489 15.158 4.276 342 HD1 TRP 43 HD1 TRP 43 -4.358 13.547 5.060 343 HE1 TRP 43 HE1 TRP 43 -4.577 10.982 5.186 344 HE3 TRP 43 HE3 TRP 43 -0.300 12.176 2.278 345 HZ2 TRP 43 HZ2 TRP 43 -3.212 8.659 4.235 346 HZ3 TRP 43 HZ3 TRP 43 0.208 9.781 1.906 347 HH2 TRP 43 HH2 TRP 43 -1.236 8.022 2.879 348 H GLY 44 H GLY 44 -4.686 16.082 3.017 349 1HA GLY 44 1HA GLY 44 -6.629 14.036 2.769 350 2HA GLY 44 2HA GLY 44 -6.996 15.759 2.844 351 H THR 45 H THR 45 -6.401 16.934 0.667 352 HA THR 45 HA THR 45 -8.073 15.795 -1.389 353 HB THR 45 HB THR 45 -5.970 17.929 -1.593 354 HG1 THR 45 HG1 THR 45 -7.855 19.287 -1.110 355 1HG2 THR 45 1HG2 THR 45 -6.736 17.523 -3.762 356 2HG2 THR 45 2HG2 THR 45 -7.772 18.845 -3.218 357 3HG2 THR 45 3HG2 THR 45 -8.378 17.189 -3.209 358 H ALA 46 H ALA 46 -4.540 15.865 -0.956 359 HA ALA 46 HA ALA 46 -3.822 14.900 -3.565 360 1HB ALA 46 1HB ALA 46 -1.725 14.300 -2.407 361 2HB ALA 46 2HB ALA 46 -2.535 14.442 -0.846 362 3HB ALA 46 3HB ALA 46 -2.291 15.875 -1.846 363 H LEU 47 H LEU 47 -3.991 13.105 -0.480 364 HA LEU 47 HA LEU 47 -4.495 10.586 -1.971 365 1HB LEU 47 1HB LEU 47 -3.769 11.377 0.858 366 2HB LEU 47 2HB LEU 47 -4.304 9.739 0.490 367 HG LEU 47 HG LEU 47 -1.864 9.836 0.409 368 1HD1 LEU 47 1HD1 LEU 47 -3.525 8.891 -1.625 369 2HD1 LEU 47 2HD1 LEU 47 -1.842 8.438 -1.357 370 3HD1 LEU 47 3HD1 LEU 47 -2.237 9.743 -2.476 371 1HD2 LEU 47 1HD2 LEU 47 -2.124 12.396 -0.379 372 2HD2 LEU 47 2HD2 LEU 47 -1.861 11.646 -1.953 373 3HD2 LEU 47 3HD2 LEU 47 -0.658 11.461 -0.676 374 H GLU 48 H GLU 48 -6.575 12.673 -1.896 375 HA GLU 48 HA GLU 48 -8.561 12.069 0.075 376 1HB GLU 48 1HB GLU 48 -8.034 13.938 -1.875 377 2HB GLU 48 2HB GLU 48 -9.466 13.156 -2.460 378 1HG GLU 48 1HG GLU 48 -10.153 13.425 0.126 379 2HG GLU 48 2HG GLU 48 -9.076 14.806 -0.060 380 H ASP 49 H ASP 49 -7.498 10.087 -2.409 381 HA ASP 49 HA ASP 49 -10.167 8.765 -2.614 382 1HB ASP 49 1HB ASP 49 -8.966 9.820 -4.679 383 2HB ASP 49 2HB ASP 49 -7.856 8.457 -4.539 384 H TYR 50 H TYR 50 -10.122 6.470 -2.345 385 HA TYR 50 HA TYR 50 -9.351 4.438 -1.396 386 1HB TYR 50 1HB TYR 50 -6.649 5.499 -2.301 387 2HB TYR 50 2HB TYR 50 -7.111 3.815 -2.101 388 HD1 TYR 50 HD1 TYR 50 -9.510 3.321 -3.444 389 HD2 TYR 50 HD2 TYR 50 -6.485 6.185 -4.506 390 HE1 TYR 50 HE1 TYR 50 -10.293 3.281 -5.792 391 HE2 TYR 50 HE2 TYR 50 -7.271 6.140 -6.857 392 HH TYR 50 HH TYR 50 -9.556 3.790 -7.986 393 H LEU 51 H LEU 51 -9.391 6.992 0.190 394 HA LEU 51 HA LEU 51 -7.389 6.215 2.285 395 1HB LEU 51 1HB LEU 51 -6.997 8.309 0.822 396 2HB LEU 51 2HB LEU 51 -8.365 9.019 1.678 397 HG LEU 51 HG LEU 51 -7.001 8.170 3.808 398 1HD1 LEU 51 1HD1 LEU 51 -4.639 9.026 2.257 399 2HD1 LEU 51 2HD1 LEU 51 -5.251 7.425 1.841 400 3HD1 LEU 51 3HD1 LEU 51 -4.779 7.788 3.500 401 1HD2 LEU 51 1HD2 LEU 51 -7.287 10.634 2.380 402 2HD2 LEU 51 2HD2 LEU 51 -5.636 10.549 3.001 403 3HD2 LEU 51 3HD2 LEU 51 -7.006 10.401 4.106 404 H PHE 52 H PHE 52 -8.196 6.090 4.358 405 HA PHE 52 HA PHE 52 -11.110 6.502 4.749 406 1HB PHE 52 1HB PHE 52 -8.848 5.174 6.270 407 2HB PHE 52 2HB PHE 52 -10.454 5.363 6.974 408 HD1 PHE 52 HD1 PHE 52 -8.387 3.417 4.760 409 HD2 PHE 52 HD2 PHE 52 -12.460 4.429 5.677 410 HE1 PHE 52 HE1 PHE 52 -9.164 1.412 3.523 411 HE2 PHE 52 HE2 PHE 52 -13.237 2.424 4.441 412 HZ PHE 52 HZ PHE 52 -11.588 0.915 3.364 413 H SER 53 H SER 53 -11.797 7.686 6.753 414 HA SER 53 HA SER 53 -9.783 9.687 7.695 415 1HB SER 53 1HB SER 53 -11.285 11.475 7.167 416 2HB SER 53 2HB SER 53 -11.294 10.427 5.751 417 HG SER 53 HG SER 53 -13.314 11.075 7.415 418 H ARG 54 H ARG 54 -9.721 9.349 9.882 419 HA ARG 54 HA ARG 54 -12.202 8.529 11.310 420 1HB ARG 54 1HB ARG 54 -9.823 7.442 11.432 421 2HB ARG 54 2HB ARG 54 -9.425 8.813 12.466 422 1HG ARG 54 1HG ARG 54 -10.535 7.912 14.212 423 2HG ARG 54 2HG ARG 54 -11.969 7.624 13.226 424 1HD ARG 54 1HD ARG 54 -10.514 5.644 12.232 425 2HD ARG 54 2HD ARG 54 -9.646 5.797 13.771 426 HE ARG 54 HE ARG 54 -12.532 5.843 14.131 427 1HH1 ARG 54 1HH1 ARG 54 -9.764 3.783 13.669 428 2HH1 ARG 54 2HH1 ARG 54 -10.505 2.428 14.447 429 1HH2 ARG 54 1HH2 ARG 54 -13.472 4.070 15.137 430 2HH2 ARG 54 2HH2 ARG 54 -12.588 2.587 15.273 431 H LYS 55 H LYS 55 -12.248 9.575 13.656 432 HA LYS 55 HA LYS 55 -12.478 12.456 13.273 433 1HB LYS 55 1HB LYS 55 -13.042 10.403 15.402 434 2HB LYS 55 2HB LYS 55 -13.065 12.110 15.847 435 1HG LYS 55 1HG LYS 55 -14.955 12.539 14.625 436 2HG LYS 55 2HG LYS 55 -14.521 11.391 13.359 437 1HD LYS 55 1HD LYS 55 -16.057 10.004 14.270 438 2HD LYS 55 2HD LYS 55 -14.924 9.788 15.604 439 1HE LYS 55 1HE LYS 55 -16.252 10.968 17.023 440 2HE LYS 55 2HE LYS 55 -16.462 12.275 15.842 441 1HZ LYS 55 1HZ LYS 55 -17.767 9.625 15.555 442 2HZ LYS 55 2HZ LYS 55 -18.124 11.059 14.718 443 3HZ LYS 55 3HZ LYS 55 -18.516 10.916 16.365 444 H ASN 56 H ASN 56 -10.246 13.032 12.933 445 HA ASN 56 HA ASN 56 -8.340 12.616 15.163 446 1HB ASN 56 1HB ASN 56 -9.650 14.616 15.760 447 2HB ASN 56 2HB ASN 56 -8.015 15.099 15.308 448 1HD2 ASN 56 1HD2 ASN 56 -11.401 15.258 14.369 449 2HD2 ASN 56 2HD2 ASN 56 -11.180 16.292 13.040 450 H MET 57 H MET 57 -8.684 11.972 12.193 451 HA MET 57 HA MET 57 -6.852 13.571 10.660 452 1HB MET 57 1HB MET 57 -4.878 12.074 10.817 453 2HB MET 57 2HB MET 57 -5.277 12.737 12.392 454 1HG MET 57 1HG MET 57 -6.523 10.162 11.629 455 2HG MET 57 2HG MET 57 -4.814 10.133 11.994 456 1HE MET 57 1HE MET 57 -3.773 11.049 13.604 457 2HE MET 57 2HE MET 57 -4.099 9.854 14.860 458 3HE MET 57 3HE MET 57 -4.292 11.573 15.208 459 H SER 58 H SER 58 -5.646 11.478 9.148 460 HA SER 58 HA SER 58 -7.941 9.789 8.263 461 1HB SER 58 1HB SER 58 -6.168 11.463 6.449 462 2HB SER 58 2HB SER 58 -7.588 10.535 5.968 463 HG SER 58 HG SER 58 -7.401 12.979 7.259 464 H ALA 59 H ALA 59 -7.100 8.096 6.632 465 HA ALA 59 HA ALA 59 -4.205 7.511 6.906 466 1HB ALA 59 1HB ALA 59 -4.978 6.409 8.844 467 2HB ALA 59 2HB ALA 59 -5.029 5.121 7.641 468 3HB ALA 59 3HB ALA 59 -6.510 5.966 8.091 469 H MET 60 H MET 60 -3.452 6.077 5.262 470 HA MET 60 HA MET 60 -5.317 5.791 2.966 471 1HB MET 60 1HB MET 60 -3.079 6.804 2.683 472 2HB MET 60 2HB MET 60 -2.331 5.334 3.307 473 1HG MET 60 1HG MET 60 -2.948 4.070 1.417 474 2HG MET 60 2HG MET 60 -4.181 5.233 0.931 475 1HE MET 60 1HE MET 60 -2.539 6.701 -1.903 476 2HE MET 60 2HE MET 60 -3.767 7.183 -0.731 477 3HE MET 60 3HE MET 60 -3.701 5.516 -1.304 478 H ALA 61 H ALA 61 -5.558 3.737 1.865 479 HA ALA 61 HA ALA 61 -5.558 1.443 3.709 480 1HB ALA 61 1HB ALA 61 -7.445 1.347 2.407 481 2HB ALA 61 2HB ALA 61 -6.386 0.544 1.248 482 3HB ALA 61 3HB ALA 61 -6.701 2.273 1.103 483 H LEU 62 H LEU 62 -3.287 0.999 3.962 484 HA LEU 62 HA LEU 62 -1.278 -0.109 3.424 485 1HB LEU 62 1HB LEU 62 -0.926 0.557 0.730 486 2HB LEU 62 2HB LEU 62 -1.944 1.853 1.358 487 HG LEU 62 HG LEU 62 -0.324 2.109 3.265 488 1HD1 LEU 62 1HD1 LEU 62 0.973 0.250 3.545 489 2HD1 LEU 62 2HD1 LEU 62 2.019 1.046 2.368 490 3HD1 LEU 62 3HD1 LEU 62 0.879 -0.192 1.840 491 1HD2 LEU 62 1HD2 LEU 62 -0.254 3.460 1.111 492 2HD2 LEU 62 2HD2 LEU 62 1.025 2.374 0.568 493 3HD2 LEU 62 3HD2 LEU 62 1.268 3.378 1.997 494 H GLY 63 H GLY 63 -2.726 -2.134 3.540 495 1HA GLY 63 1HA GLY 63 -2.088 -3.873 1.360 496 2HA GLY 63 2HA GLY 63 -3.190 -4.266 2.678 497 H PHE 64 H PHE 64 -4.948 -5.080 1.584 498 HA PHE 64 HA PHE 64 -5.939 -3.815 -0.877 499 1HB PHE 64 1HB PHE 64 -6.966 -6.061 0.900 500 2HB PHE 64 2HB PHE 64 -7.585 -5.682 -0.707 501 HD1 PHE 64 HD1 PHE 64 -5.638 -5.425 -2.558 502 HD2 PHE 64 HD2 PHE 64 -5.368 -7.745 1.047 503 HE1 PHE 64 HE1 PHE 64 -3.839 -6.796 -3.576 504 HE2 PHE 64 HE2 PHE 64 -3.569 -9.116 0.029 505 HZ PHE 64 HZ PHE 64 -2.805 -8.642 -2.282 506 H GLY 65 H GLY 65 -6.048 -1.866 1.056 507 1HA GLY 65 1HA GLY 65 -8.747 -1.891 2.259 508 2HA GLY 65 2HA GLY 65 -7.514 -0.659 2.519 509 H ALA 66 H ALA 66 -7.021 -0.472 -0.437 510 HA ALA 66 HA ALA 66 -9.172 1.469 -1.006 511 1HB ALA 66 1HB ALA 66 -6.676 0.641 -2.531 512 2HB ALA 66 2HB ALA 66 -6.748 1.940 -1.340 513 3HB ALA 66 3HB ALA 66 -7.649 2.077 -2.850 514 H ILE 67 H ILE 67 -7.750 -1.418 -2.583 515 HA ILE 67 HA ILE 67 -9.337 -1.628 -4.855 516 HB ILE 67 HB ILE 67 -9.006 -4.119 -4.524 517 1HG1 ILE 67 1HG1 ILE 67 -7.435 -4.590 -2.498 518 2HG1 ILE 67 2HG1 ILE 67 -8.134 -3.127 -1.813 519 1HG2 ILE 67 1HG2 ILE 67 -6.733 -2.172 -4.125 520 2HG2 ILE 67 2HG2 ILE 67 -7.252 -2.952 -5.620 521 3HG2 ILE 67 3HG2 ILE 67 -6.458 -3.898 -4.360 522 1HD1 ILE 67 1HD1 ILE 67 -10.194 -4.839 -2.933 523 2HD1 ILE 67 2HD1 ILE 67 -10.048 -4.196 -1.297 524 3HD1 ILE 67 3HD1 ILE 67 -9.235 -5.699 -1.729 525 H PHE 68 H PHE 68 -10.348 -2.094 -1.532 526 HA PHE 68 HA PHE 68 -12.635 -3.675 -1.733 527 1HB PHE 68 1HB PHE 68 -11.774 -1.280 -0.146 528 2HB PHE 68 2HB PHE 68 -13.444 -1.816 0.024 529 HD1 PHE 68 HD1 PHE 68 -10.630 -1.975 1.775 530 HD2 PHE 68 HD2 PHE 68 -13.259 -4.722 -0.221 531 HE1 PHE 68 HE1 PHE 68 -9.884 -3.790 3.291 532 HE2 PHE 68 HE2 PHE 68 -12.514 -6.537 1.295 533 HZ PHE 68 HZ PHE 68 -10.826 -6.071 3.051 534 H ASN 69 H ASN 69 -14.362 -3.509 -3.110 535 HA ASN 69 HA ASN 69 -14.994 -0.882 -4.343 536 1HB ASN 69 1HB ASN 69 -15.883 -3.748 -4.827 537 2HB ASN 69 2HB ASN 69 -16.441 -2.376 -5.785 538 1HD2 ASN 69 1HD2 ASN 69 -15.073 -4.263 -7.228 539 2HD2 ASN 69 2HD2 ASN 69 -13.497 -3.738 -7.583 540 H HIS 70 H HIS 70 -17.506 -0.589 -4.675 541 HA HIS 70 HA HIS 70 -18.724 -0.702 -1.968 542 1HB HIS 70 1HB HIS 70 -18.518 1.393 -3.383 543 2HB HIS 70 2HB HIS 70 -19.656 0.664 -4.516 544 HD1 HIS 70 HD1 HIS 70 -21.485 2.446 -3.986 545 HD2 HIS 70 HD2 HIS 70 -20.303 0.205 -0.676 546 HE1 HIS 70 HE1 HIS 70 -23.190 2.898 -2.170 547 H SER 71 H SER 71 -20.568 -1.893 -1.532 548 HA SER 71 HA SER 71 -22.028 -3.173 -3.795 549 1HB SER 71 1HB SER 71 -20.346 -4.785 -3.156 550 2HB SER 71 2HB SER 71 -20.662 -4.519 -1.442 551 HG SER 71 HG SER 71 -21.936 -6.134 -3.214 552 H LYS 72 H LYS 72 -24.147 -4.053 -3.056 553 HA LYS 72 HA LYS 72 -25.363 -2.308 -1.029 554 1HB LYS 72 1HB LYS 72 -26.441 -2.834 -3.190 555 2HB LYS 72 2HB LYS 72 -26.433 -4.550 -2.786 556 1HG LYS 72 1HG LYS 72 -28.641 -3.559 -2.321 557 2HG LYS 72 2HG LYS 72 -27.870 -4.088 -0.826 558 1HD LYS 72 1HD LYS 72 -27.121 -1.792 -0.378 559 2HD LYS 72 2HD LYS 72 -27.835 -1.249 -1.896 560 1HE LYS 72 1HE LYS 72 -29.555 -0.733 -0.392 561 2HE LYS 72 2HE LYS 72 -30.025 -2.377 -0.866 562 1HZ LYS 72 1HZ LYS 72 -28.309 -1.653 1.458 563 2HZ LYS 72 2HZ LYS 72 -28.724 -3.233 0.996 564 3HZ LYS 72 3HZ LYS 72 -29.925 -2.167 1.550 565 H ASP 73 H ASP 73 -24.522 -5.740 -1.369 566 HA ASP 73 HA ASP 73 -25.314 -6.126 1.500 567 1HB ASP 73 1HB ASP 73 -26.167 -7.398 -0.939 568 2HB ASP 73 2HB ASP 73 -25.333 -8.589 0.057 569 HA PRO 74 HA PRO 74 -20.829 -7.249 0.618 570 1HB PRO 74 1HB PRO 74 -19.701 -5.412 2.346 571 2HB PRO 74 2HB PRO 74 -19.954 -5.100 0.620 572 1HG PRO 74 1HG PRO 74 -21.542 -4.204 2.967 573 2HG PRO 74 2HG PRO 74 -21.184 -3.357 1.456 574 1HD PRO 74 1HD PRO 74 -23.581 -4.559 2.007 575 2HD PRO 74 2HD PRO 74 -22.955 -4.304 0.365 576 H ASN 75 H ASN 75 -20.597 -9.084 1.773 577 HA ASN 75 HA ASN 75 -21.454 -9.220 4.589 578 1HB ASN 75 1HB ASN 75 -20.226 -11.263 2.707 579 2HB ASN 75 2HB ASN 75 -21.027 -11.613 4.229 580 1HD2 ASN 75 1HD2 ASN 75 -21.559 -10.819 0.861 581 2HD2 ASN 75 2HD2 ASN 75 -23.253 -10.917 0.904 582 H ALA 76 H ALA 76 -18.869 -7.787 3.508 583 HA ALA 76 HA ALA 76 -16.983 -9.134 5.414 584 1HB ALA 76 1HB ALA 76 -16.041 -7.407 3.154 585 2HB ALA 76 2HB ALA 76 -16.688 -8.997 2.748 586 3HB ALA 76 3HB ALA 76 -15.302 -8.859 3.831 587 H ARG 77 H ARG 77 -15.510 -7.624 6.534 588 HA ARG 77 HA ARG 77 -16.316 -4.755 6.487 589 1HB ARG 77 1HB ARG 77 -17.490 -6.457 8.213 590 2HB ARG 77 2HB ARG 77 -16.025 -6.119 9.135 591 1HG ARG 77 1HG ARG 77 -17.677 -4.494 9.800 592 2HG ARG 77 2HG ARG 77 -16.497 -3.654 8.795 593 1HD ARG 77 1HD ARG 77 -18.054 -3.190 7.198 594 2HD ARG 77 2HD ARG 77 -18.706 -4.839 7.248 595 HE ARG 77 HE ARG 77 -20.317 -4.061 8.791 596 1HH1 ARG 77 1HH1 ARG 77 -17.551 -1.948 8.747 597 2HH1 ARG 77 2HH1 ARG 77 -18.256 -0.821 9.853 598 1HH2 ARG 77 1HH2 ARG 77 -21.212 -2.584 10.225 599 2HH2 ARG 77 2HH2 ARG 77 -20.313 -1.176 10.685 600 H HIS 78 H HIS 78 -14.768 -3.461 7.930 601 HA HIS 78 HA HIS 78 -12.062 -4.750 8.023 602 1HB HIS 78 1HB HIS 78 -11.216 -2.514 7.259 603 2HB HIS 78 2HB HIS 78 -12.285 -3.270 6.078 604 HD1 HIS 78 HD1 HIS 78 -14.737 -2.308 5.904 605 HD2 HIS 78 HD2 HIS 78 -12.193 -0.123 8.380 606 HE1 HIS 78 HE1 HIS 78 -15.882 -0.088 6.328 607 H GLU 79 H GLU 79 -11.079 -4.531 9.993 608 HA GLU 79 HA GLU 79 -12.291 -2.632 11.961 609 1HB GLU 79 1HB GLU 79 -12.331 -5.051 12.482 610 2HB GLU 79 2HB GLU 79 -10.582 -5.130 12.272 611 1HG GLU 79 1HG GLU 79 -11.062 -4.956 14.647 612 2HG GLU 79 2HG GLU 79 -10.347 -3.437 14.110 613 H LEU 80 H LEU 80 -10.846 -1.333 13.252 614 HA LEU 80 HA LEU 80 -8.107 -1.015 12.065 615 1HB LEU 80 1HB LEU 80 -10.269 0.853 12.975 616 2HB LEU 80 2HB LEU 80 -8.596 1.381 13.159 617 HG LEU 80 HG LEU 80 -9.497 0.205 10.545 618 1HD1 LEU 80 1HD1 LEU 80 -11.085 1.840 10.438 619 2HD1 LEU 80 2HD1 LEU 80 -9.708 2.891 10.108 620 3HD1 LEU 80 3HD1 LEU 80 -10.354 2.771 11.745 621 1HD2 LEU 80 1HD2 LEU 80 -7.760 1.823 9.726 622 2HD2 LEU 80 2HD2 LEU 80 -7.122 0.622 10.849 623 3HD2 LEU 80 3HD2 LEU 80 -7.443 2.265 11.404 624 H THR 81 H THR 81 -6.422 -1.288 13.482 625 HA THR 81 HA THR 81 -6.735 -2.234 16.137 626 HB THR 81 HB THR 81 -4.279 -1.643 16.260 627 HG1 THR 81 HG1 THR 81 -4.573 -0.728 13.614 628 1HG2 THR 81 1HG2 THR 81 -5.490 -3.592 14.834 629 2HG2 THR 81 2HG2 THR 81 -3.738 -3.407 14.899 630 3HG2 THR 81 3HG2 THR 81 -4.642 -2.762 13.530 631 H ALA 82 H ALA 82 -5.116 -0.713 17.787 632 HA ALA 82 HA ALA 82 -6.925 1.411 18.618 633 1HB ALA 82 1HB ALA 82 -5.503 1.467 20.521 634 2HB ALA 82 2HB ALA 82 -4.103 0.928 19.595 635 3HB ALA 82 3HB ALA 82 -5.398 -0.207 19.976 636 H GLY 83 H GLY 83 -6.449 2.364 16.229 637 1HA GLY 83 1HA GLY 83 -5.333 4.894 16.462 638 2HA GLY 83 2HA GLY 83 -3.985 3.876 15.952 639 H LEU 84 H LEU 84 -3.706 4.092 13.785 640 HA LEU 84 HA LEU 84 -6.021 3.648 11.989 641 1HB LEU 84 1HB LEU 84 -5.294 6.201 12.766 642 2HB LEU 84 2HB LEU 84 -4.393 6.003 11.265 643 HG LEU 84 HG LEU 84 -6.463 5.353 10.097 644 1HD1 LEU 84 1HD1 LEU 84 -8.616 5.902 11.511 645 2HD1 LEU 84 2HD1 LEU 84 -7.561 5.566 12.885 646 3HD1 LEU 84 3HD1 LEU 84 -7.847 4.322 11.667 647 1HD2 LEU 84 1HD2 LEU 84 -5.845 7.922 11.168 648 2HD2 LEU 84 2HD2 LEU 84 -7.598 7.738 11.217 649 3HD2 LEU 84 3HD2 LEU 84 -6.735 7.550 9.691 650 H LYS 85 H LYS 85 -3.341 2.376 12.683 651 HA LYS 85 HA LYS 85 -1.990 2.604 10.022 652 1HB LYS 85 1HB LYS 85 -1.140 1.685 12.787 653 2HB LYS 85 2HB LYS 85 -0.125 1.460 11.362 654 1HG LYS 85 1HG LYS 85 -0.076 3.862 10.963 655 2HG LYS 85 2HG LYS 85 -1.213 4.138 12.283 656 1HD LYS 85 1HD LYS 85 0.404 3.302 13.905 657 2HD LYS 85 2HD LYS 85 1.525 2.874 12.613 658 1HE LYS 85 1HE LYS 85 0.655 5.676 12.468 659 2HE LYS 85 2HE LYS 85 1.525 5.292 13.966 660 1HZ LYS 85 1HZ LYS 85 2.400 4.688 11.186 661 2HZ LYS 85 2HZ LYS 85 3.196 4.133 12.580 662 3HZ LYS 85 3HZ LYS 85 3.119 5.797 12.252 663 H ARG 86 H ARG 86 -2.226 -0.021 12.448 664 HA ARG 86 HA ARG 86 -2.216 -2.089 10.428 665 1HB ARG 86 1HB ARG 86 -2.779 -1.922 13.399 666 2HB ARG 86 2HB ARG 86 -2.866 -3.455 12.531 667 1HG ARG 86 1HG ARG 86 -0.474 -2.494 11.632 668 2HG ARG 86 2HG ARG 86 -0.503 -1.835 13.269 669 1HD ARG 86 1HD ARG 86 -1.265 -4.295 13.909 670 2HD ARG 86 2HD ARG 86 -0.460 -4.703 12.382 671 HE ARG 86 HE ARG 86 1.264 -2.931 13.730 672 1HH1 ARG 86 1HH1 ARG 86 -0.139 -6.072 14.264 673 2HH1 ARG 86 2HH1 ARG 86 1.190 -6.624 15.223 674 1HH2 ARG 86 1HH2 ARG 86 2.977 -3.671 14.978 675 2HH2 ARG 86 2HH2 ARG 86 2.942 -5.277 15.625 676 H MET 87 H MET 87 -3.944 -2.732 9.213 677 HA MET 87 HA MET 87 -6.698 -2.177 10.272 678 1HB MET 87 1HB MET 87 -5.324 -1.836 7.652 679 2HB MET 87 2HB MET 87 -6.993 -2.399 7.579 680 1HG MET 87 1HG MET 87 -7.607 -0.486 9.118 681 2HG MET 87 2HG MET 87 -5.964 0.121 8.910 682 1HE MET 87 1HE MET 87 -8.098 -1.516 5.620 683 2HE MET 87 2HE MET 87 -9.374 -0.378 6.051 684 3HE MET 87 3HE MET 87 -8.750 -1.501 7.259 685 H ARG 88 H ARG 88 -7.859 -4.011 10.682 686 HA ARG 88 HA ARG 88 -6.960 -6.580 9.449 687 1HB ARG 88 1HB ARG 88 -8.681 -5.857 11.848 688 2HB ARG 88 2HB ARG 88 -8.379 -7.515 11.327 689 1HG ARG 88 1HG ARG 88 -6.058 -7.354 11.794 690 2HG ARG 88 2HG ARG 88 -6.116 -5.594 11.883 691 1HD ARG 88 1HD ARG 88 -6.122 -6.111 14.158 692 2HD ARG 88 2HD ARG 88 -7.868 -6.138 13.846 693 HE ARG 88 HE ARG 88 -6.566 -8.687 13.265 694 1HH1 ARG 88 1HH1 ARG 88 -7.996 -6.697 15.738 695 2HH1 ARG 88 2HH1 ARG 88 -8.396 -8.044 16.745 696 1HH2 ARG 88 1HH2 ARG 88 -7.097 -10.420 14.590 697 2HH2 ARG 88 2HH2 ARG 88 -7.892 -10.137 16.102 698 H ILE 89 H ILE 89 -8.776 -8.086 8.801 699 HA ILE 89 HA ILE 89 -11.241 -6.622 7.939 700 HB ILE 89 HB ILE 89 -9.454 -8.443 6.285 701 1HG1 ILE 89 1HG1 ILE 89 -10.086 -5.500 5.922 702 2HG1 ILE 89 2HG1 ILE 89 -8.628 -6.096 6.714 703 1HG2 ILE 89 1HG2 ILE 89 -11.418 -6.960 4.789 704 2HG2 ILE 89 2HG2 ILE 89 -12.224 -7.895 6.050 705 3HG2 ILE 89 3HG2 ILE 89 -11.188 -8.706 4.875 706 1HD1 ILE 89 1HD1 ILE 89 -9.157 -7.370 4.118 707 2HD1 ILE 89 2HD1 ILE 89 -7.661 -6.682 4.751 708 3HD1 ILE 89 3HD1 ILE 89 -8.869 -5.633 4.009 709 H PHE 90 H PHE 90 -13.033 -7.764 8.554 710 HA PHE 90 HA PHE 90 -12.729 -10.714 9.027 711 1HB PHE 90 1HB PHE 90 -14.134 -8.478 10.497 712 2HB PHE 90 2HB PHE 90 -14.636 -10.152 10.728 713 HD1 PHE 90 HD1 PHE 90 -13.091 -11.809 11.711 714 HD2 PHE 90 HD2 PHE 90 -12.003 -7.673 11.317 715 HE1 PHE 90 HE1 PHE 90 -11.211 -12.154 13.290 716 HE2 PHE 90 HE2 PHE 90 -10.122 -8.017 12.896 717 HZ PHE 90 HZ PHE 90 -9.726 -10.258 13.883 718 H THR 91 H THR 91 -14.928 -11.848 8.931 719 HA THR 91 HA THR 91 -16.507 -10.766 6.627 720 HB THR 91 HB THR 91 -17.141 -13.216 6.418 721 HG1 THR 91 HG1 THR 91 -16.758 -13.837 8.538 722 1HG2 THR 91 1HG2 THR 91 -14.519 -11.985 6.019 723 2HG2 THR 91 2HG2 THR 91 -15.452 -13.014 4.931 724 3HG2 THR 91 3HG2 THR 91 -14.423 -13.740 6.167 725 H ILE 92 H ILE 92 -18.269 -9.682 7.493 726 HA ILE 92 HA ILE 92 -19.446 -10.219 10.036 727 HB ILE 92 HB ILE 92 -21.289 -8.792 9.088 728 1HG1 ILE 92 1HG1 ILE 92 -19.822 -8.327 6.579 729 2HG1 ILE 92 2HG1 ILE 92 -20.569 -9.921 6.686 730 1HG2 ILE 92 1HG2 ILE 92 -19.510 -6.976 8.204 731 2HG2 ILE 92 2HG2 ILE 92 -18.391 -8.121 8.945 732 3HG2 ILE 92 3HG2 ILE 92 -19.669 -7.385 9.913 733 1HD1 ILE 92 1HD1 ILE 92 -22.562 -8.985 6.210 734 2HD1 ILE 92 2HD1 ILE 92 -21.828 -7.382 6.196 735 3HD1 ILE 92 3HD1 ILE 92 -22.454 -8.051 7.703 736 H LYS 93 H LYS 93 -19.908 -11.744 6.908 737 HA LYS 93 HA LYS 93 -21.779 -13.669 8.176 738 1HB LYS 93 1HB LYS 93 -22.431 -12.188 5.603 739 2HB LYS 93 2HB LYS 93 -23.482 -13.306 6.470 740 1HG LYS 93 1HG LYS 93 -23.366 -11.706 8.441 741 2HG LYS 93 2HG LYS 93 -22.575 -10.561 7.355 742 1HD LYS 93 1HD LYS 93 -24.623 -11.061 5.787 743 2HD LYS 93 2HD LYS 93 -25.392 -11.612 7.276 744 1HE LYS 93 1HE LYS 93 -24.314 -9.239 8.112 745 2HE LYS 93 2HE LYS 93 -24.706 -8.861 6.424 746 1HZ LYS 93 1HZ LYS 93 -26.922 -9.609 6.731 747 2HZ LYS 93 2HZ LYS 93 -26.592 -8.584 8.045 748 3HZ LYS 93 3HZ LYS 93 -26.573 -10.268 8.257 749 HA PRO 94 HA PRO 94 -19.238 -16.654 6.073 750 1HB PRO 94 1HB PRO 94 -21.843 -17.902 5.376 751 2HB PRO 94 2HB PRO 94 -20.460 -18.589 6.238 752 1HG PRO 94 1HG PRO 94 -22.828 -17.495 7.352 753 2HG PRO 94 2HG PRO 94 -21.410 -18.116 8.194 754 1HD PRO 94 1HD PRO 94 -22.216 -15.509 8.267 755 2HD PRO 94 2HD PRO 94 -20.585 -16.066 8.582 756 H ILE 95 H ILE 95 -18.624 -17.056 3.924 757 HA ILE 95 HA ILE 95 -20.355 -15.830 1.802 758 HB ILE 95 HB ILE 95 -17.345 -15.766 2.227 759 1HG1 ILE 95 1HG1 ILE 95 -19.178 -13.391 1.992 760 2HG1 ILE 95 2HG1 ILE 95 -19.035 -14.239 3.532 761 1HG2 ILE 95 1HG2 ILE 95 -17.144 -15.381 0.017 762 2HG2 ILE 95 2HG2 ILE 95 -18.194 -13.974 0.185 763 3HG2 ILE 95 3HG2 ILE 95 -18.887 -15.552 -0.189 764 1HD1 ILE 95 1HD1 ILE 95 -16.684 -13.815 3.652 765 2HD1 ILE 95 2HD1 ILE 95 -17.430 -12.284 3.192 766 3HD1 ILE 95 3HD1 ILE 95 -16.628 -13.276 1.973 767 H ALA 96 H ALA 96 -20.316 -16.900 -0.228 768 HA ALA 96 HA ALA 96 -19.546 -19.746 -0.122 769 1HB ALA 96 1HB ALA 96 -20.775 -18.224 -2.431 770 2HB ALA 96 2HB ALA 96 -21.731 -18.654 -1.013 771 3HB ALA 96 3HB ALA 96 -20.998 -19.919 -1.999 772 H ILE 97 H ILE 97 -18.259 -20.707 -1.859 773 HA ILE 97 HA ILE 97 -15.783 -19.468 -2.333 774 HB ILE 97 HB ILE 97 -17.312 -21.639 -3.813 775 1HG1 ILE 97 1HG1 ILE 97 -15.167 -22.662 -2.290 776 2HG1 ILE 97 2HG1 ILE 97 -15.964 -21.472 -1.261 777 1HG2 ILE 97 1HG2 ILE 97 -14.497 -22.033 -3.969 778 2HG2 ILE 97 2HG2 ILE 97 -14.823 -20.383 -4.499 779 3HG2 ILE 97 3HG2 ILE 97 -15.622 -21.738 -5.295 780 1HD1 ILE 97 1HD1 ILE 97 -16.888 -24.106 -2.078 781 2HD1 ILE 97 2HD1 ILE 97 -18.062 -22.859 -2.497 782 3HD1 ILE 97 3HD1 ILE 97 -17.526 -23.040 -0.827 783 H GLY 98 H GLY 98 -18.773 -19.039 -4.075 784 1HA GLY 98 1HA GLY 98 -17.271 -17.625 -6.238 785 2HA GLY 98 2HA GLY 98 -18.887 -18.303 -6.438 786 H GLU 99 H GLU 99 -17.268 -16.023 -4.165 787 HA GLU 99 HA GLU 99 -19.610 -14.189 -4.621 788 1HB GLU 99 1HB GLU 99 -18.186 -14.993 -2.069 789 2HB GLU 99 2HB GLU 99 -19.380 -13.699 -2.151 790 1HG GLU 99 1HG GLU 99 -20.590 -15.861 -3.455 791 2HG GLU 99 2HG GLU 99 -19.788 -16.578 -2.058 792 H GLU 100 H GLU 100 -19.026 -11.922 -3.654 793 HA GLU 100 HA GLU 100 -16.180 -11.271 -4.354 794 1HB GLU 100 1HB GLU 100 -18.164 -10.583 -5.906 795 2HB GLU 100 2HB GLU 100 -18.546 -9.408 -4.648 796 1HG GLU 100 1HG GLU 100 -15.878 -8.975 -4.904 797 2HG GLU 100 2HG GLU 100 -16.266 -9.473 -6.550 798 H ILE 101 H ILE 101 -15.095 -10.449 -2.614 799 HA ILE 101 HA ILE 101 -16.593 -9.622 -0.213 800 HB ILE 101 HB ILE 101 -13.650 -9.943 -0.900 801 1HG1 ILE 101 1HG1 ILE 101 -15.258 -11.653 0.979 802 2HG1 ILE 101 2HG1 ILE 101 -15.322 -11.948 -0.758 803 1HG2 ILE 101 1HG2 ILE 101 -14.105 -8.281 0.943 804 2HG2 ILE 101 2HG2 ILE 101 -13.188 -9.695 1.463 805 3HG2 ILE 101 3HG2 ILE 101 -14.908 -9.575 1.833 806 1HD1 ILE 101 1HD1 ILE 101 -12.867 -12.164 -0.818 807 2HD1 ILE 101 2HD1 ILE 101 -13.566 -13.320 0.317 808 3HD1 ILE 101 3HD1 ILE 101 -12.794 -11.852 0.917 809 H THR 102 H THR 102 -16.754 -7.539 0.515 810 HA THR 102 HA THR 102 -15.060 -5.379 -0.530 811 HB THR 102 HB THR 102 -17.505 -4.295 -1.110 812 HG1 THR 102 HG1 THR 102 -18.637 -5.920 -2.257 813 1HG2 THR 102 1HG2 THR 102 -16.237 -4.003 -2.944 814 2HG2 THR 102 2HG2 THR 102 -16.762 -5.599 -3.478 815 3HG2 THR 102 3HG2 THR 102 -15.262 -5.422 -2.567 816 H ILE 103 H ILE 103 -16.118 -3.187 0.382 817 HA ILE 103 HA ILE 103 -17.474 -3.674 2.986 818 HB ILE 103 HB ILE 103 -15.692 -2.405 4.142 819 1HG1 ILE 103 1HG1 ILE 103 -13.580 -2.386 2.316 820 2HG1 ILE 103 2HG1 ILE 103 -14.959 -1.802 1.385 821 1HG2 ILE 103 1HG2 ILE 103 -14.446 -4.576 2.435 822 2HG2 ILE 103 2HG2 ILE 103 -15.529 -4.913 3.786 823 3HG2 ILE 103 3HG2 ILE 103 -13.987 -4.104 4.072 824 1HD1 ILE 103 1HD1 ILE 103 -13.594 -0.577 3.730 825 2HD1 ILE 103 2HD1 ILE 103 -15.348 -0.403 3.657 826 3HD1 ILE 103 3HD1 ILE 103 -14.347 0.198 2.336 827 H SER 104 H SER 104 -18.943 -2.053 3.394 828 HA SER 104 HA SER 104 -19.546 -0.043 1.467 829 1HB SER 104 1HB SER 104 -21.108 -0.986 3.143 830 2HB SER 104 2HB SER 104 -20.176 -0.234 4.438 831 HG SER 104 HG SER 104 -22.141 0.877 3.455 832 H TYR 105 H TYR 105 -19.845 2.351 2.808 833 HA TYR 105 HA TYR 105 -17.027 3.102 3.512 834 1HB TYR 105 1HB TYR 105 -19.136 4.646 1.956 835 2HB TYR 105 2HB TYR 105 -17.500 5.207 2.294 836 HD1 TYR 105 HD1 TYR 105 -19.247 4.253 -0.348 837 HD2 TYR 105 HD2 TYR 105 -15.879 2.803 1.887 838 HE1 TYR 105 HE1 TYR 105 -18.431 3.053 -2.358 839 HE2 TYR 105 HE2 TYR 105 -15.061 1.603 -0.124 840 HH TYR 105 HH TYR 105 -16.128 0.659 -2.260 841 H GLY 106 H GLY 106 -20.093 4.957 3.566 842 1HA GLY 106 1HA GLY 106 -20.488 4.810 6.395 843 2HA GLY 106 2HA GLY 106 -19.537 6.248 6.023 844 H ASP 107 H ASP 107 -21.690 7.132 7.013 845 HA ASP 107 HA ASP 107 -24.042 7.142 5.298 846 1HB ASP 107 1HB ASP 107 -24.807 8.794 6.995 847 2HB ASP 107 2HB ASP 107 -24.085 7.379 7.761 848 H ASP 108 H ASP 108 -21.071 8.874 5.245 849 HA ASP 108 HA ASP 108 -22.314 11.136 3.735 850 1HB ASP 108 1HB ASP 108 -20.360 10.907 5.772 851 2HB ASP 108 2HB ASP 108 -19.482 11.375 4.315 852 H TYR 109 H TYR 109 -19.353 9.099 3.611 853 HA TYR 109 HA TYR 109 -18.533 9.750 1.001 854 1HB TYR 109 1HB TYR 109 -17.621 8.196 2.978 855 2HB TYR 109 2HB TYR 109 -18.343 6.927 1.989 856 HD1 TYR 109 HD1 TYR 109 -16.855 5.885 0.542 857 HD2 TYR 109 HD2 TYR 109 -16.382 10.075 1.357 858 HE1 TYR 109 HE1 TYR 109 -14.906 5.961 -0.988 859 HE2 TYR 109 HE2 TYR 109 -14.432 10.152 -0.174 860 HH TYR 109 HH TYR 109 -12.669 8.239 -1.000 861 H TRP 110 H TRP 110 -20.252 9.870 -0.498 862 HA TRP 110 HA TRP 110 -21.785 9.061 -2.090 863 1HB TRP 110 1HB TRP 110 -19.851 6.840 -1.491 864 2HB TRP 110 2HB TRP 110 -21.200 6.520 -2.582 865 HD1 TRP 110 HD1 TRP 110 -18.595 9.363 -2.158 866 HE1 TRP 110 HE1 TRP 110 -17.780 10.052 -4.505 867 HE3 TRP 110 HE3 TRP 110 -21.397 6.202 -5.028 868 HZ2 TRP 110 HZ2 TRP 110 -18.254 9.354 -7.238 869 HZ3 TRP 110 HZ3 TRP 110 -21.196 6.235 -7.498 870 HH2 TRP 110 HH2 TRP 110 -19.629 7.806 -8.606 871 H LEU 111 H LEU 111 -21.580 5.921 -0.463 872 HA LEU 111 HA LEU 111 -24.329 5.415 -0.379 873 1HB LEU 111 1HB LEU 111 -22.451 3.831 0.077 874 2HB LEU 111 2HB LEU 111 -22.206 4.608 1.641 875 HG LEU 111 HG LEU 111 -24.935 3.589 0.907 876 1HD1 LEU 111 1HD1 LEU 111 -22.510 1.979 1.350 877 2HD1 LEU 111 2HD1 LEU 111 -24.065 1.504 0.668 878 3HD1 LEU 111 3HD1 LEU 111 -23.850 1.560 2.418 879 1HD2 LEU 111 1HD2 LEU 111 -23.669 4.774 3.168 880 2HD2 LEU 111 2HD2 LEU 111 -24.086 3.116 3.603 881 3HD2 LEU 111 3HD2 LEU 111 -25.336 4.219 3.027 882 H SER 112 H SER 112 -25.925 5.638 1.269 883 HA SER 112 HA SER 112 -25.391 7.070 3.751 884 1HB SER 112 1HB SER 112 -26.772 9.065 3.039 885 2HB SER 112 2HB SER 112 -25.252 8.917 2.157 886 HG SER 112 HG SER 112 -27.647 9.049 1.144 887 H ARG 113 H ARG 113 -28.089 6.750 1.407 888 HA ARG 113 HA ARG 113 -29.654 5.380 3.553 889 1HB ARG 113 1HB ARG 113 -30.337 7.575 1.593 890 2HB ARG 113 2HB ARG 113 -31.607 6.578 2.304 891 1HG ARG 113 1HG ARG 113 -31.489 7.714 4.245 892 2HG ARG 113 2HG ARG 113 -29.750 7.452 4.346 893 1HD ARG 113 1HD ARG 113 -29.775 9.342 2.418 894 2HD ARG 113 2HD ARG 113 -31.250 9.802 3.291 895 HE ARG 113 HE ARG 113 -28.527 9.979 4.326 896 1HH1 ARG 113 1HH1 ARG 113 -31.873 9.478 5.148 897 2HH1 ARG 113 2HH1 ARG 113 -31.671 10.032 6.774 898 1HH2 ARG 113 1HH2 ARG 113 -28.290 10.693 6.441 899 2HH2 ARG 113 2HH2 ARG 113 -29.658 10.715 7.503 900 HA PRO 114 HA PRO 114 -30.085 2.061 0.688 901 1HB PRO 114 1HB PRO 114 -32.888 1.823 1.673 902 2HB PRO 114 2HB PRO 114 -31.591 0.615 1.675 903 1HG PRO 114 1HG PRO 114 -32.397 1.855 3.913 904 2HG PRO 114 2HG PRO 114 -30.716 1.367 3.653 905 1HD PRO 114 1HD PRO 114 -31.941 4.073 3.540 906 2HD PRO 114 2HD PRO 114 -30.305 3.587 4.031 907 H ARG 115 H ARG 115 -30.120 3.385 -1.241 908 HA ARG 115 HA ARG 115 -32.880 3.854 -2.315 909 1HB ARG 115 1HB ARG 115 -30.456 5.629 -2.123 910 2HB ARG 115 2HB ARG 115 -31.573 5.853 -3.470 911 1HG ARG 115 1HG ARG 115 -33.420 6.240 -1.966 912 2HG ARG 115 2HG ARG 115 -32.447 5.777 -0.570 913 1HD ARG 115 1HD ARG 115 -31.433 7.827 -0.455 914 2HD ARG 115 2HD ARG 115 -31.301 7.961 -2.218 915 HE ARG 115 HE ARG 115 -34.066 8.071 -1.398 916 1HH1 ARG 115 1HH1 ARG 115 -31.129 9.937 -1.505 917 2HH1 ARG 115 2HH1 ARG 115 -31.964 11.451 -1.570 918 1HH2 ARG 115 1HH2 ARG 115 -35.126 10.049 -1.482 919 2HH2 ARG 115 2HH2 ARG 115 -34.209 11.516 -1.557 920 H LEU 116 H LEU 116 -31.726 1.500 -2.969 921 HA LEU 116 HA LEU 116 -30.309 1.925 -5.571 922 1HB LEU 116 1HB LEU 116 -30.286 -0.058 -3.370 923 2HB LEU 116 2HB LEU 116 -30.190 -0.758 -4.986 924 HG LEU 116 HG LEU 116 -28.371 1.046 -5.421 925 1HD1 LEU 116 1HD1 LEU 116 -27.310 2.020 -3.556 926 2HD1 LEU 116 2HD1 LEU 116 -28.046 0.880 -2.429 927 3HD1 LEU 116 3HD1 LEU 116 -29.023 2.155 -3.158 928 1HD2 LEU 116 1HD2 LEU 116 -27.452 -1.060 -5.413 929 2HD2 LEU 116 2HD2 LEU 116 -28.204 -1.494 -3.878 930 3HD2 LEU 116 3HD2 LEU 116 -26.757 -0.486 -3.896 931 H THR 117 H THR 117 -31.495 1.585 -7.404 932 HA THR 117 HA THR 117 -33.957 -0.119 -7.194 933 HB THR 117 HB THR 117 -33.355 2.359 -8.852 934 HG1 THR 117 HG1 THR 117 -33.812 2.859 -6.732 935 1HG2 THR 117 1HG2 THR 117 -34.826 1.173 -10.218 936 2HG2 THR 117 2HG2 THR 117 -35.952 2.082 -9.211 937 3HG2 THR 117 3HG2 THR 117 -35.619 0.387 -8.853 938 H GLN 118 H GLN 118 -34.278 -1.616 -8.875 939 HA GLN 118 HA GLN 118 -33.622 -3.077 -10.612 940 1HB GLN 118 1HB GLN 118 -33.382 -0.304 -11.404 941 2HB GLN 118 2HB GLN 118 -32.156 -1.264 -12.235 942 1HG GLN 118 1HG GLN 118 -34.110 -1.347 -13.617 943 2HG GLN 118 2HG GLN 118 -34.020 -2.910 -12.805 944 1HE2 GLN 118 1HE2 GLN 118 -36.359 -0.993 -13.763 945 2HE2 GLN 118 2HE2 GLN 118 -37.415 -1.017 -12.434 946 H ASN 119 H ASN 119 -31.493 -3.613 -12.015 947 HA ASN 119 HA ASN 119 -28.992 -3.067 -10.533 948 1HB ASN 119 1HB ASN 119 -30.658 -5.267 -9.945 949 2HB ASN 119 2HB ASN 119 -29.336 -5.933 -10.904 950 1HD2 ASN 119 1HD2 ASN 119 -27.347 -6.230 -9.839 951 2HD2 ASN 119 2HD2 ASN 119 -26.993 -5.633 -8.289 952 1H GLY 201 1H GLY 201 -22.004 17.099 -19.661 953 2H GLY 201 2H GLY 201 -22.116 18.778 -19.891 954 3H GLY 201 3H GLY 201 -23.395 17.768 -20.370 955 1HA GLY 201 1HA GLY 201 -23.462 17.081 -17.899 956 2HA GLY 201 2HA GLY 201 -22.590 18.595 -17.662 957 H LYS 202 H LYS 202 -24.865 18.804 -16.466 958 HA LYS 202 HA LYS 202 -27.068 19.588 -18.264 959 1HB LYS 202 1HB LYS 202 -26.934 18.440 -15.820 960 2HB LYS 202 2HB LYS 202 -27.074 20.127 -15.325 961 1HG LYS 202 1HG LYS 202 -28.967 19.911 -17.337 962 2HG LYS 202 2HG LYS 202 -29.091 18.359 -16.509 963 1HD LYS 202 1HD LYS 202 -28.861 20.709 -14.728 964 2HD LYS 202 2HD LYS 202 -30.349 20.632 -15.671 965 1HE LYS 202 1HE LYS 202 -30.982 18.559 -14.719 966 2HE LYS 202 2HE LYS 202 -29.334 18.213 -14.163 967 1HZ LYS 202 1HZ LYS 202 -30.603 19.022 -12.309 968 2HZ LYS 202 2HZ LYS 202 -31.138 20.370 -13.192 969 3HZ LYS 202 3HZ LYS 202 -29.502 20.235 -12.758 970 H ALA 203 H ALA 203 -25.095 21.200 -15.735 971 HA ALA 203 HA ALA 203 -25.604 23.794 -17.156 972 1HB ALA 203 1HB ALA 203 -25.091 24.247 -14.403 973 2HB ALA 203 2HB ALA 203 -26.201 22.878 -14.472 974 3HB ALA 203 3HB ALA 203 -26.639 24.408 -15.234 975 HA PRO 204 HA PRO 204 -21.260 24.412 -17.134 976 1HB PRO 204 1HB PRO 204 -21.018 27.065 -16.397 977 2HB PRO 204 2HB PRO 204 -21.523 26.535 -18.011 978 1HG PRO 204 1HG PRO 204 -23.163 27.519 -15.735 979 2HG PRO 204 2HG PRO 204 -23.368 27.786 -17.471 980 1HD PRO 204 1HD PRO 204 -24.858 26.015 -16.027 981 2HD PRO 204 2HD PRO 204 -24.520 25.828 -17.761 982 H ARG 205 H ARG 205 -20.613 23.101 -15.344 983 HA ARG 205 HA ARG 205 -20.700 24.246 -12.617 984 1HB ARG 205 1HB ARG 205 -21.090 21.775 -13.536 985 2HB ARG 205 2HB ARG 205 -19.336 21.679 -13.378 986 1HG ARG 205 1HG ARG 205 -19.565 21.353 -11.164 987 2HG ARG 205 2HG ARG 205 -20.345 22.928 -11.021 988 1HD ARG 205 1HD ARG 205 -22.495 21.718 -11.829 989 2HD ARG 205 2HD ARG 205 -21.635 20.223 -11.415 990 HE ARG 205 HE ARG 205 -21.826 20.819 -9.131 991 1HH1 ARG 205 1HH1 ARG 205 -22.378 23.577 -11.183 992 2HH1 ARG 205 2HH1 ARG 205 -22.831 24.603 -9.867 993 1HH2 ARG 205 1HH2 ARG 205 -22.418 22.170 -7.440 994 2HH2 ARG 205 2HH2 ARG 205 -22.854 23.815 -7.763 995 H LYS 206 H LYS 206 -19.063 25.637 -12.079 996 HA LYS 206 HA LYS 206 -16.422 25.404 -13.410 997 1HB LYS 206 1HB LYS 206 -16.073 27.596 -12.285 998 2HB LYS 206 2HB LYS 206 -17.587 27.580 -13.189 999 1HG LYS 206 1HG LYS 206 -18.129 26.569 -10.576 1000 2HG LYS 206 2HG LYS 206 -17.198 28.055 -10.391 1001 1HD LYS 206 1HD LYS 206 -19.603 27.841 -12.217 1002 2HD LYS 206 2HD LYS 206 -19.721 28.362 -10.536 1003 1HE LYS 206 1HE LYS 206 -18.686 30.386 -10.956 1004 2HE LYS 206 2HE LYS 206 -17.667 29.713 -12.243 1005 1HZ LYS 206 1HZ LYS 206 -19.363 31.034 -13.265 1006 2HZ LYS 206 2HZ LYS 206 -20.586 30.276 -12.363 1007 3HZ LYS 206 3HZ LYS 206 -19.745 29.405 -13.554 1008 H GLN 207 H GLN 207 -16.977 23.233 -11.677 1009 HA GLN 207 HA GLN 207 -16.067 22.075 -9.829 1010 1HB GLN 207 1HB GLN 207 -14.062 22.759 -11.184 1011 2HB GLN 207 2HB GLN 207 -13.940 24.217 -10.198 1012 1HG GLN 207 1HG GLN 207 -13.041 23.089 -8.442 1013 2HG GLN 207 2HG GLN 207 -14.154 21.735 -8.630 1014 1HE2 GLN 207 1HE2 GLN 207 -11.373 23.186 -10.435 1015 2HE2 GLN 207 2HE2 GLN 207 -10.684 21.693 -10.856 1016 H LEU 208 H LEU 208 -17.753 22.833 -8.345 1017 HA LEU 208 HA LEU 208 -16.818 25.007 -6.498 1018 1HB LEU 208 1HB LEU 208 -19.245 24.558 -7.988 1019 2HB LEU 208 2HB LEU 208 -19.618 24.514 -6.265 1020 HG LEU 208 HG LEU 208 -19.768 26.818 -7.152 1021 1HD1 LEU 208 1HD1 LEU 208 -18.490 25.985 -4.857 1022 2HD1 LEU 208 2HD1 LEU 208 -18.920 27.656 -5.220 1023 3HD1 LEU 208 3HD1 LEU 208 -17.297 27.066 -5.576 1024 1HD2 LEU 208 1HD2 LEU 208 -18.213 27.680 -8.547 1025 2HD2 LEU 208 2HD2 LEU 208 -17.545 26.051 -8.652 1026 3HD2 LEU 208 3HD2 LEU 208 -16.892 27.198 -7.482 1027 H ALA 209 H ALA 209 -16.142 22.143 -6.291 1028 HA ALA 209 HA ALA 209 -17.583 21.508 -3.735 1029 1HB ALA 209 1HB ALA 209 -16.427 19.593 -5.795 1030 2HB ALA 209 2HB ALA 209 -18.124 20.069 -5.738 1031 3HB ALA 209 3HB ALA 209 -17.417 19.163 -4.400 1032 H THR 210 H THR 210 -16.085 22.001 -2.154 1033 HA THR 210 HA THR 210 -13.254 21.109 -2.593 1034 HB THR 210 HB THR 210 -13.625 23.546 -2.384 1035 HG1 THR 210 HG1 THR 210 -11.841 23.532 -1.316 1036 1HG2 THR 210 1HG2 THR 210 -15.377 24.170 -1.097 1037 2HG2 THR 210 2HG2 THR 210 -14.314 23.918 0.288 1038 3HG2 THR 210 3HG2 THR 210 -15.390 22.626 -0.244 1039 H LYS 211 H LYS 211 -15.707 19.651 -1.402 1040 HA LYS 211 HA LYS 211 -14.270 18.417 0.819 1041 1HB LYS 211 1HB LYS 211 -15.970 19.107 2.519 1042 2HB LYS 211 2HB LYS 211 -15.098 20.490 1.858 1043 1HG LYS 211 1HG LYS 211 -17.112 20.438 0.099 1044 2HG LYS 211 2HG LYS 211 -17.940 19.663 1.450 1045 1HD LYS 211 1HD LYS 211 -17.501 21.542 2.893 1046 2HD LYS 211 2HD LYS 211 -16.421 22.272 1.706 1047 1HE LYS 211 1HE LYS 211 -18.750 21.948 0.250 1048 2HE LYS 211 2HE LYS 211 -19.357 22.374 1.861 1049 1HZ LYS 211 1HZ LYS 211 -18.863 24.420 0.852 1050 2HZ LYS 211 2HZ LYS 211 -17.414 23.847 0.175 1051 3HZ LYS 211 3HZ LYS 211 -17.522 24.117 1.849 1052 H ALA 212 H ALA 212 -14.707 16.401 -0.127 1053 HA ALA 212 HA ALA 212 -17.593 15.694 -0.529 1054 1HB ALA 212 1HB ALA 212 -14.973 14.897 -1.786 1055 2HB ALA 212 2HB ALA 212 -16.465 15.412 -2.573 1056 3HB ALA 212 3HB ALA 212 -16.347 13.794 -1.880 1057 H ALA 213 H ALA 213 -15.820 15.602 1.997 1058 HA ALA 213 HA ALA 213 -15.496 14.127 3.813 1059 1HB ALA 213 1HB ALA 213 -17.421 12.137 3.114 1060 2HB ALA 213 2HB ALA 213 -18.029 13.681 2.517 1061 3HB ALA 213 3HB ALA 213 -17.631 13.491 4.224 1062 H ARG 214 H ARG 214 -15.185 11.625 4.275 1063 HA ARG 214 HA ARG 214 -13.810 10.356 1.931 1064 1HB ARG 214 1HB ARG 214 -12.902 10.882 4.767 1065 2HB ARG 214 2HB ARG 214 -12.158 9.606 3.803 1066 1HG ARG 214 1HG ARG 214 -11.159 11.094 2.358 1067 2HG ARG 214 2HG ARG 214 -12.449 12.285 2.523 1068 1HD ARG 214 1HD ARG 214 -11.472 12.329 5.054 1069 2HD ARG 214 2HD ARG 214 -9.993 11.917 4.163 1070 HE ARG 214 HE ARG 214 -11.546 14.044 2.894 1071 1HH1 ARG 214 1HH1 ARG 214 -9.141 13.280 5.293 1072 2HH1 ARG 214 2HH1 ARG 214 -8.434 14.857 5.244 1073 1HH2 ARG 214 1HH2 ARG 214 -10.609 16.084 2.849 1074 2HH2 ARG 214 2HH2 ARG 214 -9.257 16.434 3.873 1075 1HN MLZ 215 1HN MLZ 215 -13.093 7.971 2.995 1076 HA MLZ 215 HA MLZ 215 -15.555 6.509 3.185 1077 1HB MLZ 215 1HB MLZ 215 -12.743 5.736 4.045 1078 2HB MLZ 215 2HB MLZ 215 -14.037 4.624 3.601 1079 1HG MLZ 215 1HG MLZ 215 -12.157 5.972 1.885 1080 2HG MLZ 215 2HG MLZ 215 -13.794 6.478 1.468 1081 1HD MLZ 215 1HD MLZ 215 -14.242 3.845 1.743 1082 2HD MLZ 215 2HD MLZ 215 -13.704 4.547 0.217 1083 1HE MLZ 215 1HE MLZ 215 -12.377 2.503 1.063 1084 2HE MLZ 215 2HE MLZ 215 -11.720 3.596 2.296 1085 HZ MLZ 215 HZ MLZ 215 -10.271 3.868 0.509 1086 1HCM MLZ 215 1HCM MLZ 215 -11.047 2.741 -1.282 1087 2HCM MLZ 215 2HCM MLZ 215 -11.399 4.386 -1.798 1088 3HCM MLZ 215 3HCM MLZ 215 -12.671 3.394 -1.095 1089 H SER 216 H SER 216 -16.870 6.293 4.943 1090 HA SER 216 HA SER 216 -17.582 6.207 7.192 1091 1HB SER 216 1HB SER 216 -15.752 7.918 8.446 1092 2HB SER 216 2HB SER 216 -15.756 8.452 6.765 1093 HG SER 216 HG SER 216 -17.633 8.781 8.659 1094 H ALA 217 H ALA 217 -16.661 5.821 9.528 1095 HA ALA 217 HA ALA 217 -14.289 3.992 9.329 1096 1HB ALA 217 1HB ALA 217 -14.088 6.215 10.589 1097 2HB ALA 217 2HB ALA 217 -13.674 4.778 11.523 1098 3HB ALA 217 3HB ALA 217 -15.240 5.556 11.750 1099 HA PRO 218 HA PRO 218 -16.944 0.844 10.876 1100 1HB PRO 218 1HB PRO 218 -15.137 -0.720 12.239 1101 2HB PRO 218 2HB PRO 218 -15.247 -0.679 10.470 1102 1HG PRO 218 1HG PRO 218 -13.315 0.670 12.286 1103 2HG PRO 218 2HG PRO 218 -13.047 -0.063 10.699 1104 1HD PRO 218 1HD PRO 218 -13.271 2.630 11.117 1105 2HD PRO 218 2HD PRO 218 -13.675 1.832 9.583 1106 H ALA 219 H ALA 219 -15.461 3.087 12.925 1107 HA ALA 219 HA ALA 219 -15.862 3.707 15.165 1108 1HB ALA 219 1HB ALA 219 -18.273 1.890 14.860 1109 2HB ALA 219 2HB ALA 219 -18.189 3.484 14.111 1110 3HB ALA 219 3HB ALA 219 -18.135 3.331 15.867 1111 H THR 220 H THR 220 -16.205 2.694 17.426 1112 HA THR 220 HA THR 220 -14.715 0.115 17.509 1113 HB THR 220 HB THR 220 -14.650 0.928 20.018 1114 HG1 THR 220 HG1 THR 220 -15.906 2.608 20.192 1115 1HG2 THR 220 1HG2 THR 220 -13.275 2.440 17.774 1116 2HG2 THR 220 2HG2 THR 220 -12.708 0.944 18.516 1117 3HG2 THR 220 3HG2 THR 220 -12.753 2.433 19.459 1118 H GLY 221 H GLY 221 -15.426 -1.009 19.826 1119 1HA GLY 221 1HA GLY 221 -17.679 -1.291 21.093 1120 2HA GLY 221 2HA GLY 221 -18.338 -1.566 19.480 1121 1H MET 1 1H MET 1 0.894 -12.721 7.853 1122 2H MET 1 2H MET 1 0.086 -12.221 6.444 1123 3H MET 1 3H MET 1 -0.051 -11.310 7.871 1124 HA MET 1 HA MET 1 1.496 -10.327 6.195 1125 1HB MET 1 1HB MET 1 1.533 -10.595 8.972 1126 2HB MET 1 2HB MET 1 3.196 -10.948 8.504 1127 1HG MET 1 1HG MET 1 2.975 -8.552 8.871 1128 2HG MET 1 2HG MET 1 3.200 -8.845 7.148 1129 1HE MET 1 1HE MET 1 1.837 -6.979 5.734 1130 2HE MET 1 2HE MET 1 2.580 -6.423 7.233 1131 3HE MET 1 3HE MET 1 0.952 -5.895 6.807 1132 H PHE 2 H PHE 2 1.506 -13.301 5.644 1133 HA PHE 2 HA PHE 2 4.448 -13.564 5.120 1134 1HB PHE 2 1HB PHE 2 4.067 -16.025 5.530 1135 2HB PHE 2 2HB PHE 2 3.779 -15.029 6.956 1136 HD1 PHE 2 HD1 PHE 2 1.492 -14.573 7.740 1137 HD2 PHE 2 HD2 PHE 2 2.238 -17.123 4.365 1138 HE1 PHE 2 HE1 PHE 2 -0.831 -15.431 7.875 1139 HE2 PHE 2 HE2 PHE 2 -0.086 -17.981 4.500 1140 HZ PHE 2 HZ PHE 2 -1.620 -17.135 6.255 1141 H ASN 3 H ASN 3 4.935 -14.068 3.010 1142 HA ASN 3 HA ASN 3 2.641 -14.665 1.177 1143 1HB ASN 3 1HB ASN 3 5.017 -12.926 1.149 1144 2HB ASN 3 2HB ASN 3 4.814 -13.844 -0.343 1145 1HD2 ASN 3 1HD2 ASN 3 3.219 -11.475 1.794 1146 2HD2 ASN 3 2HD2 ASN 3 2.085 -10.952 0.644 1147 H ASP 4 H ASP 4 3.902 -16.790 2.648 1148 HA ASP 4 HA ASP 4 4.892 -18.899 2.301 1149 1HB ASP 4 1HB ASP 4 3.957 -18.047 -0.456 1150 2HB ASP 4 2HB ASP 4 4.541 -19.674 -0.108 1151 H ARG 5 H ARG 5 5.879 -17.807 -0.917 1152 HA ARG 5 HA ARG 5 8.539 -18.673 -0.728 1153 1HB ARG 5 1HB ARG 5 7.328 -16.347 -2.267 1154 2HB ARG 5 2HB ARG 5 8.864 -17.122 -2.658 1155 1HG ARG 5 1HG ARG 5 7.302 -19.311 -2.572 1156 2HG ARG 5 2HG ARG 5 6.082 -18.124 -3.031 1157 1HD ARG 5 1HD ARG 5 8.721 -18.165 -4.485 1158 2HD ARG 5 2HD ARG 5 7.450 -19.321 -4.928 1159 HE ARG 5 HE ARG 5 6.116 -16.893 -4.735 1160 1HH1 ARG 5 1HH1 ARG 5 8.888 -18.054 -6.491 1161 2HH1 ARG 5 2HH1 ARG 5 8.642 -16.970 -7.815 1162 1HH2 ARG 5 1HH2 ARG 5 5.816 -15.495 -6.465 1163 2HH2 ARG 5 2HH2 ARG 5 6.916 -15.530 -7.803 1164 H VAL 6 H VAL 6 7.172 -15.501 0.141 1165 HA VAL 6 HA VAL 6 9.730 -14.906 1.585 1166 HB VAL 6 HB VAL 6 8.087 -13.104 -0.233 1167 1HG1 VAL 6 1HG1 VAL 6 9.012 -11.934 1.777 1168 2HG1 VAL 6 2HG1 VAL 6 9.727 -11.370 0.267 1169 3HG1 VAL 6 3HG1 VAL 6 10.623 -12.476 1.308 1170 1HG2 VAL 6 1HG2 VAL 6 10.189 -13.047 -1.562 1171 2HG2 VAL 6 2HG2 VAL 6 9.526 -14.677 -1.444 1172 3HG2 VAL 6 3HG2 VAL 6 10.904 -14.210 -0.447 1173 H ILE 7 H ILE 7 9.414 -13.840 3.577 1174 HA ILE 7 HA ILE 7 6.550 -13.365 4.341 1175 HB ILE 7 HB ILE 7 7.688 -15.337 5.372 1176 1HG1 ILE 7 1HG1 ILE 7 7.320 -13.147 7.427 1177 2HG1 ILE 7 2HG1 ILE 7 5.964 -13.902 6.589 1178 1HG2 ILE 7 1HG2 ILE 7 9.809 -15.204 6.118 1179 2HG2 ILE 7 2HG2 ILE 7 9.401 -13.845 7.168 1180 3HG2 ILE 7 3HG2 ILE 7 9.865 -13.556 5.491 1181 1HD1 ILE 7 1HD1 ILE 7 6.151 -15.833 7.778 1182 2HD1 ILE 7 2HD1 ILE 7 7.061 -14.845 8.920 1183 3HD1 ILE 7 3HD1 ILE 7 7.913 -15.810 7.714 1184 H VAL 8 H VAL 8 6.318 -11.704 6.120 1185 HA VAL 8 HA VAL 8 8.181 -9.432 5.614 1186 HB VAL 8 HB VAL 8 5.432 -9.636 6.900 1187 1HG1 VAL 8 1HG1 VAL 8 5.418 -7.299 7.096 1188 2HG1 VAL 8 2HG1 VAL 8 6.726 -7.097 5.932 1189 3HG1 VAL 8 3HG1 VAL 8 7.074 -7.696 7.554 1190 1HG2 VAL 8 1HG2 VAL 8 6.277 -8.552 4.197 1191 2HG2 VAL 8 2HG2 VAL 8 4.629 -8.649 4.816 1192 3HG2 VAL 8 3HG2 VAL 8 5.523 -10.125 4.453 1193 H LYS 9 H LYS 9 9.604 -8.833 7.177 1194 HA LYS 9 HA LYS 9 8.995 -9.448 10.020 1195 1HB LYS 9 1HB LYS 9 11.498 -10.195 8.479 1196 2HB LYS 9 2HB LYS 9 11.324 -10.355 10.226 1197 1HG LYS 9 1HG LYS 9 9.087 -11.651 9.435 1198 2HG LYS 9 2HG LYS 9 10.122 -11.979 8.047 1199 1HD LYS 9 1HD LYS 9 11.912 -12.691 9.726 1200 2HD LYS 9 2HD LYS 9 10.643 -12.649 10.949 1201 1HE LYS 9 1HE LYS 9 9.306 -14.178 9.326 1202 2HE LYS 9 2HE LYS 9 10.872 -14.463 8.543 1203 1HZ LYS 9 1HZ LYS 9 10.261 -14.804 11.438 1204 2HZ LYS 9 2HZ LYS 9 11.794 -15.005 10.736 1205 3HZ LYS 9 3HZ LYS 9 10.527 -16.058 10.323 1206 H LYS 10 H LYS 10 10.743 -6.385 10.775 1207 HA LYS 10 HA LYS 10 9.741 -7.207 12.710 1208 1HB LYS 10 1HB LYS 10 7.985 -7.347 10.511 1209 2HB LYS 10 2HB LYS 10 7.760 -8.861 11.387 1210 1HG LYS 10 1HG LYS 10 7.661 -6.086 12.611 1211 2HG LYS 10 2HG LYS 10 6.260 -7.099 12.257 1212 1HD LYS 10 1HD LYS 10 6.589 -8.387 14.096 1213 2HD LYS 10 2HD LYS 10 8.331 -8.466 13.835 1214 1HE LYS 10 1HE LYS 10 8.032 -7.242 15.885 1215 2HE LYS 10 2HE LYS 10 8.392 -6.016 14.654 1216 1HZ LYS 10 1HZ LYS 10 5.905 -5.956 14.270 1217 2HZ LYS 10 2HZ LYS 10 6.444 -5.274 15.729 1218 3HZ LYS 10 3HZ LYS 10 5.743 -6.821 15.723 1219 H SER 11 H SER 11 11.977 -8.561 12.277 1220 HA SER 11 HA SER 11 11.331 -11.475 12.340 1221 1HB SER 11 1HB SER 11 13.116 -11.510 10.939 1222 2HB SER 11 2HB SER 11 13.323 -9.775 11.147 1223 HG SER 11 HG SER 11 14.981 -10.159 12.342 1224 HA PRO 12 HA PRO 12 12.521 -12.164 16.507 1225 1HB PRO 12 1HB PRO 12 15.098 -13.457 15.751 1226 2HB PRO 12 2HB PRO 12 13.752 -14.109 16.701 1227 1HG PRO 12 1HG PRO 12 14.241 -14.878 14.174 1228 2HG PRO 12 2HG PRO 12 12.608 -14.799 14.846 1229 1HD PRO 12 1HD PRO 12 13.944 -12.997 12.910 1230 2HD PRO 12 2HD PRO 12 12.224 -13.400 13.083 1231 H LEU 13 H LEU 13 14.849 -10.691 14.371 1232 HA LEU 13 HA LEU 13 16.395 -9.576 16.661 1233 1HB LEU 13 1HB LEU 13 16.778 -10.116 13.766 1234 2HB LEU 13 2HB LEU 13 17.561 -8.655 14.366 1235 HG LEU 13 HG LEU 13 19.058 -10.619 14.550 1236 1HD1 LEU 13 1HD1 LEU 13 18.322 -8.805 16.628 1237 2HD1 LEU 13 2HD1 LEU 13 19.886 -9.575 16.363 1238 3HD1 LEU 13 3HD1 LEU 13 18.677 -10.362 17.376 1239 1HD2 LEU 13 1HD2 LEU 13 18.432 -12.596 15.514 1240 2HD2 LEU 13 2HD2 LEU 13 16.808 -12.035 15.115 1241 3HD2 LEU 13 3HD2 LEU 13 17.446 -11.800 16.742 1242 H GLY 14 H GLY 14 14.312 -8.587 13.958 1243 1HA GLY 14 1HA GLY 14 12.851 -6.590 14.545 1244 2HA GLY 14 2HA GLY 14 14.340 -5.810 15.077 1245 H GLY 15 H GLY 15 12.926 -4.477 13.189 1246 1HA GLY 15 1HA GLY 15 13.715 -3.316 11.221 1247 2HA GLY 15 2HA GLY 15 14.681 -4.732 10.806 1248 H TYR 16 H TYR 16 11.932 -3.054 9.973 1249 HA TYR 16 HA TYR 16 10.263 -5.364 9.227 1250 1HB TYR 16 1HB TYR 16 9.996 -2.566 9.707 1251 2HB TYR 16 2HB TYR 16 9.477 -2.857 8.047 1252 HD1 TYR 16 HD1 TYR 16 8.157 -5.312 7.916 1253 HD2 TYR 16 HD2 TYR 16 8.246 -2.588 11.236 1254 HE1 TYR 16 HE1 TYR 16 6.022 -6.260 8.751 1255 HE2 TYR 16 HE2 TYR 16 6.111 -3.535 12.071 1256 HH TYR 16 HH TYR 16 4.083 -5.389 10.237 1257 H GLY 17 H GLY 17 12.374 -6.060 7.903 1258 1HA GLY 17 1HA GLY 17 12.244 -4.846 5.172 1259 2HA GLY 17 2HA GLY 17 13.609 -5.785 5.784 1260 H VAL 18 H VAL 18 13.140 -7.050 3.691 1261 HA VAL 18 HA VAL 18 10.773 -8.845 3.937 1262 HB VAL 18 HB VAL 18 12.860 -8.439 1.763 1263 1HG1 VAL 18 1HG1 VAL 18 11.606 -10.689 1.904 1264 2HG1 VAL 18 2HG1 VAL 18 11.528 -9.822 0.370 1265 3HG1 VAL 18 3HG1 VAL 18 10.163 -9.767 1.485 1266 1HG2 VAL 18 1HG2 VAL 18 11.185 -7.120 0.633 1267 2HG2 VAL 18 2HG2 VAL 18 11.355 -6.480 2.267 1268 3HG2 VAL 18 3HG2 VAL 18 9.981 -7.508 1.861 1269 H PHE 19 H PHE 19 11.045 -10.906 4.728 1270 HA PHE 19 HA PHE 19 13.796 -11.854 5.291 1271 1HB PHE 19 1HB PHE 19 11.194 -12.084 6.443 1272 2HB PHE 19 2HB PHE 19 11.719 -13.708 5.998 1273 HD1 PHE 19 HD1 PHE 19 12.713 -14.845 7.760 1274 HD2 PHE 19 HD2 PHE 19 13.441 -10.636 7.309 1275 HE1 PHE 19 HE1 PHE 19 14.240 -14.900 9.713 1276 HE2 PHE 19 HE2 PHE 19 14.968 -10.691 9.262 1277 HZ PHE 19 HZ PHE 19 15.367 -12.823 10.465 1278 H ALA 20 H ALA 20 14.801 -13.255 3.939 1279 HA ALA 20 HA ALA 20 13.329 -14.383 1.650 1280 1HB ALA 20 1HB ALA 20 15.966 -13.503 2.314 1281 2HB ALA 20 2HB ALA 20 15.373 -14.030 0.738 1282 3HB ALA 20 3HB ALA 20 16.081 -15.201 1.851 1283 H ARG 21 H ARG 21 12.041 -16.036 2.660 1284 HA ARG 21 HA ARG 21 13.155 -18.100 4.368 1285 1HB ARG 21 1HB ARG 21 10.673 -17.206 3.654 1286 2HB ARG 21 2HB ARG 21 10.791 -18.658 2.661 1287 1HG ARG 21 1HG ARG 21 10.962 -20.071 4.509 1288 2HG ARG 21 2HG ARG 21 11.579 -18.793 5.555 1289 1HD ARG 21 1HD ARG 21 9.466 -18.008 6.055 1290 2HD ARG 21 2HD ARG 21 8.825 -18.421 4.453 1291 HE ARG 21 HE ARG 21 9.446 -20.881 5.566 1292 1HH1 ARG 21 1HH1 ARG 21 7.541 -18.147 6.573 1293 2HH1 ARG 21 2HH1 ARG 21 6.446 -19.112 7.500 1294 1HH2 ARG 21 1HH2 ARG 21 8.011 -22.112 6.775 1295 2HH2 ARG 21 2HH2 ARG 21 6.708 -21.340 7.614 1296 H LYS 22 H LYS 22 13.063 -17.515 0.943 1297 HA LYS 22 HA LYS 22 13.979 -20.295 0.341 1298 1HB LYS 22 1HB LYS 22 12.418 -18.152 -0.950 1299 2HB LYS 22 2HB LYS 22 13.582 -18.908 -2.028 1300 1HG LYS 22 1HG LYS 22 12.297 -20.751 -2.202 1301 2HG LYS 22 2HG LYS 22 12.258 -20.927 -0.447 1302 1HD LYS 22 1HD LYS 22 10.500 -19.078 -0.436 1303 2HD LYS 22 2HD LYS 22 10.421 -19.270 -2.186 1304 1HE LYS 22 1HE LYS 22 8.684 -20.612 -0.924 1305 2HE LYS 22 2HE LYS 22 9.737 -21.604 -1.947 1306 1HZ LYS 22 1HZ LYS 22 10.530 -21.000 0.830 1307 2HZ LYS 22 2HZ LYS 22 10.952 -22.329 -0.140 1308 3HZ LYS 22 3HZ LYS 22 9.400 -22.234 0.542 1309 H SER 23 H SER 23 16.964 -18.954 -1.431 1310 HA SER 23 HA SER 23 14.632 -20.826 -1.628 1311 1HB SER 23 1HB SER 23 17.057 -21.569 -1.152 1312 2HB SER 23 2HB SER 23 16.237 -22.378 -2.488 1313 HG SER 23 HG SER 23 18.471 -21.415 -2.779 1314 H PHE 24 H PHE 24 16.749 -18.630 -3.447 1315 HA PHE 24 HA PHE 24 14.893 -18.925 -5.784 1316 1HB PHE 24 1HB PHE 24 16.132 -16.453 -4.520 1317 2HB PHE 24 2HB PHE 24 15.202 -16.434 -6.018 1318 HD1 PHE 24 HD1 PHE 24 14.927 -15.735 -2.668 1319 HD2 PHE 24 HD2 PHE 24 12.920 -17.997 -5.718 1320 HE1 PHE 24 HE1 PHE 24 12.822 -15.629 -1.361 1321 HE2 PHE 24 HE2 PHE 24 10.815 -17.891 -4.412 1322 HZ PHE 24 HZ PHE 24 10.765 -16.707 -2.233 1323 H GLU 25 H GLU 25 15.868 -18.283 -7.863 1324 HA GLU 25 HA GLU 25 18.804 -18.848 -7.937 1325 1HB GLU 25 1HB GLU 25 16.533 -19.815 -9.311 1326 2HB GLU 25 2HB GLU 25 17.404 -18.828 -10.485 1327 1HG GLU 25 1HG GLU 25 19.513 -20.082 -9.658 1328 2HG GLU 25 2HG GLU 25 18.382 -21.237 -8.955 1329 H LYS 26 H LYS 26 19.240 -17.782 -10.547 1330 HA LYS 26 HA LYS 26 19.158 -14.865 -9.914 1331 1HB LYS 26 1HB LYS 26 21.340 -16.011 -10.314 1332 2HB LYS 26 2HB LYS 26 20.792 -16.475 -11.913 1333 1HG LYS 26 1HG LYS 26 20.746 -14.217 -12.657 1334 2HG LYS 26 2HG LYS 26 20.851 -13.594 -11.011 1335 1HD LYS 26 1HD LYS 26 23.123 -14.782 -10.875 1336 2HD LYS 26 2HD LYS 26 23.008 -14.965 -12.626 1337 1HE LYS 26 1HE LYS 26 22.406 -12.234 -11.706 1338 2HE LYS 26 2HE LYS 26 24.067 -12.754 -11.359 1339 1HZ LYS 26 1HZ LYS 26 22.684 -13.061 -13.978 1340 2HZ LYS 26 2HZ LYS 26 24.292 -13.489 -13.638 1341 3HZ LYS 26 3HZ LYS 26 23.827 -11.856 -13.626 1342 H GLY 27 H GLY 27 17.156 -14.193 -10.711 1343 1HA GLY 27 1HA GLY 27 16.337 -13.141 -12.857 1344 2HA GLY 27 2HA GLY 27 16.659 -14.699 -13.618 1345 H GLU 28 H GLU 28 15.252 -14.311 -10.395 1346 HA GLU 28 HA GLU 28 12.718 -15.510 -11.468 1347 1HB GLU 28 1HB GLU 28 14.418 -15.929 -9.029 1348 2HB GLU 28 2HB GLU 28 12.684 -16.222 -8.897 1349 1HG GLU 28 1HG GLU 28 12.850 -17.714 -10.911 1350 2HG GLU 28 2HG GLU 28 14.601 -17.515 -10.859 1351 H LEU 29 H LEU 29 10.777 -14.537 -10.842 1352 HA LEU 29 HA LEU 29 10.950 -11.832 -9.704 1353 1HB LEU 29 1HB LEU 29 9.499 -12.399 -11.621 1354 2HB LEU 29 2HB LEU 29 8.639 -13.579 -10.633 1355 HG LEU 29 HG LEU 29 8.449 -11.348 -9.065 1356 1HD1 LEU 29 1HD1 LEU 29 7.794 -9.490 -10.582 1357 2HD1 LEU 29 2HD1 LEU 29 8.322 -10.453 -11.962 1358 3HD1 LEU 29 3HD1 LEU 29 9.496 -9.916 -10.759 1359 1HD2 LEU 29 1HD2 LEU 29 6.346 -12.122 -9.297 1360 2HD2 LEU 29 2HD2 LEU 29 6.753 -12.901 -10.827 1361 3HD2 LEU 29 3HD2 LEU 29 6.240 -11.213 -10.805 1362 H VAL 30 H VAL 30 10.360 -11.275 -7.622 1363 HA VAL 30 HA VAL 30 9.796 -13.481 -5.726 1364 HB VAL 30 HB VAL 30 10.326 -10.507 -5.359 1365 1HG1 VAL 30 1HG1 VAL 30 10.228 -10.845 -3.115 1366 2HG1 VAL 30 2HG1 VAL 30 11.033 -12.410 -3.226 1367 3HG1 VAL 30 3HG1 VAL 30 9.300 -12.287 -3.528 1368 1HG2 VAL 30 1HG2 VAL 30 12.244 -12.827 -5.026 1369 2HG2 VAL 30 2HG2 VAL 30 12.625 -11.106 -4.980 1370 3HG2 VAL 30 3HG2 VAL 30 12.144 -11.862 -6.499 1371 H GLU 31 H GLU 31 8.493 -10.169 -6.166 1372 HA GLU 31 HA GLU 31 5.726 -11.169 -6.083 1373 1HB GLU 31 1HB GLU 31 5.229 -9.931 -3.987 1374 2HB GLU 31 2HB GLU 31 6.465 -11.159 -3.713 1375 1HG GLU 31 1HG GLU 31 7.960 -8.965 -4.478 1376 2HG GLU 31 2HG GLU 31 6.663 -8.232 -3.535 1377 H GLU 32 H GLU 32 4.246 -9.550 -6.797 1378 HA GLU 32 HA GLU 32 5.459 -6.913 -7.540 1379 1HB GLU 32 1HB GLU 32 5.440 -8.254 -9.517 1380 2HB GLU 32 2HB GLU 32 3.864 -8.942 -9.131 1381 1HG GLU 32 1HG GLU 32 2.847 -6.685 -9.443 1382 2HG GLU 32 2HG GLU 32 4.424 -6.071 -9.940 1383 H CYS 33 H CYS 33 4.129 -5.162 -7.112 1384 HA CYS 33 HA CYS 33 1.249 -5.662 -6.493 1385 1HB CYS 33 1HB CYS 33 3.413 -4.431 -4.772 1386 2HB CYS 33 2HB CYS 33 1.713 -4.041 -4.506 1387 HG CYS 33 HG CYS 33 1.326 -6.693 -4.205 1388 H LEU 34 H LEU 34 0.230 -3.314 -6.079 1389 HA LEU 34 HA LEU 34 0.972 -1.699 -8.450 1390 1HB LEU 34 1HB LEU 34 -1.337 -1.925 -6.529 1391 2HB LEU 34 2HB LEU 34 -1.186 -0.484 -7.533 1392 HG LEU 34 HG LEU 34 -1.072 -1.928 -9.552 1393 1HD1 LEU 34 1HD1 LEU 34 -0.192 -3.978 -8.796 1394 2HD1 LEU 34 2HD1 LEU 34 -1.888 -4.357 -9.099 1395 3HD1 LEU 34 3HD1 LEU 34 -1.328 -4.074 -7.450 1396 1HD2 LEU 34 1HD2 LEU 34 -3.245 -1.082 -9.014 1397 2HD2 LEU 34 2HD2 LEU 34 -3.444 -2.239 -7.698 1398 3HD2 LEU 34 3HD2 LEU 34 -3.469 -2.794 -9.372 1399 H CYS 35 H CYS 35 0.904 0.753 -8.119 1400 HA CYS 35 HA CYS 35 1.854 1.625 -5.434 1401 1HB CYS 35 1HB CYS 35 3.319 1.960 -8.080 1402 2HB CYS 35 2HB CYS 35 3.811 2.714 -6.566 1403 HG CYS 35 HG CYS 35 4.601 0.495 -5.677 1404 H ILE 36 H ILE 36 2.030 4.099 -5.420 1405 HA ILE 36 HA ILE 36 -0.238 5.228 -6.988 1406 HB ILE 36 HB ILE 36 1.377 6.259 -4.627 1407 1HG1 ILE 36 1HG1 ILE 36 -1.486 5.347 -4.537 1408 2HG1 ILE 36 2HG1 ILE 36 -0.190 4.152 -4.454 1409 1HG2 ILE 36 1HG2 ILE 36 0.361 8.071 -5.962 1410 2HG2 ILE 36 2HG2 ILE 36 -0.446 7.908 -4.402 1411 3HG2 ILE 36 3HG2 ILE 36 -1.206 7.267 -5.859 1412 1HD1 ILE 36 1HD1 ILE 36 0.030 6.559 -2.698 1413 2HD1 ILE 36 2HD1 ILE 36 0.548 4.901 -2.397 1414 3HD1 ILE 36 3HD1 ILE 36 -1.156 5.333 -2.254 1415 H VAL 37 H VAL 37 0.120 7.467 -7.903 1416 HA VAL 37 HA VAL 37 2.968 8.046 -8.581 1417 HB VAL 37 HB VAL 37 0.675 7.699 -10.550 1418 1HG1 VAL 37 1HG1 VAL 37 1.996 9.112 -11.759 1419 2HG1 VAL 37 2HG1 VAL 37 2.989 7.674 -11.998 1420 3HG1 VAL 37 3HG1 VAL 37 3.402 8.830 -10.732 1421 1HG2 VAL 37 1HG2 VAL 37 1.245 5.509 -10.009 1422 2HG2 VAL 37 2HG2 VAL 37 2.915 5.929 -9.631 1423 3HG2 VAL 37 3HG2 VAL 37 2.389 5.834 -11.311 1424 H ARG 38 H ARG 38 3.213 10.157 -7.984 1425 HA ARG 38 HA ARG 38 1.198 12.144 -8.912 1426 1HB ARG 38 1HB ARG 38 2.181 11.685 -6.080 1427 2HB ARG 38 2HB ARG 38 1.352 13.159 -6.574 1428 1HG ARG 38 1HG ARG 38 0.228 10.354 -6.845 1429 2HG ARG 38 2HG ARG 38 -0.207 11.498 -5.576 1430 1HD ARG 38 1HD ARG 38 -0.839 13.115 -7.492 1431 2HD ARG 38 2HD ARG 38 -0.779 11.685 -8.541 1432 HE ARG 38 HE ARG 38 -2.793 12.220 -6.496 1433 1HH1 ARG 38 1HH1 ARG 38 -1.031 9.749 -8.201 1434 2HH1 ARG 38 2HH1 ARG 38 -2.252 8.551 -7.949 1435 1HH2 ARG 38 1HH2 ARG 38 -4.363 10.648 -6.183 1436 2HH2 ARG 38 2HH2 ARG 38 -4.125 9.053 -6.816 1437 H HIS 39 H HIS 39 2.163 14.120 -9.463 1438 HA HIS 39 HA HIS 39 4.914 14.260 -10.073 1439 1HB HIS 39 1HB HIS 39 2.640 16.185 -9.706 1440 2HB HIS 39 2HB HIS 39 4.260 16.841 -9.946 1441 HD1 HIS 39 HD1 HIS 39 4.010 17.627 -12.357 1442 HD2 HIS 39 HD2 HIS 39 2.937 13.630 -11.854 1443 HE1 HIS 39 HE1 HIS 39 3.692 16.672 -14.681 1444 H ASN 40 H ASN 40 5.992 16.563 -9.056 1445 HA ASN 40 HA ASN 40 6.551 15.787 -6.238 1446 1HB ASN 40 1HB ASN 40 8.373 16.015 -7.915 1447 2HB ASN 40 2HB ASN 40 7.916 17.699 -8.171 1448 1HD2 ASN 40 1HD2 ASN 40 10.248 18.087 -7.389 1449 2HD2 ASN 40 2HD2 ASN 40 10.513 18.177 -5.714 1450 H ASP 41 H ASP 41 5.504 16.906 -4.666 1451 HA ASP 41 HA ASP 41 5.451 19.778 -4.513 1452 1HB ASP 41 1HB ASP 41 3.689 18.865 -6.351 1453 2HB ASP 41 2HB ASP 41 2.686 18.707 -4.910 1454 H ASP 42 H ASP 42 2.691 19.594 -3.131 1455 HA ASP 42 HA ASP 42 3.480 19.133 -0.466 1456 1HB ASP 42 1HB ASP 42 0.787 18.648 -1.802 1457 2HB ASP 42 2HB ASP 42 1.037 18.940 -0.081 1458 H TRP 43 H TRP 43 2.324 16.872 -2.922 1459 HA TRP 43 HA TRP 43 2.071 14.532 -1.270 1460 1HB TRP 43 1HB TRP 43 1.103 14.506 -3.444 1461 2HB TRP 43 2HB TRP 43 2.547 15.186 -4.186 1462 HD1 TRP 43 HD1 TRP 43 4.409 13.568 -4.979 1463 HE1 TRP 43 HE1 TRP 43 4.612 11.002 -5.110 1464 HE3 TRP 43 HE3 TRP 43 0.363 12.217 -2.169 1465 HZ2 TRP 43 HZ2 TRP 43 3.241 8.686 -4.154 1466 HZ3 TRP 43 HZ3 TRP 43 -0.160 9.824 -1.796 1467 HH2 TRP 43 HH2 TRP 43 1.271 8.058 -2.782 1468 H GLY 44 H GLY 44 4.767 16.098 -2.937 1469 1HA GLY 44 1HA GLY 44 6.701 14.042 -2.705 1470 2HA GLY 44 2HA GLY 44 7.077 15.763 -2.780 1471 H THR 45 H THR 45 6.519 16.939 -0.591 1472 HA THR 45 HA THR 45 8.182 15.791 1.447 1473 HB THR 45 HB THR 45 6.081 17.960 1.661 1474 HG1 THR 45 HG1 THR 45 7.986 19.283 1.169 1475 1HG2 THR 45 1HG2 THR 45 6.877 17.525 3.831 1476 2HG2 THR 45 2HG2 THR 45 7.915 18.840 3.280 1477 3HG2 THR 45 3HG2 THR 45 8.510 17.180 3.261 1478 H ALA 46 H ALA 46 4.648 15.879 1.037 1479 HA ALA 46 HA ALA 46 3.942 14.915 3.650 1480 1HB ALA 46 1HB ALA 46 1.833 14.328 2.505 1481 2HB ALA 46 2HB ALA 46 2.632 14.467 0.939 1482 3HB ALA 46 3HB ALA 46 2.402 15.900 1.942 1483 H LEU 47 H LEU 47 4.084 13.122 0.560 1484 HA LEU 47 HA LEU 47 4.582 10.600 2.050 1485 1HB LEU 47 1HB LEU 47 3.839 11.397 -0.775 1486 2HB LEU 47 2HB LEU 47 4.367 9.756 -0.413 1487 HG LEU 47 HG LEU 47 1.928 9.867 -0.315 1488 1HD1 LEU 47 1HD1 LEU 47 3.599 8.909 1.708 1489 2HD1 LEU 47 2HD1 LEU 47 1.911 8.467 1.452 1490 3HD1 LEU 47 3HD1 LEU 47 2.322 9.769 2.568 1491 1HD2 LEU 47 1HD2 LEU 47 2.209 12.425 0.474 1492 2HD2 LEU 47 2HD2 LEU 47 1.953 11.674 2.049 1493 3HD2 LEU 47 3HD2 LEU 47 0.740 11.497 0.781 1494 H GLU 48 H GLU 48 6.666 12.660 1.972 1495 HA GLU 48 HA GLU 48 8.632 12.054 -0.041 1496 1HB GLU 48 1HB GLU 48 8.144 13.927 1.938 1497 2HB GLU 48 2HB GLU 48 9.592 13.119 2.513 1498 1HG GLU 48 1HG GLU 48 10.244 13.409 -0.089 1499 2HG GLU 48 2HG GLU 48 9.182 14.802 0.101 1500 H ASP 49 H ASP 49 7.580 10.091 2.465 1501 HA ASP 49 HA ASP 49 10.247 8.747 2.646 1502 1HB ASP 49 1HB ASP 49 9.067 9.805 4.722 1503 2HB ASP 49 2HB ASP 49 7.947 8.448 4.589 1504 H TYR 50 H TYR 50 10.193 6.441 2.376 1505 HA TYR 50 HA TYR 50 9.398 4.423 1.430 1506 1HB TYR 50 1HB TYR 50 6.709 5.500 2.355 1507 2HB TYR 50 2HB TYR 50 7.160 3.813 2.151 1508 HD1 TYR 50 HD1 TYR 50 9.563 3.307 3.471 1509 HD2 TYR 50 HD2 TYR 50 6.564 6.184 4.563 1510 HE1 TYR 50 HE1 TYR 50 10.365 3.257 5.816 1511 HE2 TYR 50 HE2 TYR 50 7.366 6.132 6.907 1512 HH TYR 50 HH TYR 50 9.647 3.767 8.017 1513 H LEU 51 H LEU 51 9.443 6.980 -0.155 1514 HA LEU 51 HA LEU 51 7.417 6.215 -2.233 1515 1HB LEU 51 1HB LEU 51 7.048 8.311 -0.767 1516 2HB LEU 51 2HB LEU 51 8.415 9.013 -1.632 1517 HG LEU 51 HG LEU 51 7.030 8.175 -3.752 1518 1HD1 LEU 51 1HD1 LEU 51 4.684 9.042 -2.183 1519 2HD1 LEU 51 2HD1 LEU 51 5.290 7.437 -1.774 1520 3HD1 LEU 51 3HD1 LEU 51 4.808 7.805 -3.429 1521 1HD2 LEU 51 1HD2 LEU 51 7.344 10.636 -2.326 1522 2HD2 LEU 51 2HD2 LEU 51 5.690 10.562 -2.936 1523 3HD2 LEU 51 3HD2 LEU 51 7.049 10.406 -4.050 1524 H PHE 52 H PHE 52 8.206 6.088 -4.315 1525 HA PHE 52 HA PHE 52 11.121 6.485 -4.724 1526 1HB PHE 52 1HB PHE 52 8.841 5.171 -6.233 1527 2HB PHE 52 2HB PHE 52 10.444 5.352 -6.947 1528 HD1 PHE 52 HD1 PHE 52 8.383 3.415 -4.720 1529 HD2 PHE 52 HD2 PHE 52 12.454 4.405 -5.666 1530 HE1 PHE 52 HE1 PHE 52 9.157 1.404 -3.491 1531 HE2 PHE 52 HE2 PHE 52 13.228 2.394 -4.438 1532 HZ PHE 52 HZ PHE 52 11.580 0.894 -3.350 1533 H SER 53 H SER 53 11.801 7.667 -6.733 1534 HA SER 53 HA SER 53 9.793 9.679 -7.659 1535 1HB SER 53 1HB SER 53 11.308 11.459 -7.142 1536 2HB SER 53 2HB SER 53 11.322 10.411 -5.726 1537 HG SER 53 HG SER 53 13.333 11.048 -7.404 1538 H ARG 54 H ARG 54 9.711 9.344 -9.845 1539 HA ARG 54 HA ARG 54 12.178 8.516 -11.296 1540 1HB ARG 54 1HB ARG 54 9.792 7.438 -11.397 1541 2HB ARG 54 2HB ARG 54 9.393 8.812 -12.427 1542 1HG ARG 54 1HG ARG 54 10.486 7.908 -14.182 1543 2HG ARG 54 2HG ARG 54 11.925 7.610 -13.208 1544 1HD ARG 54 1HD ARG 54 10.467 5.639 -12.205 1545 2HD ARG 54 2HD ARG 54 9.589 5.798 -13.738 1546 HE ARG 54 HE ARG 54 12.472 5.828 -14.120 1547 1HH1 ARG 54 1HH1 ARG 54 9.696 3.783 -13.639 1548 2HH1 ARG 54 2HH1 ARG 54 10.424 2.424 -14.424 1549 1HH2 ARG 54 1HH2 ARG 54 13.394 4.051 -15.134 1550 2HH2 ARG 54 2HH2 ARG 54 12.501 2.572 -15.265 1551 H LYS 55 H LYS 55 12.216 9.559 -13.636 1552 HA LYS 55 HA LYS 55 12.467 12.442 -13.262 1553 1HB LYS 55 1HB LYS 55 13.000 10.386 -15.392 1554 2HB LYS 55 2HB LYS 55 13.028 12.094 -15.834 1555 1HG LYS 55 1HG LYS 55 14.930 12.511 -14.625 1556 2HG LYS 55 2HG LYS 55 14.497 11.363 -13.357 1557 1HD LYS 55 1HD LYS 55 16.020 9.969 -14.279 1558 2HD LYS 55 2HD LYS 55 14.876 9.760 -15.605 1559 1HE LYS 55 1HE LYS 55 16.200 10.935 -17.033 1560 2HE LYS 55 2HE LYS 55 16.426 12.239 -15.852 1561 1HZ LYS 55 1HZ LYS 55 17.718 9.581 -15.577 1562 2HZ LYS 55 2HZ LYS 55 18.089 11.013 -14.742 1563 3HZ LYS 55 3HZ LYS 55 18.468 10.869 -16.391 1564 H ASN 56 H ASN 56 10.236 13.030 -12.893 1565 HA ASN 56 HA ASN 56 8.311 12.625 -15.112 1566 1HB ASN 56 1HB ASN 56 9.628 14.618 -15.717 1567 2HB ASN 56 2HB ASN 56 7.999 15.110 -15.252 1568 1HD2 ASN 56 1HD2 ASN 56 11.392 15.249 -14.338 1569 2HD2 ASN 56 2HD2 ASN 56 11.187 16.283 -13.008 1570 H MET 57 H MET 57 8.661 11.977 -12.151 1571 HA MET 57 HA MET 57 6.862 13.587 -10.596 1572 1HB MET 57 1HB MET 57 4.870 12.113 -10.735 1573 2HB MET 57 2HB MET 57 5.271 12.762 -12.320 1574 1HG MET 57 1HG MET 57 6.522 10.168 -11.567 1575 2HG MET 57 2HG MET 57 4.798 10.154 -11.917 1576 1HE MET 57 1HE MET 57 3.735 11.085 -13.534 1577 2HE MET 57 2HE MET 57 4.055 9.888 -14.790 1578 3HE MET 57 3HE MET 57 4.257 11.606 -15.136 1579 H SER 58 H SER 58 5.654 11.497 -9.079 1580 HA SER 58 HA SER 58 7.946 9.793 -8.213 1581 1HB SER 58 1HB SER 58 6.196 11.476 -6.384 1582 2HB SER 58 2HB SER 58 7.614 10.539 -5.915 1583 HG SER 58 HG SER 58 7.432 12.986 -7.201 1584 H ALA 59 H ALA 59 7.108 8.104 -6.579 1585 HA ALA 59 HA ALA 59 4.208 7.535 -6.831 1586 1HB ALA 59 1HB ALA 59 4.960 6.431 -8.775 1587 2HB ALA 59 2HB ALA 59 5.013 5.141 -7.574 1588 3HB ALA 59 3HB ALA 59 6.495 5.978 -8.034 1589 H MET 60 H MET 60 3.461 6.105 -5.179 1590 HA MET 60 HA MET 60 5.339 5.802 -2.900 1591 1HB MET 60 1HB MET 60 3.110 6.830 -2.601 1592 2HB MET 60 2HB MET 60 2.347 5.365 -3.220 1593 1HG MET 60 1HG MET 60 2.971 4.095 -1.337 1594 2HG MET 60 2HG MET 60 4.215 5.251 -0.858 1595 1HE MET 60 1HE MET 60 2.602 6.724 1.990 1596 2HE MET 60 2HE MET 60 3.823 7.201 0.810 1597 3HE MET 60 3HE MET 60 3.752 5.534 1.380 1598 H ALA 61 H ALA 61 5.571 3.744 -1.808 1599 HA ALA 61 HA ALA 61 5.552 1.452 -3.648 1600 1HB ALA 61 1HB ALA 61 7.446 1.347 -2.361 1601 2HB ALA 61 2HB ALA 61 6.390 0.549 -1.196 1602 3HB ALA 61 3HB ALA 61 6.717 2.277 -1.051 1603 H LEU 62 H LEU 62 3.274 1.026 -3.889 1604 HA LEU 62 HA LEU 62 1.263 -0.072 -3.336 1605 1HB LEU 62 1HB LEU 62 0.934 0.594 -0.639 1606 2HB LEU 62 2HB LEU 62 1.955 1.885 -1.273 1607 HG LEU 62 HG LEU 62 0.323 2.151 -3.168 1608 1HD1 LEU 62 1HD1 LEU 62 -0.986 0.300 -3.439 1609 2HD1 LEU 62 2HD1 LEU 62 -2.019 1.101 -2.255 1610 3HD1 LEU 62 3HD1 LEU 62 -0.883 -0.144 -1.736 1611 1HD2 LEU 62 1HD2 LEU 62 0.277 3.501 -1.011 1612 2HD2 LEU 62 2HD2 LEU 62 -1.005 2.421 -0.460 1613 3HD2 LEU 62 3HD2 LEU 62 -1.253 3.428 -1.886 1614 H GLY 63 H GLY 63 2.698 -2.105 -3.464 1615 1HA GLY 63 1HA GLY 63 2.067 -3.843 -1.281 1616 2HA GLY 63 2HA GLY 63 3.157 -4.241 -2.608 1617 H PHE 64 H PHE 64 4.918 -5.066 -1.528 1618 HA PHE 64 HA PHE 64 5.935 -3.809 0.927 1619 1HB PHE 64 1HB PHE 64 6.935 -6.059 -0.860 1620 2HB PHE 64 2HB PHE 64 7.569 -5.685 0.742 1621 HD1 PHE 64 HD1 PHE 64 5.636 -5.419 2.609 1622 HD2 PHE 64 HD2 PHE 64 5.327 -7.734 -0.997 1623 HE1 PHE 64 HE1 PHE 64 3.838 -6.781 3.638 1624 HE2 PHE 64 HE2 PHE 64 3.527 -9.096 0.033 1625 HZ PHE 64 HZ PHE 64 2.783 -8.619 2.350 1626 H GLY 65 H GLY 65 6.041 -1.858 -1.004 1627 1HA GLY 65 1HA GLY 65 8.731 -1.898 -2.227 1628 2HA GLY 65 2HA GLY 65 7.502 -0.659 -2.477 1629 H ALA 66 H ALA 66 7.032 -0.472 0.483 1630 HA ALA 66 HA ALA 66 9.199 1.456 1.037 1631 1HB ALA 66 1HB ALA 66 6.709 0.641 2.580 1632 2HB ALA 66 2HB ALA 66 6.780 1.941 1.391 1633 3HB ALA 66 3HB ALA 66 7.692 2.071 2.894 1634 H ILE 67 H ILE 67 7.772 -1.424 2.622 1635 HA ILE 67 HA ILE 67 9.374 -1.646 4.882 1636 HB ILE 67 HB ILE 67 9.026 -4.134 4.551 1637 1HG1 ILE 67 1HG1 ILE 67 7.438 -4.594 2.537 1638 2HG1 ILE 67 2HG1 ILE 67 8.140 -3.134 1.848 1639 1HG2 ILE 67 1HG2 ILE 67 6.761 -2.174 4.170 1640 2HG2 ILE 67 2HG2 ILE 67 7.286 -2.959 5.660 1641 3HG2 ILE 67 3HG2 ILE 67 6.479 -3.899 4.405 1642 1HD1 ILE 67 1HD1 ILE 67 10.199 -4.859 2.952 1643 2HD1 ILE 67 2HD1 ILE 67 10.044 -4.214 1.317 1644 3HD1 ILE 67 3HD1 ILE 67 9.225 -5.713 1.754 1645 H PHE 68 H PHE 68 10.358 -2.114 1.551 1646 HA PHE 68 HA PHE 68 12.637 -3.708 1.733 1647 1HB PHE 68 1HB PHE 68 11.778 -1.306 0.156 1648 2HB PHE 68 2HB PHE 68 13.444 -1.851 -0.028 1649 HD1 PHE 68 HD1 PHE 68 10.616 -1.992 -1.757 1650 HD2 PHE 68 HD2 PHE 68 13.244 -4.757 0.216 1651 HE1 PHE 68 HE1 PHE 68 9.849 -3.802 -3.270 1652 HE2 PHE 68 HE2 PHE 68 12.478 -6.566 -1.296 1653 HZ PHE 68 HZ PHE 68 10.780 -6.088 -3.039 1654 H ASN 69 H ASN 69 14.375 -3.553 3.098 1655 HA ASN 69 HA ASN 69 15.031 -0.931 4.329 1656 1HB ASN 69 1HB ASN 69 15.906 -3.802 4.804 1657 2HB ASN 69 2HB ASN 69 16.480 -2.435 5.759 1658 1HD2 ASN 69 1HD2 ASN 69 15.113 -4.313 7.212 1659 2HD2 ASN 69 2HD2 ASN 69 13.542 -3.784 7.578 1660 H HIS 70 H HIS 70 17.547 -0.653 4.643 1661 HA HIS 70 HA HIS 70 18.744 -0.771 1.927 1662 1HB HIS 70 1HB HIS 70 18.561 1.325 3.346 1663 2HB HIS 70 2HB HIS 70 19.703 0.588 4.470 1664 HD1 HIS 70 HD1 HIS 70 21.539 2.360 3.929 1665 HD2 HIS 70 HD2 HIS 70 20.319 0.129 0.625 1666 HE1 HIS 70 HE1 HIS 70 23.233 2.805 2.100 1667 H SER 71 H SER 71 20.579 -1.971 1.477 1668 HA SER 71 HA SER 71 22.048 -3.262 3.727 1669 1HB SER 71 1HB SER 71 20.353 -4.864 3.099 1670 2HB SER 71 2HB SER 71 20.657 -4.598 1.382 1671 HG SER 71 HG SER 71 21.935 -6.222 3.144 1672 H LYS 72 H LYS 72 24.156 -4.154 2.972 1673 HA LYS 72 HA LYS 72 25.367 -2.413 0.938 1674 1HB LYS 72 1HB LYS 72 26.458 -2.947 3.090 1675 2HB LYS 72 2HB LYS 72 26.437 -4.663 2.684 1676 1HG LYS 72 1HG LYS 72 28.647 -3.683 2.204 1677 2HG LYS 72 2HG LYS 72 27.863 -4.207 0.714 1678 1HD LYS 72 1HD LYS 72 27.123 -1.906 0.274 1679 2HD LYS 72 2HD LYS 72 27.851 -1.369 1.788 1680 1HE LYS 72 1HE LYS 72 29.564 -0.862 0.271 1681 2HE LYS 72 2HE LYS 72 30.027 -2.509 0.740 1682 1HZ LYS 72 1HZ LYS 72 28.298 -1.772 -1.570 1683 2HZ LYS 72 2HZ LYS 72 28.708 -3.355 -1.113 1684 3HZ LYS 72 3HZ LYS 72 29.910 -2.295 -1.675 1685 H ASP 73 H ASP 73 24.509 -5.840 1.280 1686 HA ASP 73 HA ASP 73 25.282 -6.225 -1.594 1687 1HB ASP 73 1HB ASP 73 26.142 -7.508 0.836 1688 2HB ASP 73 2HB ASP 73 25.293 -8.692 -0.156 1689 HA PRO 74 HA PRO 74 20.792 -7.316 -0.673 1690 1HB PRO 74 1HB PRO 74 19.664 -5.480 -2.400 1691 2HB PRO 74 2HB PRO 74 19.930 -5.170 -0.675 1692 1HG PRO 74 1HG PRO 74 21.506 -4.282 -3.032 1693 2HG PRO 74 2HG PRO 74 21.164 -3.434 -1.518 1694 1HD PRO 74 1HD PRO 74 23.550 -4.650 -2.087 1695 2HD PRO 74 2HD PRO 74 22.938 -4.393 -0.440 1696 H ASN 75 H ASN 75 20.536 -9.162 -1.836 1697 HA ASN 75 HA ASN 75 21.377 -9.297 -4.659 1698 1HB ASN 75 1HB ASN 75 20.151 -11.336 -2.768 1699 2HB ASN 75 2HB ASN 75 20.938 -11.696 -4.303 1700 1HD2 ASN 75 1HD2 ASN 75 21.501 -10.901 -0.933 1701 2HD2 ASN 75 2HD2 ASN 75 23.194 -11.007 -0.990 1702 H ALA 76 H ALA 76 18.809 -7.850 -3.557 1703 HA ALA 76 HA ALA 76 16.901 -9.184 -5.451 1704 1HB ALA 76 1HB ALA 76 15.986 -7.454 -3.182 1705 2HB ALA 76 2HB ALA 76 16.627 -9.048 -2.783 1706 3HB ALA 76 3HB ALA 76 15.234 -8.901 -3.855 1707 H ARG 77 H ARG 77 15.429 -7.665 -6.559 1708 HA ARG 77 HA ARG 77 16.252 -4.800 -6.514 1709 1HB ARG 77 1HB ARG 77 17.403 -6.507 -8.250 1710 2HB ARG 77 2HB ARG 77 15.933 -6.159 -9.161 1711 1HG ARG 77 1HG ARG 77 17.589 -4.543 -9.837 1712 2HG ARG 77 2HG ARG 77 16.422 -3.698 -8.822 1713 1HD ARG 77 1HD ARG 77 17.993 -3.244 -7.236 1714 2HD ARG 77 2HD ARG 77 18.636 -4.896 -7.293 1715 HE ARG 77 HE ARG 77 20.240 -4.127 -8.847 1716 1HH1 ARG 77 1HH1 ARG 77 17.486 -1.998 -8.781 1717 2HH1 ARG 77 2HH1 ARG 77 18.189 -0.874 -9.890 1718 1HH2 ARG 77 1HH2 ARG 77 21.132 -2.653 -10.286 1719 2HH2 ARG 77 2HH2 ARG 77 20.238 -1.239 -10.738 1720 H HIS 78 H HIS 78 14.700 -3.495 -7.945 1721 HA HIS 78 HA HIS 78 11.986 -4.770 -8.018 1722 1HB HIS 78 1HB HIS 78 11.158 -2.529 -7.244 1723 2HB HIS 78 2HB HIS 78 12.233 -3.293 -6.073 1724 HD1 HIS 78 HD1 HIS 78 14.691 -2.344 -5.917 1725 HD2 HIS 78 HD2 HIS 78 12.141 -0.142 -8.372 1726 HE1 HIS 78 HE1 HIS 78 15.845 -0.131 -6.347 1727 H GLU 79 H GLU 79 10.989 -4.543 -9.981 1728 HA GLU 79 HA GLU 79 12.198 -2.649 -11.957 1729 1HB GLU 79 1HB GLU 79 12.221 -5.066 -12.481 1730 2HB GLU 79 2HB GLU 79 10.473 -5.136 -12.258 1731 1HG GLU 79 1HG GLU 79 10.937 -4.962 -14.636 1732 2HG GLU 79 2HG GLU 79 10.233 -3.439 -14.092 1733 H LEU 80 H LEU 80 10.752 -1.340 -13.235 1734 HA LEU 80 HA LEU 80 8.023 -1.007 -12.028 1735 1HB LEU 80 1HB LEU 80 10.189 0.849 -12.952 1736 2HB LEU 80 2HB LEU 80 8.518 1.387 -13.123 1737 HG LEU 80 HG LEU 80 9.431 0.204 -10.517 1738 1HD1 LEU 80 1HD1 LEU 80 11.030 1.829 -10.419 1739 2HD1 LEU 80 2HD1 LEU 80 9.661 2.887 -10.079 1740 3HD1 LEU 80 3HD1 LEU 80 10.294 2.765 -11.720 1741 1HD2 LEU 80 1HD2 LEU 80 7.709 1.830 -9.683 1742 2HD2 LEU 80 2HD2 LEU 80 7.056 0.634 -10.802 1743 3HD2 LEU 80 3HD2 LEU 80 7.382 2.275 -11.358 1744 H THR 81 H THR 81 6.327 -1.269 -13.433 1745 HA THR 81 HA THR 81 6.614 -2.214 -16.090 1746 HB THR 81 HB THR 81 4.161 -1.608 -16.195 1747 HG1 THR 81 HG1 THR 81 4.479 -0.698 -13.550 1748 1HG2 THR 81 1HG2 THR 81 5.371 -3.567 -14.780 1749 2HG2 THR 81 2HG2 THR 81 3.619 -3.371 -14.832 1750 3HG2 THR 81 3HG2 THR 81 4.538 -2.733 -13.469 1751 H ALA 82 H ALA 82 4.992 -0.681 -17.728 1752 HA ALA 82 HA ALA 82 6.806 1.433 -18.569 1753 1HB ALA 82 1HB ALA 82 5.372 1.500 -20.462 1754 2HB ALA 82 2HB ALA 82 3.975 0.968 -19.526 1755 3HB ALA 82 3HB ALA 82 5.261 -0.174 -19.918 1756 H GLY 83 H GLY 83 6.354 2.386 -16.176 1757 1HA GLY 83 1HA GLY 83 5.250 4.922 -16.398 1758 2HA GLY 83 2HA GLY 83 3.901 3.912 -15.880 1759 H LEU 84 H LEU 84 3.639 4.127 -13.710 1760 HA LEU 84 HA LEU 84 5.964 3.667 -11.931 1761 1HB LEU 84 1HB LEU 84 5.248 6.225 -12.701 1762 2HB LEU 84 2HB LEU 84 4.356 6.032 -11.194 1763 HG LEU 84 HG LEU 84 6.430 5.368 -10.041 1764 1HD1 LEU 84 1HD1 LEU 84 8.575 5.905 -11.470 1765 2HD1 LEU 84 2HD1 LEU 84 7.509 5.578 -12.836 1766 3HD1 LEU 84 3HD1 LEU 84 7.796 4.330 -11.623 1767 1HD2 LEU 84 1HD2 LEU 84 5.819 7.940 -11.104 1768 2HD2 LEU 84 2HD2 LEU 84 7.571 7.747 -11.167 1769 3HD2 LEU 84 3HD2 LEU 84 6.718 7.563 -9.634 1770 H LYS 85 H LYS 85 3.272 2.412 -12.606 1771 HA LYS 85 HA LYS 85 1.941 2.641 -9.935 1772 1HB LYS 85 1HB LYS 85 1.067 1.733 -12.695 1773 2HB LYS 85 2HB LYS 85 0.061 1.513 -11.264 1774 1HG LYS 85 1HG LYS 85 0.028 3.914 -10.861 1775 2HG LYS 85 2HG LYS 85 1.157 4.185 -12.189 1776 1HD LYS 85 1HD LYS 85 -0.476 3.361 -13.800 1777 2HD LYS 85 2HD LYS 85 -1.590 2.937 -12.500 1778 1HE LYS 85 1HE LYS 85 -0.704 5.735 -12.360 1779 2HE LYS 85 2HE LYS 85 -1.587 5.357 -13.851 1780 1HZ LYS 85 1HZ LYS 85 -2.445 4.755 -11.065 1781 2HZ LYS 85 2HZ LYS 85 -3.254 4.206 -12.454 1782 3HZ LYS 85 3HZ LYS 85 -3.165 5.869 -12.125 1783 H ARG 86 H ARG 86 2.145 0.020 -12.367 1784 HA ARG 86 HA ARG 86 2.139 -2.049 -10.348 1785 1HB ARG 86 1HB ARG 86 2.680 -1.883 -13.323 1786 2HB ARG 86 2HB ARG 86 2.765 -3.417 -12.457 1787 1HG ARG 86 1HG ARG 86 0.386 -2.442 -11.541 1788 2HG ARG 86 2HG ARG 86 0.406 -1.783 -13.177 1789 1HD ARG 86 1HD ARG 86 1.149 -4.246 -13.825 1790 2HD ARG 86 2HD ARG 86 0.354 -4.651 -12.292 1791 HE ARG 86 HE ARG 86 -1.371 -2.868 -13.626 1792 1HH1 ARG 86 1HH1 ARG 86 0.010 -6.016 -14.174 1793 2HH1 ARG 86 2HH1 ARG 86 -1.329 -6.560 -15.123 1794 1HH2 ARG 86 1HH2 ARG 86 -3.098 -3.596 -14.862 1795 2HH2 ARG 86 2HH2 ARG 86 -3.076 -5.202 -15.511 1796 H MET 87 H MET 87 3.871 -2.704 -9.147 1797 HA MET 87 HA MET 87 6.621 -2.163 -10.226 1798 1HB MET 87 1HB MET 87 5.268 -1.818 -7.595 1799 2HB MET 87 2HB MET 87 6.934 -2.390 -7.535 1800 1HG MET 87 1HG MET 87 7.548 -0.479 -9.077 1801 2HG MET 87 2HG MET 87 5.910 0.138 -8.856 1802 1HE MET 87 1HE MET 87 8.058 -1.514 -5.584 1803 2HE MET 87 2HE MET 87 9.338 -0.383 -6.023 1804 3HE MET 87 3HE MET 87 8.698 -1.501 -7.227 1805 H ARG 88 H ARG 88 7.769 -4.003 -10.646 1806 HA ARG 88 HA ARG 88 6.864 -6.568 -9.408 1807 1HB ARG 88 1HB ARG 88 8.571 -5.853 -11.820 1808 2HB ARG 88 2HB ARG 88 8.263 -7.510 -11.299 1809 1HG ARG 88 1HG ARG 88 5.940 -7.335 -11.749 1810 2HG ARG 88 2HG ARG 88 6.007 -5.575 -11.836 1811 1HD ARG 88 1HD ARG 88 5.993 -6.089 -14.111 1812 2HD ARG 88 2HD ARG 88 7.741 -6.126 -13.813 1813 HE ARG 88 HE ARG 88 6.430 -8.669 -13.225 1814 1HH1 ARG 88 1HH1 ARG 88 7.853 -6.684 -15.706 1815 2HH1 ARG 88 2HH1 ARG 88 8.238 -8.033 -16.717 1816 1HH2 ARG 88 1HH2 ARG 88 6.941 -10.403 -14.555 1817 2HH2 ARG 88 2HH2 ARG 88 7.727 -10.123 -16.073 1818 H ILE 89 H ILE 89 8.675 -8.084 -8.775 1819 HA ILE 89 HA ILE 89 11.156 -6.637 -7.931 1820 HB ILE 89 HB ILE 89 9.370 -8.450 -6.266 1821 1HG1 ILE 89 1HG1 ILE 89 10.023 -5.512 -5.903 1822 2HG1 ILE 89 2HG1 ILE 89 8.555 -6.097 -6.686 1823 1HG2 ILE 89 1HG2 ILE 89 11.354 -6.979 -4.783 1824 2HG2 ILE 89 2HG2 ILE 89 12.145 -7.917 -6.050 1825 3HG2 ILE 89 3HG2 ILE 89 11.113 -8.724 -4.869 1826 1HD1 ILE 89 1HD1 ILE 89 9.095 -7.377 -4.096 1827 2HD1 ILE 89 2HD1 ILE 89 7.598 -6.680 -4.717 1828 3HD1 ILE 89 3HD1 ILE 89 8.818 -5.639 -3.983 1829 H PHE 90 H PHE 90 12.937 -7.788 -8.560 1830 HA PHE 90 HA PHE 90 12.612 -10.736 -9.034 1831 1HB PHE 90 1HB PHE 90 14.019 -8.506 -10.512 1832 2HB PHE 90 2HB PHE 90 14.509 -10.183 -10.748 1833 HD1 PHE 90 HD1 PHE 90 12.948 -11.830 -11.722 1834 HD2 PHE 90 HD2 PHE 90 11.886 -7.687 -11.315 1835 HE1 PHE 90 HE1 PHE 90 11.054 -12.162 -13.287 1836 HE2 PHE 90 HE2 PHE 90 9.992 -8.020 -12.881 1837 HZ PHE 90 HZ PHE 90 9.576 -10.257 -13.867 1838 H THR 91 H THR 91 14.805 -11.883 -8.956 1839 HA THR 91 HA THR 91 16.407 -10.812 -6.662 1840 HB THR 91 HB THR 91 17.029 -13.265 -6.460 1841 HG1 THR 91 HG1 THR 91 16.626 -13.882 -8.578 1842 1HG2 THR 91 1HG2 THR 91 14.417 -12.020 -6.040 1843 2HG2 THR 91 2HG2 THR 91 15.352 -13.055 -4.960 1844 3HG2 THR 91 3HG2 THR 91 14.310 -13.774 -6.189 1845 H ILE 92 H ILE 92 18.169 -9.737 -7.540 1846 HA ILE 92 HA ILE 92 19.324 -10.278 -10.092 1847 HB ILE 92 HB ILE 92 21.182 -8.862 -9.156 1848 1HG1 ILE 92 1HG1 ILE 92 19.737 -8.392 -6.636 1849 2HG1 ILE 92 2HG1 ILE 92 20.474 -9.990 -6.750 1850 1HG2 ILE 92 1HG2 ILE 92 19.420 -7.037 -8.257 1851 2HG2 ILE 92 2HG2 ILE 92 18.289 -8.175 -8.991 1852 3HG2 ILE 92 3HG2 ILE 92 19.564 -7.446 -9.967 1853 1HD1 ILE 92 1HD1 ILE 92 22.475 -9.066 -6.288 1854 2HD1 ILE 92 2HD1 ILE 92 21.750 -7.458 -6.266 1855 3HD1 ILE 92 3HD1 ILE 92 22.361 -8.130 -7.778 1856 H LYS 93 H LYS 93 19.800 -11.809 -6.969 1857 HA LYS 93 HA LYS 93 21.650 -13.743 -8.253 1858 1HB LYS 93 1HB LYS 93 22.330 -12.268 -5.684 1859 2HB LYS 93 2HB LYS 93 23.368 -13.391 -6.559 1860 1HG LYS 93 1HG LYS 93 23.248 -11.790 -8.528 1861 2HG LYS 93 2HG LYS 93 22.472 -10.640 -7.439 1862 1HD LYS 93 1HD LYS 93 24.526 -11.154 -5.883 1863 2HD LYS 93 2HD LYS 93 25.282 -11.707 -7.377 1864 1HE LYS 93 1HE LYS 93 24.212 -9.328 -8.203 1865 2HE LYS 93 2HE LYS 93 24.618 -8.954 -6.517 1866 1HZ LYS 93 1HZ LYS 93 26.827 -9.714 -6.842 1867 2HZ LYS 93 2HZ LYS 93 26.494 -8.685 -8.151 1868 3HZ LYS 93 3HZ LYS 93 26.464 -10.370 -8.365 1869 HA PRO 94 HA PRO 94 19.100 -16.712 -6.125 1870 1HB PRO 94 1HB PRO 94 21.708 -17.982 -5.456 1871 2HB PRO 94 2HB PRO 94 20.313 -18.663 -6.307 1872 1HG PRO 94 1HG PRO 94 22.687 -17.580 -7.433 1873 2HG PRO 94 2HG PRO 94 21.263 -18.197 -8.277 1874 1HD PRO 94 1HD PRO 94 22.098 -15.570 -8.308 1875 2HD PRO 94 2HD PRO 94 20.455 -16.123 -8.658 1876 H ILE 95 H ILE 95 18.508 -17.115 -3.978 1877 HA ILE 95 HA ILE 95 20.262 -15.903 -1.870 1878 HB ILE 95 HB ILE 95 17.249 -15.819 -2.271 1879 1HG1 ILE 95 1HG1 ILE 95 19.097 -13.456 -2.050 1880 2HG1 ILE 95 2HG1 ILE 95 18.938 -14.303 -3.589 1881 1HG2 ILE 95 1HG2 ILE 95 17.067 -15.437 -0.061 1882 2HG2 ILE 95 2HG2 ILE 95 18.124 -14.035 -0.235 1883 3HG2 ILE 95 3HG2 ILE 95 18.811 -15.618 0.131 1884 1HD1 ILE 95 1HD1 ILE 95 16.588 -13.865 -3.692 1885 2HD1 ILE 95 2HD1 ILE 95 17.346 -12.339 -3.236 1886 3HD1 ILE 95 3HD1 ILE 95 16.547 -13.327 -2.012 1887 H ALA 96 H ALA 96 20.232 -16.975 0.159 1888 HA ALA 96 HA ALA 96 19.446 -19.816 0.056 1889 1HB ALA 96 1HB ALA 96 20.700 -18.303 2.358 1890 2HB ALA 96 2HB ALA 96 21.643 -18.738 0.932 1891 3HB ALA 96 3HB ALA 96 20.910 -19.999 1.923 1892 H ILE 97 H ILE 97 18.164 -20.772 1.800 1893 HA ILE 97 HA ILE 97 15.697 -19.525 2.292 1894 HB ILE 97 HB ILE 97 17.227 -21.701 3.760 1895 1HG1 ILE 97 1HG1 ILE 97 15.065 -22.710 2.252 1896 2HG1 ILE 97 2HG1 ILE 97 15.861 -21.523 1.219 1897 1HG2 ILE 97 1HG2 ILE 97 14.411 -22.079 3.936 1898 2HG2 ILE 97 2HG2 ILE 97 14.750 -20.432 4.466 1899 3HG2 ILE 97 3HG2 ILE 97 15.547 -21.792 5.254 1900 1HD1 ILE 97 1HD1 ILE 97 16.776 -24.164 2.026 1901 2HD1 ILE 97 2HD1 ILE 97 17.961 -22.924 2.437 1902 3HD1 ILE 97 3HD1 ILE 97 17.411 -23.100 0.771 1903 H GLY 98 H GLY 98 18.705 -19.109 4.014 1904 1HA GLY 98 1HA GLY 98 17.227 -17.688 6.190 1905 2HA GLY 98 2HA GLY 98 18.839 -18.377 6.377 1906 H GLU 99 H GLU 99 17.226 -16.078 4.126 1907 HA GLU 99 HA GLU 99 19.576 -14.262 4.561 1908 1HB GLU 99 1HB GLU 99 18.125 -15.059 2.017 1909 2HB GLU 99 2HB GLU 99 19.328 -13.771 2.091 1910 1HG GLU 99 1HG GLU 99 20.536 -15.940 3.385 1911 2HG GLU 99 2HG GLU 99 19.720 -16.653 1.994 1912 H GLU 100 H GLU 100 18.995 -11.993 3.601 1913 HA GLU 100 HA GLU 100 16.158 -11.327 4.322 1914 1HB GLU 100 1HB GLU 100 18.157 -10.653 5.859 1915 2HB GLU 100 2HB GLU 100 18.536 -9.478 4.599 1916 1HG GLU 100 1HG GLU 100 15.873 -9.031 4.875 1917 2HG GLU 100 2HG GLU 100 16.271 -9.532 6.518 1918 H ILE 101 H ILE 101 15.063 -10.498 2.590 1919 HA ILE 101 HA ILE 101 16.549 -9.679 0.178 1920 HB ILE 101 HB ILE 101 13.610 -9.981 0.887 1921 1HG1 ILE 101 1HG1 ILE 101 15.194 -11.697 -1.007 1922 2HG1 ILE 101 2HG1 ILE 101 15.270 -11.995 0.730 1923 1HG2 ILE 101 1HG2 ILE 101 14.061 -8.320 -0.958 1924 2HG2 ILE 101 2HG2 ILE 101 13.132 -9.728 -1.472 1925 3HG2 ILE 101 3HG2 ILE 101 14.850 -9.617 -1.855 1926 1HD1 ILE 101 1HD1 ILE 101 12.813 -12.198 0.808 1927 2HD1 ILE 101 2HD1 ILE 101 13.498 -13.356 -0.333 1928 3HD1 ILE 101 3HD1 ILE 101 12.729 -11.884 -0.926 1929 H THR 102 H THR 102 16.719 -7.593 -0.552 1930 HA THR 102 HA THR 102 15.044 -5.426 0.511 1931 HB THR 102 HB THR 102 17.499 -4.355 1.074 1932 HG1 THR 102 HG1 THR 102 18.630 -5.988 2.211 1933 1HG2 THR 102 1HG2 THR 102 16.246 -4.058 2.917 1934 2HG2 THR 102 2HG2 THR 102 16.766 -5.658 3.446 1935 3HG2 THR 102 3HG2 THR 102 15.260 -5.471 2.546 1936 H ILE 103 H ILE 103 16.107 -3.238 -0.406 1937 HA ILE 103 HA ILE 103 17.441 -3.729 -3.021 1938 HB ILE 103 HB ILE 103 15.658 -2.449 -4.163 1939 1HG1 ILE 103 1HG1 ILE 103 13.560 -2.420 -2.321 1940 2HG1 ILE 103 2HG1 ILE 103 14.949 -1.845 -1.399 1941 1HG2 ILE 103 1HG2 ILE 103 14.412 -4.614 -2.449 1942 2HG2 ILE 103 2HG2 ILE 103 15.483 -4.956 -3.808 1943 3HG2 ILE 103 3HG2 ILE 103 13.945 -4.138 -4.082 1944 1HD1 ILE 103 1HD1 ILE 103 13.574 -0.609 -3.733 1945 2HD1 ILE 103 2HD1 ILE 103 15.329 -0.445 -3.673 1946 3HD1 ILE 103 3HD1 ILE 103 14.341 0.160 -2.343 1947 H SER 104 H SER 104 18.916 -2.117 -3.438 1948 HA SER 104 HA SER 104 19.545 -0.112 -1.513 1949 1HB SER 104 1HB SER 104 21.089 -1.062 -3.202 1950 2HB SER 104 2HB SER 104 20.152 -0.303 -4.489 1951 HG SER 104 HG SER 104 22.131 0.795 -3.519 1952 H TYR 105 H TYR 105 19.847 2.281 -2.854 1953 HA TYR 105 HA TYR 105 17.029 3.049 -3.536 1954 1HB TYR 105 1HB TYR 105 19.159 4.580 -1.995 1955 2HB TYR 105 2HB TYR 105 17.523 5.150 -2.320 1956 HD1 TYR 105 HD1 TYR 105 19.285 4.183 0.309 1957 HD2 TYR 105 HD2 TYR 105 15.892 2.755 -1.904 1958 HE1 TYR 105 HE1 TYR 105 18.475 2.986 2.324 1959 HE2 TYR 105 HE2 TYR 105 15.081 1.558 0.112 1960 HH TYR 105 HH TYR 105 16.159 0.605 2.239 1961 H GLY 106 H GLY 106 20.107 4.882 -3.614 1962 1HA GLY 106 1HA GLY 106 20.479 4.741 -6.443 1963 2HA GLY 106 2HA GLY 106 19.539 6.183 -6.063 1964 H ASP 107 H ASP 107 21.689 7.057 -7.067 1965 HA ASP 107 HA ASP 107 24.054 7.052 -5.369 1966 1HB ASP 107 1HB ASP 107 24.815 8.701 -7.070 1967 2HB ASP 107 2HB ASP 107 24.080 7.291 -7.833 1968 H ASP 108 H ASP 108 21.093 8.800 -5.293 1969 HA ASP 108 HA ASP 108 22.360 11.054 -3.790 1970 1HB ASP 108 1HB ASP 108 20.390 10.838 -5.812 1971 2HB ASP 108 2HB ASP 108 19.526 11.310 -4.349 1972 H TYR 109 H TYR 109 19.391 9.033 -3.645 1973 HA TYR 109 HA TYR 109 18.592 9.686 -1.030 1974 1HB TYR 109 1HB TYR 109 17.656 8.139 -3.001 1975 2HB TYR 109 2HB TYR 109 18.378 6.865 -2.019 1976 HD1 TYR 109 HD1 TYR 109 16.895 5.830 -0.562 1977 HD2 TYR 109 HD2 TYR 109 16.440 10.023 -1.370 1978 HE1 TYR 109 HE1 TYR 109 14.957 5.916 0.983 1979 HE2 TYR 109 HE2 TYR 109 14.502 10.110 0.176 1980 HH TYR 109 HH TYR 109 12.734 8.207 1.014 1981 H TRP 110 H TRP 110 20.323 9.795 0.458 1982 HA TRP 110 HA TRP 110 21.862 8.975 2.038 1983 1HB TRP 110 1HB TRP 110 19.912 6.766 1.450 1984 2HB TRP 110 2HB TRP 110 21.266 6.436 2.531 1985 HD1 TRP 110 HD1 TRP 110 18.675 9.295 2.129 1986 HE1 TRP 110 HE1 TRP 110 17.881 9.986 4.482 1987 HE3 TRP 110 HE3 TRP 110 21.480 6.115 4.975 1988 HZ2 TRP 110 HZ2 TRP 110 18.371 9.283 7.211 1989 HZ3 TRP 110 HZ3 TRP 110 21.296 6.147 7.446 1990 HH2 TRP 110 HH2 TRP 110 19.747 7.725 8.567 1991 H LEU 111 H LEU 111 21.627 5.839 0.408 1992 HA LEU 111 HA LEU 111 24.372 5.317 0.305 1993 1HB LEU 111 1HB LEU 111 22.482 3.743 -0.140 1994 2HB LEU 111 2HB LEU 111 22.231 4.524 -1.702 1995 HG LEU 111 HG LEU 111 24.959 3.488 -0.989 1996 1HD1 LEU 111 1HD1 LEU 111 22.521 1.893 -1.416 1997 2HD1 LEU 111 2HD1 LEU 111 24.079 1.408 -0.746 1998 3HD1 LEU 111 3HD1 LEU 111 23.851 1.468 -2.494 1999 1HD2 LEU 111 1HD2 LEU 111 23.683 4.683 -3.240 2000 2HD2 LEU 111 2HD2 LEU 111 24.087 3.023 -3.679 2001 3HD2 LEU 111 3HD2 LEU 111 25.348 4.118 -3.112 2002 H SER 112 H SER 112 25.958 5.533 -1.356 2003 HA SER 112 HA SER 112 25.414 6.971 -3.833 2004 1HB SER 112 1HB SER 112 26.811 8.957 -3.129 2005 2HB SER 112 2HB SER 112 25.297 8.816 -2.236 2006 HG SER 112 HG SER 112 27.700 8.933 -1.240 2007 H ARG 113 H ARG 113 28.122 6.633 -1.504 2008 HA ARG 113 HA ARG 113 29.670 5.254 -3.670 2009 1HB ARG 113 1HB ARG 113 30.379 7.444 -1.710 2010 2HB ARG 113 2HB ARG 113 31.638 6.441 -2.431 2011 1HG ARG 113 1HG ARG 113 31.514 7.581 -4.372 2012 2HG ARG 113 2HG ARG 113 29.771 7.328 -4.460 2013 1HD ARG 113 1HD ARG 113 29.820 9.215 -2.529 2014 2HD ARG 113 2HD ARG 113 31.291 9.668 -3.412 2015 HE ARG 113 HE ARG 113 28.563 9.861 -4.428 2016 1HH1 ARG 113 1HH1 ARG 113 31.899 9.343 -5.275 2017 2HH1 ARG 113 2HH1 ARG 113 31.688 9.899 -6.898 2018 1HH2 ARG 113 1HH2 ARG 113 28.313 10.580 -6.540 2019 2HH2 ARG 113 2HH2 ARG 113 29.674 10.595 -7.612 2020 HA PRO 114 HA PRO 114 30.102 1.931 -0.810 2021 1HB PRO 114 1HB PRO 114 32.895 1.678 -1.816 2022 2HB PRO 114 2HB PRO 114 31.592 0.477 -1.809 2023 1HG PRO 114 1HG PRO 114 32.388 1.715 -4.052 2024 2HG PRO 114 2HG PRO 114 30.707 1.237 -3.780 2025 1HD PRO 114 1HD PRO 114 31.948 3.935 -3.673 2026 2HD PRO 114 2HD PRO 114 30.305 3.459 -4.152 2027 H ARG 115 H ARG 115 30.159 3.252 1.121 2028 HA ARG 115 HA ARG 115 32.928 3.705 2.175 2029 1HB ARG 115 1HB ARG 115 30.514 5.493 2.003 2030 2HB ARG 115 2HB ARG 115 31.641 5.709 3.341 2031 1HG ARG 115 1HG ARG 115 33.479 6.088 1.824 2032 2HG ARG 115 2HG ARG 115 32.494 5.632 0.435 2033 1HD ARG 115 1HD ARG 115 31.491 7.688 0.329 2034 2HD ARG 115 2HD ARG 115 31.373 7.821 2.094 2035 HE ARG 115 HE ARG 115 34.132 7.916 1.254 2036 1HH1 ARG 115 1HH1 ARG 115 31.207 9.799 1.384 2037 2HH1 ARG 115 2HH1 ARG 115 32.050 11.308 1.444 2038 1HH2 ARG 115 1HH2 ARG 115 35.204 9.888 1.332 2039 2HH2 ARG 115 2HH2 ARG 115 34.295 11.360 1.415 2040 H LEU 116 H LEU 116 31.766 1.357 2.835 2041 HA LEU 116 HA LEU 116 30.371 1.786 5.448 2042 1HB LEU 116 1HB LEU 116 30.320 -0.194 3.245 2043 2HB LEU 116 2HB LEU 116 30.232 -0.894 4.861 2044 HG LEU 116 HG LEU 116 28.427 0.919 5.311 2045 1HD1 LEU 116 1HD1 LEU 116 27.358 1.900 3.455 2046 2HD1 LEU 116 2HD1 LEU 116 28.079 0.758 2.321 2047 3HD1 LEU 116 3HD1 LEU 116 29.069 2.026 3.045 2048 1HD2 LEU 116 1HD2 LEU 116 27.496 -1.181 5.307 2049 2HD2 LEU 116 2HD2 LEU 116 28.234 -1.619 3.766 2050 3HD2 LEU 116 3HD2 LEU 116 26.793 -0.602 3.797 2051 H THR 117 H THR 117 31.568 1.438 7.271 2052 HA THR 117 HA THR 117 34.019 -0.280 7.042 2053 HB THR 117 HB THR 117 33.443 2.200 8.706 2054 HG1 THR 117 HG1 THR 117 33.887 2.699 6.584 2055 1HG2 THR 117 1HG2 THR 117 34.917 1.004 10.061 2056 2HG2 THR 117 2HG2 THR 117 36.041 1.907 9.046 2057 3HG2 THR 117 3HG2 THR 117 35.696 0.215 8.689 2058 H GLN 118 H GLN 118 34.343 -1.780 8.718 2059 HA GLN 118 HA GLN 118 33.692 -3.240 10.458 2060 1HB GLN 118 1HB GLN 118 33.474 -0.467 11.256 2061 2HB GLN 118 2HB GLN 118 32.249 -1.420 12.094 2062 1HG GLN 118 1HG GLN 118 34.212 -1.516 13.462 2063 2HG GLN 118 2HG GLN 118 34.107 -3.077 12.649 2064 1HE2 GLN 118 1HE2 GLN 118 36.465 -1.175 13.592 2065 2HE2 GLN 118 2HE2 GLN 118 37.510 -1.204 12.255 2066 H ASN 119 H ASN 119 31.570 -3.765 11.876 2067 HA ASN 119 HA ASN 119 29.061 -3.203 10.414 2068 1HB ASN 119 1HB ASN 119 30.711 -5.412 9.812 2069 2HB ASN 119 2HB ASN 119 29.393 -6.072 10.779 2070 1HD2 ASN 119 1HD2 ASN 119 27.393 -6.356 9.728 2071 2HD2 ASN 119 2HD2 ASN 119 27.032 -5.755 8.182 2072 1H GLY 201 1H GLY 201 22.257 16.992 19.614 2073 2H GLY 201 2H GLY 201 22.379 18.670 19.846 2074 3H GLY 201 3H GLY 201 23.656 17.653 20.313 2075 1HA GLY 201 1HA GLY 201 23.701 16.968 17.842 2076 2HA GLY 201 2HA GLY 201 22.836 18.487 17.613 2077 H LYS 202 H LYS 202 25.103 18.685 16.400 2078 HA LYS 202 HA LYS 202 27.324 19.454 18.182 2079 1HB LYS 202 1HB LYS 202 27.166 18.310 15.738 2080 2HB LYS 202 2HB LYS 202 27.311 19.996 15.244 2081 1HG LYS 202 1HG LYS 202 29.218 19.767 17.242 2082 2HG LYS 202 2HG LYS 202 29.327 18.215 16.412 2083 1HD LYS 202 1HD LYS 202 29.097 20.569 14.635 2084 2HD LYS 202 2HD LYS 202 30.592 20.482 15.567 2085 1HE LYS 202 1HE LYS 202 31.206 18.406 14.608 2086 2HE LYS 202 2HE LYS 202 29.551 18.071 14.064 2087 1HZ LYS 202 1HZ LYS 202 30.812 18.874 12.202 2088 2HZ LYS 202 2HZ LYS 202 31.361 20.219 13.082 2089 3HZ LYS 202 3HZ LYS 202 29.721 20.093 12.660 2090 H ALA 203 H ALA 203 25.341 21.080 15.671 2091 HA ALA 203 HA ALA 203 25.876 23.670 17.090 2092 1HB ALA 203 1HB ALA 203 25.346 24.129 14.342 2093 2HB ALA 203 2HB ALA 203 26.448 22.754 14.401 2094 3HB ALA 203 3HB ALA 203 26.900 24.279 15.161 2095 HA PRO 204 HA PRO 204 21.535 24.312 17.101 2096 1HB PRO 204 1HB PRO 204 21.304 26.968 16.368 2097 2HB PRO 204 2HB PRO 204 21.817 26.432 17.978 2098 1HG PRO 204 1HG PRO 204 23.446 27.410 15.691 2099 2HG PRO 204 2HG PRO 204 23.665 27.674 17.426 2100 1HD PRO 204 1HD PRO 204 25.134 25.895 15.969 2101 2HD PRO 204 2HD PRO 204 24.808 25.709 17.705 2102 H ARG 205 H ARG 205 20.868 23.007 15.314 2103 HA ARG 205 HA ARG 205 20.942 24.155 12.588 2104 1HB ARG 205 1HB ARG 205 21.324 21.680 13.501 2105 2HB ARG 205 2HB ARG 205 19.569 21.595 13.356 2106 1HG ARG 205 1HG ARG 205 19.779 21.270 11.140 2107 2HG ARG 205 2HG ARG 205 20.567 22.840 10.993 2108 1HD ARG 205 1HD ARG 205 22.716 21.617 11.784 2109 2HD ARG 205 2HD ARG 205 21.844 20.127 11.375 2110 HE ARG 205 HE ARG 205 22.022 20.725 9.090 2111 1HH1 ARG 205 1HH1 ARG 205 22.605 23.477 11.141 2112 2HH1 ARG 205 2HH1 ARG 205 23.054 24.502 9.822 2113 1HH2 ARG 205 1HH2 ARG 205 22.609 22.074 7.396 2114 2HH2 ARG 205 2HH2 ARG 205 23.057 23.716 7.718 2115 H LYS 206 H LYS 206 19.309 25.556 12.064 2116 HA LYS 206 HA LYS 206 16.676 25.336 13.413 2117 1HB LYS 206 1HB LYS 206 16.331 27.531 12.294 2118 2HB LYS 206 2HB LYS 206 17.852 27.505 13.186 2119 1HG LYS 206 1HG LYS 206 18.369 26.494 10.568 2120 2HG LYS 206 2HG LYS 206 17.445 27.986 10.392 2121 1HD LYS 206 1HD LYS 206 19.863 27.757 12.200 2122 2HD LYS 206 2HD LYS 206 19.971 28.279 10.519 2123 1HE LYS 206 1HE LYS 206 18.950 30.308 10.948 2124 2HE LYS 206 2HE LYS 206 17.937 29.638 12.242 2125 1HZ LYS 206 1HZ LYS 206 19.648 30.949 13.253 2126 2HZ LYS 206 2HZ LYS 206 20.860 30.185 12.341 2127 3HZ LYS 206 3HZ LYS 206 20.023 29.318 13.537 2128 H GLN 207 H GLN 207 17.206 23.163 11.674 2129 HA GLN 207 HA GLN 207 16.276 22.013 9.831 2130 1HB GLN 207 1HB GLN 207 14.285 22.707 11.202 2131 2HB GLN 207 2HB GLN 207 14.163 24.167 10.219 2132 1HG GLN 207 1HG GLN 207 13.245 23.046 8.468 2133 2HG GLN 207 2HG GLN 207 14.352 21.685 8.646 2134 1HE2 GLN 207 1HE2 GLN 207 11.593 23.150 10.474 2135 2HE2 GLN 207 2HE2 GLN 207 10.898 21.660 10.898 2136 H LEU 208 H LEU 208 17.955 22.763 8.336 2137 HA LEU 208 HA LEU 208 17.019 24.944 6.499 2138 1HB LEU 208 1HB LEU 208 19.454 24.480 7.970 2139 2HB LEU 208 2HB LEU 208 19.815 24.435 6.245 2140 HG LEU 208 HG LEU 208 19.984 26.738 7.133 2141 1HD1 LEU 208 1HD1 LEU 208 18.684 25.914 4.846 2142 2HD1 LEU 208 2HD1 LEU 208 19.127 27.582 5.208 2143 3HD1 LEU 208 3HD1 LEU 208 17.502 27.002 5.574 2144 1HD2 LEU 208 1HD2 LEU 208 18.444 27.607 8.540 2145 2HD2 LEU 208 2HD2 LEU 208 17.767 25.982 8.648 2146 3HD2 LEU 208 3HD2 LEU 208 17.113 27.134 7.484 2147 H ALA 209 H ALA 209 16.325 22.084 6.294 2148 HA ALA 209 HA ALA 209 17.743 21.444 3.726 2149 1HB ALA 209 1HB ALA 209 16.592 19.533 5.792 2150 2HB ALA 209 2HB ALA 209 18.291 20.000 5.724 2151 3HB ALA 209 3HB ALA 209 17.569 19.100 4.390 2152 H THR 210 H THR 210 16.236 21.947 2.156 2153 HA THR 210 HA THR 210 13.404 21.071 2.616 2154 HB THR 210 HB THR 210 13.787 23.506 2.406 2155 HG1 THR 210 HG1 THR 210 11.996 23.503 1.351 2156 1HG2 THR 210 1HG2 THR 210 15.533 24.121 1.107 2157 2HG2 THR 210 2HG2 THR 210 14.459 23.877 -0.270 2158 3HG2 THR 210 3HG2 THR 210 15.532 22.578 0.252 2159 H LYS 211 H LYS 211 15.840 19.600 1.405 2160 HA LYS 211 HA LYS 211 14.379 18.377 -0.807 2161 1HB LYS 211 1HB LYS 211 16.071 19.060 -2.519 2162 2HB LYS 211 2HB LYS 211 15.212 20.446 -1.849 2163 1HG LYS 211 1HG LYS 211 17.239 20.381 -0.106 2164 2HG LYS 211 2HG LYS 211 18.052 19.603 -1.463 2165 1HD LYS 211 1HD LYS 211 17.613 21.486 -2.902 2166 2HD LYS 211 2HD LYS 211 16.546 22.221 -1.705 2167 1HE LYS 211 1HE LYS 211 18.883 21.882 -0.266 2168 2HE LYS 211 2HE LYS 211 19.482 22.306 -1.882 2169 1HZ LYS 211 1HZ LYS 211 19.006 24.354 -0.867 2170 2HZ LYS 211 2HZ LYS 211 17.559 23.789 -0.180 2171 3HZ LYS 211 3HZ LYS 211 17.656 24.059 -1.854 2172 H ALA 212 H ALA 212 14.812 16.357 0.133 2173 HA ALA 212 HA ALA 212 17.696 15.633 0.514 2174 1HB ALA 212 1HB ALA 212 15.082 14.850 1.790 2175 2HB ALA 212 2HB ALA 212 16.582 15.355 2.566 2176 3HB ALA 212 3HB ALA 212 16.449 13.740 1.871 2177 H ALA 213 H ALA 213 15.905 15.554 -1.999 2178 HA ALA 213 HA ALA 213 15.559 14.084 -3.814 2179 1HB ALA 213 1HB ALA 213 17.477 12.082 -3.132 2180 2HB ALA 213 2HB ALA 213 18.099 13.622 -2.537 2181 3HB ALA 213 3HB ALA 213 17.687 13.436 -4.242 2182 H ARG 214 H ARG 214 15.230 11.584 -4.277 2183 HA ARG 214 HA ARG 214 13.865 10.320 -1.924 2184 1HB ARG 214 1HB ARG 214 12.939 10.854 -4.752 2185 2HB ARG 214 2HB ARG 214 12.196 9.582 -3.784 2186 1HG ARG 214 1HG ARG 214 11.215 11.074 -2.329 2187 2HG ARG 214 2HG ARG 214 12.511 12.258 -2.504 2188 1HD ARG 214 1HD ARG 214 11.517 12.309 -5.027 2189 2HD ARG 214 2HD ARG 214 10.042 11.905 -4.127 2190 HE ARG 214 HE ARG 214 11.615 14.022 -2.866 2191 1HH1 ARG 214 1HH1 ARG 214 9.189 13.275 -5.248 2192 2HH1 ARG 214 2HH1 ARG 214 8.491 14.856 -5.193 2193 1HH2 ARG 214 1HH2 ARG 214 10.691 16.067 -2.813 2194 2HH2 ARG 214 2HH2 ARG 214 9.333 16.426 -3.826 2195 1HN MLZ 215 1HN MLZ 215 13.133 7.941 -2.984 2196 HA MLZ 215 HA MLZ 215 15.580 6.463 -3.195 2197 1HB MLZ 215 1HB MLZ 215 12.756 5.709 -4.035 2198 2HB MLZ 215 2HB MLZ 215 14.047 4.589 -3.602 2199 1HG MLZ 215 1HG MLZ 215 12.188 5.946 -1.870 2200 2HG MLZ 215 2HG MLZ 215 13.831 6.442 -1.465 2201 1HD MLZ 215 1HD MLZ 215 14.261 3.807 -1.746 2202 2HD MLZ 215 2HD MLZ 215 13.740 4.510 -0.215 2203 1HE MLZ 215 1HE MLZ 215 12.394 2.474 -1.054 2204 2HE MLZ 215 2HE MLZ 215 11.733 3.572 -2.280 2205 HZ MLZ 215 HZ MLZ 215 10.300 3.850 -0.481 2206 1HCM MLZ 215 1HCM MLZ 215 11.083 2.716 1.300 2207 2HCM MLZ 215 2HCM MLZ 215 11.449 4.361 1.816 2208 3HCM MLZ 215 3HCM MLZ 215 12.711 3.363 1.096 2209 H SER 216 H SER 216 16.880 6.245 -4.963 2210 HA SER 216 HA SER 216 17.575 6.155 -7.217 2211 1HB SER 216 1HB SER 216 15.745 7.878 -8.456 2212 2HB SER 216 2HB SER 216 15.765 8.410 -6.774 2213 HG SER 216 HG SER 216 17.630 8.731 -8.682 2214 H ALA 217 H ALA 217 16.635 5.777 -9.547 2215 HA ALA 217 HA ALA 217 14.253 3.961 -9.332 2216 1HB ALA 217 1HB ALA 217 14.056 6.187 -10.588 2217 2HB ALA 217 2HB ALA 217 13.627 4.753 -11.521 2218 3HB ALA 217 3HB ALA 217 15.196 5.523 -11.758 2219 HA PRO 218 HA PRO 218 16.880 0.801 -10.901 2220 1HB PRO 218 1HB PRO 218 15.053 -0.753 -12.253 2221 2HB PRO 218 2HB PRO 218 15.177 -0.714 -10.484 2222 1HG PRO 218 1HG PRO 218 13.239 0.649 -12.286 2223 2HG PRO 218 2HG PRO 218 12.979 -0.085 -10.697 2224 1HD PRO 218 1HD PRO 218 13.214 2.608 -11.114 2225 2HD PRO 218 2HD PRO 218 13.626 1.805 -9.584 2226 H ALA 219 H ALA 219 15.393 3.054 -12.937 2227 HA ALA 219 HA ALA 219 15.782 3.674 -15.179 2228 1HB ALA 219 1HB ALA 219 18.185 1.843 -14.894 2229 2HB ALA 219 2HB ALA 219 18.116 3.437 -14.143 2230 3HB ALA 219 3HB ALA 219 18.048 3.286 -15.899 2231 H THR 220 H THR 220 16.102 2.661 -17.444 2232 HA THR 220 HA THR 220 14.597 0.091 -17.519 2233 HB THR 220 HB THR 220 14.518 0.907 -20.027 2234 HG1 THR 220 HG1 THR 220 15.783 2.581 -20.208 2235 1HG2 THR 220 1HG2 THR 220 13.169 2.424 -17.771 2236 2HG2 THR 220 2HG2 THR 220 12.588 0.932 -18.511 2237 3HG2 THR 220 3HG2 THR 220 12.634 2.423 -19.452 2238 H GLY 221 H GLY 221 15.285 -1.034 -19.842 2239 1HA GLY 221 1HA GLY 221 17.527 -1.328 -21.126 2240 2HA GLY 221 2HA GLY 221 18.196 -1.609 -19.518 2241 1HN SAH 301 1HN SAH 301 -11.398 -1.665 -7.183 2242 2HN SAH 301 2HN SAH 301 -9.789 -1.141 -7.020 2243 HA SAH 301 HA SAH 301 -12.183 0.528 -7.567 2244 1HB SAH 301 1HB SAH 301 -10.759 -0.371 -5.283 2245 2HB SAH 301 2HB SAH 301 -10.349 1.332 -5.484 2246 1HG SAH 301 1HG SAH 301 -12.804 0.172 -4.517 2247 2HG SAH 301 2HG SAH 301 -13.138 1.095 -5.980 2248 1H5* SAH 301 1H5* SAH 301 -14.648 2.064 -4.481 2249 2H5* SAH 301 2H5* SAH 301 -14.349 3.326 -3.285 2250 H4* SAH 301 H4* SAH 301 -13.392 4.561 -5.390 2251 H3* SAH 301 H3* SAH 301 -15.857 4.510 -3.897 2252 *HO3 SAH 301 *HO3 SAH 301 -14.268 6.324 -5.302 2253 H2* SAH 301 H2* SAH 301 -17.413 4.285 -5.488 2254 *HO2 SAH 301 *HO2 SAH 301 -16.664 5.855 -7.480 2255 H1* SAH 301 H1* SAH 301 -15.870 4.211 -7.913 2256 H8 SAH 301 H8 SAH 301 -15.704 0.980 -6.130 2257 1HN6 SAH 301 1HN6 SAH 301 -21.559 -0.202 -7.503 2258 2HN6 SAH 301 2HN6 SAH 301 -20.233 -0.689 -6.473 2259 H2 SAH 301 H2 SAH 301 -20.678 4.051 -8.726 2260 1HN SAH 302 1HN SAH 302 11.452 -1.694 7.194 2261 2HN SAH 302 2HN SAH 302 9.845 -1.162 7.043 2262 HA SAH 302 HA SAH 302 12.257 0.485 7.577 2263 1HB SAH 302 1HB SAH 302 10.806 -0.397 5.302 2264 2HB SAH 302 2HB SAH 302 10.408 1.309 5.509 2265 1HG SAH 302 1HG SAH 302 12.848 0.136 4.520 2266 2HG SAH 302 2HG SAH 302 13.198 1.056 5.982 2267 1H5* SAH 302 1H5* SAH 302 14.702 2.017 4.473 2268 2H5* SAH 302 2H5* SAH 302 14.402 3.281 3.281 2269 H4* SAH 302 H4* SAH 302 13.469 4.519 5.394 2270 H3* SAH 302 H3* SAH 302 15.922 4.456 3.882 2271 *HO3 SAH 302 *HO3 SAH 302 14.354 6.278 5.302 2272 H2* SAH 302 H2* SAH 302 17.488 4.220 5.462 2273 *HO2 SAH 302 *HO2 SAH 302 16.762 5.793 7.461 2274 H1* SAH 302 H1* SAH 302 15.962 4.152 7.898 2275 H8 SAH 302 H8 SAH 302 15.764 0.923 6.113 2276 1HN6 SAH 302 1HN6 SAH 302 21.624 -0.293 7.442 2277 2HN6 SAH 302 2HN6 SAH 302 20.287 -0.771 6.421 2278 H2 SAH 302 H2 SAH 302 20.775 3.964 8.676 Start of MODEL 18 1 1H MET 1 1H MET 1 0.872 -11.352 -8.771 2 2H MET 1 2H MET 1 1.465 -11.052 -7.208 3 3H MET 1 3H MET 1 1.611 -9.865 -8.414 4 HA MET 1 HA MET 1 -0.198 -9.358 -6.837 5 1HB MET 1 1HB MET 1 -0.400 -9.823 -9.778 6 2HB MET 1 2HB MET 1 -1.900 -9.420 -8.943 7 1HG MET 1 1HG MET 1 0.587 -7.801 -8.447 8 2HG MET 1 2HG MET 1 -0.415 -7.478 -9.862 9 1HE MET 1 1HE MET 1 -0.922 -5.366 -9.500 10 2HE MET 1 2HE MET 1 -0.309 -4.918 -7.908 11 3HE MET 1 3HE MET 1 -2.006 -4.649 -8.308 12 H PHE 2 H PHE 2 -1.265 -11.950 -9.076 13 HA PHE 2 HA PHE 2 -3.556 -12.769 -7.688 14 1HB PHE 2 1HB PHE 2 -3.110 -14.960 -8.867 15 2HB PHE 2 2HB PHE 2 -2.955 -13.552 -9.916 16 HD1 PHE 2 HD1 PHE 2 -1.014 -15.986 -7.865 17 HD2 PHE 2 HD2 PHE 2 -0.894 -13.022 -10.972 18 HE1 PHE 2 HE1 PHE 2 1.326 -16.624 -8.384 19 HE2 PHE 2 HE2 PHE 2 1.445 -13.660 -11.491 20 HZ PHE 2 HZ PHE 2 2.555 -15.460 -10.196 21 H ASN 3 H ASN 3 -3.946 -14.144 -5.951 22 HA ASN 3 HA ASN 3 -1.599 -15.422 -4.612 23 1HB ASN 3 1HB ASN 3 -3.288 -13.185 -3.749 24 2HB ASN 3 2HB ASN 3 -3.258 -14.493 -2.567 25 1HD2 ASN 3 1HD2 ASN 3 -1.767 -11.673 -3.024 26 2HD2 ASN 3 2HD2 ASN 3 -0.182 -12.049 -2.547 27 H ASP 4 H ASP 4 -2.108 -17.394 -3.630 28 HA ASP 4 HA ASP 4 -4.157 -19.023 -4.525 29 1HB ASP 4 1HB ASP 4 -2.111 -19.574 -3.133 30 2HB ASP 4 2HB ASP 4 -3.005 -19.029 -1.714 31 H ARG 5 H ARG 5 -4.261 -17.141 -1.465 32 HA ARG 5 HA ARG 5 -6.953 -17.916 -0.802 33 1HB ARG 5 1HB ARG 5 -4.896 -15.927 0.049 34 2HB ARG 5 2HB ARG 5 -6.559 -15.601 0.539 35 1HG ARG 5 1HG ARG 5 -5.061 -18.194 1.031 36 2HG ARG 5 2HG ARG 5 -5.368 -16.947 2.240 37 1HD ARG 5 1HD ARG 5 -7.880 -17.510 1.063 38 2HD ARG 5 2HD ARG 5 -7.116 -19.078 1.383 39 HE ARG 5 HE ARG 5 -6.806 -17.144 3.563 40 1HH1 ARG 5 1HH1 ARG 5 -8.791 -19.645 2.175 41 2HH1 ARG 5 2HH1 ARG 5 -9.552 -20.026 3.680 42 1HH2 ARG 5 1HH2 ARG 5 -7.809 -17.656 5.502 43 2HH2 ARG 5 2HH2 ARG 5 -9.003 -18.910 5.550 44 H VAL 6 H VAL 6 -5.600 -15.139 -2.575 45 HA VAL 6 HA VAL 6 -8.279 -14.593 -3.714 46 HB VAL 6 HB VAL 6 -6.680 -12.631 -2.025 47 1HG1 VAL 6 1HG1 VAL 6 -9.380 -12.153 -3.294 48 2HG1 VAL 6 2HG1 VAL 6 -7.879 -11.723 -4.114 49 3HG1 VAL 6 3HG1 VAL 6 -8.288 -10.970 -2.573 50 1HG2 VAL 6 1HG2 VAL 6 -7.887 -14.090 -0.579 51 2HG2 VAL 6 2HG2 VAL 6 -9.299 -14.091 -1.637 52 3HG2 VAL 6 3HG2 VAL 6 -8.886 -12.644 -0.717 53 H ILE 7 H ILE 7 -8.124 -13.403 -5.690 54 HA ILE 7 HA ILE 7 -5.314 -12.953 -6.655 55 HB ILE 7 HB ILE 7 -6.500 -14.840 -7.708 56 1HG1 ILE 7 1HG1 ILE 7 -6.513 -12.504 -9.634 57 2HG1 ILE 7 2HG1 ILE 7 -5.029 -13.270 -9.069 58 1HG2 ILE 7 1HG2 ILE 7 -8.742 -14.703 -7.878 59 2HG2 ILE 7 2HG2 ILE 7 -8.513 -13.569 -9.209 60 3HG2 ILE 7 3HG2 ILE 7 -8.706 -12.968 -7.563 61 1HD1 ILE 7 1HD1 ILE 7 -6.110 -15.489 -9.839 62 2HD1 ILE 7 2HD1 ILE 7 -5.523 -14.396 -11.093 63 3HD1 ILE 7 3HD1 ILE 7 -7.247 -14.474 -10.726 64 H VAL 8 H VAL 8 -5.207 -11.256 -8.428 65 HA VAL 8 HA VAL 8 -6.915 -8.935 -7.672 66 HB VAL 8 HB VAL 8 -4.331 -9.222 -9.250 67 1HG1 VAL 8 1HG1 VAL 8 -6.163 -7.134 -9.350 68 2HG1 VAL 8 2HG1 VAL 8 -4.453 -7.022 -9.768 69 3HG1 VAL 8 3HG1 VAL 8 -4.995 -6.594 -8.145 70 1HG2 VAL 8 1HG2 VAL 8 -4.833 -9.345 -6.486 71 2HG2 VAL 8 2HG2 VAL 8 -4.221 -7.716 -6.772 72 3HG2 VAL 8 3HG2 VAL 8 -3.267 -9.116 -7.264 73 H LYS 9 H LYS 9 -8.527 -8.317 -9.033 74 HA LYS 9 HA LYS 9 -8.262 -8.756 -11.941 75 1HB LYS 9 1HB LYS 9 -9.762 -10.356 -10.116 76 2HB LYS 9 2HB LYS 9 -10.847 -9.609 -11.271 77 1HG LYS 9 1HG LYS 9 -10.240 -11.215 -12.732 78 2HG LYS 9 2HG LYS 9 -8.653 -10.447 -12.795 79 1HD LYS 9 1HD LYS 9 -7.718 -11.979 -11.345 80 2HD LYS 9 2HD LYS 9 -9.245 -12.245 -10.499 81 1HE LYS 9 1HE LYS 9 -9.301 -14.198 -11.701 82 2HE LYS 9 2HE LYS 9 -9.826 -13.163 -13.038 83 1HZ LYS 9 1HZ LYS 9 -7.667 -12.966 -13.840 84 2HZ LYS 9 2HZ LYS 9 -7.730 -14.596 -13.369 85 3HZ LYS 9 3HZ LYS 9 -6.960 -13.455 -12.376 86 H LYS 10 H LYS 10 -10.049 -5.631 -12.056 87 HA LYS 10 HA LYS 10 -8.409 -5.676 -13.709 88 1HB LYS 10 1HB LYS 10 -7.274 -6.653 -11.329 89 2HB LYS 10 2HB LYS 10 -6.735 -7.764 -12.588 90 1HG LYS 10 1HG LYS 10 -6.552 -4.748 -12.812 91 2HG LYS 10 2HG LYS 10 -5.225 -5.774 -12.267 92 1HD LYS 10 1HD LYS 10 -4.925 -6.731 -14.363 93 2HD LYS 10 2HD LYS 10 -6.599 -6.450 -14.844 94 1HE LYS 10 1HE LYS 10 -6.102 -3.986 -14.923 95 2HE LYS 10 2HE LYS 10 -4.397 -4.366 -14.614 96 1HZ LYS 10 1HZ LYS 10 -4.639 -6.004 -16.522 97 2HZ LYS 10 2HZ LYS 10 -4.602 -4.359 -16.943 98 3HZ LYS 10 3HZ LYS 10 -6.080 -5.195 -16.911 99 H SER 11 H SER 11 -10.376 -6.848 -14.764 100 HA SER 11 HA SER 11 -9.384 -8.972 -16.368 101 1HB SER 11 1HB SER 11 -9.639 -10.660 -14.885 102 2HB SER 11 2HB SER 11 -10.640 -9.668 -13.829 103 HG SER 11 HG SER 11 -12.407 -10.123 -15.114 104 HA PRO 12 HA PRO 12 -13.935 -8.278 -17.414 105 1HB PRO 12 1HB PRO 12 -15.079 -6.426 -15.460 106 2HB PRO 12 2HB PRO 12 -15.572 -8.090 -15.819 107 1HG PRO 12 1HG PRO 12 -14.383 -7.359 -13.493 108 2HG PRO 12 2HG PRO 12 -14.235 -8.969 -14.186 109 1HD PRO 12 1HD PRO 12 -12.335 -6.670 -14.257 110 2HD PRO 12 2HD PRO 12 -12.024 -8.390 -13.963 111 H LEU 13 H LEU 13 -15.458 -5.785 -17.257 112 HA LEU 13 HA LEU 13 -13.590 -4.038 -18.787 113 1HB LEU 13 1HB LEU 13 -16.179 -5.005 -19.179 114 2HB LEU 13 2HB LEU 13 -16.434 -3.330 -18.691 115 HG LEU 13 HG LEU 13 -14.411 -2.954 -20.423 116 1HD1 LEU 13 1HD1 LEU 13 -15.872 -5.435 -21.377 117 2HD1 LEU 13 2HD1 LEU 13 -14.153 -5.302 -21.004 118 3HD1 LEU 13 3HD1 LEU 13 -14.823 -4.449 -22.395 119 1HD2 LEU 13 1HD2 LEU 13 -16.502 -1.783 -20.611 120 2HD2 LEU 13 2HD2 LEU 13 -17.362 -3.265 -21.027 121 3HD2 LEU 13 3HD2 LEU 13 -16.216 -2.562 -22.167 122 H GLY 14 H GLY 14 -15.125 -4.230 -15.715 123 1HA GLY 14 1HA GLY 14 -15.598 -1.453 -15.206 124 2HA GLY 14 2HA GLY 14 -15.342 -2.682 -13.968 125 H GLY 15 H GLY 15 -13.819 -1.714 -12.655 126 1HA GLY 15 1HA GLY 15 -11.370 -0.630 -13.980 127 2HA GLY 15 2HA GLY 15 -11.941 -0.126 -12.390 128 H TYR 16 H TYR 16 -10.105 -0.737 -11.215 129 HA TYR 16 HA TYR 16 -9.136 -3.539 -11.456 130 1HB TYR 16 1HB TYR 16 -8.162 -0.972 -10.185 131 2HB TYR 16 2HB TYR 16 -7.386 -2.513 -9.831 132 HD1 TYR 16 HD1 TYR 16 -8.640 -0.613 -12.823 133 HD2 TYR 16 HD2 TYR 16 -5.562 -3.096 -11.146 134 HE1 TYR 16 HE1 TYR 16 -7.355 -0.449 -14.938 135 HE2 TYR 16 HE2 TYR 16 -4.277 -2.932 -13.261 136 HH TYR 16 HH TYR 16 -4.614 -0.718 -15.447 137 H GLY 17 H GLY 17 -10.465 -4.881 -10.240 138 1HA GLY 17 1HA GLY 17 -10.950 -4.074 -7.397 139 2HA GLY 17 2HA GLY 17 -12.090 -5.058 -8.317 140 H VAL 18 H VAL 18 -11.591 -6.507 -6.286 141 HA VAL 18 HA VAL 18 -9.213 -8.210 -6.996 142 HB VAL 18 HB VAL 18 -8.696 -7.081 -4.953 143 1HG1 VAL 18 1HG1 VAL 18 -10.646 -7.630 -3.076 144 2HG1 VAL 18 2HG1 VAL 18 -11.582 -7.283 -4.526 145 3HG1 VAL 18 3HG1 VAL 18 -10.436 -6.092 -3.916 146 1HG2 VAL 18 1HG2 VAL 18 -8.584 -9.693 -5.010 147 2HG2 VAL 18 2HG2 VAL 18 -9.915 -9.601 -3.855 148 3HG2 VAL 18 3HG2 VAL 18 -8.361 -8.861 -3.471 149 H PHE 19 H PHE 19 -9.702 -10.337 -7.372 150 HA PHE 19 HA PHE 19 -12.538 -11.167 -7.086 151 1HB PHE 19 1HB PHE 19 -10.101 -11.956 -8.646 152 2HB PHE 19 2HB PHE 19 -11.348 -13.176 -8.403 153 HD1 PHE 19 HD1 PHE 19 -11.952 -13.284 -10.758 154 HD2 PHE 19 HD2 PHE 19 -12.160 -9.566 -8.611 155 HE1 PHE 19 HE1 PHE 19 -13.275 -12.290 -12.603 156 HE2 PHE 19 HE2 PHE 19 -13.484 -8.575 -10.459 157 HZ PHE 19 HZ PHE 19 -14.036 -9.937 -12.457 158 H ALA 20 H ALA 20 -12.968 -13.403 -6.286 159 HA ALA 20 HA ALA 20 -11.027 -14.232 -4.154 160 1HB ALA 20 1HB ALA 20 -13.665 -15.028 -3.501 161 2HB ALA 20 2HB ALA 20 -13.786 -13.373 -4.099 162 3HB ALA 20 3HB ALA 20 -12.723 -13.746 -2.741 163 H ARG 21 H ARG 21 -10.093 -15.988 -5.299 164 HA ARG 21 HA ARG 21 -11.484 -17.868 -6.933 165 1HB ARG 21 1HB ARG 21 -8.894 -17.503 -5.617 166 2HB ARG 21 2HB ARG 21 -9.361 -19.203 -5.683 167 1HG ARG 21 1HG ARG 21 -9.050 -19.300 -7.923 168 2HG ARG 21 2HG ARG 21 -9.913 -17.784 -8.185 169 1HD ARG 21 1HD ARG 21 -7.948 -16.684 -8.448 170 2HD ARG 21 2HD ARG 21 -7.383 -17.262 -6.869 171 HE ARG 21 HE ARG 21 -6.764 -18.470 -9.459 172 1HH1 ARG 21 1HH1 ARG 21 -7.186 -19.029 -6.049 173 2HH1 ARG 21 2HH1 ARG 21 -6.185 -20.440 -6.045 174 1HH2 ARG 21 1HH2 ARG 21 -5.469 -20.303 -9.428 175 2HH2 ARG 21 2HH2 ARG 21 -5.220 -21.158 -7.942 176 H LYS 22 H LYS 22 -11.418 -17.453 -3.492 177 HA LYS 22 HA LYS 22 -12.371 -20.206 -2.949 178 1HB LYS 22 1HB LYS 22 -12.057 -17.810 -1.099 179 2HB LYS 22 2HB LYS 22 -12.114 -19.507 -0.634 180 1HG LYS 22 1HG LYS 22 -10.038 -19.363 -2.507 181 2HG LYS 22 2HG LYS 22 -9.837 -17.930 -1.500 182 1HD LYS 22 1HD LYS 22 -9.354 -19.153 0.375 183 2HD LYS 22 2HD LYS 22 -10.463 -20.452 -0.063 184 1HE LYS 22 1HE LYS 22 -8.113 -20.136 -1.854 185 2HE LYS 22 2HE LYS 22 -7.761 -20.714 -0.214 186 1HZ LYS 22 1HZ LYS 22 -9.724 -21.834 -2.148 187 2HZ LYS 22 2HZ LYS 22 -9.669 -22.281 -0.510 188 3HZ LYS 22 3HZ LYS 22 -8.345 -22.604 -1.523 189 H SER 23 H SER 23 -15.741 -19.140 -1.866 190 HA SER 23 HA SER 23 -13.385 -20.875 -1.277 191 1HB SER 23 1HB SER 23 -15.512 -21.900 -2.013 192 2HB SER 23 2HB SER 23 -15.172 -22.344 -0.339 193 HG SER 23 HG SER 23 -16.972 -21.437 0.170 194 H PHE 24 H PHE 24 -15.366 -18.358 0.075 195 HA PHE 24 HA PHE 24 -13.934 -18.695 2.685 196 1HB PHE 24 1HB PHE 24 -15.091 -16.344 1.157 197 2HB PHE 24 2HB PHE 24 -14.560 -16.203 2.833 198 HD1 PHE 24 HD1 PHE 24 -12.169 -17.773 3.037 199 HD2 PHE 24 HD2 PHE 24 -13.515 -15.358 -0.251 200 HE1 PHE 24 HE1 PHE 24 -9.822 -17.506 2.272 201 HE2 PHE 24 HE2 PHE 24 -11.171 -15.092 -1.015 202 HZ PHE 24 HZ PHE 24 -9.326 -16.166 0.246 203 H GLU 25 H GLU 25 -15.181 -18.197 4.641 204 HA GLU 25 HA GLU 25 -18.055 -18.948 4.354 205 1HB GLU 25 1HB GLU 25 -15.876 -19.613 6.090 206 2HB GLU 25 2HB GLU 25 -17.112 -18.816 7.065 207 1HG GLU 25 1HG GLU 25 -18.808 -20.368 5.991 208 2HG GLU 25 2HG GLU 25 -17.450 -21.252 5.296 209 H LYS 26 H LYS 26 -18.897 -17.902 6.859 210 HA LYS 26 HA LYS 26 -19.061 -15.011 6.170 211 1HB LYS 26 1HB LYS 26 -21.020 -16.672 6.616 212 2HB LYS 26 2HB LYS 26 -20.584 -16.500 8.311 213 1HG LYS 26 1HG LYS 26 -20.871 -14.061 8.157 214 2HG LYS 26 2HG LYS 26 -21.275 -14.213 6.448 215 1HD LYS 26 1HD LYS 26 -23.269 -15.481 6.961 216 2HD LYS 26 2HD LYS 26 -22.823 -15.582 8.665 217 1HE LYS 26 1HE LYS 26 -22.773 -12.871 8.287 218 2HE LYS 26 2HE LYS 26 -24.075 -13.347 7.181 219 1HZ LYS 26 1HZ LYS 26 -24.914 -14.785 9.040 220 2HZ LYS 26 2HZ LYS 26 -25.047 -13.115 9.322 221 3HZ LYS 26 3HZ LYS 26 -23.807 -14.006 10.066 222 H GLY 27 H GLY 27 -16.990 -14.331 7.033 223 1HA GLY 27 1HA GLY 27 -16.442 -13.037 9.153 224 2HA GLY 27 2HA GLY 27 -16.793 -14.537 10.013 225 H GLU 28 H GLU 28 -14.887 -13.793 7.069 226 HA GLU 28 HA GLU 28 -12.558 -15.147 8.392 227 1HB GLU 28 1HB GLU 28 -14.057 -15.685 5.932 228 2HB GLU 28 2HB GLU 28 -12.327 -15.516 5.631 229 1HG GLU 28 1HG GLU 28 -13.073 -17.132 8.006 230 2HG GLU 28 2HG GLU 28 -13.476 -17.839 6.441 231 H LEU 29 H LEU 29 -10.650 -13.998 8.276 232 HA LEU 29 HA LEU 29 -10.668 -11.294 7.197 233 1HB LEU 29 1HB LEU 29 -9.465 -12.373 9.262 234 2HB LEU 29 2HB LEU 29 -8.250 -12.874 8.088 235 HG LEU 29 HG LEU 29 -7.672 -10.705 9.146 236 1HD1 LEU 29 1HD1 LEU 29 -7.379 -11.372 6.567 237 2HD1 LEU 29 2HD1 LEU 29 -6.860 -9.804 7.188 238 3HD1 LEU 29 3HD1 LEU 29 -8.407 -9.955 6.354 239 1HD2 LEU 29 1HD2 LEU 29 -9.222 -9.102 9.456 240 2HD2 LEU 29 2HD2 LEU 29 -10.428 -10.209 8.800 241 3HD2 LEU 29 3HD2 LEU 29 -9.598 -9.077 7.733 242 H VAL 30 H VAL 30 -10.679 -11.181 4.955 243 HA VAL 30 HA VAL 30 -9.375 -13.064 3.210 244 HB VAL 30 HB VAL 30 -10.331 -10.197 2.869 245 1HG1 VAL 30 1HG1 VAL 30 -8.840 -11.895 1.087 246 2HG1 VAL 30 2HG1 VAL 30 -9.452 -10.267 0.798 247 3HG1 VAL 30 3HG1 VAL 30 -10.466 -11.666 0.443 248 1HG2 VAL 30 1HG2 VAL 30 -11.872 -12.313 1.600 249 2HG2 VAL 30 2HG2 VAL 30 -12.409 -11.063 2.722 250 3HG2 VAL 30 3HG2 VAL 30 -11.738 -12.573 3.339 251 H GLU 31 H GLU 31 -8.466 -9.778 4.306 252 HA GLU 31 HA GLU 31 -5.625 -10.430 4.216 253 1HB GLU 31 1HB GLU 31 -6.986 -9.545 1.853 254 2HB GLU 31 2HB GLU 31 -5.917 -8.244 2.380 255 1HG GLU 31 1HG GLU 31 -4.748 -10.962 2.493 256 2HG GLU 31 2HG GLU 31 -5.092 -10.360 0.872 257 H GLU 32 H GLU 32 -4.357 -8.716 5.159 258 HA GLU 32 HA GLU 32 -5.864 -6.302 6.069 259 1HB GLU 32 1HB GLU 32 -5.016 -6.720 8.358 260 2HB GLU 32 2HB GLU 32 -5.972 -8.090 7.794 261 1HG GLU 32 1HG GLU 32 -3.680 -9.027 6.958 262 2HG GLU 32 2HG GLU 32 -2.983 -7.866 8.088 263 H CYS 33 H CYS 33 -4.567 -4.459 6.194 264 HA CYS 33 HA CYS 33 -1.612 -4.767 5.993 265 1HB CYS 33 1HB CYS 33 -3.490 -4.024 3.882 266 2HB CYS 33 2HB CYS 33 -2.294 -2.757 4.156 267 HG CYS 33 HG CYS 33 -0.720 -5.226 4.055 268 H LEU 34 H LEU 34 -0.743 -2.288 5.840 269 HA LEU 34 HA LEU 34 -1.925 -0.938 8.204 270 1HB LEU 34 1HB LEU 34 0.671 -1.264 6.910 271 2HB LEU 34 2HB LEU 34 0.357 0.411 7.304 272 HG LEU 34 HG LEU 34 -0.436 -0.561 9.607 273 1HD1 LEU 34 1HD1 LEU 34 -0.292 -2.834 9.460 274 2HD1 LEU 34 2HD1 LEU 34 1.387 -2.528 9.910 275 3HD1 LEU 34 3HD1 LEU 34 0.956 -2.764 8.216 276 1HD2 LEU 34 1HD2 LEU 34 2.280 0.063 8.549 277 2HD2 LEU 34 2HD2 LEU 34 2.203 -0.684 10.145 278 3HD2 LEU 34 3HD2 LEU 34 1.374 0.843 9.846 279 H CYS 35 H CYS 35 -1.605 1.642 7.928 280 HA CYS 35 HA CYS 35 -2.476 2.541 5.230 281 1HB CYS 35 1HB CYS 35 -4.472 3.628 6.288 282 2HB CYS 35 2HB CYS 35 -4.515 1.874 6.443 283 HG CYS 35 HG CYS 35 -4.495 3.777 8.746 284 H ILE 36 H ILE 36 -2.796 5.046 5.342 285 HA ILE 36 HA ILE 36 -0.550 6.167 6.985 286 HB ILE 36 HB ILE 36 -1.977 7.248 4.525 287 1HG1 ILE 36 1HG1 ILE 36 0.653 5.756 4.772 288 2HG1 ILE 36 2HG1 ILE 36 -0.823 5.128 4.039 289 1HG2 ILE 36 1HG2 ILE 36 0.633 8.252 4.712 290 2HG2 ILE 36 2HG2 ILE 36 0.007 8.323 6.359 291 3HG2 ILE 36 3HG2 ILE 36 -0.856 9.133 5.051 292 1HD1 ILE 36 1HD1 ILE 36 0.924 6.098 2.429 293 2HD1 ILE 36 2HD1 ILE 36 0.484 7.679 3.076 294 3HD1 ILE 36 3HD1 ILE 36 -0.725 6.697 2.250 295 H VAL 37 H VAL 37 -1.591 6.776 8.920 296 HA VAL 37 HA VAL 37 -4.201 8.119 8.850 297 HB VAL 37 HB VAL 37 -2.218 7.688 11.118 298 1HG1 VAL 37 1HG1 VAL 37 -5.233 8.045 11.137 299 2HG1 VAL 37 2HG1 VAL 37 -4.066 9.302 11.555 300 3HG1 VAL 37 3HG1 VAL 37 -4.191 7.850 12.550 301 1HG2 VAL 37 1HG2 VAL 37 -2.934 5.599 9.802 302 2HG2 VAL 37 2HG2 VAL 37 -4.559 5.910 10.412 303 3HG2 VAL 37 3HG2 VAL 37 -3.242 5.579 11.539 304 H ARG 38 H ARG 38 -3.792 10.108 7.736 305 HA ARG 38 HA ARG 38 -1.949 12.010 9.144 306 1HB ARG 38 1HB ARG 38 -1.352 11.373 6.815 307 2HB ARG 38 2HB ARG 38 -2.934 11.926 6.267 308 1HG ARG 38 1HG ARG 38 -1.501 13.762 5.840 309 2HG ARG 38 2HG ARG 38 -2.305 14.187 7.350 310 1HD ARG 38 1HD ARG 38 -0.385 13.811 8.630 311 2HD ARG 38 2HD ARG 38 0.298 12.676 7.450 312 HE ARG 38 HE ARG 38 0.036 15.148 6.119 313 1HH1 ARG 38 1HH1 ARG 38 1.747 13.851 8.859 314 2HH1 ARG 38 2HH1 ARG 38 3.070 14.951 8.693 315 1HH2 ARG 38 1HH2 ARG 38 1.764 16.566 5.924 316 2HH2 ARG 38 2HH2 ARG 38 3.082 16.478 7.044 317 H HIS 39 H HIS 39 -2.735 14.205 9.392 318 HA HIS 39 HA HIS 39 -5.470 14.476 10.148 319 1HB HIS 39 1HB HIS 39 -3.066 16.176 9.728 320 2HB HIS 39 2HB HIS 39 -4.611 17.028 9.707 321 HD1 HIS 39 HD1 HIS 39 -3.327 17.942 12.054 322 HD2 HIS 39 HD2 HIS 39 -5.033 14.138 12.087 323 HE1 HIS 39 HE1 HIS 39 -3.649 17.323 14.489 324 H ASN 40 H ASN 40 -6.460 16.769 9.002 325 HA ASN 40 HA ASN 40 -6.930 15.919 6.168 326 1HB ASN 40 1HB ASN 40 -8.556 16.938 8.425 327 2HB ASN 40 2HB ASN 40 -8.975 17.609 6.849 328 1HD2 ASN 40 1HD2 ASN 40 -9.793 15.117 8.874 329 2HD2 ASN 40 2HD2 ASN 40 -10.291 13.966 7.730 330 H ASP 41 H ASP 41 -5.816 17.198 4.768 331 HA ASP 41 HA ASP 41 -6.186 20.052 4.637 332 1HB ASP 41 1HB ASP 41 -4.579 19.452 6.671 333 2HB ASP 41 2HB ASP 41 -3.373 19.293 5.395 334 H ASP 42 H ASP 42 -3.231 20.207 3.591 335 HA ASP 42 HA ASP 42 -3.654 19.790 0.845 336 1HB ASP 42 1HB ASP 42 -1.236 19.701 2.662 337 2HB ASP 42 2HB ASP 42 -1.063 19.504 0.918 338 H TRP 43 H TRP 43 -2.952 17.485 3.370 339 HA TRP 43 HA TRP 43 -2.015 15.256 1.879 340 1HB TRP 43 1HB TRP 43 -1.914 15.157 4.237 341 2HB TRP 43 2HB TRP 43 -3.557 15.757 4.427 342 HD1 TRP 43 HD1 TRP 43 -5.302 14.020 5.002 343 HE1 TRP 43 HE1 TRP 43 -5.473 11.452 4.849 344 HE3 TRP 43 HE3 TRP 43 -0.921 12.977 2.586 345 HZ2 TRP 43 HZ2 TRP 43 -3.958 9.253 3.840 346 HZ3 TRP 43 HZ3 TRP 43 -0.312 10.638 2.043 347 HH2 TRP 43 HH2 TRP 43 -1.824 8.774 2.666 348 H GLY 44 H GLY 44 -5.387 15.977 2.898 349 1HA GLY 44 1HA GLY 44 -6.620 13.918 1.390 350 2HA GLY 44 2HA GLY 44 -7.429 15.401 1.897 351 H THR 45 H THR 45 -5.712 17.224 0.477 352 HA THR 45 HA THR 45 -7.002 17.291 -2.073 353 HB THR 45 HB THR 45 -4.355 18.563 -1.308 354 HG1 THR 45 HG1 THR 45 -5.679 20.192 -0.369 355 1HG2 THR 45 1HG2 THR 45 -5.899 18.745 -3.597 356 2HG2 THR 45 2HG2 THR 45 -4.724 19.948 -3.064 357 3HG2 THR 45 3HG2 THR 45 -6.430 20.140 -2.658 358 H ALA 46 H ALA 46 -3.487 16.831 -1.498 359 HA ALA 46 HA ALA 46 -2.839 15.908 -4.086 360 1HB ALA 46 1HB ALA 46 -0.804 15.139 -3.008 361 2HB ALA 46 2HB ALA 46 -1.622 15.007 -1.451 362 3HB ALA 46 3HB ALA 46 -1.327 16.595 -2.160 363 H LEU 47 H LEU 47 -3.693 13.988 -1.184 364 HA LEU 47 HA LEU 47 -3.785 11.513 -2.804 365 1HB LEU 47 1HB LEU 47 -3.972 12.298 0.103 366 2HB LEU 47 2HB LEU 47 -4.482 10.687 -0.399 367 HG LEU 47 HG LEU 47 -2.119 10.674 0.290 368 1HD1 LEU 47 1HD1 LEU 47 -2.030 10.462 -2.700 369 2HD1 LEU 47 2HD1 LEU 47 -3.100 9.390 -1.796 370 3HD1 LEU 47 3HD1 LEU 47 -1.365 9.372 -1.483 371 1HD2 LEU 47 1HD2 LEU 47 -0.462 12.007 -0.815 372 2HD2 LEU 47 2HD2 LEU 47 -1.769 13.104 -0.369 373 3HD2 LEU 47 3HD2 LEU 47 -1.617 12.544 -2.034 374 H GLU 48 H GLU 48 -5.765 13.491 -3.532 375 HA GLU 48 HA GLU 48 -8.295 13.009 -2.233 376 1HB GLU 48 1HB GLU 48 -9.146 14.122 -4.328 377 2HB GLU 48 2HB GLU 48 -7.822 15.001 -3.565 378 1HG GLU 48 1HG GLU 48 -6.758 14.913 -5.553 379 2HG GLU 48 2HG GLU 48 -6.560 13.184 -5.278 380 H ASP 49 H ASP 49 -7.627 10.487 -2.354 381 HA ASP 49 HA ASP 49 -9.568 9.173 -3.993 382 1HB ASP 49 1HB ASP 49 -7.022 9.848 -5.212 383 2HB ASP 49 2HB ASP 49 -7.227 8.097 -5.162 384 H TYR 50 H TYR 50 -9.846 7.089 -3.186 385 HA TYR 50 HA TYR 50 -9.506 5.222 -1.779 386 1HB TYR 50 1HB TYR 50 -6.586 5.878 -2.324 387 2HB TYR 50 2HB TYR 50 -7.254 4.300 -1.913 388 HD1 TYR 50 HD1 TYR 50 -5.722 5.592 -4.500 389 HD2 TYR 50 HD2 TYR 50 -9.703 4.253 -3.599 390 HE1 TYR 50 HE1 TYR 50 -6.114 5.139 -6.906 391 HE2 TYR 50 HE2 TYR 50 -10.095 3.801 -6.006 392 HH TYR 50 HH TYR 50 -7.849 3.404 -8.189 393 H LEU 51 H LEU 51 -9.628 7.920 -0.544 394 HA LEU 51 HA LEU 51 -7.783 7.578 1.781 395 1HB LEU 51 1HB LEU 51 -9.183 9.827 0.392 396 2HB LEU 51 2HB LEU 51 -8.969 9.995 2.131 397 HG LEU 51 HG LEU 51 -6.796 9.596 0.054 398 1HD1 LEU 51 1HD1 LEU 51 -7.815 11.892 0.425 399 2HD1 LEU 51 2HD1 LEU 51 -6.080 11.794 0.728 400 3HD1 LEU 51 3HD1 LEU 51 -7.212 11.810 2.080 401 1HD2 LEU 51 1HD2 LEU 51 -5.989 8.344 1.880 402 2HD2 LEU 51 2HD2 LEU 51 -6.743 9.412 3.064 403 3HD2 LEU 51 3HD2 LEU 51 -5.317 9.950 2.169 404 H PHE 52 H PHE 52 -8.875 6.155 3.170 405 HA PHE 52 HA PHE 52 -11.761 6.549 3.720 406 1HB PHE 52 1HB PHE 52 -9.602 4.617 4.635 407 2HB PHE 52 2HB PHE 52 -11.250 4.564 5.262 408 HD1 PHE 52 HD1 PHE 52 -13.131 4.679 3.340 409 HD2 PHE 52 HD2 PHE 52 -9.108 3.270 2.806 410 HE1 PHE 52 HE1 PHE 52 -13.845 3.394 1.343 411 HE2 PHE 52 HE2 PHE 52 -9.823 1.985 0.809 412 HZ PHE 52 HZ PHE 52 -12.191 2.047 0.077 413 H SER 53 H SER 53 -12.007 8.428 4.956 414 HA SER 53 HA SER 53 -10.112 8.880 7.211 415 1HB SER 53 1HB SER 53 -10.356 10.726 5.705 416 2HB SER 53 2HB SER 53 -12.110 10.553 5.669 417 HG SER 53 HG SER 53 -11.602 12.231 7.037 418 H ARG 54 H ARG 54 -10.939 9.445 9.307 419 HA ARG 54 HA ARG 54 -13.702 8.413 9.855 420 1HB ARG 54 1HB ARG 54 -11.041 8.232 11.263 421 2HB ARG 54 2HB ARG 54 -12.528 8.103 12.202 422 1HG ARG 54 1HG ARG 54 -13.268 6.318 10.532 423 2HG ARG 54 2HG ARG 54 -11.612 6.330 9.927 424 1HD ARG 54 1HD ARG 54 -11.175 4.806 11.569 425 2HD ARG 54 2HD ARG 54 -11.307 6.165 12.702 426 HE ARG 54 HE ARG 54 -13.893 5.044 11.905 427 1HH1 ARG 54 1HH1 ARG 54 -11.220 4.849 14.128 428 2HH1 ARG 54 2HH1 ARG 54 -12.159 4.084 15.361 429 1HH2 ARG 54 1HH2 ARG 54 -15.090 4.049 13.523 430 2HH2 ARG 54 2HH2 ARG 54 -14.333 3.633 15.024 431 H LYS 55 H LYS 55 -14.277 9.401 12.247 432 HA LYS 55 HA LYS 55 -14.420 12.285 11.837 433 1HB LYS 55 1HB LYS 55 -16.059 10.467 12.907 434 2HB LYS 55 2HB LYS 55 -15.192 10.887 14.385 435 1HG LYS 55 1HG LYS 55 -16.164 12.937 14.510 436 2HG LYS 55 2HG LYS 55 -16.011 13.214 12.775 437 1HD LYS 55 1HD LYS 55 -18.103 12.428 12.347 438 2HD LYS 55 2HD LYS 55 -17.942 11.106 13.503 439 1HE LYS 55 1HE LYS 55 -18.129 12.977 15.319 440 2HE LYS 55 2HE LYS 55 -18.812 13.951 14.003 441 1HZ LYS 55 1HZ LYS 55 -19.705 11.185 14.614 442 2HZ LYS 55 2HZ LYS 55 -20.456 12.314 13.592 443 3HZ LYS 55 3HZ LYS 55 -20.459 12.557 15.273 444 H ASN 56 H ASN 56 -11.969 12.466 11.930 445 HA ASN 56 HA ASN 56 -10.603 12.106 14.464 446 1HB ASN 56 1HB ASN 56 -12.055 14.006 15.025 447 2HB ASN 56 2HB ASN 56 -10.396 14.582 14.876 448 1HD2 ASN 56 1HD2 ASN 56 -13.332 15.689 14.196 449 2HD2 ASN 56 2HD2 ASN 56 -13.074 16.445 12.698 450 H MET 57 H MET 57 -10.364 11.687 11.466 451 HA MET 57 HA MET 57 -8.349 13.505 10.466 452 1HB MET 57 1HB MET 57 -6.436 12.037 10.839 453 2HB MET 57 2HB MET 57 -7.173 12.449 12.377 454 1HG MET 57 1HG MET 57 -8.551 10.172 11.545 455 2HG MET 57 2HG MET 57 -6.880 9.855 11.096 456 1HE MET 57 1HE MET 57 -4.841 10.354 14.142 457 2HE MET 57 2HE MET 57 -5.651 11.908 13.945 458 3HE MET 57 3HE MET 57 -5.126 11.001 12.526 459 H SER 58 H SER 58 -6.966 12.097 8.711 460 HA SER 58 HA SER 58 -8.989 10.459 7.221 461 1HB SER 58 1HB SER 58 -7.455 11.341 5.260 462 2HB SER 58 2HB SER 58 -8.646 12.425 5.978 463 HG SER 58 HG SER 58 -5.935 12.224 6.781 464 H ALA 59 H ALA 59 -8.223 8.531 6.231 465 HA ALA 59 HA ALA 59 -5.384 7.788 6.826 466 1HB ALA 59 1HB ALA 59 -6.212 5.597 7.540 467 2HB ALA 59 2HB ALA 59 -7.858 6.045 7.091 468 3HB ALA 59 3HB ALA 59 -7.063 6.850 8.443 469 H MET 60 H MET 60 -4.334 6.886 5.067 470 HA MET 60 HA MET 60 -5.865 6.528 2.560 471 1HB MET 60 1HB MET 60 -3.384 7.512 3.215 472 2HB MET 60 2HB MET 60 -2.975 5.878 2.702 473 1HG MET 60 1HG MET 60 -4.913 7.019 0.888 474 2HG MET 60 2HG MET 60 -3.535 8.108 1.049 475 1HE MET 60 1HE MET 60 -3.945 7.605 -1.328 476 2HE MET 60 2HE MET 60 -3.318 6.233 -2.240 477 3HE MET 60 3HE MET 60 -2.216 7.480 -1.656 478 H ALA 61 H ALA 61 -5.827 4.509 1.371 479 HA ALA 61 HA ALA 61 -5.798 2.138 3.109 480 1HB ALA 61 1HB ALA 61 -6.190 1.422 0.410 481 2HB ALA 61 2HB ALA 61 -6.875 3.040 0.555 482 3HB ALA 61 3HB ALA 61 -7.452 1.742 1.600 483 H LEU 62 H LEU 62 -3.566 1.803 3.601 484 HA LEU 62 HA LEU 62 -1.419 0.898 3.239 485 1HB LEU 62 1HB LEU 62 -1.132 1.944 0.533 486 2HB LEU 62 2HB LEU 62 -1.901 3.130 1.583 487 HG LEU 62 HG LEU 62 0.763 1.751 2.033 488 1HD1 LEU 62 1HD1 LEU 62 0.862 3.625 0.474 489 2HD1 LEU 62 2HD1 LEU 62 1.573 4.122 2.007 490 3HD1 LEU 62 3HD1 LEU 62 -0.060 4.637 1.583 491 1HD2 LEU 62 1HD2 LEU 62 -1.090 3.106 3.901 492 2HD2 LEU 62 2HD2 LEU 62 0.582 3.663 3.971 493 3HD2 LEU 62 3HD2 LEU 62 0.209 1.960 4.237 494 H GLY 63 H GLY 63 -2.791 -1.200 2.988 495 1HA GLY 63 1HA GLY 63 -1.684 -2.745 0.860 496 2HA GLY 63 2HA GLY 63 -2.981 -3.280 1.927 497 H PHE 64 H PHE 64 -4.140 -4.248 0.193 498 HA PHE 64 HA PHE 64 -4.879 -2.768 -2.200 499 1HB PHE 64 1HB PHE 64 -5.587 -5.382 -0.869 500 2HB PHE 64 2HB PHE 64 -6.476 -4.848 -2.296 501 HD1 PHE 64 HD1 PHE 64 -5.473 -4.881 -4.479 502 HD2 PHE 64 HD2 PHE 64 -3.112 -5.724 -0.991 503 HE1 PHE 64 HE1 PHE 64 -3.618 -5.667 -5.925 504 HE2 PHE 64 HE2 PHE 64 -1.257 -6.510 -2.437 505 HZ PHE 64 HZ PHE 64 -1.510 -6.482 -4.904 506 H GLY 65 H GLY 65 -5.645 -1.004 -0.335 507 1HA GLY 65 1HA GLY 65 -8.466 -1.488 0.410 508 2HA GLY 65 2HA GLY 65 -7.495 -0.098 0.895 509 H ALA 66 H ALA 66 -6.586 0.202 -1.989 510 HA ALA 66 HA ALA 66 -8.777 1.973 -2.814 511 1HB ALA 66 1HB ALA 66 -6.142 1.230 -4.142 512 2HB ALA 66 2HB ALA 66 -6.331 2.512 -2.945 513 3HB ALA 66 3HB ALA 66 -7.129 2.644 -4.512 514 H ILE 67 H ILE 67 -7.201 -0.970 -4.085 515 HA ILE 67 HA ILE 67 -8.491 -1.249 -6.547 516 HB ILE 67 HB ILE 67 -8.221 -3.737 -6.053 517 1HG1 ILE 67 1HG1 ILE 67 -6.652 -3.534 -3.708 518 2HG1 ILE 67 2HG1 ILE 67 -8.164 -2.699 -3.359 519 1HG2 ILE 67 1HG2 ILE 67 -6.033 -3.532 -6.583 520 2HG2 ILE 67 2HG2 ILE 67 -5.677 -2.585 -5.139 521 3HG2 ILE 67 3HG2 ILE 67 -6.347 -1.796 -6.567 522 1HD1 ILE 67 1HD1 ILE 67 -7.667 -5.563 -3.838 523 2HD1 ILE 67 2HD1 ILE 67 -9.065 -4.910 -4.695 524 3HD1 ILE 67 3HD1 ILE 67 -8.967 -4.781 -2.939 525 H PHE 68 H PHE 68 -9.850 -1.753 -3.329 526 HA PHE 68 HA PHE 68 -12.106 -3.323 -3.941 527 1HB PHE 68 1HB PHE 68 -11.524 -1.097 -1.980 528 2HB PHE 68 2HB PHE 68 -13.082 -1.921 -1.981 529 HD1 PHE 68 HD1 PHE 68 -10.291 -1.885 -0.148 530 HD2 PHE 68 HD2 PHE 68 -12.453 -4.679 -2.592 531 HE1 PHE 68 HE1 PHE 68 -9.304 -3.768 1.130 532 HE2 PHE 68 HE2 PHE 68 -11.466 -6.561 -1.315 533 HZ PHE 68 HZ PHE 68 -9.892 -6.105 0.546 534 H ASN 69 H ASN 69 -14.103 -2.881 -4.857 535 HA ASN 69 HA ASN 69 -14.516 -0.104 -5.920 536 1HB ASN 69 1HB ASN 69 -15.354 -2.826 -6.994 537 2HB ASN 69 2HB ASN 69 -15.691 -1.281 -7.777 538 1HD2 ASN 69 1HD2 ASN 69 -14.081 -3.342 -9.031 539 2HD2 ASN 69 2HD2 ASN 69 -12.497 -2.742 -9.174 540 H HIS 70 H HIS 70 -17.071 0.002 -6.536 541 HA HIS 70 HA HIS 70 -18.486 -0.581 -3.975 542 1HB HIS 70 1HB HIS 70 -18.260 1.737 -5.104 543 2HB HIS 70 2HB HIS 70 -19.413 1.132 -6.295 544 HD1 HIS 70 HD1 HIS 70 -19.118 2.083 -2.669 545 HD2 HIS 70 HD2 HIS 70 -22.064 0.790 -5.320 546 HE1 HIS 70 HE1 HIS 70 -21.334 2.386 -1.481 547 H SER 71 H SER 71 -19.932 -2.241 -3.945 548 HA SER 71 HA SER 71 -21.197 -3.074 -6.533 549 1HB SER 71 1HB SER 71 -19.425 -4.630 -5.957 550 2HB SER 71 2HB SER 71 -19.978 -4.719 -4.286 551 HG SER 71 HG SER 71 -20.812 -6.107 -6.440 552 H LYS 72 H LYS 72 -23.403 -3.552 -6.374 553 HA LYS 72 HA LYS 72 -25.013 -2.452 -4.365 554 1HB LYS 72 1HB LYS 72 -25.302 -4.648 -6.403 555 2HB LYS 72 2HB LYS 72 -26.632 -4.334 -5.288 556 1HG LYS 72 1HG LYS 72 -25.439 -1.939 -6.566 557 2HG LYS 72 2HG LYS 72 -26.322 -3.020 -7.645 558 1HD LYS 72 1HD LYS 72 -28.311 -2.863 -6.289 559 2HD LYS 72 2HD LYS 72 -27.443 -1.995 -5.022 560 1HE LYS 72 1HE LYS 72 -27.202 -0.043 -6.395 561 2HE LYS 72 2HE LYS 72 -27.708 -0.923 -7.850 562 1HZ LYS 72 1HZ LYS 72 -29.516 0.401 -6.779 563 2HZ LYS 72 2HZ LYS 72 -29.398 -0.613 -5.422 564 3HZ LYS 72 3HZ LYS 72 -29.868 -1.254 -6.923 565 H ASP 73 H ASP 73 -23.488 -5.640 -4.466 566 HA ASP 73 HA ASP 73 -24.590 -6.180 -1.727 567 1HB ASP 73 1HB ASP 73 -24.368 -7.736 -4.226 568 2HB ASP 73 2HB ASP 73 -23.812 -8.608 -2.797 569 HA PRO 74 HA PRO 74 -20.023 -5.598 -1.330 570 1HB PRO 74 1HB PRO 74 -20.289 -5.144 1.431 571 2HB PRO 74 2HB PRO 74 -20.192 -3.886 0.188 572 1HG PRO 74 1HG PRO 74 -22.559 -4.988 1.592 573 2HG PRO 74 2HG PRO 74 -22.260 -3.351 0.995 574 1HD PRO 74 1HD PRO 74 -23.916 -5.089 -0.256 575 2HD PRO 74 2HD PRO 74 -22.981 -3.858 -1.130 576 H ASN 75 H ASN 75 -19.312 -7.723 -1.495 577 HA ASN 75 HA ASN 75 -20.280 -9.838 0.269 578 1HB ASN 75 1HB ASN 75 -17.925 -9.699 -1.651 579 2HB ASN 75 2HB ASN 75 -18.663 -11.174 -1.027 580 1HD2 ASN 75 1HD2 ASN 75 -18.675 -9.150 -3.698 581 2HD2 ASN 75 2HD2 ASN 75 -20.217 -9.515 -4.306 582 H ALA 76 H ALA 76 -17.757 -7.468 0.443 583 HA ALA 76 HA ALA 76 -16.723 -8.802 2.909 584 1HB ALA 76 1HB ALA 76 -15.455 -8.707 0.388 585 2HB ALA 76 2HB ALA 76 -14.711 -9.164 1.920 586 3HB ALA 76 3HB ALA 76 -14.633 -7.491 1.367 587 H ARG 77 H ARG 77 -15.380 -7.220 4.216 588 HA ARG 77 HA ARG 77 -16.145 -4.369 3.711 589 1HB ARG 77 1HB ARG 77 -17.386 -6.000 5.516 590 2HB ARG 77 2HB ARG 77 -16.084 -5.354 6.515 591 1HG ARG 77 1HG ARG 77 -16.869 -3.063 5.368 592 2HG ARG 77 2HG ARG 77 -18.394 -3.941 5.258 593 1HD ARG 77 1HD ARG 77 -18.699 -3.951 7.544 594 2HD ARG 77 2HD ARG 77 -16.961 -4.071 7.875 595 HE ARG 77 HE ARG 77 -16.860 -1.707 7.832 596 1HH1 ARG 77 1HH1 ARG 77 -19.753 -2.845 6.267 597 2HH1 ARG 77 2HH1 ARG 77 -20.390 -1.253 6.044 598 1HH2 ARG 77 1HH2 ARG 77 -17.708 0.350 7.530 599 2HH2 ARG 77 2HH2 ARG 77 -19.243 0.543 6.752 600 H HIS 78 H HIS 78 -14.919 -3.289 5.983 601 HA HIS 78 HA HIS 78 -12.106 -4.285 5.936 602 1HB HIS 78 1HB HIS 78 -11.371 -1.948 5.455 603 2HB HIS 78 2HB HIS 78 -12.368 -2.600 4.155 604 HD1 HIS 78 HD1 HIS 78 -14.896 -1.785 4.077 605 HD2 HIS 78 HD2 HIS 78 -12.468 0.283 6.761 606 HE1 HIS 78 HE1 HIS 78 -16.157 0.318 4.709 607 H GLU 79 H GLU 79 -10.798 -3.245 7.693 608 HA GLU 79 HA GLU 79 -12.385 -1.956 9.861 609 1HB GLU 79 1HB GLU 79 -12.428 -4.477 10.075 610 2HB GLU 79 2HB GLU 79 -10.678 -4.445 10.211 611 1HG GLU 79 1HG GLU 79 -10.851 -3.007 12.206 612 2HG GLU 79 2HG GLU 79 -12.609 -3.021 12.065 613 H LEU 80 H LEU 80 -11.154 -0.117 10.181 614 HA LEU 80 HA LEU 80 -8.212 -0.229 9.872 615 1HB LEU 80 1HB LEU 80 -10.113 2.035 10.584 616 2HB LEU 80 2HB LEU 80 -8.438 2.212 10.065 617 HG LEU 80 HG LEU 80 -9.616 0.617 8.091 618 1HD1 LEU 80 1HD1 LEU 80 -11.854 1.068 8.678 619 2HD1 LEU 80 2HD1 LEU 80 -11.513 2.270 7.433 620 3HD1 LEU 80 3HD1 LEU 80 -11.493 2.734 9.135 621 1HD2 LEU 80 1HD2 LEU 80 -7.963 2.659 8.086 622 2HD2 LEU 80 2HD2 LEU 80 -9.429 3.608 7.840 623 3HD2 LEU 80 3HD2 LEU 80 -8.976 2.365 6.673 624 H THR 81 H THR 81 -8.595 -1.811 11.957 625 HA THR 81 HA THR 81 -8.384 -2.124 14.294 626 HB THR 81 HB THR 81 -6.611 -0.148 15.012 627 HG1 THR 81 HG1 THR 81 -5.427 0.359 13.199 628 1HG2 THR 81 1HG2 THR 81 -6.273 -2.607 15.067 629 2HG2 THR 81 2HG2 THR 81 -4.876 -1.765 14.398 630 3HG2 THR 81 3HG2 THR 81 -6.004 -2.594 13.325 631 H ALA 82 H ALA 82 -10.568 -0.231 13.454 632 HA ALA 82 HA ALA 82 -12.047 1.306 14.468 633 1HB ALA 82 1HB ALA 82 -11.872 0.991 17.084 634 2HB ALA 82 2HB ALA 82 -10.717 -0.274 16.663 635 3HB ALA 82 3HB ALA 82 -12.380 -0.370 16.084 636 H GLY 83 H GLY 83 -9.124 2.153 13.951 637 1HA GLY 83 1HA GLY 83 -9.351 4.763 15.198 638 2HA GLY 83 2HA GLY 83 -8.076 3.797 15.938 639 H LEU 84 H LEU 84 -8.875 3.456 12.535 640 HA LEU 84 HA LEU 84 -7.530 3.826 10.621 641 1HB LEU 84 1HB LEU 84 -7.021 6.264 12.360 642 2HB LEU 84 2HB LEU 84 -6.517 6.154 10.675 643 HG LEU 84 HG LEU 84 -9.363 5.941 11.702 644 1HD1 LEU 84 1HD1 LEU 84 -7.665 8.127 10.670 645 2HD1 LEU 84 2HD1 LEU 84 -9.130 8.207 11.652 646 3HD1 LEU 84 3HD1 LEU 84 -9.252 8.006 9.903 647 1HD2 LEU 84 1HD2 LEU 84 -9.714 4.788 9.786 648 2HD2 LEU 84 2HD2 LEU 84 -8.086 5.131 9.199 649 3HD2 LEU 84 3HD2 LEU 84 -9.381 6.300 8.940 650 H LYS 85 H LYS 85 -5.939 2.160 10.831 651 HA LYS 85 HA LYS 85 -3.226 2.975 11.162 652 1HB LYS 85 1HB LYS 85 -4.743 2.166 13.536 653 2HB LYS 85 2HB LYS 85 -3.279 1.205 13.316 654 1HG LYS 85 1HG LYS 85 -2.942 4.085 12.814 655 2HG LYS 85 2HG LYS 85 -3.342 3.691 14.484 656 1HD LYS 85 1HD LYS 85 -1.278 2.847 14.853 657 2HD LYS 85 2HD LYS 85 -1.356 1.860 13.393 658 1HE LYS 85 1HE LYS 85 -1.087 4.441 12.389 659 2HE LYS 85 2HE LYS 85 -0.019 4.434 13.811 660 1HZ LYS 85 1HZ LYS 85 0.733 2.174 12.988 661 2HZ LYS 85 2HZ LYS 85 1.254 3.508 12.074 662 3HZ LYS 85 3HZ LYS 85 -0.033 2.549 11.519 663 H ARG 86 H ARG 86 -5.559 0.306 11.261 664 HA ARG 86 HA ARG 86 -3.737 -1.264 9.503 665 1HB ARG 86 1HB ARG 86 -4.447 -1.754 12.312 666 2HB ARG 86 2HB ARG 86 -4.794 -3.136 11.273 667 1HG ARG 86 1HG ARG 86 -2.605 -3.650 11.246 668 2HG ARG 86 2HG ARG 86 -2.260 -2.094 10.490 669 1HD ARG 86 1HD ARG 86 -1.552 -1.159 12.463 670 2HD ARG 86 2HD ARG 86 -2.787 -2.005 13.415 671 HE ARG 86 HE ARG 86 -0.831 -3.839 12.291 672 1HH1 ARG 86 1HH1 ARG 86 -1.455 -1.604 14.885 673 2HH1 ARG 86 2HH1 ARG 86 -0.360 -2.387 15.971 674 1HH2 ARG 86 1HH2 ARG 86 0.585 -4.839 13.718 675 2HH2 ARG 86 2HH2 ARG 86 0.787 -4.205 15.317 676 H MET 87 H MET 87 -5.156 -1.247 7.742 677 HA MET 87 HA MET 87 -8.039 -1.624 8.084 678 1HB MET 87 1HB MET 87 -6.098 -0.833 6.063 679 2HB MET 87 2HB MET 87 -7.281 -1.954 5.389 680 1HG MET 87 1HG MET 87 -9.091 -0.516 6.413 681 2HG MET 87 2HG MET 87 -7.840 0.658 6.821 682 1HE MET 87 1HE MET 87 -7.783 -1.424 3.156 683 2HE MET 87 2HE MET 87 -9.401 -0.787 2.861 684 3HE MET 87 3HE MET 87 -9.064 -1.690 4.338 685 H ARG 88 H ARG 88 -8.905 -3.631 8.403 686 HA ARG 88 HA ARG 88 -7.476 -6.003 7.252 687 1HB ARG 88 1HB ARG 88 -9.540 -5.840 9.480 688 2HB ARG 88 2HB ARG 88 -8.568 -7.245 9.055 689 1HG ARG 88 1HG ARG 88 -6.780 -6.491 10.220 690 2HG ARG 88 2HG ARG 88 -6.952 -4.853 9.593 691 1HD ARG 88 1HD ARG 88 -7.521 -4.441 11.805 692 2HD ARG 88 2HD ARG 88 -9.124 -4.936 11.220 693 HE ARG 88 HE ARG 88 -8.869 -6.910 12.490 694 1HH1 ARG 88 1HH1 ARG 88 -5.756 -5.528 11.766 695 2HH1 ARG 88 2HH1 ARG 88 -4.894 -6.714 12.683 696 1HH2 ARG 88 1HH2 ARG 88 -7.727 -8.438 13.674 697 2HH2 ARG 88 2HH2 ARG 88 -5.999 -8.350 13.756 698 H ILE 89 H ILE 89 -8.517 -6.996 5.563 699 HA ILE 89 HA ILE 89 -11.259 -6.150 4.865 700 HB ILE 89 HB ILE 89 -9.209 -7.985 3.568 701 1HG1 ILE 89 1HG1 ILE 89 -9.966 -5.364 2.398 702 2HG1 ILE 89 2HG1 ILE 89 -9.035 -5.296 3.894 703 1HG2 ILE 89 1HG2 ILE 89 -11.595 -6.724 2.218 704 2HG2 ILE 89 2HG2 ILE 89 -11.717 -8.304 2.992 705 3HG2 ILE 89 3HG2 ILE 89 -10.595 -8.062 1.653 706 1HD1 ILE 89 1HD1 ILE 89 -8.163 -7.144 1.692 707 2HD1 ILE 89 2HD1 ILE 89 -7.194 -6.380 2.954 708 3HD1 ILE 89 3HD1 ILE 89 -7.777 -5.426 1.590 709 H PHE 90 H PHE 90 -12.950 -7.259 5.736 710 HA PHE 90 HA PHE 90 -12.549 -10.121 6.512 711 1HB PHE 90 1HB PHE 90 -14.212 -7.799 7.444 712 2HB PHE 90 2HB PHE 90 -14.821 -9.429 7.730 713 HD1 PHE 90 HD1 PHE 90 -13.616 -10.994 9.186 714 HD2 PHE 90 HD2 PHE 90 -12.189 -6.995 8.536 715 HE1 PHE 90 HE1 PHE 90 -12.084 -11.225 11.123 716 HE2 PHE 90 HE2 PHE 90 -10.657 -7.226 10.472 717 HZ PHE 90 HZ PHE 90 -10.605 -9.341 11.766 718 H THR 91 H THR 91 -15.013 -11.133 6.512 719 HA THR 91 HA THR 91 -16.162 -10.599 3.795 720 HB THR 91 HB THR 91 -16.467 -13.143 3.761 721 HG1 THR 91 HG1 THR 91 -15.334 -14.301 5.244 722 1HG2 THR 91 1HG2 THR 91 -14.575 -11.772 2.664 723 2HG2 THR 91 2HG2 THR 91 -14.288 -13.498 2.892 724 3HG2 THR 91 3HG2 THR 91 -13.568 -12.330 4.000 725 H ILE 92 H ILE 92 -17.953 -9.450 4.724 726 HA ILE 92 HA ILE 92 -19.491 -10.238 6.964 727 HB ILE 92 HB ILE 92 -21.207 -8.787 5.909 728 1HG1 ILE 92 1HG1 ILE 92 -19.586 -8.253 3.505 729 2HG1 ILE 92 2HG1 ILE 92 -20.321 -9.855 3.538 730 1HG2 ILE 92 1HG2 ILE 92 -18.950 -7.213 5.031 731 2HG2 ILE 92 2HG2 ILE 92 -18.526 -8.100 6.496 732 3HG2 ILE 92 3HG2 ILE 92 -19.926 -7.027 6.488 733 1HD1 ILE 92 1HD1 ILE 92 -22.354 -8.190 4.446 734 2HD1 ILE 92 2HD1 ILE 92 -22.214 -8.851 2.817 735 3HD1 ILE 92 3HD1 ILE 92 -21.582 -7.243 3.174 736 H LYS 93 H LYS 93 -19.306 -11.657 3.801 737 HA LYS 93 HA LYS 93 -21.358 -13.653 4.602 738 1HB LYS 93 1HB LYS 93 -22.428 -13.345 2.343 739 2HB LYS 93 2HB LYS 93 -22.558 -11.915 3.366 740 1HG LYS 93 1HG LYS 93 -21.358 -10.675 1.912 741 2HG LYS 93 2HG LYS 93 -20.085 -11.893 1.834 742 1HD LYS 93 1HD LYS 93 -21.017 -11.674 -0.384 743 2HD LYS 93 2HD LYS 93 -21.567 -13.215 0.272 744 1HE LYS 93 1HE LYS 93 -23.677 -11.980 1.045 745 2HE LYS 93 2HE LYS 93 -23.140 -10.636 0.019 746 1HZ LYS 93 1HZ LYS 93 -24.469 -12.047 -1.335 747 2HZ LYS 93 2HZ LYS 93 -23.670 -13.445 -0.795 748 3HZ LYS 93 3HZ LYS 93 -22.857 -12.332 -1.787 749 HA PRO 94 HA PRO 94 -18.394 -16.491 2.975 750 1HB PRO 94 1HB PRO 94 -20.686 -17.942 1.845 751 2HB PRO 94 2HB PRO 94 -19.434 -18.525 2.940 752 1HG PRO 94 1HG PRO 94 -21.956 -18.012 3.747 753 2HG PRO 94 2HG PRO 94 -20.550 -17.814 4.799 754 1HD PRO 94 1HD PRO 94 -22.242 -15.762 3.513 755 2HD PRO 94 2HD PRO 94 -21.262 -15.663 4.993 756 H ILE 95 H ILE 95 -17.320 -16.674 0.989 757 HA ILE 95 HA ILE 95 -18.707 -15.418 -1.349 758 HB ILE 95 HB ILE 95 -15.780 -15.749 -0.594 759 1HG1 ILE 95 1HG1 ILE 95 -17.088 -13.104 -1.000 760 2HG1 ILE 95 2HG1 ILE 95 -17.526 -13.991 0.460 761 1HG2 ILE 95 1HG2 ILE 95 -15.972 -13.862 -2.628 762 2HG2 ILE 95 2HG2 ILE 95 -17.094 -15.128 -3.140 763 3HG2 ILE 95 3HG2 ILE 95 -15.402 -15.520 -2.816 764 1HD1 ILE 95 1HD1 ILE 95 -14.641 -13.618 -0.352 765 2HD1 ILE 95 2HD1 ILE 95 -15.286 -14.041 1.234 766 3HD1 ILE 95 3HD1 ILE 95 -15.492 -12.406 0.607 767 H ALA 96 H ALA 96 -18.535 -16.433 -3.396 768 HA ALA 96 HA ALA 96 -18.078 -19.365 -3.299 769 1HB ALA 96 1HB ALA 96 -19.423 -17.350 -5.100 770 2HB ALA 96 2HB ALA 96 -20.127 -18.763 -4.309 771 3HB ALA 96 3HB ALA 96 -19.074 -18.970 -5.709 772 H ILE 97 H ILE 97 -16.724 -20.385 -4.956 773 HA ILE 97 HA ILE 97 -14.206 -19.098 -5.394 774 HB ILE 97 HB ILE 97 -15.591 -21.486 -6.666 775 1HG1 ILE 97 1HG1 ILE 97 -13.340 -21.646 -4.703 776 2HG1 ILE 97 2HG1 ILE 97 -14.935 -21.214 -4.098 777 1HG2 ILE 97 1HG2 ILE 97 -12.745 -21.717 -6.684 778 2HG2 ILE 97 2HG2 ILE 97 -13.163 -20.173 -7.429 779 3HG2 ILE 97 3HG2 ILE 97 -13.839 -21.672 -8.067 780 1HD1 ILE 97 1HD1 ILE 97 -14.178 -23.767 -4.326 781 2HD1 ILE 97 2HD1 ILE 97 -14.741 -23.529 -5.980 782 3HD1 ILE 97 3HD1 ILE 97 -15.845 -23.275 -4.628 783 H GLY 98 H GLY 98 -14.000 -17.326 -6.703 784 1HA GLY 98 1HA GLY 98 -13.803 -16.476 -8.988 785 2HA GLY 98 2HA GLY 98 -15.190 -17.471 -9.433 786 H GLU 99 H GLU 99 -14.960 -15.438 -6.536 787 HA GLU 99 HA GLU 99 -17.392 -13.991 -7.439 788 1HB GLU 99 1HB GLU 99 -16.481 -15.224 -5.094 789 2HB GLU 99 2HB GLU 99 -16.325 -13.514 -4.760 790 1HG GLU 99 1HG GLU 99 -18.822 -14.957 -5.675 791 2HG GLU 99 2HG GLU 99 -18.550 -14.264 -4.085 792 H GLU 100 H GLU 100 -17.454 -11.639 -7.224 793 HA GLU 100 HA GLU 100 -14.799 -10.361 -7.629 794 1HB GLU 100 1HB GLU 100 -17.097 -10.130 -8.990 795 2HB GLU 100 2HB GLU 100 -17.424 -8.913 -7.758 796 1HG GLU 100 1HG GLU 100 -14.721 -8.617 -8.731 797 2HG GLU 100 2HG GLU 100 -15.846 -8.612 -10.088 798 H ILE 101 H ILE 101 -13.841 -9.632 -5.789 799 HA ILE 101 HA ILE 101 -15.468 -8.979 -3.419 800 HB ILE 101 HB ILE 101 -12.461 -8.828 -3.793 801 1HG1 ILE 101 1HG1 ILE 101 -14.180 -11.218 -3.061 802 2HG1 ILE 101 2HG1 ILE 101 -13.220 -11.038 -4.519 803 1HG2 ILE 101 1HG2 ILE 101 -12.341 -8.710 -1.511 804 2HG2 ILE 101 2HG2 ILE 101 -13.767 -9.721 -1.285 805 3HG2 ILE 101 3HG2 ILE 101 -13.952 -8.016 -1.697 806 1HD1 ILE 101 1HD1 ILE 101 -11.485 -10.524 -2.331 807 2HD1 ILE 101 2HD1 ILE 101 -11.441 -11.892 -3.443 808 3HD1 ILE 101 3HD1 ILE 101 -12.376 -11.998 -1.952 809 H THR 102 H THR 102 -16.148 -6.972 -3.030 810 HA THR 102 HA THR 102 -14.477 -4.613 -3.630 811 HB THR 102 HB THR 102 -16.313 -3.597 -4.979 812 HG1 THR 102 HG1 THR 102 -18.013 -4.800 -4.072 813 1HG2 THR 102 1HG2 THR 102 -15.655 -6.323 -6.107 814 2HG2 THR 102 2HG2 THR 102 -14.461 -5.029 -6.008 815 3HG2 THR 102 3HG2 THR 102 -15.912 -4.818 -6.987 816 H ILE 103 H ILE 103 -14.855 -3.090 -2.005 817 HA ILE 103 HA ILE 103 -17.142 -3.645 -0.162 818 HB ILE 103 HB ILE 103 -15.756 -2.460 1.482 819 1HG1 ILE 103 1HG1 ILE 103 -13.320 -2.096 0.073 820 2HG1 ILE 103 2HG1 ILE 103 -14.586 -1.341 -0.896 821 1HG2 ILE 103 1HG2 ILE 103 -14.167 -4.414 -0.208 822 2HG2 ILE 103 2HG2 ILE 103 -15.250 -4.826 1.121 823 3HG2 ILE 103 3HG2 ILE 103 -13.757 -3.944 1.442 824 1HD1 ILE 103 1HD1 ILE 103 -15.377 -0.356 1.406 825 2HD1 ILE 103 2HD1 ILE 103 -14.012 0.388 0.571 826 3HD1 ILE 103 3HD1 ILE 103 -13.728 -0.716 1.917 827 H SER 104 H SER 104 -18.434 -1.852 0.590 828 HA SER 104 HA SER 104 -18.906 0.190 -1.454 829 1HB SER 104 1HB SER 104 -20.210 -1.042 0.830 830 2HB SER 104 2HB SER 104 -20.378 0.712 0.906 831 HG SER 104 HG SER 104 -20.989 -0.933 -1.322 832 H TYR 105 H TYR 105 -19.626 2.396 0.100 833 HA TYR 105 HA TYR 105 -17.023 3.218 1.347 834 1HB TYR 105 1HB TYR 105 -18.896 4.861 -0.400 835 2HB TYR 105 2HB TYR 105 -17.321 5.370 0.205 836 HD1 TYR 105 HD1 TYR 105 -18.638 4.733 -2.742 837 HD2 TYR 105 HD2 TYR 105 -15.711 2.914 -0.178 838 HE1 TYR 105 HE1 TYR 105 -17.557 3.689 -4.715 839 HE2 TYR 105 HE2 TYR 105 -14.630 1.872 -2.151 840 HH TYR 105 HH TYR 105 -14.990 1.325 -4.365 841 H GLY 106 H GLY 106 -20.273 4.696 0.951 842 1HA GLY 106 1HA GLY 106 -21.512 4.401 3.315 843 2HA GLY 106 2HA GLY 106 -20.195 5.465 3.807 844 H ASP 107 H ASP 107 -22.503 6.619 4.235 845 HA ASP 107 HA ASP 107 -23.984 7.848 2.190 846 1HB ASP 107 1HB ASP 107 -23.251 8.370 5.025 847 2HB ASP 107 2HB ASP 107 -23.892 9.754 4.139 848 H ASP 108 H ASP 108 -20.884 8.870 3.618 849 HA ASP 108 HA ASP 108 -20.617 11.394 2.354 850 1HB ASP 108 1HB ASP 108 -18.499 9.298 2.965 851 2HB ASP 108 2HB ASP 108 -18.224 11.033 2.812 852 H TYR 109 H TYR 109 -19.082 8.327 1.287 853 HA TYR 109 HA TYR 109 -18.827 9.451 -1.443 854 1HB TYR 109 1HB TYR 109 -17.636 7.294 0.227 855 2HB TYR 109 2HB TYR 109 -17.701 6.974 -1.507 856 HD1 TYR 109 HD1 TYR 109 -17.145 10.076 0.534 857 HD2 TYR 109 HD2 TYR 109 -15.644 7.441 -2.507 858 HE1 TYR 109 HE1 TYR 109 -15.206 11.582 0.187 859 HE2 TYR 109 HE2 TYR 109 -13.704 8.948 -2.854 860 HH TYR 109 HH TYR 109 -12.551 10.923 -0.950 861 H TRP 110 H TRP 110 -21.502 9.036 -0.938 862 HA TRP 110 HA TRP 110 -22.253 7.163 -2.994 863 1HB TRP 110 1HB TRP 110 -21.544 5.781 -0.905 864 2HB TRP 110 2HB TRP 110 -23.057 6.347 -0.197 865 HD1 TRP 110 HD1 TRP 110 -24.764 4.509 -0.427 866 HE1 TRP 110 HE1 TRP 110 -25.535 2.914 -2.310 867 HE3 TRP 110 HE3 TRP 110 -21.386 5.737 -4.039 868 HZ2 TRP 110 HZ2 TRP 110 -24.800 2.257 -5.003 869 HZ3 TRP 110 HZ3 TRP 110 -21.436 4.620 -6.250 870 HH2 TRP 110 HH2 TRP 110 -23.135 2.884 -6.738 871 H LEU 111 H LEU 111 -24.787 6.784 -2.799 872 HA LEU 111 HA LEU 111 -26.079 9.329 -2.808 873 1HB LEU 111 1HB LEU 111 -26.736 6.453 -3.033 874 2HB LEU 111 2HB LEU 111 -28.074 7.457 -2.474 875 HG LEU 111 HG LEU 111 -26.706 8.788 -4.636 876 1HD1 LEU 111 1HD1 LEU 111 -25.989 6.768 -5.590 877 2HD1 LEU 111 2HD1 LEU 111 -27.558 7.014 -6.358 878 3HD1 LEU 111 3HD1 LEU 111 -27.402 5.884 -5.012 879 1HD2 LEU 111 1HD2 LEU 111 -28.847 9.365 -5.071 880 2HD2 LEU 111 2HD2 LEU 111 -29.289 8.445 -3.633 881 3HD2 LEU 111 3HD2 LEU 111 -29.340 7.678 -5.221 882 H SER 112 H SER 112 -28.433 9.005 -1.351 883 HA SER 112 HA SER 112 -27.677 9.885 1.275 884 1HB SER 112 1HB SER 112 -30.026 9.535 -0.374 885 2HB SER 112 2HB SER 112 -30.362 8.943 1.252 886 HG SER 112 HG SER 112 -30.726 11.040 1.474 887 H ARG 113 H ARG 113 -29.861 7.125 0.746 888 HA ARG 113 HA ARG 113 -28.121 5.324 2.301 889 1HB ARG 113 1HB ARG 113 -30.476 6.812 3.331 890 2HB ARG 113 2HB ARG 113 -30.423 5.102 3.756 891 1HG ARG 113 1HG ARG 113 -28.054 5.457 4.544 892 2HG ARG 113 2HG ARG 113 -28.289 7.186 4.294 893 1HD ARG 113 1HD ARG 113 -30.436 5.890 5.863 894 2HD ARG 113 2HD ARG 113 -28.848 5.907 6.653 895 HE ARG 113 HE ARG 113 -29.085 8.457 5.590 896 1HH1 ARG 113 1HH1 ARG 113 -31.041 6.476 7.680 897 2HH1 ARG 113 2HH1 ARG 113 -31.710 7.831 8.520 898 1HH2 ARG 113 1HH2 ARG 113 -29.968 10.200 6.696 899 2HH2 ARG 113 2HH2 ARG 113 -31.109 9.924 7.970 900 HA PRO 114 HA PRO 114 -31.046 3.389 -0.794 901 1HB PRO 114 1HB PRO 114 -29.091 2.079 -2.233 902 2HB PRO 114 2HB PRO 114 -29.660 3.710 -2.632 903 1HG PRO 114 1HG PRO 114 -27.203 2.852 -1.189 904 2HG PRO 114 2HG PRO 114 -27.431 4.180 -2.334 905 1HD PRO 114 1HD PRO 114 -27.287 4.517 0.373 906 2HD PRO 114 2HD PRO 114 -28.168 5.615 -0.709 907 H ARG 115 H ARG 115 -31.926 1.526 -0.037 908 HA ARG 115 HA ARG 115 -30.092 -0.501 1.189 909 1HB ARG 115 1HB ARG 115 -32.842 0.422 2.054 910 2HB ARG 115 2HB ARG 115 -31.893 -0.831 2.843 911 1HG ARG 115 1HG ARG 115 -31.128 2.085 2.547 912 2HG ARG 115 2HG ARG 115 -31.576 1.259 4.030 913 1HD ARG 115 1HD ARG 115 -29.514 -0.324 3.088 914 2HD ARG 115 2HD ARG 115 -28.984 1.319 2.675 915 HE ARG 115 HE ARG 115 -28.840 1.791 4.990 916 1HH1 ARG 115 1HH1 ARG 115 -30.749 -1.065 4.425 917 2HH1 ARG 115 2HH1 ARG 115 -30.890 -1.437 6.108 918 1HH2 ARG 115 1HH2 ARG 115 -29.036 1.288 7.167 919 2HH2 ARG 115 2HH2 ARG 115 -29.928 -0.116 7.651 920 H LEU 116 H LEU 116 -30.178 -2.306 -0.117 921 HA LEU 116 HA LEU 116 -32.311 -2.843 -1.981 922 1HB LEU 116 1HB LEU 116 -30.067 -4.514 -0.804 923 2HB LEU 116 2HB LEU 116 -31.054 -5.026 -2.172 924 HG LEU 116 HG LEU 116 -29.862 -2.314 -2.373 925 1HD1 LEU 116 1HD1 LEU 116 -28.253 -4.836 -2.157 926 2HD1 LEU 116 2HD1 LEU 116 -27.863 -3.211 -1.592 927 3HD1 LEU 116 3HD1 LEU 116 -27.747 -3.599 -3.309 928 1HD2 LEU 116 1HD2 LEU 116 -29.313 -3.546 -4.684 929 2HD2 LEU 116 2HD2 LEU 116 -30.920 -2.907 -4.336 930 3HD2 LEU 116 3HD2 LEU 116 -30.589 -4.625 -4.118 931 H THR 117 H THR 117 -31.649 -3.882 1.332 932 HA THR 117 HA THR 117 -33.516 -6.056 1.451 933 HB THR 117 HB THR 117 -32.868 -4.220 3.756 934 HG1 THR 117 HG1 THR 117 -30.833 -4.491 3.422 935 1HG2 THR 117 1HG2 THR 117 -33.422 -7.124 3.296 936 2HG2 THR 117 2HG2 THR 117 -34.017 -6.058 4.569 937 3HG2 THR 117 3HG2 THR 117 -32.369 -6.682 4.640 938 H GLN 118 H GLN 118 -35.474 -5.832 3.082 939 HA GLN 118 HA GLN 118 -37.481 -4.208 1.900 940 1HB GLN 118 1HB GLN 118 -37.769 -6.267 3.304 941 2HB GLN 118 2HB GLN 118 -37.306 -5.328 4.723 942 1HG GLN 118 1HG GLN 118 -39.209 -3.770 4.245 943 2HG GLN 118 2HG GLN 118 -39.707 -4.840 2.935 944 1HE2 GLN 118 1HE2 GLN 118 -41.740 -4.942 4.435 945 2HE2 GLN 118 2HE2 GLN 118 -41.736 -6.139 5.639 946 H ASN 119 H ASN 119 -38.433 -2.229 2.602 947 HA ASN 119 HA ASN 119 -36.601 -0.359 3.911 948 1HB ASN 119 1HB ASN 119 -38.147 0.086 1.944 949 2HB ASN 119 2HB ASN 119 -39.501 -0.022 3.069 950 1HD2 ASN 119 1HD2 ASN 119 -36.252 1.535 3.347 951 2HD2 ASN 119 2HD2 ASN 119 -36.860 3.062 3.771 952 1H GLY 201 1H GLY 201 -1.108 12.543 -12.280 953 2H GLY 201 2H GLY 201 -0.556 12.173 -13.843 954 3H GLY 201 3H GLY 201 -0.367 11.046 -12.588 955 1HA GLY 201 1HA GLY 201 -2.180 10.186 -13.675 956 2HA GLY 201 2HA GLY 201 -2.931 11.176 -12.423 957 H LYS 202 H LYS 202 -4.073 10.499 -15.026 958 HA LYS 202 HA LYS 202 -4.007 13.114 -16.464 959 1HB LYS 202 1HB LYS 202 -4.620 10.253 -17.079 960 2HB LYS 202 2HB LYS 202 -5.488 11.473 -18.011 961 1HG LYS 202 1HG LYS 202 -2.477 11.465 -17.667 962 2HG LYS 202 2HG LYS 202 -3.299 10.728 -19.041 963 1HD LYS 202 1HD LYS 202 -4.436 12.994 -19.393 964 2HD LYS 202 2HD LYS 202 -3.271 13.645 -18.240 965 1HE LYS 202 1HE LYS 202 -1.791 12.067 -20.093 966 2HE LYS 202 2HE LYS 202 -2.880 13.102 -21.037 967 1HZ LYS 202 1HZ LYS 202 -2.196 14.964 -19.560 968 2HZ LYS 202 2HZ LYS 202 -0.926 14.362 -20.513 969 3HZ LYS 202 3HZ LYS 202 -1.026 13.946 -18.869 970 H ALA 203 H ALA 203 -5.565 14.523 -15.746 971 HA ALA 203 HA ALA 203 -8.130 13.439 -14.693 972 1HB ALA 203 1HB ALA 203 -6.706 16.114 -14.613 973 2HB ALA 203 2HB ALA 203 -6.990 15.007 -13.270 974 3HB ALA 203 3HB ALA 203 -8.338 15.893 -13.982 975 HA PRO 204 HA PRO 204 -9.909 14.379 -18.701 976 1HB PRO 204 1HB PRO 204 -12.481 14.236 -17.218 977 2HB PRO 204 2HB PRO 204 -11.946 13.305 -18.628 978 1HG PRO 204 1HG PRO 204 -12.119 12.232 -16.170 979 2HG PRO 204 2HG PRO 204 -10.904 11.721 -17.350 980 1HD PRO 204 1HD PRO 204 -10.597 13.422 -14.930 981 2HD PRO 204 2HD PRO 204 -9.453 12.280 -15.667 982 H ARG 205 H ARG 205 -12.273 15.846 -18.974 983 HA ARG 205 HA ARG 205 -11.451 18.535 -18.717 984 1HB ARG 205 1HB ARG 205 -13.472 17.189 -19.904 985 2HB ARG 205 2HB ARG 205 -14.355 17.858 -18.532 986 1HG ARG 205 1HG ARG 205 -14.229 19.982 -19.335 987 2HG ARG 205 2HG ARG 205 -12.562 19.778 -19.871 988 1HD ARG 205 1HD ARG 205 -13.231 18.774 -21.924 989 2HD ARG 205 2HD ARG 205 -14.875 18.472 -21.329 990 HE ARG 205 HE ARG 205 -14.322 21.273 -21.144 991 1HH1 ARG 205 1HH1 ARG 205 -14.881 18.776 -23.504 992 2HH1 ARG 205 2HH1 ARG 205 -15.545 19.870 -24.666 993 1HH2 ARG 205 1HH2 ARG 205 -15.187 22.674 -22.669 994 2HH2 ARG 205 2HH2 ARG 205 -15.718 22.061 -24.200 995 H LYS 206 H LYS 206 -12.968 16.412 -16.375 996 HA LYS 206 HA LYS 206 -14.065 18.303 -14.565 997 1HB LYS 206 1HB LYS 206 -13.260 15.502 -14.674 998 2HB LYS 206 2HB LYS 206 -12.960 16.184 -13.076 999 1HG LYS 206 1HG LYS 206 -15.165 16.229 -12.604 1000 2HG LYS 206 2HG LYS 206 -15.528 17.059 -14.118 1001 1HD LYS 206 1HD LYS 206 -16.653 14.866 -14.037 1002 2HD LYS 206 2HD LYS 206 -15.440 14.897 -15.318 1003 1HE LYS 206 1HE LYS 206 -13.959 14.029 -13.156 1004 2HE LYS 206 2HE LYS 206 -15.529 13.254 -12.875 1005 1HZ LYS 206 1HZ LYS 206 -15.533 12.443 -15.123 1006 2HZ LYS 206 2HZ LYS 206 -14.071 11.974 -14.397 1007 3HZ LYS 206 3HZ LYS 206 -14.099 13.278 -15.484 1008 H GLN 207 H GLN 207 -13.133 19.596 -12.981 1009 HA GLN 207 HA GLN 207 -10.169 19.379 -12.591 1010 1HB GLN 207 1HB GLN 207 -10.821 21.189 -14.175 1011 2HB GLN 207 2HB GLN 207 -11.865 21.881 -12.934 1012 1HG GLN 207 1HG GLN 207 -10.114 22.785 -11.796 1013 2HG GLN 207 2HG GLN 207 -9.097 21.367 -12.051 1014 1HE2 GLN 207 1HE2 GLN 207 -7.383 21.700 -13.475 1015 2HE2 GLN 207 2HE2 GLN 207 -7.329 22.901 -14.673 1016 H LEU 208 H LEU 208 -13.167 20.876 -11.312 1017 HA LEU 208 HA LEU 208 -11.978 20.807 -8.577 1018 1HB LEU 208 1HB LEU 208 -13.480 22.652 -10.061 1019 2HB LEU 208 2HB LEU 208 -14.633 21.989 -8.903 1020 HG LEU 208 HG LEU 208 -12.076 22.505 -7.630 1021 1HD1 LEU 208 1HD1 LEU 208 -13.487 24.918 -8.800 1022 2HD1 LEU 208 2HD1 LEU 208 -11.999 24.242 -9.462 1023 3HD1 LEU 208 3HD1 LEU 208 -12.014 24.912 -7.831 1024 1HD2 LEU 208 1HD2 LEU 208 -14.208 22.199 -6.448 1025 2HD2 LEU 208 2HD2 LEU 208 -14.871 23.624 -7.249 1026 3HD2 LEU 208 3HD2 LEU 208 -13.543 23.795 -6.100 1027 H ALA 209 H ALA 209 -12.473 18.991 -7.415 1028 HA ALA 209 HA ALA 209 -15.259 18.103 -7.191 1029 1HB ALA 209 1HB ALA 209 -14.643 17.010 -9.258 1030 2HB ALA 209 2HB ALA 209 -14.607 15.773 -8.002 1031 3HB ALA 209 3HB ALA 209 -13.101 16.484 -8.584 1032 H THR 210 H THR 210 -13.581 19.074 -5.203 1033 HA THR 210 HA THR 210 -12.875 16.597 -3.661 1034 HB THR 210 HB THR 210 -11.622 19.368 -3.578 1035 HG1 THR 210 HG1 THR 210 -10.659 16.938 -4.675 1036 1HG2 THR 210 1HG2 THR 210 -11.132 18.478 -1.493 1037 2HG2 THR 210 2HG2 THR 210 -9.796 17.816 -2.434 1038 3HG2 THR 210 3HG2 THR 210 -11.201 16.814 -2.073 1039 H LYS 211 H LYS 211 -15.481 17.602 -3.518 1040 HA LYS 211 HA LYS 211 -15.503 19.057 -0.893 1041 1HB LYS 211 1HB LYS 211 -17.025 19.251 -3.438 1042 2HB LYS 211 2HB LYS 211 -17.985 19.419 -1.968 1043 1HG LYS 211 1HG LYS 211 -15.408 20.945 -2.307 1044 2HG LYS 211 2HG LYS 211 -16.915 21.561 -2.985 1045 1HD LYS 211 1HD LYS 211 -16.741 20.686 -0.102 1046 2HD LYS 211 2HD LYS 211 -16.282 22.318 -0.591 1047 1HE LYS 211 1HE LYS 211 -18.481 22.826 -1.347 1048 2HE LYS 211 2HE LYS 211 -18.953 21.116 -1.368 1049 1HZ LYS 211 1HZ LYS 211 -18.228 22.729 1.026 1050 2HZ LYS 211 2HZ LYS 211 -18.539 21.059 1.047 1051 3HZ LYS 211 3HZ LYS 211 -19.777 22.149 0.639 1052 H ALA 212 H ALA 212 -15.425 17.004 0.277 1053 HA ALA 212 HA ALA 212 -18.061 15.856 0.744 1054 1HB ALA 212 1HB ALA 212 -17.645 13.688 -0.193 1055 2HB ALA 212 2HB ALA 212 -15.931 14.036 -0.414 1056 3HB ALA 212 3HB ALA 212 -17.130 14.833 -1.431 1057 H ALA 213 H ALA 213 -17.191 13.405 1.872 1058 HA ALA 213 HA ALA 213 -15.251 14.309 3.974 1059 1HB ALA 213 1HB ALA 213 -17.395 14.454 4.975 1060 2HB ALA 213 2HB ALA 213 -16.831 12.857 5.466 1061 3HB ALA 213 3HB ALA 213 -17.978 13.017 4.136 1062 H ARG 214 H ARG 214 -14.460 12.756 1.740 1063 HA ARG 214 HA ARG 214 -13.445 10.699 1.174 1064 1HB ARG 214 1HB ARG 214 -13.158 11.106 4.144 1065 2HB ARG 214 2HB ARG 214 -12.478 9.663 3.390 1066 1HG ARG 214 1HG ARG 214 -10.679 11.097 3.165 1067 2HG ARG 214 2HG ARG 214 -11.527 11.464 1.666 1068 1HD ARG 214 1HD ARG 214 -12.789 13.224 3.237 1069 2HD ARG 214 2HD ARG 214 -11.274 13.109 4.153 1070 HE ARG 214 HE ARG 214 -10.414 13.318 1.538 1071 1HH1 ARG 214 1HH1 ARG 214 -12.601 15.163 3.521 1072 2HH1 ARG 214 2HH1 ARG 214 -12.277 16.645 2.691 1073 1HH2 ARG 214 1HH2 ARG 214 -10.010 15.253 0.478 1074 2HH2 ARG 214 2HH2 ARG 214 -10.822 16.698 0.982 1075 1HN MLZ 215 1HN MLZ 215 -13.399 8.220 2.159 1076 HA MLZ 215 HA MLZ 215 -16.195 7.341 1.983 1077 1HB MLZ 215 1HB MLZ 215 -13.438 6.172 1.937 1078 2HB MLZ 215 2HB MLZ 215 -14.773 5.090 2.333 1079 1HG MLZ 215 1HG MLZ 215 -15.597 6.689 0.124 1080 2HG MLZ 215 2HG MLZ 215 -15.292 4.954 0.150 1081 1HD MLZ 215 1HD MLZ 215 -13.504 7.183 -0.717 1082 2HD MLZ 215 2HD MLZ 215 -12.752 5.783 0.048 1083 1HE MLZ 215 1HE MLZ 215 -14.788 5.311 -2.111 1084 2HE MLZ 215 2HE MLZ 215 -13.362 4.348 -1.680 1085 HZ MLZ 215 HZ MLZ 215 -11.980 6.244 -2.418 1086 1HCM MLZ 215 1HCM MLZ 215 -11.974 4.758 -4.099 1087 2HCM MLZ 215 2HCM MLZ 215 -12.877 6.039 -4.902 1088 3HCM MLZ 215 3HCM MLZ 215 -13.732 4.696 -4.152 1089 H SER 216 H SER 216 -17.381 6.403 3.662 1090 HA SER 216 HA SER 216 -18.003 5.908 5.884 1091 1HB SER 216 1HB SER 216 -15.891 7.441 7.169 1092 2HB SER 216 2HB SER 216 -16.550 8.327 5.795 1093 HG SER 216 HG SER 216 -18.200 7.066 7.706 1094 H ALA 217 H ALA 217 -17.190 4.785 7.872 1095 HA ALA 217 HA ALA 217 -15.021 2.910 7.172 1096 1HB ALA 217 1HB ALA 217 -13.444 3.951 8.422 1097 2HB ALA 217 2HB ALA 217 -14.516 3.952 9.822 1098 3HB ALA 217 3HB ALA 217 -14.573 5.284 8.667 1099 HA PRO 218 HA PRO 218 -17.026 0.066 9.846 1100 1HB PRO 218 1HB PRO 218 -14.884 -0.016 11.894 1101 2HB PRO 218 2HB PRO 218 -15.472 -1.311 10.838 1102 1HG PRO 218 1HG PRO 218 -13.080 -0.121 10.494 1103 2HG PRO 218 2HG PRO 218 -14.034 -0.761 9.150 1104 1HD PRO 218 1HD PRO 218 -13.617 2.058 10.002 1105 2HD PRO 218 2HD PRO 218 -13.838 1.386 8.373 1106 H ALA 219 H ALA 219 -18.703 1.420 10.665 1107 HA ALA 219 HA ALA 219 -19.909 2.605 12.314 1108 1HB ALA 219 1HB ALA 219 -18.550 1.851 14.650 1109 2HB ALA 219 2HB ALA 219 -18.217 0.545 13.513 1110 3HB ALA 219 3HB ALA 219 -19.884 0.975 13.899 1111 H THR 220 H THR 220 -18.656 4.557 11.307 1112 HA THR 220 HA THR 220 -16.472 5.678 12.902 1113 HB THR 220 HB THR 220 -17.203 7.685 11.315 1114 HG1 THR 220 HG1 THR 220 -18.599 7.153 9.809 1115 1HG2 THR 220 1HG2 THR 220 -15.164 6.654 10.816 1116 2HG2 THR 220 2HG2 THR 220 -16.112 6.299 9.372 1117 3HG2 THR 220 3HG2 THR 220 -15.904 5.066 10.615 1118 H GLY 221 H GLY 221 -18.013 5.435 14.922 1119 1HA GLY 221 1HA GLY 221 -18.601 7.317 16.495 1120 2HA GLY 221 2HA GLY 221 -19.593 7.964 15.188 1121 1H MET 1 1H MET 1 -0.831 -11.329 8.868 1122 2H MET 1 2H MET 1 -1.434 -11.030 7.309 1123 3H MET 1 3H MET 1 -1.569 -9.841 8.515 1124 HA MET 1 HA MET 1 0.229 -9.340 6.924 1125 1HB MET 1 1HB MET 1 0.450 -9.802 9.864 1126 2HB MET 1 2HB MET 1 1.946 -9.403 9.019 1127 1HG MET 1 1HG MET 1 -0.543 -7.780 8.538 1128 2HG MET 1 2HG MET 1 0.468 -7.457 9.947 1129 1HE MET 1 1HE MET 1 0.976 -5.346 9.580 1130 2HE MET 1 2HE MET 1 0.354 -4.899 7.992 1131 3HE MET 1 3HE MET 1 2.053 -4.631 8.380 1132 H PHE 2 H PHE 2 1.307 -11.931 9.159 1133 HA PHE 2 HA PHE 2 3.588 -12.754 7.758 1134 1HB PHE 2 1HB PHE 2 3.147 -14.944 8.941 1135 2HB PHE 2 2HB PHE 2 3.001 -13.534 9.990 1136 HD1 PHE 2 HD1 PHE 2 1.043 -15.967 7.953 1137 HD2 PHE 2 HD2 PHE 2 0.947 -13.001 11.059 1138 HE1 PHE 2 HE1 PHE 2 -1.294 -16.602 8.488 1139 HE2 PHE 2 HE2 PHE 2 -1.389 -13.635 11.593 1140 HZ PHE 2 HZ PHE 2 -2.510 -15.434 10.307 1141 H ASN 3 H ASN 3 3.967 -14.131 6.019 1142 HA ASN 3 HA ASN 3 1.608 -15.406 4.697 1143 1HB ASN 3 1HB ASN 3 3.295 -13.173 3.820 1144 2HB ASN 3 2HB ASN 3 3.255 -14.482 2.639 1145 1HD2 ASN 3 1HD2 ASN 3 1.771 -11.659 3.104 1146 2HD2 ASN 3 2HD2 ASN 3 0.183 -12.035 2.638 1147 H ASP 4 H ASP 4 2.109 -17.380 3.710 1148 HA ASP 4 HA ASP 4 4.161 -19.012 4.596 1149 1HB ASP 4 1HB ASP 4 2.105 -19.561 3.218 1150 2HB ASP 4 2HB ASP 4 2.991 -19.019 1.793 1151 H ARG 5 H ARG 5 4.247 -17.132 1.534 1152 HA ARG 5 HA ARG 5 6.934 -17.911 0.854 1153 1HB ARG 5 1HB ARG 5 4.875 -15.920 0.015 1154 2HB ARG 5 2HB ARG 5 6.534 -15.597 -0.486 1155 1HG ARG 5 1HG ARG 5 5.030 -18.188 -0.966 1156 2HG ARG 5 2HG ARG 5 5.329 -16.944 -2.179 1157 1HD ARG 5 1HD ARG 5 7.850 -17.508 -1.017 1158 2HD ARG 5 2HD ARG 5 7.082 -19.076 -1.331 1159 HE ARG 5 HE ARG 5 6.760 -17.143 -3.511 1160 1HH1 ARG 5 1HH1 ARG 5 8.751 -19.645 -2.134 1161 2HH1 ARG 5 2HH1 ARG 5 9.502 -20.028 -3.643 1162 1HH2 ARG 5 1HH2 ARG 5 7.750 -17.659 -5.456 1163 2HH2 ARG 5 2HH2 ARG 5 8.942 -18.914 -5.510 1164 H VAL 6 H VAL 6 5.597 -15.128 2.627 1165 HA VAL 6 HA VAL 6 8.282 -14.588 3.755 1166 HB VAL 6 HB VAL 6 6.676 -12.625 2.074 1167 1HG1 VAL 6 1HG1 VAL 6 9.384 -12.150 3.326 1168 2HG1 VAL 6 2HG1 VAL 6 7.889 -11.717 4.155 1169 3HG1 VAL 6 3HG1 VAL 6 8.290 -10.966 2.611 1170 1HG2 VAL 6 1HG2 VAL 6 7.872 -14.087 0.622 1171 2HG2 VAL 6 2HG2 VAL 6 9.290 -14.089 1.671 1172 3HG2 VAL 6 3HG2 VAL 6 8.874 -12.642 0.752 1173 H ILE 7 H ILE 7 8.139 -13.397 5.731 1174 HA ILE 7 HA ILE 7 5.339 -12.941 6.714 1175 HB ILE 7 HB ILE 7 6.529 -14.829 7.760 1176 1HG1 ILE 7 1HG1 ILE 7 6.559 -12.492 9.684 1177 2HG1 ILE 7 2HG1 ILE 7 5.069 -13.256 9.129 1178 1HG2 ILE 7 1HG2 ILE 7 8.773 -14.695 7.915 1179 2HG2 ILE 7 2HG2 ILE 7 8.555 -13.560 9.247 1180 3HG2 ILE 7 3HG2 ILE 7 8.737 -12.960 7.599 1181 1HD1 ILE 7 1HD1 ILE 7 6.152 -15.476 9.894 1182 2HD1 ILE 7 2HD1 ILE 7 5.575 -14.381 11.151 1183 3HD1 ILE 7 3HD1 ILE 7 7.296 -14.461 10.773 1184 H VAL 8 H VAL 8 5.246 -11.243 8.485 1185 HA VAL 8 HA VAL 8 6.952 -8.924 7.717 1186 HB VAL 8 HB VAL 8 4.378 -9.207 9.311 1187 1HG1 VAL 8 1HG1 VAL 8 6.214 -7.121 9.398 1188 2HG1 VAL 8 2HG1 VAL 8 4.507 -7.007 9.827 1189 3HG1 VAL 8 3HG1 VAL 8 5.038 -6.581 8.200 1190 1HG2 VAL 8 1HG2 VAL 8 4.862 -9.333 6.544 1191 2HG2 VAL 8 2HG2 VAL 8 4.254 -7.703 6.832 1192 3HG2 VAL 8 3HG2 VAL 8 3.302 -9.101 7.332 1193 H LYS 9 H LYS 9 8.573 -8.307 9.067 1194 HA LYS 9 HA LYS 9 8.321 -8.738 11.983 1195 1HB LYS 9 1HB LYS 9 9.826 -10.352 10.135 1196 2HB LYS 9 2HB LYS 9 10.911 -9.590 11.295 1197 1HG LYS 9 1HG LYS 9 10.309 -11.200 12.758 1198 2HG LYS 9 2HG LYS 9 8.722 -10.434 12.827 1199 1HD LYS 9 1HD LYS 9 7.774 -11.968 11.388 1200 2HD LYS 9 2HD LYS 9 9.288 -12.246 10.527 1201 1HE LYS 9 1HE LYS 9 9.354 -14.194 11.734 1202 2HE LYS 9 2HE LYS 9 9.892 -13.155 13.066 1203 1HZ LYS 9 1HZ LYS 9 7.739 -12.951 13.883 1204 2HZ LYS 9 2HZ LYS 9 7.795 -14.582 13.414 1205 3HZ LYS 9 3HZ LYS 9 7.020 -13.441 12.424 1206 H LYS 10 H LYS 10 10.120 -5.622 12.077 1207 HA LYS 10 HA LYS 10 8.490 -5.663 13.741 1208 1HB LYS 10 1HB LYS 10 7.338 -6.641 11.368 1209 2HB LYS 10 2HB LYS 10 6.805 -7.748 12.633 1210 1HG LYS 10 1HG LYS 10 6.628 -4.733 12.855 1211 2HG LYS 10 2HG LYS 10 5.296 -5.757 12.320 1212 1HD LYS 10 1HD LYS 10 5.008 -6.712 14.418 1213 2HD LYS 10 2HD LYS 10 6.685 -6.433 14.888 1214 1HE LYS 10 1HE LYS 10 6.192 -3.967 14.970 1215 2HE LYS 10 2HE LYS 10 4.485 -4.347 14.670 1216 1HZ LYS 10 1HZ LYS 10 4.737 -5.983 16.579 1217 2HZ LYS 10 2HZ LYS 10 4.705 -4.338 16.998 1218 3HZ LYS 10 3HZ LYS 10 6.182 -5.176 16.957 1219 H SER 11 H SER 11 10.460 -6.839 14.787 1220 HA SER 11 HA SER 11 9.448 -8.964 16.412 1221 1HB SER 11 1HB SER 11 9.718 -10.649 14.915 1222 2HB SER 11 2HB SER 11 10.709 -9.655 13.854 1223 HG SER 11 HG SER 11 12.489 -10.112 15.123 1224 HA PRO 12 HA PRO 12 14.035 -8.269 17.411 1225 1HB PRO 12 1HB PRO 12 15.172 -6.420 15.451 1226 2HB PRO 12 2HB PRO 12 15.664 -8.084 15.808 1227 1HG PRO 12 1HG PRO 12 14.487 -7.344 13.477 1228 2HG PRO 12 2HG PRO 12 14.327 -8.960 14.178 1229 1HD PRO 12 1HD PRO 12 12.417 -6.661 14.262 1230 2HD PRO 12 2HD PRO 12 12.104 -8.382 13.971 1231 H LEU 13 H LEU 13 15.561 -5.778 17.244 1232 HA LEU 13 HA LEU 13 13.705 -4.028 18.785 1233 1HB LEU 13 1HB LEU 13 16.295 -4.998 19.160 1234 2HB LEU 13 2HB LEU 13 16.549 -3.323 18.669 1235 HG LEU 13 HG LEU 13 14.538 -2.943 20.413 1236 1HD1 LEU 13 1HD1 LEU 13 16.001 -5.425 21.360 1237 2HD1 LEU 13 2HD1 LEU 13 14.280 -5.290 20.999 1238 3HD1 LEU 13 3HD1 LEU 13 14.960 -4.437 22.385 1239 1HD2 LEU 13 1HD2 LEU 13 16.631 -1.774 20.588 1240 2HD2 LEU 13 2HD2 LEU 13 17.492 -3.258 20.999 1241 3HD2 LEU 13 3HD2 LEU 13 16.354 -2.552 22.146 1242 H GLY 14 H GLY 14 15.220 -4.224 15.703 1243 1HA GLY 14 1HA GLY 14 15.694 -1.448 15.189 1244 2HA GLY 14 2HA GLY 14 15.428 -2.677 13.953 1245 H GLY 15 H GLY 15 13.898 -1.709 12.649 1246 1HA GLY 15 1HA GLY 15 11.458 -0.620 13.989 1247 2HA GLY 15 2HA GLY 15 12.020 -0.118 12.395 1248 H TYR 16 H TYR 16 10.175 -0.728 11.232 1249 HA TYR 16 HA TYR 16 9.205 -3.528 11.482 1250 1HB TYR 16 1HB TYR 16 8.226 -0.960 10.215 1251 2HB TYR 16 2HB TYR 16 7.446 -2.502 9.867 1252 HD1 TYR 16 HD1 TYR 16 8.721 -0.600 12.849 1253 HD2 TYR 16 HD2 TYR 16 5.629 -3.080 11.194 1254 HE1 TYR 16 HE1 TYR 16 7.450 -0.433 14.972 1255 HE2 TYR 16 HE2 TYR 16 4.358 -2.913 13.317 1256 HH TYR 16 HH TYR 16 4.713 -0.698 15.500 1257 H GLY 17 H GLY 17 10.524 -4.871 10.259 1258 1HA GLY 17 1HA GLY 17 10.991 -4.070 7.412 1259 2HA GLY 17 2HA GLY 17 12.134 -5.056 8.325 1260 H VAL 18 H VAL 18 11.608 -6.502 6.308 1261 HA VAL 18 HA VAL 18 9.245 -8.207 7.025 1262 HB VAL 18 HB VAL 18 8.719 -7.075 4.984 1263 1HG1 VAL 18 1HG1 VAL 18 10.658 -7.631 3.096 1264 2HG1 VAL 18 2HG1 VAL 18 11.604 -7.283 4.540 1265 3HG1 VAL 18 3HG1 VAL 18 10.458 -6.092 3.933 1266 1HG2 VAL 18 1HG2 VAL 18 8.602 -9.687 5.045 1267 2HG2 VAL 18 2HG2 VAL 18 9.925 -9.599 3.881 1268 3HG2 VAL 18 3HG2 VAL 18 8.370 -8.855 3.507 1269 H PHE 19 H PHE 19 9.737 -10.330 7.398 1270 HA PHE 19 HA PHE 19 12.569 -11.165 7.097 1271 1HB PHE 19 1HB PHE 19 10.141 -11.949 8.673 1272 2HB PHE 19 2HB PHE 19 11.384 -13.171 8.423 1273 HD1 PHE 19 HD1 PHE 19 12.003 -13.277 10.774 1274 HD2 PHE 19 HD2 PHE 19 12.202 -9.561 8.623 1275 HE1 PHE 19 HE1 PHE 19 13.341 -12.284 12.609 1276 HE2 PHE 19 HE2 PHE 19 13.540 -8.571 10.461 1277 HZ PHE 19 HZ PHE 19 14.108 -9.933 12.454 1278 H ALA 20 H ALA 20 12.991 -13.403 6.296 1279 HA ALA 20 HA ALA 20 11.029 -14.228 4.180 1280 1HB ALA 20 1HB ALA 20 13.666 -15.030 3.507 1281 2HB ALA 20 2HB ALA 20 13.793 -13.375 4.103 1282 3HB ALA 20 3HB ALA 20 12.722 -13.747 2.752 1283 H ARG 21 H ARG 21 10.105 -15.983 5.330 1284 HA ARG 21 HA ARG 21 11.500 -17.861 6.959 1285 1HB ARG 21 1HB ARG 21 8.906 -17.498 5.656 1286 2HB ARG 21 2HB ARG 21 9.372 -19.197 5.721 1287 1HG ARG 21 1HG ARG 21 9.075 -19.292 7.962 1288 2HG ARG 21 2HG ARG 21 9.941 -17.778 8.217 1289 1HD ARG 21 1HD ARG 21 7.980 -16.674 8.492 1290 2HD ARG 21 2HD ARG 21 7.404 -17.253 6.918 1291 HE ARG 21 HE ARG 21 6.800 -18.458 9.512 1292 1HH1 ARG 21 1HH1 ARG 21 7.199 -19.021 6.100 1293 2HH1 ARG 21 2HH1 ARG 21 6.196 -20.430 6.104 1294 1HH2 ARG 21 1HH2 ARG 21 5.503 -20.289 9.492 1295 2HH2 ARG 21 2HH2 ARG 21 5.242 -21.145 8.008 1296 H LYS 22 H LYS 22 11.417 -17.452 3.515 1297 HA LYS 22 HA LYS 22 12.363 -20.207 2.968 1298 1HB LYS 22 1HB LYS 22 12.040 -17.812 1.118 1299 2HB LYS 22 2HB LYS 22 12.092 -19.509 0.654 1300 1HG LYS 22 1HG LYS 22 10.028 -19.362 2.540 1301 2HG LYS 22 2HG LYS 22 9.823 -17.929 1.534 1302 1HD LYS 22 1HD LYS 22 9.325 -19.153 -0.337 1303 2HD LYS 22 2HD LYS 22 10.436 -20.453 0.095 1304 1HE LYS 22 1HE LYS 22 8.098 -20.132 1.901 1305 2HE LYS 22 2HE LYS 22 7.735 -20.712 0.264 1306 1HZ LYS 22 1HZ LYS 22 9.708 -21.832 2.185 1307 2HZ LYS 22 2HZ LYS 22 9.642 -22.280 0.548 1308 3HZ LYS 22 3HZ LYS 22 8.324 -22.601 1.570 1309 H SER 23 H SER 23 15.727 -19.147 1.863 1310 HA SER 23 HA SER 23 13.365 -20.879 1.291 1311 1HB SER 23 1HB SER 23 15.493 -21.909 2.013 1312 2HB SER 23 2HB SER 23 15.143 -22.350 0.342 1313 HG SER 23 HG SER 23 16.942 -21.447 -0.179 1314 H PHE 24 H PHE 24 15.338 -18.365 -0.077 1315 HA PHE 24 HA PHE 24 13.892 -18.703 -2.677 1316 1HB PHE 24 1HB PHE 24 15.062 -16.353 -1.159 1317 2HB PHE 24 2HB PHE 24 14.520 -16.212 -2.830 1318 HD1 PHE 24 HD1 PHE 24 12.126 -17.779 -3.019 1319 HD2 PHE 24 HD2 PHE 24 13.496 -15.363 0.259 1320 HE1 PHE 24 HE1 PHE 24 9.786 -17.509 -2.239 1321 HE2 PHE 24 HE2 PHE 24 11.158 -15.093 1.038 1322 HZ PHE 24 HZ PHE 24 9.303 -16.166 -0.211 1323 H GLU 25 H GLU 25 15.127 -18.208 -4.642 1324 HA GLU 25 HA GLU 25 18.002 -18.963 -4.372 1325 1HB GLU 25 1HB GLU 25 15.811 -19.627 -6.094 1326 2HB GLU 25 2HB GLU 25 17.041 -18.832 -7.077 1327 1HG GLU 25 1HG GLU 25 18.742 -20.385 -6.013 1328 2HG GLU 25 2HG GLU 25 17.387 -21.267 -5.308 1329 H LYS 26 H LYS 26 18.829 -17.920 -6.883 1330 HA LYS 26 HA LYS 26 19.001 -15.029 -6.198 1331 1HB LYS 26 1HB LYS 26 20.955 -16.694 -6.657 1332 2HB LYS 26 2HB LYS 26 20.507 -16.523 -8.352 1333 1HG LYS 26 1HG LYS 26 20.801 -14.085 -8.198 1334 2HG LYS 26 2HG LYS 26 21.213 -14.235 -6.492 1335 1HD LYS 26 1HD LYS 26 23.204 -15.505 -7.016 1336 2HD LYS 26 2HD LYS 26 22.747 -15.607 -8.716 1337 1HE LYS 26 1HE LYS 26 22.702 -12.896 -8.340 1338 2HE LYS 26 2HE LYS 26 24.011 -13.372 -7.242 1339 1HZ LYS 26 1HZ LYS 26 24.836 -14.813 -9.106 1340 2HZ LYS 26 2HZ LYS 26 24.969 -13.144 -9.390 1341 3HZ LYS 26 3HZ LYS 26 23.724 -14.034 -10.125 1342 H GLY 27 H GLY 27 16.926 -14.347 -7.048 1343 1HA GLY 27 1HA GLY 27 16.366 -13.054 -9.166 1344 2HA GLY 27 2HA GLY 27 16.709 -14.555 -10.026 1345 H GLU 28 H GLU 28 14.824 -13.806 -7.072 1346 HA GLU 28 HA GLU 28 12.484 -15.158 -8.378 1347 1HB GLU 28 1HB GLU 28 13.998 -15.696 -5.926 1348 2HB GLU 28 2HB GLU 28 12.270 -15.525 -5.616 1349 1HG GLU 28 1HG GLU 28 12.998 -17.143 -7.994 1350 2HG GLU 28 2HG GLU 28 13.410 -17.849 -6.431 1351 H LEU 29 H LEU 29 10.580 -14.008 -8.250 1352 HA LEU 29 HA LEU 29 10.607 -11.302 -7.174 1353 1HB LEU 29 1HB LEU 29 9.389 -12.381 -9.231 1354 2HB LEU 29 2HB LEU 29 8.180 -12.879 -8.049 1355 HG LEU 29 HG LEU 29 7.598 -10.709 -9.104 1356 1HD1 LEU 29 1HD1 LEU 29 7.321 -11.374 -6.522 1357 2HD1 LEU 29 2HD1 LEU 29 6.801 -9.807 -7.142 1358 3HD1 LEU 29 3HD1 LEU 29 8.353 -9.958 -6.318 1359 1HD2 LEU 29 1HD2 LEU 29 9.149 -9.110 -9.426 1360 2HD2 LEU 29 2HD2 LEU 29 10.358 -10.218 -8.776 1361 3HD2 LEU 29 3HD2 LEU 29 9.536 -9.083 -7.705 1362 H VAL 30 H VAL 30 10.632 -11.187 -4.933 1363 HA VAL 30 HA VAL 30 9.336 -13.067 -3.177 1364 HB VAL 30 HB VAL 30 10.298 -10.200 -2.845 1365 1HG1 VAL 30 1HG1 VAL 30 8.818 -11.895 -1.052 1366 2HG1 VAL 30 2HG1 VAL 30 9.433 -10.267 -0.769 1367 3HG1 VAL 30 3HG1 VAL 30 10.447 -11.667 -0.419 1368 1HG2 VAL 30 1HG2 VAL 30 11.845 -12.317 -1.585 1369 2HG2 VAL 30 2HG2 VAL 30 12.377 -11.069 -2.711 1370 3HG2 VAL 30 3HG2 VAL 30 11.700 -12.579 -3.323 1371 H GLU 31 H GLU 31 8.425 -9.780 -4.271 1372 HA GLU 31 HA GLU 31 5.584 -10.428 -4.162 1373 1HB GLU 31 1HB GLU 31 6.961 -9.543 -1.809 1374 2HB GLU 31 2HB GLU 31 5.891 -8.241 -2.329 1375 1HG GLU 31 1HG GLU 31 4.717 -10.958 -2.433 1376 2HG GLU 31 2HG GLU 31 5.073 -10.354 -0.814 1377 H GLU 32 H GLU 32 4.313 -8.713 -5.098 1378 HA GLU 32 HA GLU 32 5.817 -6.302 -6.019 1379 1HB GLU 32 1HB GLU 32 4.953 -6.721 -8.303 1380 2HB GLU 32 2HB GLU 32 5.911 -8.092 -7.744 1381 1HG GLU 32 1HG GLU 32 3.623 -9.025 -6.892 1382 2HG GLU 32 2HG GLU 32 2.921 -7.864 -8.019 1383 H CYS 33 H CYS 33 4.521 -4.457 -6.139 1384 HA CYS 33 HA CYS 33 1.568 -4.761 -5.918 1385 1HB CYS 33 1HB CYS 33 3.460 -4.019 -3.820 1386 2HB CYS 33 2HB CYS 33 2.264 -2.750 -4.087 1387 HG CYS 33 HG CYS 33 0.687 -5.218 -3.974 1388 H LEU 34 H LEU 34 0.703 -2.281 -5.761 1389 HA LEU 34 HA LEU 34 1.872 -0.932 -8.133 1390 1HB LEU 34 1HB LEU 34 -0.717 -1.250 -6.819 1391 2HB LEU 34 2HB LEU 34 -0.397 0.438 -7.213 1392 HG LEU 34 HG LEU 34 0.373 -0.557 -9.527 1393 1HD1 LEU 34 1HD1 LEU 34 0.225 -2.837 -9.385 1394 2HD1 LEU 34 2HD1 LEU 34 -1.455 -2.526 -9.824 1395 3HD1 LEU 34 3HD1 LEU 34 -1.016 -2.776 -8.135 1396 1HD2 LEU 34 1HD2 LEU 34 -2.335 0.072 -8.453 1397 2HD2 LEU 34 2HD2 LEU 34 -2.269 -0.677 -10.049 1398 3HD2 LEU 34 3HD2 LEU 34 -1.435 0.850 -9.756 1399 H CYS 35 H CYS 35 1.557 1.646 -7.858 1400 HA CYS 35 HA CYS 35 2.446 2.547 -5.167 1401 1HB CYS 35 1HB CYS 35 4.437 3.630 -6.238 1402 2HB CYS 35 2HB CYS 35 4.476 1.875 -6.391 1403 HG CYS 35 HG CYS 35 4.444 3.776 -8.697 1404 H ILE 36 H ILE 36 2.763 5.055 -5.286 1405 HA ILE 36 HA ILE 36 0.511 6.175 -6.912 1406 HB ILE 36 HB ILE 36 1.958 7.254 -4.463 1407 1HG1 ILE 36 1HG1 ILE 36 -0.676 5.765 -4.691 1408 2HG1 ILE 36 2HG1 ILE 36 0.804 5.137 -3.968 1409 1HG2 ILE 36 1HG2 ILE 36 -0.652 8.262 -4.633 1410 2HG2 ILE 36 2HG2 ILE 36 -0.036 8.331 -6.284 1411 3HG2 ILE 36 3HG2 ILE 36 0.837 9.141 -4.983 1412 1HD1 ILE 36 1HD1 ILE 36 -0.931 6.110 -2.347 1413 2HD1 ILE 36 2HD1 ILE 36 -0.494 7.689 -2.998 1414 3HD1 ILE 36 3HD1 ILE 36 0.720 6.707 -2.179 1415 H VAL 37 H VAL 37 1.545 6.776 -8.853 1416 HA VAL 37 HA VAL 37 4.156 8.119 -8.807 1417 HB VAL 37 HB VAL 37 2.156 7.688 -11.059 1418 1HG1 VAL 37 1HG1 VAL 37 5.169 8.042 -11.095 1419 2HG1 VAL 37 2HG1 VAL 37 4.002 9.300 -11.506 1420 3HG1 VAL 37 3HG1 VAL 37 4.123 7.850 -12.503 1421 1HG2 VAL 37 1HG2 VAL 37 2.879 5.598 -9.746 1422 2HG2 VAL 37 2HG2 VAL 37 4.501 5.908 -10.366 1423 3HG2 VAL 37 3HG2 VAL 37 3.177 5.578 -11.484 1424 H ARG 38 H ARG 38 3.757 10.110 -7.686 1425 HA ARG 38 HA ARG 38 1.907 12.012 -9.085 1426 1HB ARG 38 1HB ARG 38 1.323 11.378 -6.752 1427 2HB ARG 38 2HB ARG 38 2.910 11.930 -6.215 1428 1HG ARG 38 1HG ARG 38 1.482 13.768 -5.780 1429 2HG ARG 38 2HG ARG 38 2.277 14.191 -7.296 1430 1HD ARG 38 1HD ARG 38 0.348 13.816 -8.563 1431 2HD ARG 38 2HD ARG 38 -0.328 12.683 -7.378 1432 HE ARG 38 HE ARG 38 -0.055 15.156 -6.050 1433 1HH1 ARG 38 1HH1 ARG 38 -1.784 13.858 -8.778 1434 2HH1 ARG 38 2HH1 ARG 38 -3.105 14.961 -8.605 1435 1HH2 ARG 38 1HH2 ARG 38 -1.780 16.576 -5.845 1436 2HH2 ARG 38 2HH2 ARG 38 -3.105 16.490 -6.957 1437 H HIS 39 H HIS 39 2.694 14.206 -9.341 1438 HA HIS 39 HA HIS 39 5.424 14.473 -10.114 1439 1HB HIS 39 1HB HIS 39 3.026 16.176 -9.680 1440 2HB HIS 39 2HB HIS 39 4.571 17.026 -9.670 1441 HD1 HIS 39 HD1 HIS 39 3.274 17.940 -12.009 1442 HD2 HIS 39 HD2 HIS 39 4.975 14.134 -12.051 1443 HE1 HIS 39 HE1 HIS 39 3.579 17.318 -14.446 1444 H ASN 40 H ASN 40 6.425 16.766 -8.977 1445 HA ASN 40 HA ASN 40 6.913 15.917 -6.145 1446 1HB ASN 40 1HB ASN 40 8.527 16.935 -8.415 1447 2HB ASN 40 2HB ASN 40 8.955 17.604 -6.841 1448 1HD2 ASN 40 1HD2 ASN 40 9.757 15.109 -8.869 1449 2HD2 ASN 40 2HD2 ASN 40 10.260 13.959 -7.727 1450 H ASP 41 H ASP 41 5.809 17.200 -4.738 1451 HA ASP 41 HA ASP 41 6.183 20.053 -4.613 1452 1HB ASP 41 1HB ASP 41 4.562 19.453 -6.636 1453 2HB ASP 41 2HB ASP 41 3.364 19.297 -5.351 1454 H ASP 42 H ASP 42 3.236 20.213 -3.547 1455 HA ASP 42 HA ASP 42 3.676 19.797 -0.804 1456 1HB ASP 42 1HB ASP 42 1.245 19.710 -2.606 1457 2HB ASP 42 2HB ASP 42 1.084 19.515 -0.860 1458 H TRP 43 H TRP 43 2.954 17.491 -3.323 1459 HA TRP 43 HA TRP 43 2.024 15.265 -1.824 1460 1HB TRP 43 1HB TRP 43 1.908 15.164 -4.181 1461 2HB TRP 43 2HB TRP 43 3.550 15.761 -4.382 1462 HD1 TRP 43 HD1 TRP 43 5.287 14.020 -4.965 1463 HE1 TRP 43 HE1 TRP 43 5.457 11.454 -4.812 1464 HE3 TRP 43 HE3 TRP 43 0.921 12.987 -2.522 1465 HZ2 TRP 43 HZ2 TRP 43 3.946 9.258 -3.794 1466 HZ3 TRP 43 HZ3 TRP 43 0.313 10.648 -1.973 1467 HH2 TRP 43 HH2 TRP 43 1.819 8.783 -2.604 1468 H GLY 44 H GLY 44 5.390 15.981 -2.865 1469 1HA GLY 44 1HA GLY 44 6.630 13.920 -1.363 1470 2HA GLY 44 2HA GLY 44 7.437 15.402 -1.876 1471 H THR 45 H THR 45 5.733 17.229 -0.446 1472 HA THR 45 HA THR 45 7.039 17.298 2.094 1473 HB THR 45 HB THR 45 4.388 18.572 1.346 1474 HG1 THR 45 HG1 THR 45 5.709 20.198 0.396 1475 1HG2 THR 45 1HG2 THR 45 5.947 18.754 3.624 1476 2HG2 THR 45 2HG2 THR 45 4.771 19.958 3.098 1477 3HG2 THR 45 3HG2 THR 45 6.474 20.147 2.681 1478 H ALA 46 H ALA 46 3.519 16.840 1.542 1479 HA ALA 46 HA ALA 46 2.886 15.920 4.135 1480 1HB ALA 46 1HB ALA 46 0.843 15.154 3.071 1481 2HB ALA 46 2HB ALA 46 1.651 15.019 1.509 1482 3HB ALA 46 3HB ALA 46 1.363 16.608 2.219 1483 H LEU 47 H LEU 47 3.721 13.998 1.230 1484 HA LEU 47 HA LEU 47 3.818 11.524 2.852 1485 1HB LEU 47 1HB LEU 47 3.989 12.305 -0.057 1486 2HB LEU 47 2HB LEU 47 4.499 10.694 0.443 1487 HG LEU 47 HG LEU 47 2.131 10.685 -0.231 1488 1HD1 LEU 47 1HD1 LEU 47 2.061 10.475 2.760 1489 2HD1 LEU 47 2HD1 LEU 47 3.124 9.400 1.851 1490 3HD1 LEU 47 3HD1 LEU 47 1.386 9.385 1.548 1491 1HD2 LEU 47 1HD2 LEU 47 0.483 12.020 0.884 1492 2HD2 LEU 47 2HD2 LEU 47 1.786 13.117 0.430 1493 3HD2 LEU 47 3HD2 LEU 47 1.646 12.557 2.096 1494 H GLU 48 H GLU 48 5.806 13.499 3.564 1495 HA GLU 48 HA GLU 48 8.327 13.013 2.250 1496 1HB GLU 48 1HB GLU 48 9.193 14.125 4.339 1497 2HB GLU 48 2HB GLU 48 7.865 15.006 3.584 1498 1HG GLU 48 1HG GLU 48 6.813 14.921 5.578 1499 2HG GLU 48 2HG GLU 48 6.611 13.190 5.307 1500 H ASP 49 H ASP 49 7.657 10.492 2.377 1501 HA ASP 49 HA ASP 49 9.608 9.178 4.004 1502 1HB ASP 49 1HB ASP 49 7.069 9.856 5.240 1503 2HB ASP 49 2HB ASP 49 7.269 8.105 5.191 1504 H TYR 50 H TYR 50 9.876 7.092 3.198 1505 HA TYR 50 HA TYR 50 9.525 5.224 1.795 1506 1HB TYR 50 1HB TYR 50 6.610 5.884 2.357 1507 2HB TYR 50 2HB TYR 50 7.272 4.305 1.944 1508 HD1 TYR 50 HD1 TYR 50 5.759 5.601 4.540 1509 HD2 TYR 50 HD2 TYR 50 9.732 4.256 3.614 1510 HE1 TYR 50 HE1 TYR 50 6.165 5.150 6.943 1511 HE2 TYR 50 HE2 TYR 50 10.139 3.805 6.019 1512 HH TYR 50 HH TYR 50 7.906 3.415 8.217 1513 H LEU 51 H LEU 51 9.644 7.922 0.557 1514 HA LEU 51 HA LEU 51 7.781 7.579 -1.755 1515 1HB LEU 51 1HB LEU 51 9.194 9.827 -0.378 1516 2HB LEU 51 2HB LEU 51 8.969 9.994 -2.115 1517 HG LEU 51 HG LEU 51 6.808 9.599 -0.025 1518 1HD1 LEU 51 1HD1 LEU 51 7.828 11.894 -0.404 1519 2HD1 LEU 51 2HD1 LEU 51 6.091 11.798 -0.695 1520 3HD1 LEU 51 3HD1 LEU 51 7.214 11.811 -2.055 1521 1HD2 LEU 51 1HD2 LEU 51 5.991 8.346 -1.845 1522 2HD2 LEU 51 2HD2 LEU 51 6.739 9.412 -3.034 1523 3HD2 LEU 51 3HD2 LEU 51 5.320 9.951 -2.134 1524 H PHE 52 H PHE 52 8.861 6.152 -3.150 1525 HA PHE 52 HA PHE 52 11.744 6.542 -3.720 1526 1HB PHE 52 1HB PHE 52 9.578 4.612 -4.620 1527 2HB PHE 52 2HB PHE 52 11.222 4.557 -5.257 1528 HD1 PHE 52 HD1 PHE 52 13.116 4.671 -3.347 1529 HD2 PHE 52 HD2 PHE 52 9.094 3.268 -2.785 1530 HE1 PHE 52 HE1 PHE 52 13.841 3.387 -1.353 1531 HE2 PHE 52 HE2 PHE 52 9.820 1.984 -0.792 1532 HZ PHE 52 HZ PHE 52 12.194 2.044 -0.076 1533 H SER 53 H SER 53 11.984 8.422 -4.958 1534 HA SER 53 HA SER 53 10.077 8.874 -7.202 1535 1HB SER 53 1HB SER 53 10.334 10.720 -5.699 1536 2HB SER 53 2HB SER 53 12.088 10.545 -5.675 1537 HG SER 53 HG SER 53 11.573 12.222 -7.041 1538 H ARG 54 H ARG 54 10.891 9.435 -9.304 1539 HA ARG 54 HA ARG 54 13.651 8.403 -9.872 1540 1HB ARG 54 1HB ARG 54 10.979 8.219 -11.259 1541 2HB ARG 54 2HB ARG 54 12.459 8.087 -12.208 1542 1HG ARG 54 1HG ARG 54 13.209 6.304 -10.541 1543 2HG ARG 54 2HG ARG 54 11.556 6.318 -9.926 1544 1HD ARG 54 1HD ARG 54 11.107 4.794 -11.563 1545 2HD ARG 54 2HD ARG 54 11.234 6.152 -12.698 1546 HE ARG 54 HE ARG 54 13.823 5.028 -11.917 1547 1HH1 ARG 54 1HH1 ARG 54 11.135 4.835 -14.122 1548 2HH1 ARG 54 2HH1 ARG 54 12.066 4.067 -15.361 1549 1HH2 ARG 54 1HH2 ARG 54 15.009 4.031 -13.542 1550 2HH2 ARG 54 2HH2 ARG 54 14.241 3.615 -15.038 1551 H LYS 55 H LYS 55 14.213 9.382 -12.262 1552 HA LYS 55 HA LYS 55 14.368 12.271 -11.866 1553 1HB LYS 55 1HB LYS 55 15.992 10.447 -12.941 1554 2HB LYS 55 2HB LYS 55 15.115 10.867 -14.412 1555 1HG LYS 55 1HG LYS 55 16.089 12.916 -14.544 1556 2HG LYS 55 2HG LYS 55 15.947 13.194 -12.808 1557 1HD LYS 55 1HD LYS 55 18.041 12.406 -12.392 1558 2HD LYS 55 2HD LYS 55 17.871 11.083 -13.546 1559 1HE LYS 55 1HE LYS 55 18.048 12.953 -15.365 1560 2HE LYS 55 2HE LYS 55 18.741 13.927 -14.055 1561 1HZ LYS 55 1HZ LYS 55 19.626 11.159 -14.668 1562 2HZ LYS 55 2HZ LYS 55 20.385 12.288 -13.652 1563 3HZ LYS 55 3HZ LYS 55 20.378 12.529 -15.333 1564 H ASN 56 H ASN 56 11.907 12.453 -11.933 1565 HA ASN 56 HA ASN 56 10.526 12.092 -14.460 1566 1HB ASN 56 1HB ASN 56 11.978 13.989 -15.032 1567 2HB ASN 56 2HB ASN 56 10.320 14.568 -14.873 1568 1HD2 ASN 56 1HD2 ASN 56 13.262 15.672 -14.213 1569 2HD2 ASN 56 2HD2 ASN 56 13.014 16.429 -12.714 1570 H MET 57 H MET 57 10.293 11.675 -11.469 1571 HA MET 57 HA MET 57 8.304 13.508 -10.449 1572 1HB MET 57 1HB MET 57 6.381 12.033 -10.809 1573 2HB MET 57 2HB MET 57 7.111 12.444 -12.352 1574 1HG MET 57 1HG MET 57 8.490 10.163 -11.527 1575 2HG MET 57 2HG MET 57 6.818 9.840 -11.071 1576 1HE MET 57 1HE MET 57 4.765 10.348 -14.100 1577 2HE MET 57 2HE MET 57 5.577 11.902 -13.910 1578 3HE MET 57 3HE MET 57 5.062 10.996 -12.487 1579 H SER 58 H SER 58 6.927 12.094 -8.684 1580 HA SER 58 HA SER 58 8.957 10.453 -7.207 1581 1HB SER 58 1HB SER 58 7.437 11.339 -5.237 1582 2HB SER 58 2HB SER 58 8.624 12.422 -5.964 1583 HG SER 58 HG SER 58 5.908 12.223 -6.749 1584 H ALA 59 H ALA 59 8.195 8.528 -6.209 1585 HA ALA 59 HA ALA 59 5.351 7.787 -6.785 1586 1HB ALA 59 1HB ALA 59 6.172 5.596 -7.503 1587 2HB ALA 59 2HB ALA 59 7.821 6.042 -7.065 1588 3HB ALA 59 3HB ALA 59 7.018 6.848 -8.413 1589 H MET 60 H MET 60 4.313 6.890 -5.019 1590 HA MET 60 HA MET 60 5.855 6.528 -2.520 1591 1HB MET 60 1HB MET 60 3.376 7.520 -3.163 1592 2HB MET 60 2HB MET 60 2.964 5.887 -2.646 1593 1HG MET 60 1HG MET 60 4.917 7.025 -0.844 1594 2HG MET 60 2HG MET 60 3.540 8.116 -0.997 1595 1HE MET 60 1HE MET 60 3.963 7.614 1.377 1596 2HE MET 60 2HE MET 60 3.340 6.243 2.295 1597 3HE MET 60 3HE MET 60 2.237 7.492 1.716 1598 H ALA 61 H ALA 61 5.820 4.511 -1.334 1599 HA ALA 61 HA ALA 61 5.784 2.136 -3.063 1600 1HB ALA 61 1HB ALA 61 6.190 1.426 -0.368 1601 2HB ALA 61 2HB ALA 61 6.876 3.043 -0.519 1602 3HB ALA 61 3HB ALA 61 7.445 1.743 -1.566 1603 H LEU 62 H LEU 62 3.545 1.808 -3.546 1604 HA LEU 62 HA LEU 62 1.400 0.906 -3.168 1605 1HB LEU 62 1HB LEU 62 1.132 1.954 -0.461 1606 2HB LEU 62 2HB LEU 62 1.895 3.139 -1.517 1607 HG LEU 62 HG LEU 62 -0.774 1.763 -1.948 1608 1HD1 LEU 62 1HD1 LEU 62 -0.861 3.636 -0.389 1609 2HD1 LEU 62 2HD1 LEU 62 -1.581 4.134 -1.918 1610 3HD1 LEU 62 3HD1 LEU 62 0.055 4.647 -1.504 1611 1HD2 LEU 62 1HD2 LEU 62 1.070 3.114 -3.828 1612 2HD2 LEU 62 2HD2 LEU 62 -0.601 3.674 -3.889 1613 3HD2 LEU 62 3HD2 LEU 62 -0.233 1.971 -4.156 1614 H GLY 63 H GLY 63 2.770 -1.193 -2.924 1615 1HA GLY 63 1HA GLY 63 1.675 -2.735 -0.787 1616 2HA GLY 63 2HA GLY 63 2.964 -3.272 -1.862 1617 H PHE 64 H PHE 64 4.133 -4.241 -0.135 1618 HA PHE 64 HA PHE 64 4.888 -2.758 2.251 1619 1HB PHE 64 1HB PHE 64 5.585 -5.376 0.920 1620 2HB PHE 64 2HB PHE 64 6.484 -4.842 2.339 1621 HD1 PHE 64 HD1 PHE 64 5.495 -4.871 4.529 1622 HD2 PHE 64 HD2 PHE 64 3.110 -5.714 1.057 1623 HE1 PHE 64 HE1 PHE 64 3.648 -5.654 5.988 1624 HE2 PHE 64 HE2 PHE 64 1.264 -6.497 2.516 1625 HZ PHE 64 HZ PHE 64 1.533 -6.467 4.981 1626 H GLY 65 H GLY 65 5.647 -0.997 0.382 1627 1HA GLY 65 1HA GLY 65 8.462 -1.488 -0.381 1628 2HA GLY 65 2HA GLY 65 7.490 -0.098 -0.862 1629 H ALA 66 H ALA 66 6.599 0.207 2.027 1630 HA ALA 66 HA ALA 66 8.797 1.977 2.838 1631 1HB ALA 66 1HB ALA 66 6.170 1.239 4.182 1632 2HB ALA 66 2HB ALA 66 6.352 2.519 2.983 1633 3HB ALA 66 3HB ALA 66 7.161 2.652 4.545 1634 H ILE 67 H ILE 67 7.226 -0.963 4.120 1635 HA ILE 67 HA ILE 67 8.530 -1.240 6.576 1636 HB ILE 67 HB ILE 67 8.254 -3.730 6.085 1637 1HG1 ILE 67 1HG1 ILE 67 6.672 -3.527 3.750 1638 2HG1 ILE 67 2HG1 ILE 67 8.182 -2.694 3.391 1639 1HG2 ILE 67 1HG2 ILE 67 6.066 -3.518 6.631 1640 2HG2 ILE 67 2HG2 ILE 67 5.704 -2.573 5.187 1641 3HG2 ILE 67 3HG2 ILE 67 6.385 -1.784 6.609 1642 1HD1 ILE 67 1HD1 ILE 67 7.685 -5.559 3.874 1643 2HD1 ILE 67 2HD1 ILE 67 9.089 -4.910 4.721 1644 3HD1 ILE 67 3HD1 ILE 67 8.979 -4.780 2.966 1645 H PHE 68 H PHE 68 9.869 -1.750 3.348 1646 HA PHE 68 HA PHE 68 12.126 -3.323 3.948 1647 1HB PHE 68 1HB PHE 68 11.535 -1.098 1.989 1648 2HB PHE 68 2HB PHE 68 13.092 -1.923 1.980 1649 HD1 PHE 68 HD1 PHE 68 10.289 -1.886 0.165 1650 HD2 PHE 68 HD2 PHE 68 12.463 -4.680 2.598 1651 HE1 PHE 68 HE1 PHE 68 9.292 -3.768 -1.105 1652 HE2 PHE 68 HE2 PHE 68 11.465 -6.562 1.328 1653 HZ PHE 68 HZ PHE 68 9.880 -6.106 -0.523 1654 H ASN 69 H ASN 69 14.131 -2.882 4.850 1655 HA ASN 69 HA ASN 69 14.554 -0.106 5.907 1656 1HB ASN 69 1HB ASN 69 15.394 -2.827 6.979 1657 2HB ASN 69 2HB ASN 69 15.738 -1.282 7.758 1658 1HD2 ASN 69 1HD2 ASN 69 14.137 -3.338 9.025 1659 2HD2 ASN 69 2HD2 ASN 69 12.555 -2.740 9.179 1660 H HIS 70 H HIS 70 17.113 -0.002 6.507 1661 HA HIS 70 HA HIS 70 18.511 -0.589 3.938 1662 1HB HIS 70 1HB HIS 70 18.295 1.730 5.067 1663 2HB HIS 70 2HB HIS 70 19.455 1.124 6.250 1664 HD1 HIS 70 HD1 HIS 70 19.138 2.073 2.625 1665 HD2 HIS 70 HD2 HIS 70 22.099 0.778 5.259 1666 HE1 HIS 70 HE1 HIS 70 21.347 2.372 1.423 1667 H SER 71 H SER 71 19.954 -2.252 3.900 1668 HA SER 71 HA SER 71 21.235 -3.084 6.480 1669 1HB SER 71 1HB SER 71 19.457 -4.639 5.915 1670 2HB SER 71 2HB SER 71 20.004 -4.729 4.241 1671 HG SER 71 HG SER 71 20.844 -6.116 6.393 1672 H LYS 72 H LYS 72 23.439 -3.565 6.309 1673 HA LYS 72 HA LYS 72 25.038 -2.469 4.288 1674 1HB LYS 72 1HB LYS 72 25.337 -4.664 6.326 1675 2HB LYS 72 2HB LYS 72 26.660 -4.353 5.202 1676 1HG LYS 72 1HG LYS 72 25.478 -1.955 6.486 1677 2HG LYS 72 2HG LYS 72 26.366 -3.035 7.560 1678 1HD LYS 72 1HD LYS 72 28.348 -2.882 6.191 1679 2HD LYS 72 2HD LYS 72 27.472 -2.015 4.929 1680 1HE LYS 72 1HE LYS 72 27.243 -0.061 6.302 1681 2HE LYS 72 2HE LYS 72 27.757 -0.941 7.754 1682 1HZ LYS 72 1HZ LYS 72 29.560 0.380 6.670 1683 2HZ LYS 72 2HZ LYS 72 29.431 -0.635 5.315 1684 3HZ LYS 72 3HZ LYS 72 29.911 -1.276 6.813 1685 H ASP 73 H ASP 73 23.509 -5.655 4.402 1686 HA ASP 73 HA ASP 73 24.592 -6.198 1.655 1687 1HB ASP 73 1HB ASP 73 24.384 -7.752 4.158 1688 2HB ASP 73 2HB ASP 73 23.819 -8.624 2.733 1689 HA PRO 74 HA PRO 74 20.024 -5.610 1.288 1690 1HB PRO 74 1HB PRO 74 20.273 -5.159 -1.476 1691 2HB PRO 74 2HB PRO 74 20.185 -3.900 -0.233 1692 1HG PRO 74 1HG PRO 74 22.542 -5.007 -1.651 1693 2HG PRO 74 2HG PRO 74 22.249 -3.368 -1.053 1694 1HD PRO 74 1HD PRO 74 23.911 -5.108 0.187 1695 2HD PRO 74 2HD PRO 74 22.982 -3.875 1.067 1696 H ASN 75 H ASN 75 19.310 -7.735 1.458 1697 HA ASN 75 HA ASN 75 20.265 -9.852 -0.309 1698 1HB ASN 75 1HB ASN 75 17.922 -9.709 1.626 1699 2HB ASN 75 2HB ASN 75 18.654 -11.185 0.998 1700 1HD2 ASN 75 1HD2 ASN 75 18.687 -9.159 3.667 1701 2HD2 ASN 75 2HD2 ASN 75 20.232 -9.525 4.266 1702 H ALA 76 H ALA 76 17.744 -7.480 -0.469 1703 HA ALA 76 HA ALA 76 16.692 -8.814 -2.927 1704 1HB ALA 76 1HB ALA 76 15.441 -8.715 -0.398 1705 2HB ALA 76 2HB ALA 76 14.687 -9.172 -1.926 1706 3HB ALA 76 3HB ALA 76 14.614 -7.499 -1.373 1707 H ARG 77 H ARG 77 15.343 -7.231 -4.227 1708 HA ARG 77 HA ARG 77 16.115 -4.381 -3.729 1709 1HB ARG 77 1HB ARG 77 17.343 -6.015 -5.541 1710 2HB ARG 77 2HB ARG 77 16.035 -5.368 -6.532 1711 1HG ARG 77 1HG ARG 77 16.830 -3.077 -5.392 1712 2HG ARG 77 2HG ARG 77 18.355 -3.957 -5.291 1713 1HD ARG 77 1HD ARG 77 18.645 -3.970 -7.579 1714 2HD ARG 77 2HD ARG 77 16.905 -4.087 -7.899 1715 HE ARG 77 HE ARG 77 16.807 -1.723 -7.857 1716 1HH1 ARG 77 1HH1 ARG 77 19.709 -2.864 -6.310 1717 2HH1 ARG 77 2HH1 ARG 77 20.350 -1.273 -6.092 1718 1HH2 ARG 77 1HH2 ARG 77 17.660 0.333 -7.562 1719 2HH2 ARG 77 2HH2 ARG 77 19.201 0.525 -6.795 1720 H HIS 78 H HIS 78 14.877 -3.302 -5.994 1721 HA HIS 78 HA HIS 78 12.063 -4.293 -5.928 1722 1HB HIS 78 1HB HIS 78 11.335 -1.954 -5.446 1723 2HB HIS 78 2HB HIS 78 12.337 -2.607 -4.151 1724 HD1 HIS 78 HD1 HIS 78 14.867 -1.796 -4.090 1725 HD2 HIS 78 HD2 HIS 78 12.425 0.273 -6.760 1726 HE1 HIS 78 HE1 HIS 78 16.127 0.306 -4.731 1727 H GLU 79 H GLU 79 10.745 -3.253 -7.678 1728 HA GLU 79 HA GLU 79 12.319 -1.968 -9.856 1729 1HB GLU 79 1HB GLU 79 12.366 -4.486 -10.067 1730 2HB GLU 79 2HB GLU 79 10.610 -4.457 -10.193 1731 1HG GLU 79 1HG GLU 79 10.770 -3.019 -12.190 1732 2HG GLU 79 2HG GLU 79 12.529 -3.035 -12.063 1733 H LEU 80 H LEU 80 11.089 -0.128 -10.172 1734 HA LEU 80 HA LEU 80 8.148 -0.236 -9.843 1735 1HB LEU 80 1HB LEU 80 10.048 2.026 -10.569 1736 2HB LEU 80 2HB LEU 80 8.377 2.205 -10.040 1737 HG LEU 80 HG LEU 80 9.564 0.610 -8.072 1738 1HD1 LEU 80 1HD1 LEU 80 11.800 1.058 -8.673 1739 2HD1 LEU 80 2HD1 LEU 80 11.468 2.261 -7.427 1740 3HD1 LEU 80 3HD1 LEU 80 11.438 2.723 -9.129 1741 1HD2 LEU 80 1HD2 LEU 80 7.914 2.654 -8.058 1742 2HD2 LEU 80 2HD2 LEU 80 9.383 3.601 -7.822 1743 3HD2 LEU 80 3HD2 LEU 80 8.936 2.361 -6.651 1744 H THR 81 H THR 81 8.516 -1.820 -11.929 1745 HA THR 81 HA THR 81 8.289 -2.135 -14.265 1746 HB THR 81 HB THR 81 6.515 -0.157 -14.972 1747 HG1 THR 81 HG1 THR 81 5.343 0.354 -13.153 1748 1HG2 THR 81 1HG2 THR 81 6.173 -2.616 -15.024 1749 2HG2 THR 81 2HG2 THR 81 4.781 -1.771 -14.346 1750 3HG2 THR 81 3HG2 THR 81 5.915 -2.600 -13.279 1751 H ALA 82 H ALA 82 10.482 -0.243 -13.440 1752 HA ALA 82 HA ALA 82 11.956 1.290 -14.465 1753 1HB ALA 82 1HB ALA 82 11.764 0.974 -17.079 1754 2HB ALA 82 2HB ALA 82 10.610 -0.289 -16.650 1755 3HB ALA 82 3HB ALA 82 12.277 -0.387 -16.081 1756 H GLY 83 H GLY 83 9.038 2.142 -13.930 1757 1HA GLY 83 1HA GLY 83 9.260 4.751 -15.181 1758 2HA GLY 83 2HA GLY 83 7.979 3.786 -15.911 1759 H LEU 84 H LEU 84 8.800 3.447 -12.513 1760 HA LEU 84 HA LEU 84 7.469 3.820 -10.591 1761 1HB LEU 84 1HB LEU 84 6.951 6.257 -12.329 1762 2HB LEU 84 2HB LEU 84 6.457 6.149 -10.640 1763 HG LEU 84 HG LEU 84 9.296 5.932 -11.685 1764 1HD1 LEU 84 1HD1 LEU 84 7.612 8.121 -10.643 1765 2HD1 LEU 84 2HD1 LEU 84 9.068 8.198 -11.635 1766 3HD1 LEU 84 3HD1 LEU 84 9.201 7.997 -9.888 1767 1HD2 LEU 84 1HD2 LEU 84 9.657 4.780 -9.771 1768 2HD2 LEU 84 2HD2 LEU 84 8.034 5.126 -9.174 1769 3HD2 LEU 84 3HD2 LEU 84 9.333 6.293 -8.924 1770 H LYS 85 H LYS 85 5.884 2.150 -10.784 1771 HA LYS 85 HA LYS 85 3.161 2.974 -11.103 1772 1HB LYS 85 1HB LYS 85 4.660 2.163 -13.486 1773 2HB LYS 85 2HB LYS 85 3.197 1.203 -13.256 1774 1HG LYS 85 1HG LYS 85 2.857 4.090 -12.762 1775 2HG LYS 85 2HG LYS 85 3.252 3.687 -14.429 1776 1HD LYS 85 1HD LYS 85 1.185 2.845 -14.783 1777 2HD LYS 85 2HD LYS 85 1.273 1.859 -13.323 1778 1HE LYS 85 1HE LYS 85 1.004 4.442 -12.320 1779 2HE LYS 85 2HE LYS 85 -0.067 4.434 -13.735 1780 1HZ LYS 85 1HZ LYS 85 -0.814 2.177 -12.904 1781 2HZ LYS 85 2HZ LYS 85 -1.328 3.511 -11.988 1782 3HZ LYS 85 3HZ LYS 85 -0.038 2.552 -11.440 1783 H ARG 86 H ARG 86 5.488 0.302 -11.215 1784 HA ARG 86 HA ARG 86 3.675 -1.264 -9.445 1785 1HB ARG 86 1HB ARG 86 4.366 -1.757 -12.257 1786 2HB ARG 86 2HB ARG 86 4.719 -3.139 -11.221 1787 1HG ARG 86 1HG ARG 86 2.528 -3.650 -11.178 1788 2HG ARG 86 2HG ARG 86 2.190 -2.094 -10.421 1789 1HD ARG 86 1HD ARG 86 1.471 -1.159 -12.390 1790 2HD ARG 86 2HD ARG 86 2.698 -2.007 -13.350 1791 HE ARG 86 HE ARG 86 0.747 -3.838 -12.211 1792 1HH1 ARG 86 1HH1 ARG 86 1.357 -1.606 -14.812 1793 2HH1 ARG 86 2HH1 ARG 86 0.255 -2.388 -15.889 1794 1HH2 ARG 86 1HH2 ARG 86 -0.680 -4.837 -13.629 1795 2HH2 ARG 86 2HH2 ARG 86 -0.891 -4.204 -15.227 1796 H MET 87 H MET 87 5.105 -1.247 -7.692 1797 HA MET 87 HA MET 87 7.985 -1.628 -8.053 1798 1HB MET 87 1HB MET 87 6.059 -0.833 -6.020 1799 2HB MET 87 2HB MET 87 7.244 -1.955 -5.352 1800 1HG MET 87 1HG MET 87 9.050 -0.520 -6.390 1801 2HG MET 87 2HG MET 87 7.797 0.654 -6.791 1802 1HE MET 87 1HE MET 87 7.761 -1.424 -3.123 1803 2HE MET 87 2HE MET 87 9.382 -0.789 -2.839 1804 3HE MET 87 3HE MET 87 9.034 -1.693 -4.314 1805 H ARG 88 H ARG 88 8.847 -3.637 -8.377 1806 HA ARG 88 HA ARG 88 7.422 -6.006 -7.213 1807 1HB ARG 88 1HB ARG 88 9.472 -5.846 -9.456 1808 2HB ARG 88 2HB ARG 88 8.501 -7.250 -9.022 1809 1HG ARG 88 1HG ARG 88 6.705 -6.496 -10.176 1810 2HG ARG 88 2HG ARG 88 6.884 -4.857 -9.552 1811 1HD ARG 88 1HD ARG 88 7.436 -4.448 -11.768 1812 2HD ARG 88 2HD ARG 88 9.039 -4.945 -11.195 1813 HE ARG 88 HE ARG 88 8.779 -6.919 -12.460 1814 1HH1 ARG 88 1HH1 ARG 88 5.673 -5.533 -11.717 1815 2HH1 ARG 88 2HH1 ARG 88 4.803 -6.719 -12.628 1816 1HH2 ARG 88 1HH2 ARG 88 7.628 -8.446 -13.635 1817 2HH2 ARG 88 2HH2 ARG 88 5.900 -8.357 -13.706 1818 H ILE 89 H ILE 89 8.472 -6.998 -5.530 1819 HA ILE 89 HA ILE 89 11.220 -6.157 -4.849 1820 HB ILE 89 HB ILE 89 9.176 -7.988 -3.538 1821 1HG1 ILE 89 1HG1 ILE 89 9.943 -5.367 -2.376 1822 2HG1 ILE 89 2HG1 ILE 89 9.003 -5.299 -3.866 1823 1HG2 ILE 89 1HG2 ILE 89 11.572 -6.728 -2.205 1824 2HG2 ILE 89 2HG2 ILE 89 11.686 -8.309 -2.979 1825 3HG2 ILE 89 3HG2 ILE 89 10.574 -8.064 -1.633 1826 1HD1 ILE 89 1HD1 ILE 89 8.142 -7.144 -1.657 1827 2HD1 ILE 89 2HD1 ILE 89 7.166 -6.380 -2.912 1828 3HD1 ILE 89 3HD1 ILE 89 7.758 -5.425 -1.553 1829 H PHE 90 H PHE 90 12.903 -7.269 -5.731 1830 HA PHE 90 HA PHE 90 12.493 -10.130 -6.502 1831 1HB PHE 90 1HB PHE 90 14.154 -7.812 -7.446 1832 2HB PHE 90 2HB PHE 90 14.759 -9.443 -7.735 1833 HD1 PHE 90 HD1 PHE 90 13.542 -11.006 -9.183 1834 HD2 PHE 90 HD2 PHE 90 12.125 -7.005 -8.526 1835 HE1 PHE 90 HE1 PHE 90 11.998 -11.238 -11.109 1836 HE2 PHE 90 HE2 PHE 90 10.580 -7.236 -10.453 1837 HZ PHE 90 HZ PHE 90 10.517 -9.352 -11.744 1838 H THR 91 H THR 91 14.956 -11.146 -6.518 1839 HA THR 91 HA THR 91 16.124 -10.610 -3.809 1840 HB THR 91 HB THR 91 16.425 -13.155 -3.774 1841 HG1 THR 91 HG1 THR 91 15.281 -14.313 -5.249 1842 1HG2 THR 91 1HG2 THR 91 14.542 -11.782 -2.665 1843 2HG2 THR 91 2HG2 THR 91 14.252 -13.506 -2.891 1844 3HG2 THR 91 3HG2 THR 91 13.526 -12.339 -3.995 1845 H ILE 92 H ILE 92 17.910 -9.465 -4.750 1846 HA ILE 92 HA ILE 92 19.431 -10.255 -6.998 1847 HB ILE 92 HB ILE 92 21.157 -8.807 -5.956 1848 1HG1 ILE 92 1HG1 ILE 92 19.552 -8.270 -3.543 1849 2HG1 ILE 92 2HG1 ILE 92 20.285 -9.872 -3.579 1850 1HG2 ILE 92 1HG2 ILE 92 18.908 -7.230 -5.064 1851 2HG2 ILE 92 2HG2 ILE 92 18.474 -8.117 -6.526 1852 3HG2 ILE 92 3HG2 ILE 92 19.875 -7.046 -6.528 1853 1HD1 ILE 92 1HD1 ILE 92 22.314 -8.211 -4.501 1854 2HD1 ILE 92 2HD1 ILE 92 22.184 -8.870 -2.871 1855 3HD1 ILE 92 3HD1 ILE 92 21.552 -7.262 -3.225 1856 H LYS 93 H LYS 93 19.265 -11.673 -3.834 1857 HA LYS 93 HA LYS 93 21.310 -13.673 -4.645 1858 1HB LYS 93 1HB LYS 93 22.395 -13.364 -2.394 1859 2HB LYS 93 2HB LYS 93 22.520 -11.935 -3.419 1860 1HG LYS 93 1HG LYS 93 21.331 -10.693 -1.958 1861 2HG LYS 93 2HG LYS 93 20.057 -11.908 -1.872 1862 1HD LYS 93 1HD LYS 93 21.004 -11.688 0.340 1863 2HD LYS 93 2HD LYS 93 21.547 -13.232 -0.318 1864 1HE LYS 93 1HE LYS 93 23.654 -12.000 -1.105 1865 2HE LYS 93 2HE LYS 93 23.125 -10.655 -0.077 1866 1HZ LYS 93 1HZ LYS 93 24.461 -12.066 1.270 1867 2HZ LYS 93 2HZ LYS 93 23.657 -13.463 0.736 1868 3HZ LYS 93 3HZ LYS 93 22.851 -12.349 1.732 1869 HA PRO 94 HA PRO 94 18.341 -16.495 -3.004 1870 1HB PRO 94 1HB PRO 94 20.664 -17.968 -1.876 1871 2HB PRO 94 2HB PRO 94 19.393 -18.544 -2.967 1872 1HG PRO 94 1HG PRO 94 21.908 -18.032 -3.792 1873 2HG PRO 94 2HG PRO 94 20.494 -17.833 -4.834 1874 1HD PRO 94 1HD PRO 94 22.198 -15.783 -3.557 1875 2HD PRO 94 2HD PRO 94 21.211 -15.681 -5.029 1876 H ILE 95 H ILE 95 17.290 -16.685 -1.004 1877 HA ILE 95 HA ILE 95 18.695 -15.429 1.324 1878 HB ILE 95 HB ILE 95 15.763 -15.757 0.586 1879 1HG1 ILE 95 1HG1 ILE 95 17.077 -13.113 0.983 1880 2HG1 ILE 95 2HG1 ILE 95 17.504 -14.002 -0.479 1881 1HG2 ILE 95 1HG2 ILE 95 15.972 -13.868 2.616 1882 2HG2 ILE 95 2HG2 ILE 95 17.092 -15.135 3.117 1883 3HG2 ILE 95 3HG2 ILE 95 15.401 -15.526 2.809 1884 1HD1 ILE 95 1HD1 ILE 95 14.625 -13.624 0.351 1885 2HD1 ILE 95 2HD1 ILE 95 15.259 -14.050 -1.239 1886 3HD1 ILE 95 3HD1 ILE 95 15.471 -12.414 -0.614 1887 H ALA 96 H ALA 96 18.534 -16.441 3.373 1888 HA ALA 96 HA ALA 96 18.074 -19.372 3.281 1889 1HB ALA 96 1HB ALA 96 19.436 -17.363 5.074 1890 2HB ALA 96 2HB ALA 96 20.130 -18.776 4.277 1891 3HB ALA 96 3HB ALA 96 19.086 -18.981 5.684 1892 H ILE 97 H ILE 97 16.728 -20.390 4.947 1893 HA ILE 97 HA ILE 97 14.215 -19.100 5.400 1894 HB ILE 97 HB ILE 97 15.605 -21.488 6.666 1895 1HG1 ILE 97 1HG1 ILE 97 13.342 -21.647 4.716 1896 2HG1 ILE 97 2HG1 ILE 97 14.937 -21.222 4.100 1897 1HG2 ILE 97 1HG2 ILE 97 12.758 -21.715 6.702 1898 2HG2 ILE 97 2HG2 ILE 97 13.184 -20.172 7.443 1899 3HG2 ILE 97 3HG2 ILE 97 13.861 -21.671 8.077 1900 1HD1 ILE 97 1HD1 ILE 97 14.174 -23.770 4.337 1901 2HD1 ILE 97 2HD1 ILE 97 14.748 -23.531 5.987 1902 3HD1 ILE 97 3HD1 ILE 97 15.843 -23.280 4.628 1903 H GLY 98 H GLY 98 14.020 -17.326 6.710 1904 1HA GLY 98 1HA GLY 98 13.839 -16.475 8.995 1905 2HA GLY 98 2HA GLY 98 15.227 -17.471 9.433 1906 H GLU 99 H GLU 99 14.974 -15.449 6.545 1907 HA GLU 99 HA GLU 99 17.419 -13.993 7.419 1908 1HB GLU 99 1HB GLU 99 16.492 -15.224 5.078 1909 2HB GLU 99 2HB GLU 99 16.347 -13.505 4.740 1910 1HG GLU 99 1HG GLU 99 18.843 -14.963 5.657 1911 2HG GLU 99 2HG GLU 99 18.560 -14.272 4.061 1912 H GLU 100 H GLU 100 17.483 -11.643 7.203 1913 HA GLU 100 HA GLU 100 14.834 -10.360 7.632 1914 1HB GLU 100 1HB GLU 100 17.142 -10.133 8.971 1915 2HB GLU 100 2HB GLU 100 17.462 -8.917 7.734 1916 1HG GLU 100 1HG GLU 100 14.766 -8.617 8.725 1917 2HG GLU 100 2HG GLU 100 15.900 -8.613 10.075 1918 H ILE 101 H ILE 101 13.859 -9.632 5.789 1919 HA ILE 101 HA ILE 101 15.480 -8.988 3.410 1920 HB ILE 101 HB ILE 101 12.474 -8.829 3.801 1921 1HG1 ILE 101 1HG1 ILE 101 14.183 -11.223 3.054 1922 2HG1 ILE 101 2HG1 ILE 101 13.236 -11.045 4.529 1923 1HG2 ILE 101 1HG2 ILE 101 12.339 -8.709 1.517 1924 2HG2 ILE 101 2HG2 ILE 101 13.763 -9.722 1.280 1925 3HG2 ILE 101 3HG2 ILE 101 13.952 -8.018 1.694 1926 1HD1 ILE 101 1HD1 ILE 101 11.486 -10.524 2.348 1927 2HD1 ILE 101 2HD1 ILE 101 11.447 -11.891 3.462 1928 3HD1 ILE 101 3HD1 ILE 101 12.372 -12.000 1.964 1929 H THR 102 H THR 102 16.163 -6.979 3.012 1930 HA THR 102 HA THR 102 14.495 -4.618 3.621 1931 HB THR 102 HB THR 102 16.340 -3.602 4.958 1932 HG1 THR 102 HG1 THR 102 18.032 -4.808 4.042 1933 1HG2 THR 102 1HG2 THR 102 15.684 -6.326 6.094 1934 2HG2 THR 102 2HG2 THR 102 14.491 -5.030 6.001 1935 3HG2 THR 102 3HG2 THR 102 15.949 -4.820 6.972 1936 H ILE 103 H ILE 103 14.863 -3.096 1.994 1937 HA ILE 103 HA ILE 103 17.138 -3.655 0.136 1938 HB ILE 103 HB ILE 103 15.744 -2.469 -1.500 1939 1HG1 ILE 103 1HG1 ILE 103 13.316 -2.101 -0.075 1940 2HG1 ILE 103 2HG1 ILE 103 14.590 -1.346 0.884 1941 1HG2 ILE 103 1HG2 ILE 103 14.162 -4.420 0.202 1942 2HG2 ILE 103 2HG2 ILE 103 15.236 -4.835 -1.133 1943 3HG2 ILE 103 3HG2 ILE 103 13.742 -3.951 -1.445 1944 1HD1 ILE 103 1HD1 ILE 103 15.367 -0.364 -1.423 1945 2HD1 ILE 103 2HD1 ILE 103 14.009 0.381 -0.581 1946 3HD1 ILE 103 3HD1 ILE 103 13.714 -0.724 -1.923 1947 H SER 104 H SER 104 18.427 -1.864 -0.626 1948 HA SER 104 HA SER 104 18.915 0.179 1.413 1949 1HB SER 104 1HB SER 104 20.203 -1.057 -0.877 1950 2HB SER 104 2HB SER 104 20.373 0.697 -0.956 1951 HG SER 104 HG SER 104 20.997 -0.947 1.270 1952 H TYR 105 H TYR 105 19.628 2.383 -0.147 1953 HA TYR 105 HA TYR 105 17.019 3.207 -1.377 1954 1HB TYR 105 1HB TYR 105 18.905 4.849 0.356 1955 2HB TYR 105 2HB TYR 105 17.327 5.359 -0.240 1956 HD1 TYR 105 HD1 TYR 105 18.662 4.723 2.700 1957 HD2 TYR 105 HD2 TYR 105 15.716 2.906 0.156 1958 HE1 TYR 105 HE1 TYR 105 17.592 3.683 4.680 1959 HE2 TYR 105 HE2 TYR 105 14.647 1.867 2.136 1960 HH TYR 105 HH TYR 105 15.020 1.322 4.349 1961 H GLY 106 H GLY 106 20.274 4.677 -1.006 1962 1HA GLY 106 1HA GLY 106 21.497 4.382 -3.376 1963 2HA GLY 106 2HA GLY 106 20.178 5.448 -3.860 1964 H ASP 107 H ASP 107 22.484 6.598 -4.303 1965 HA ASP 107 HA ASP 107 23.981 7.827 -2.269 1966 1HB ASP 107 1HB ASP 107 23.230 8.347 -5.100 1967 2HB ASP 107 2HB ASP 107 23.878 9.731 -4.220 1968 H ASP 108 H ASP 108 20.872 8.851 -3.679 1969 HA ASP 108 HA ASP 108 20.617 11.377 -2.415 1970 1HB ASP 108 1HB ASP 108 18.492 9.283 -3.012 1971 2HB ASP 108 2HB ASP 108 18.221 11.019 -2.857 1972 H TYR 109 H TYR 109 19.091 8.310 -1.333 1973 HA TYR 109 HA TYR 109 18.848 9.440 1.398 1974 1HB TYR 109 1HB TYR 109 17.644 7.284 -0.265 1975 2HB TYR 109 2HB TYR 109 17.720 6.964 1.469 1976 HD1 TYR 109 HD1 TYR 109 17.155 10.065 -0.571 1977 HD2 TYR 109 HD2 TYR 109 15.670 7.435 2.482 1978 HE1 TYR 109 HE1 TYR 109 15.220 11.574 -0.214 1979 HE2 TYR 109 HE2 TYR 109 13.734 8.945 2.840 1980 HH TYR 109 HH TYR 109 12.572 10.921 0.942 1981 H TRP 110 H TRP 110 21.515 9.026 0.875 1982 HA TRP 110 HA TRP 110 22.282 7.150 2.926 1983 1HB TRP 110 1HB TRP 110 21.557 5.766 0.843 1984 2HB TRP 110 2HB TRP 110 23.066 6.329 0.124 1985 HD1 TRP 110 HD1 TRP 110 24.777 4.482 0.345 1986 HE1 TRP 110 HE1 TRP 110 25.553 2.894 2.226 1987 HE3 TRP 110 HE3 TRP 110 21.419 5.724 3.979 1988 HZ2 TRP 110 HZ2 TRP 110 24.835 2.241 4.923 1989 HZ3 TRP 110 HZ3 TRP 110 21.483 4.610 6.191 1990 HH2 TRP 110 HH2 TRP 110 23.184 2.871 6.668 1991 H LEU 111 H LEU 111 24.814 6.767 2.715 1992 HA LEU 111 HA LEU 111 26.110 9.309 2.714 1993 1HB LEU 111 1HB LEU 111 26.764 6.433 2.937 1994 2HB LEU 111 2HB LEU 111 28.100 7.434 2.369 1995 HG LEU 111 HG LEU 111 26.747 8.769 4.538 1996 1HD1 LEU 111 1HD1 LEU 111 26.034 6.751 5.499 1997 2HD1 LEU 111 2HD1 LEU 111 27.608 6.995 6.256 1998 3HD1 LEU 111 3HD1 LEU 111 27.442 5.864 4.913 1999 1HD2 LEU 111 1HD2 LEU 111 28.892 9.344 4.959 2000 2HD2 LEU 111 2HD2 LEU 111 29.323 8.421 3.519 2001 3HD2 LEU 111 3HD2 LEU 111 29.383 7.656 5.107 2002 H SER 112 H SER 112 28.454 8.981 1.243 2003 HA SER 112 HA SER 112 27.682 9.859 -1.379 2004 1HB SER 112 1HB SER 112 30.041 9.509 0.255 2005 2HB SER 112 2HB SER 112 30.365 8.915 -1.373 2006 HG SER 112 HG SER 112 30.731 11.011 -1.599 2007 H ARG 113 H ARG 113 29.867 7.099 -0.860 2008 HA ARG 113 HA ARG 113 28.111 5.296 -2.405 2009 1HB ARG 113 1HB ARG 113 30.464 6.781 -3.450 2010 2HB ARG 113 2HB ARG 113 30.405 5.070 -3.874 2011 1HG ARG 113 1HG ARG 113 28.032 5.427 -4.649 2012 2HG ARG 113 2HG ARG 113 28.271 7.157 -4.400 2013 1HD ARG 113 1HD ARG 113 30.406 5.858 -5.982 2014 2HD ARG 113 2HD ARG 113 28.813 5.875 -6.762 2015 HE ARG 113 HE ARG 113 29.060 8.426 -5.703 2016 1HH1 ARG 113 1HH1 ARG 113 30.999 6.440 -7.803 2017 2HH1 ARG 113 2HH1 ARG 113 31.666 7.794 -8.649 2018 1HH2 ARG 113 1HH2 ARG 113 29.939 10.167 -6.816 2019 2HH2 ARG 113 2HH2 ARG 113 31.071 9.888 -8.096 2020 HA PRO 114 HA PRO 114 31.054 3.369 0.680 2021 1HB PRO 114 1HB PRO 114 29.107 2.055 2.125 2022 2HB PRO 114 2HB PRO 114 29.680 3.686 2.520 2023 1HG PRO 114 1HG PRO 114 27.214 2.829 1.093 2024 2HG PRO 114 2HG PRO 114 27.451 4.158 2.236 2025 1HD PRO 114 1HD PRO 114 27.291 4.494 -0.470 2026 2HD PRO 114 2HD PRO 114 28.178 5.592 0.606 2027 H ARG 115 H ARG 115 31.929 1.494 -0.087 2028 HA ARG 115 HA ARG 115 30.078 -0.538 -1.286 2029 1HB ARG 115 1HB ARG 115 32.828 0.386 -2.186 2030 2HB ARG 115 2HB ARG 115 31.872 -0.870 -2.972 2031 1HG ARG 115 1HG ARG 115 31.114 2.053 -2.667 2032 2HG ARG 115 2HG ARG 115 31.557 1.235 -4.163 2033 1HD ARG 115 1HD ARG 115 29.496 -0.353 -3.197 2034 2HD ARG 115 2HD ARG 115 28.969 1.289 -2.782 2035 HE ARG 115 HE ARG 115 28.810 1.761 -5.096 2036 1HH1 ARG 115 1HH1 ARG 115 30.719 -1.097 -4.540 2037 2HH1 ARG 115 2HH1 ARG 115 30.848 -1.471 -6.223 2038 1HH2 ARG 115 1HH2 ARG 115 28.992 1.256 -7.273 2039 2HH2 ARG 115 2HH2 ARG 115 29.878 -0.150 -7.762 2040 H LEU 116 H LEU 116 30.176 -2.334 0.007 2041 HA LEU 116 HA LEU 116 32.321 -2.871 1.859 2042 1HB LEU 116 1HB LEU 116 30.064 -4.542 0.696 2043 2HB LEU 116 2HB LEU 116 31.060 -5.053 2.059 2044 HG LEU 116 HG LEU 116 29.874 -2.339 2.265 2045 1HD1 LEU 116 1HD1 LEU 116 28.260 -4.859 2.061 2046 2HD1 LEU 116 2HD1 LEU 116 27.868 -3.234 1.498 2047 3HD1 LEU 116 3HD1 LEU 116 27.763 -3.621 3.215 2048 1HD2 LEU 116 1HD2 LEU 116 29.338 -3.569 4.580 2049 2HD2 LEU 116 2HD2 LEU 116 30.943 -2.932 4.222 2050 3HD2 LEU 116 3HD2 LEU 116 30.609 -4.650 4.007 2051 H THR 117 H THR 117 31.635 -3.913 -1.450 2052 HA THR 117 HA THR 117 33.498 -6.089 -1.579 2053 HB THR 117 HB THR 117 32.838 -4.254 -3.881 2054 HG1 THR 117 HG1 THR 117 30.805 -4.523 -3.535 2055 1HG2 THR 117 1HG2 THR 117 33.391 -7.159 -3.423 2056 2HG2 THR 117 2HG2 THR 117 33.979 -6.095 -4.701 2057 3HG2 THR 117 3HG2 THR 117 32.330 -6.717 -4.760 2058 H GLN 118 H GLN 118 35.446 -5.870 -3.223 2059 HA GLN 118 HA GLN 118 37.463 -4.247 -2.055 2060 1HB GLN 118 1HB GLN 118 37.739 -6.308 -3.459 2061 2HB GLN 118 2HB GLN 118 37.268 -5.369 -4.876 2062 1HG GLN 118 1HG GLN 118 39.176 -3.813 -4.412 2063 2HG GLN 118 2HG GLN 118 39.681 -4.883 -3.104 2064 1HE2 GLN 118 1HE2 GLN 118 41.705 -4.989 -4.617 2065 2HE2 GLN 118 2HE2 GLN 118 41.691 -6.187 -5.820 2066 H ASN 119 H ASN 119 38.413 -2.270 -2.765 2067 HA ASN 119 HA ASN 119 36.575 -0.398 -4.064 2068 1HB ASN 119 1HB ASN 119 38.134 0.046 -2.108 2069 2HB ASN 119 2HB ASN 119 39.481 -0.065 -3.240 2070 1HD2 ASN 119 1HD2 ASN 119 36.232 1.496 -3.499 2071 2HD2 ASN 119 2HD2 ASN 119 36.840 3.022 -3.929 2072 1H GLY 201 1H GLY 201 1.204 12.565 12.343 2073 2H GLY 201 2H GLY 201 0.662 12.197 13.910 2074 3H GLY 201 3H GLY 201 0.463 11.069 12.657 2075 1HA GLY 201 1HA GLY 201 2.282 10.208 13.733 2076 2HA GLY 201 2HA GLY 201 3.026 11.196 12.476 2077 H LYS 202 H LYS 202 4.184 10.520 15.072 2078 HA LYS 202 HA LYS 202 4.130 13.136 16.507 2079 1HB LYS 202 1HB LYS 202 4.743 10.275 17.121 2080 2HB LYS 202 2HB LYS 202 5.619 11.494 18.047 2081 1HG LYS 202 1HG LYS 202 2.606 11.490 17.722 2082 2HG LYS 202 2HG LYS 202 3.436 10.752 19.092 2083 1HD LYS 202 1HD LYS 202 4.578 13.017 19.435 2084 2HD LYS 202 2HD LYS 202 3.406 13.669 18.289 2085 1HE LYS 202 1HE LYS 202 1.937 12.095 20.152 2086 2HE LYS 202 2HE LYS 202 3.032 13.129 21.088 2087 1HZ LYS 202 1HZ LYS 202 2.342 14.990 19.614 2088 2HZ LYS 202 2HZ LYS 202 1.077 14.391 20.575 2089 3HZ LYS 202 3HZ LYS 202 1.165 13.974 18.931 2090 H ALA 203 H ALA 203 5.686 14.542 15.779 2091 HA ALA 203 HA ALA 203 8.243 13.453 14.710 2092 1HB ALA 203 1HB ALA 203 6.821 16.130 14.637 2093 2HB ALA 203 2HB ALA 203 7.096 15.021 13.293 2094 3HB ALA 203 3HB ALA 203 8.449 15.907 13.996 2095 HA PRO 204 HA PRO 204 10.048 14.395 18.706 2096 1HB PRO 204 1HB PRO 204 12.610 14.247 17.206 2097 2HB PRO 204 2HB PRO 204 12.084 13.318 18.621 2098 1HG PRO 204 1HG PRO 204 12.239 12.243 16.162 2099 2HG PRO 204 2HG PRO 204 11.031 11.734 17.350 2100 1HD PRO 204 1HD PRO 204 10.710 13.433 14.931 2101 2HD PRO 204 2HD PRO 204 9.570 12.294 15.677 2102 H ARG 205 H ARG 205 12.416 15.859 18.963 2103 HA ARG 205 HA ARG 205 11.596 18.548 18.709 2104 1HB ARG 205 1HB ARG 205 13.623 17.201 19.884 2105 2HB ARG 205 2HB ARG 205 14.498 17.867 18.505 2106 1HG ARG 205 1HG ARG 205 14.380 19.993 19.307 2107 2HG ARG 205 2HG ARG 205 12.716 19.791 19.854 2108 1HD ARG 205 1HD ARG 205 13.397 18.788 21.903 2109 2HD ARG 205 2HD ARG 205 15.036 18.483 21.299 2110 HE ARG 205 HE ARG 205 14.486 21.285 21.115 2111 1HH1 ARG 205 1HH1 ARG 205 15.057 18.789 23.473 2112 2HH1 ARG 205 2HH1 ARG 205 15.730 19.883 24.630 2113 1HH2 ARG 205 1HH2 ARG 205 15.362 22.686 22.634 2114 2HH2 ARG 205 2HH2 ARG 205 15.902 22.073 24.161 2115 H LYS 206 H LYS 206 13.095 16.421 16.358 2116 HA LYS 206 HA LYS 206 14.183 18.309 14.540 2117 1HB LYS 206 1HB LYS 206 13.375 15.509 14.656 2118 2HB LYS 206 2HB LYS 206 13.066 16.191 13.060 2119 1HG LYS 206 1HG LYS 206 15.268 16.232 12.574 2120 2HG LYS 206 2HG LYS 206 15.641 17.063 14.084 2121 1HD LYS 206 1HD LYS 206 16.762 14.869 13.999 2122 2HD LYS 206 2HD LYS 206 15.558 14.903 15.287 2123 1HE LYS 206 1HE LYS 206 14.062 14.035 13.135 2124 2HE LYS 206 2HE LYS 206 15.630 13.257 12.845 2125 1HZ LYS 206 1HZ LYS 206 15.647 12.448 15.094 2126 2HZ LYS 206 2HZ LYS 206 14.180 11.980 14.377 2127 3HZ LYS 206 3HZ LYS 206 14.216 13.285 15.464 2128 H GLN 207 H GLN 207 13.243 19.603 12.961 2129 HA GLN 207 HA GLN 207 10.275 19.389 12.590 2130 1HB GLN 207 1HB GLN 207 10.940 21.199 14.169 2131 2HB GLN 207 2HB GLN 207 11.977 21.889 12.920 2132 1HG GLN 207 1HG GLN 207 10.220 22.795 11.793 2133 2HG GLN 207 2HG GLN 207 9.202 21.379 12.055 2134 1HE2 GLN 207 1HE2 GLN 207 7.498 21.715 13.490 2135 2HE2 GLN 207 2HE2 GLN 207 7.453 22.917 14.687 2136 H LEU 208 H LEU 208 13.267 20.881 11.291 2137 HA LEU 208 HA LEU 208 12.060 20.812 8.563 2138 1HB LEU 208 1HB LEU 208 13.575 22.656 10.036 2139 2HB LEU 208 2HB LEU 208 14.720 21.990 8.872 2140 HG LEU 208 HG LEU 208 12.155 22.508 7.615 2141 1HD1 LEU 208 1HD1 LEU 208 13.577 24.921 8.773 2142 2HD1 LEU 208 2HD1 LEU 208 12.092 24.247 9.446 2143 3HD1 LEU 208 3HD1 LEU 208 12.098 24.916 7.814 2144 1HD2 LEU 208 1HD2 LEU 208 14.279 22.199 6.419 2145 2HD2 LEU 208 2HD2 LEU 208 14.949 23.623 7.214 2146 3HD2 LEU 208 3HD2 LEU 208 13.615 23.795 6.074 2147 H ALA 209 H ALA 209 12.546 18.993 7.400 2148 HA ALA 209 HA ALA 209 15.330 18.102 7.158 2149 1HB ALA 209 1HB ALA 209 14.725 17.011 9.231 2150 2HB ALA 209 2HB ALA 209 14.679 15.773 7.976 2151 3HB ALA 209 3HB ALA 209 13.178 16.486 8.567 2152 H THR 210 H THR 210 13.640 19.073 5.181 2153 HA THR 210 HA THR 210 12.921 16.596 3.646 2154 HB THR 210 HB THR 210 11.671 19.369 3.568 2155 HG1 THR 210 HG1 THR 210 10.711 16.940 4.673 2156 1HG2 THR 210 1HG2 THR 210 11.166 18.477 1.487 2157 2HG2 THR 210 2HG2 THR 210 9.835 17.818 2.437 2158 3HG2 THR 210 3HG2 THR 210 11.237 16.813 2.068 2159 H LYS 211 H LYS 211 15.528 17.597 3.484 2160 HA LYS 211 HA LYS 211 15.534 19.050 0.858 2161 1HB LYS 211 1HB LYS 211 17.073 19.244 3.394 2162 2HB LYS 211 2HB LYS 211 18.024 19.410 1.918 2163 1HG LYS 211 1HG LYS 211 15.451 20.940 2.272 2164 2HG LYS 211 2HG LYS 211 16.963 21.554 2.940 2165 1HD LYS 211 1HD LYS 211 16.769 20.677 0.058 2166 2HD LYS 211 2HD LYS 211 16.316 22.309 0.549 2167 1HE LYS 211 1HE LYS 211 18.521 22.815 1.291 2168 2HE LYS 211 2HE LYS 211 18.990 21.105 1.310 2169 1HZ LYS 211 1HZ LYS 211 18.252 22.716 -1.082 2170 2HZ LYS 211 2HZ LYS 211 18.561 21.046 -1.102 2171 3HZ LYS 211 3HZ LYS 211 19.802 22.135 -0.704 2172 H ALA 212 H ALA 212 15.446 16.996 -0.309 2173 HA ALA 212 HA ALA 212 18.078 15.844 -0.793 2174 1HB ALA 212 1HB ALA 212 17.665 13.677 0.149 2175 2HB ALA 212 2HB ALA 212 15.952 14.028 0.381 2176 3HB ALA 212 3HB ALA 212 17.159 14.824 1.390 2177 H ALA 213 H ALA 213 17.197 13.394 -1.913 2178 HA ALA 213 HA ALA 213 15.244 14.297 -4.003 2179 1HB ALA 213 1HB ALA 213 17.382 14.439 -5.018 2180 2HB ALA 213 2HB ALA 213 16.813 12.842 -5.504 2181 3HB ALA 213 3HB ALA 213 17.969 13.002 -4.182 2182 H ARG 214 H ARG 214 14.473 12.749 -1.760 2183 HA ARG 214 HA ARG 214 13.451 10.693 -1.187 2184 1HB ARG 214 1HB ARG 214 13.146 11.098 -4.157 2185 2HB ARG 214 2HB ARG 214 12.469 9.657 -3.398 2186 1HG ARG 214 1HG ARG 214 10.670 11.092 -3.163 2187 2HG ARG 214 2HG ARG 214 11.531 11.460 -1.669 2188 1HD ARG 214 1HD ARG 214 12.785 13.216 -3.249 2189 2HD ARG 214 2HD ARG 214 11.264 13.103 -4.155 2190 HE ARG 214 HE ARG 214 10.422 13.315 -1.535 2191 1HH1 ARG 214 1HH1 ARG 214 12.599 15.156 -3.534 2192 2HH1 ARG 214 2HH1 ARG 214 12.282 16.639 -2.703 2193 1HH2 ARG 214 1HH2 ARG 214 10.028 15.253 -0.474 2194 2HH2 ARG 214 2HH2 ARG 214 10.838 16.696 -0.984 2195 1HN MLZ 215 1HN MLZ 215 13.396 8.213 -2.171 2196 HA MLZ 215 HA MLZ 215 16.192 7.331 -2.012 2197 1HB MLZ 215 1HB MLZ 215 13.434 6.165 -1.947 2198 2HB MLZ 215 2HB MLZ 215 14.765 5.081 -2.351 2199 1HG MLZ 215 1HG MLZ 215 15.605 6.681 -0.148 2200 2HG MLZ 215 2HG MLZ 215 15.298 4.946 -0.171 2201 1HD MLZ 215 1HD MLZ 215 13.518 7.179 0.705 2202 2HD MLZ 215 2HD MLZ 215 12.759 5.779 -0.053 2203 1HE MLZ 215 1HE MLZ 215 14.809 5.306 2.093 2204 2HE MLZ 215 2HE MLZ 215 13.378 4.344 1.672 2205 HZ MLZ 215 HZ MLZ 215 12.004 6.242 2.418 2206 1HCM MLZ 215 1HCM MLZ 215 12.005 4.759 4.096 2207 2HCM MLZ 215 2HCM MLZ 215 12.916 6.040 4.894 2208 3HCM MLZ 215 3HCM MLZ 215 13.767 4.694 4.138 2209 H SER 216 H SER 216 17.367 6.390 -3.698 2210 HA SER 216 HA SER 216 17.973 5.892 -5.923 2211 1HB SER 216 1HB SER 216 15.855 7.426 -7.196 2212 2HB SER 216 2HB SER 216 16.524 8.313 -5.827 2213 HG SER 216 HG SER 216 18.160 7.048 -7.747 2214 H ALA 217 H ALA 217 17.146 4.768 -7.905 2215 HA ALA 217 HA ALA 217 14.979 2.897 -7.189 2216 1HB ALA 217 1HB ALA 217 13.395 3.939 -8.430 2217 2HB ALA 217 2HB ALA 217 14.458 3.937 -9.838 2218 3HB ALA 217 3HB ALA 217 14.524 5.269 -8.684 2219 HA PRO 218 HA PRO 218 16.963 0.048 -9.874 2220 1HB PRO 218 1HB PRO 218 14.808 -0.033 -11.908 2221 2HB PRO 218 2HB PRO 218 15.401 -1.328 -10.854 2222 1HG PRO 218 1HG PRO 218 13.012 -0.135 -10.496 2223 2HG PRO 218 2HG PRO 218 13.975 -0.775 -9.158 2224 1HD PRO 218 1HD PRO 218 13.556 2.044 -10.010 2225 2HD PRO 218 2HD PRO 218 13.786 1.373 -8.381 2226 H ALA 219 H ALA 219 18.636 1.398 -10.704 2227 HA ALA 219 HA ALA 219 19.833 2.581 -12.363 2228 1HB ALA 219 1HB ALA 219 18.458 1.827 -14.689 2229 2HB ALA 219 2HB ALA 219 18.131 0.522 -13.549 2230 3HB ALA 219 3HB ALA 219 19.796 0.949 -13.946 2231 H THR 220 H THR 220 18.589 4.535 -11.349 2232 HA THR 220 HA THR 220 16.397 5.658 -12.931 2233 HB THR 220 HB THR 220 17.141 7.665 -11.351 2234 HG1 THR 220 HG1 THR 220 18.546 7.133 -9.853 2235 1HG2 THR 220 1HG2 THR 220 15.104 6.638 -10.837 2236 2HG2 THR 220 2HG2 THR 220 16.061 6.283 -9.399 2237 3HG2 THR 220 3HG2 THR 220 15.843 5.049 -10.640 2238 H GLY 221 H GLY 221 17.925 5.411 -14.960 2239 1HA GLY 221 1HA GLY 221 18.505 7.291 -16.539 2240 2HA GLY 221 2HA GLY 221 19.506 7.938 -15.239 2241 1HN SAH 301 1HN SAH 301 -10.715 -0.285 -8.781 2242 2HN SAH 301 2HN SAH 301 -9.483 0.373 -9.753 2243 HA SAH 301 HA SAH 301 -9.980 2.571 -8.525 2244 1HB SAH 301 1HB SAH 301 -11.250 0.380 -6.847 2245 2HB SAH 301 2HB SAH 301 -10.867 1.980 -6.210 2246 1HG SAH 301 1HG SAH 301 -13.247 1.333 -7.403 2247 2HG SAH 301 2HG SAH 301 -12.349 2.008 -8.763 2248 1H5* SAH 301 1H5* SAH 301 -14.810 2.484 -6.971 2249 2H5* SAH 301 2H5* SAH 301 -14.780 3.845 -5.851 2250 H4* SAH 301 H4* SAH 301 -14.535 5.185 -8.092 2251 H3* SAH 301 H3* SAH 301 -16.674 4.423 -6.288 2252 *HO3 SAH 301 *HO3 SAH 301 -17.341 6.601 -7.447 2253 H2* SAH 301 H2* SAH 301 -18.272 3.752 -7.706 2254 *HO2 SAH 301 *HO2 SAH 301 -18.820 5.180 -9.497 2255 H1* SAH 301 H1* SAH 301 -17.000 4.108 -10.275 2256 H8 SAH 301 H8 SAH 301 -16.141 1.091 -8.133 2257 1HN6 SAH 301 1HN6 SAH 301 -20.150 -1.945 -10.014 2258 2HN6 SAH 301 2HN6 SAH 301 -21.293 -1.236 -8.896 2259 H2 SAH 301 H2 SAH 301 -21.197 2.621 -11.743 2260 1HN SAH 302 1HN SAH 302 10.767 -0.274 8.792 2261 2HN SAH 302 2HN SAH 302 9.546 0.384 9.772 2262 HA SAH 302 HA SAH 302 10.037 2.580 8.539 2263 1HB SAH 302 1HB SAH 302 11.295 0.387 6.857 2264 2HB SAH 302 2HB SAH 302 10.910 1.985 6.219 2265 1HG SAH 302 1HG SAH 302 13.296 1.335 7.397 2266 2HG SAH 302 2HG SAH 302 12.408 2.012 8.763 2267 1H5* SAH 302 1H5* SAH 302 14.858 2.482 6.956 2268 2H5* SAH 302 2H5* SAH 302 14.823 3.842 5.834 2269 H4* SAH 302 H4* SAH 302 14.594 5.186 8.075 2270 H3* SAH 302 H3* SAH 302 16.720 4.419 6.259 2271 *HO3 SAH 302 *HO3 SAH 302 17.397 6.597 7.412 2272 H2* SAH 302 H2* SAH 302 18.324 3.747 7.666 2273 *HO2 SAH 302 *HO2 SAH 302 18.888 5.176 9.453 2274 H1* SAH 302 H1* SAH 302 17.071 4.107 10.244 2275 H8 SAH 302 H8 SAH 302 16.195 1.090 8.111 2276 1HN6 SAH 302 1HN6 SAH 302 20.211 -1.950 9.967 2277 2HN6 SAH 302 2HN6 SAH 302 21.348 -1.244 8.841 2278 H2 SAH 302 H2 SAH 302 21.276 2.615 11.686 Start of MODEL 19 1 1H MET 1 1H MET 1 -3.305 -9.885 -5.162 2 2H MET 1 2H MET 1 -4.744 -9.141 -5.671 3 3H MET 1 3H MET 1 -3.270 -8.306 -5.787 4 HA MET 1 HA MET 1 -4.009 -9.155 -7.959 5 1HB MET 1 1HB MET 1 -1.525 -9.471 -6.523 6 2HB MET 1 2HB MET 1 -1.674 -10.758 -7.719 7 1HG MET 1 1HG MET 1 -0.797 -9.134 -9.093 8 2HG MET 1 2HG MET 1 -2.496 -8.679 -9.223 9 1HE MET 1 1HE MET 1 -2.669 -5.751 -9.165 10 2HE MET 1 2HE MET 1 -1.630 -6.777 -10.155 11 3HE MET 1 3HE MET 1 -0.961 -5.355 -9.355 12 H PHE 2 H PHE 2 -3.271 -11.479 -9.116 13 HA PHE 2 HA PHE 2 -5.391 -13.272 -8.561 14 1HB PHE 2 1HB PHE 2 -3.894 -14.876 -9.942 15 2HB PHE 2 2HB PHE 2 -4.458 -13.397 -10.699 16 HD1 PHE 2 HD1 PHE 2 -1.786 -13.183 -8.153 17 HD2 PHE 2 HD2 PHE 2 -2.637 -13.533 -12.352 18 HE1 PHE 2 HE1 PHE 2 0.545 -12.551 -8.678 19 HE2 PHE 2 HE2 PHE 2 -0.301 -12.895 -12.872 20 HZ PHE 2 HZ PHE 2 1.290 -12.404 -11.037 21 H ASN 3 H ASN 3 -5.269 -13.601 -6.227 22 HA ASN 3 HA ASN 3 -3.084 -15.402 -5.298 23 1HB ASN 3 1HB ASN 3 -4.033 -13.239 -4.136 24 2HB ASN 3 2HB ASN 3 -5.350 -14.301 -3.639 25 1HD2 ASN 3 1HD2 ASN 3 -3.095 -13.043 -2.001 26 2HD2 ASN 3 2HD2 ASN 3 -2.358 -14.354 -1.214 27 H ASP 4 H ASP 4 -3.588 -17.496 -4.502 28 HA ASP 4 HA ASP 4 -5.510 -19.052 -5.769 29 1HB ASP 4 1HB ASP 4 -3.588 -19.849 -4.425 30 2HB ASP 4 2HB ASP 4 -4.401 -19.322 -2.951 31 H ARG 5 H ARG 5 -6.018 -16.901 -3.043 32 HA ARG 5 HA ARG 5 -8.717 -18.072 -2.564 33 1HB ARG 5 1HB ARG 5 -7.067 -15.990 -1.084 34 2HB ARG 5 2HB ARG 5 -8.576 -16.696 -0.505 35 1HG ARG 5 1HG ARG 5 -7.029 -18.913 -1.161 36 2HG ARG 5 2HG ARG 5 -5.867 -17.797 -0.444 37 1HD ARG 5 1HD ARG 5 -8.072 -17.581 1.242 38 2HD ARG 5 2HD ARG 5 -8.011 -19.311 0.853 39 HE ARG 5 HE ARG 5 -5.349 -18.421 1.332 40 1HH1 ARG 5 1HH1 ARG 5 -8.350 -18.889 3.034 41 2HH1 ARG 5 2HH1 ARG 5 -7.571 -19.197 4.547 42 1HH2 ARG 5 1HH2 ARG 5 -4.361 -18.824 3.307 43 2HH2 ARG 5 2HH2 ARG 5 -5.330 -19.161 4.703 44 H VAL 6 H VAL 6 -7.135 -15.129 -3.723 45 HA VAL 6 HA VAL 6 -9.753 -14.153 -4.715 46 HB VAL 6 HB VAL 6 -7.974 -12.687 -2.728 47 1HG1 VAL 6 1HG1 VAL 6 -10.045 -11.062 -2.895 48 2HG1 VAL 6 2HG1 VAL 6 -10.233 -11.791 -4.489 49 3HG1 VAL 6 3HG1 VAL 6 -8.740 -10.948 -4.076 50 1HG2 VAL 6 1HG2 VAL 6 -10.199 -12.687 -1.439 51 2HG2 VAL 6 2HG2 VAL 6 -9.348 -14.227 -1.545 52 3HG2 VAL 6 3HG2 VAL 6 -10.734 -13.912 -2.589 53 H ILE 7 H ILE 7 -9.483 -13.033 -6.634 54 HA ILE 7 HA ILE 7 -6.649 -12.397 -7.417 55 HB ILE 7 HB ILE 7 -7.638 -14.249 -8.655 56 1HG1 ILE 7 1HG1 ILE 7 -7.983 -11.961 -10.567 57 2HG1 ILE 7 2HG1 ILE 7 -6.398 -12.248 -9.852 58 1HG2 ILE 7 1HG2 ILE 7 -9.949 -14.094 -8.456 59 2HG2 ILE 7 2HG2 ILE 7 -9.730 -13.531 -10.112 60 3HG2 ILE 7 3HG2 ILE 7 -9.966 -12.367 -8.809 61 1HD1 ILE 7 1HD1 ILE 7 -8.043 -14.153 -11.531 62 2HD1 ILE 7 2HD1 ILE 7 -6.643 -14.674 -10.594 63 3HD1 ILE 7 3HD1 ILE 7 -6.446 -13.500 -11.895 64 H VAL 8 H VAL 8 -6.408 -10.548 -8.910 65 HA VAL 8 HA VAL 8 -8.209 -8.319 -8.191 66 HB VAL 8 HB VAL 8 -5.739 -8.100 -8.155 67 1HG1 VAL 8 1HG1 VAL 8 -5.373 -8.005 -11.044 68 2HG1 VAL 8 2HG1 VAL 8 -5.894 -9.603 -10.514 69 3HG1 VAL 8 3HG1 VAL 8 -4.439 -8.879 -9.832 70 1HG2 VAL 8 1HG2 VAL 8 -7.399 -6.486 -10.068 71 2HG2 VAL 8 2HG2 VAL 8 -5.665 -6.166 -9.961 72 3HG2 VAL 8 3HG2 VAL 8 -6.681 -6.005 -8.529 73 H LYS 9 H LYS 9 -9.883 -7.757 -9.485 74 HA LYS 9 HA LYS 9 -9.655 -8.072 -12.420 75 1HB LYS 9 1HB LYS 9 -11.317 -9.621 -10.519 76 2HB LYS 9 2HB LYS 9 -12.117 -9.123 -12.004 77 1HG LYS 9 1HG LYS 9 -10.318 -10.171 -13.317 78 2HG LYS 9 2HG LYS 9 -9.471 -10.602 -11.836 79 1HD LYS 9 1HD LYS 9 -11.265 -12.077 -11.169 80 2HD LYS 9 2HD LYS 9 -12.268 -11.522 -12.501 81 1HE LYS 9 1HE LYS 9 -10.236 -12.322 -13.983 82 2HE LYS 9 2HE LYS 9 -9.897 -13.324 -12.568 83 1HZ LYS 9 1HZ LYS 9 -11.413 -14.547 -13.896 84 2HZ LYS 9 2HZ LYS 9 -12.411 -13.193 -14.134 85 3HZ LYS 9 3HZ LYS 9 -12.321 -13.923 -12.603 86 H LYS 10 H LYS 10 -11.719 -5.139 -12.495 87 HA LYS 10 HA LYS 10 -10.562 -5.330 -14.488 88 1HB LYS 10 1HB LYS 10 -8.858 -5.968 -12.296 89 2HB LYS 10 2HB LYS 10 -8.418 -7.022 -13.640 90 1HG LYS 10 1HG LYS 10 -7.202 -4.859 -13.690 91 2HG LYS 10 2HG LYS 10 -8.193 -5.091 -15.123 92 1HD LYS 10 1HD LYS 10 -9.855 -3.838 -13.211 93 2HD LYS 10 2HD LYS 10 -8.313 -2.987 -13.143 94 1HE LYS 10 1HE LYS 10 -9.383 -3.616 -15.861 95 2HE LYS 10 2HE LYS 10 -10.186 -2.325 -14.946 96 1HZ LYS 10 1HZ LYS 10 -8.084 -1.268 -14.571 97 2HZ LYS 10 2HZ LYS 10 -8.225 -1.552 -16.240 98 3HZ LYS 10 3HZ LYS 10 -7.240 -2.556 -15.288 99 H SER 11 H SER 11 -12.431 -6.728 -15.165 100 HA SER 11 HA SER 11 -11.463 -9.024 -16.553 101 1HB SER 11 1HB SER 11 -12.341 -9.411 -13.867 102 2HB SER 11 2HB SER 11 -13.429 -10.262 -14.959 103 HG SER 11 HG SER 11 -11.434 -11.071 -15.968 104 HA PRO 12 HA PRO 12 -16.164 -8.691 -17.235 105 1HB PRO 12 1HB PRO 12 -16.959 -6.317 -15.663 106 2HB PRO 12 2HB PRO 12 -17.698 -7.929 -15.704 107 1HG PRO 12 1HG PRO 12 -16.293 -7.069 -13.589 108 2HG PRO 12 2HG PRO 12 -16.277 -8.757 -14.090 109 1HD PRO 12 1HD PRO 12 -14.259 -6.618 -14.525 110 2HD PRO 12 2HD PRO 12 -14.036 -8.308 -14.047 111 H LEU 13 H LEU 13 -14.406 -5.678 -16.660 112 HA LEU 13 HA LEU 13 -14.334 -4.902 -19.404 113 1HB LEU 13 1HB LEU 13 -16.794 -4.361 -17.929 114 2HB LEU 13 2HB LEU 13 -16.068 -2.867 -18.520 115 HG LEU 13 HG LEU 13 -16.167 -5.169 -20.412 116 1HD1 LEU 13 1HD1 LEU 13 -18.542 -4.130 -21.010 117 2HD1 LEU 13 2HD1 LEU 13 -18.557 -3.765 -19.285 118 3HD1 LEU 13 3HD1 LEU 13 -18.394 -5.434 -19.832 119 1HD2 LEU 13 1HD2 LEU 13 -16.777 -2.217 -20.732 120 2HD2 LEU 13 2HD2 LEU 13 -16.483 -3.380 -22.024 121 3HD2 LEU 13 3HD2 LEU 13 -15.174 -2.921 -20.935 122 H GLY 14 H GLY 14 -14.435 -3.863 -16.026 123 1HA GLY 14 1HA GLY 14 -11.898 -2.630 -16.046 124 2HA GLY 14 2HA GLY 14 -13.072 -1.361 -16.390 125 H GLY 15 H GLY 15 -12.531 -0.382 -14.318 126 1HA GLY 15 1HA GLY 15 -13.024 0.054 -12.064 127 2HA GLY 15 2HA GLY 15 -14.293 -1.165 -12.190 128 H TYR 16 H TYR 16 -10.913 -0.619 -11.392 129 HA TYR 16 HA TYR 16 -10.053 -3.294 -10.992 130 1HB TYR 16 1HB TYR 16 -9.327 -0.563 -10.199 131 2HB TYR 16 2HB TYR 16 -8.819 -1.774 -9.027 132 HD1 TYR 16 HD1 TYR 16 -7.867 -0.086 -11.949 133 HD2 TYR 16 HD2 TYR 16 -7.799 -3.991 -10.161 134 HE1 TYR 16 HE1 TYR 16 -5.988 -0.732 -13.433 135 HE2 TYR 16 HE2 TYR 16 -5.920 -4.638 -11.645 136 HH TYR 16 HH TYR 16 -4.018 -2.572 -13.206 137 H GLY 17 H GLY 17 -11.680 -4.544 -9.975 138 1HA GLY 17 1HA GLY 17 -12.210 -3.837 -7.113 139 2HA GLY 17 2HA GLY 17 -13.411 -4.641 -8.125 140 H VAL 18 H VAL 18 -12.762 -5.970 -5.825 141 HA VAL 18 HA VAL 18 -10.584 -7.891 -6.472 142 HB VAL 18 HB VAL 18 -12.422 -7.475 -4.088 143 1HG1 VAL 18 1HG1 VAL 18 -9.965 -9.234 -4.286 144 2HG1 VAL 18 2HG1 VAL 18 -11.614 -9.847 -4.408 145 3HG1 VAL 18 3HG1 VAL 18 -11.064 -9.089 -2.914 146 1HG2 VAL 18 1HG2 VAL 18 -9.529 -7.109 -3.792 147 2HG2 VAL 18 2HG2 VAL 18 -10.853 -6.064 -3.276 148 3HG2 VAL 18 3HG2 VAL 18 -10.261 -5.984 -4.936 149 H PHE 19 H PHE 19 -11.012 -10.046 -7.015 150 HA PHE 19 HA PHE 19 -13.885 -10.693 -7.544 151 1HB PHE 19 1HB PHE 19 -11.357 -11.009 -8.932 152 2HB PHE 19 2HB PHE 19 -12.153 -12.573 -8.747 153 HD1 PHE 19 HD1 PHE 19 -13.266 -9.039 -9.393 154 HD2 PHE 19 HD2 PHE 19 -13.472 -13.169 -10.566 155 HE1 PHE 19 HE1 PHE 19 -14.840 -8.441 -11.211 156 HE2 PHE 19 HE2 PHE 19 -15.048 -12.567 -12.389 157 HZ PHE 19 HZ PHE 19 -15.725 -10.198 -12.714 158 H ALA 20 H ALA 20 -14.819 -12.321 -6.401 159 HA ALA 20 HA ALA 20 -13.249 -13.698 -4.329 160 1HB ALA 20 1HB ALA 20 -16.023 -14.514 -4.633 161 2HB ALA 20 2HB ALA 20 -15.887 -12.757 -4.726 162 3HB ALA 20 3HB ALA 20 -15.278 -13.615 -3.311 163 H ARG 21 H ARG 21 -11.960 -15.138 -5.647 164 HA ARG 21 HA ARG 21 -13.088 -16.990 -7.557 165 1HB ARG 21 1HB ARG 21 -10.613 -16.126 -6.874 166 2HB ARG 21 2HB ARG 21 -10.636 -17.646 -5.981 167 1HG ARG 21 1HG ARG 21 -10.729 -18.929 -7.897 168 2HG ARG 21 2HG ARG 21 -11.599 -17.694 -8.807 169 1HD ARG 21 1HD ARG 21 -9.615 -17.135 -9.760 170 2HD ARG 21 2HD ARG 21 -9.092 -16.546 -8.171 171 HE ARG 21 HE ARG 21 -8.767 -19.284 -7.975 172 1HH1 ARG 21 1HH1 ARG 21 -7.717 -16.866 -10.250 173 2HH1 ARG 21 2HH1 ARG 21 -6.276 -17.726 -10.667 174 1HH2 ARG 21 1HH2 ARG 21 -6.889 -20.381 -8.533 175 2HH2 ARG 21 2HH2 ARG 21 -5.809 -19.702 -9.704 176 H LYS 22 H LYS 22 -13.139 -16.828 -4.116 177 HA LYS 22 HA LYS 22 -13.734 -19.748 -3.864 178 1HB LYS 22 1HB LYS 22 -12.404 -17.656 -2.283 179 2HB LYS 22 2HB LYS 22 -13.564 -18.581 -1.334 180 1HG LYS 22 1HG LYS 22 -12.451 -20.631 -1.769 181 2HG LYS 22 2HG LYS 22 -11.546 -19.946 -3.118 182 1HD LYS 22 1HD LYS 22 -10.325 -18.480 -1.535 183 2HD LYS 22 2HD LYS 22 -11.214 -19.202 -0.194 184 1HE LYS 22 1HE LYS 22 -10.040 -21.274 -1.857 185 2HE LYS 22 2HE LYS 22 -8.798 -20.144 -1.286 186 1HZ LYS 22 1HZ LYS 22 -9.708 -20.332 0.948 187 2HZ LYS 22 2HZ LYS 22 -9.261 -21.866 0.371 188 3HZ LYS 22 3HZ LYS 22 -10.898 -21.414 0.401 189 H SER 23 H SER 23 -16.885 -18.939 -2.065 190 HA SER 23 HA SER 23 -14.369 -20.567 -1.992 191 1HB SER 23 1HB SER 23 -16.822 -21.589 -0.727 192 2HB SER 23 2HB SER 23 -17.021 -21.228 -2.442 193 HG SER 23 HG SER 23 -16.257 -23.344 -2.120 194 H PHE 24 H PHE 24 -16.511 -18.523 -0.155 195 HA PHE 24 HA PHE 24 -14.892 -19.099 2.309 196 1HB PHE 24 1HB PHE 24 -16.108 -16.558 1.170 197 2HB PHE 24 2HB PHE 24 -15.394 -16.649 2.779 198 HD1 PHE 24 HD1 PHE 24 -12.987 -17.943 2.745 199 HD2 PHE 24 HD2 PHE 24 -14.727 -15.732 -0.500 200 HE1 PHE 24 HE1 PHE 24 -10.733 -17.605 1.766 201 HE2 PHE 24 HE2 PHE 24 -12.474 -15.394 -1.479 202 HZ PHE 24 HZ PHE 24 -10.478 -16.330 -0.346 203 H GLU 25 H GLU 25 -16.084 -18.626 4.357 204 HA GLU 25 HA GLU 25 -18.985 -19.317 4.094 205 1HB GLU 25 1HB GLU 25 -16.852 -20.427 5.527 206 2HB GLU 25 2HB GLU 25 -17.745 -19.512 6.741 207 1HG GLU 25 1HG GLU 25 -19.831 -20.664 5.534 208 2HG GLU 25 2HG GLU 25 -18.611 -21.869 5.121 209 H LYS 26 H LYS 26 -20.140 -18.456 6.284 210 HA LYS 26 HA LYS 26 -20.068 -15.554 6.113 211 1HB LYS 26 1HB LYS 26 -22.010 -17.229 6.597 212 2HB LYS 26 2HB LYS 26 -21.414 -17.208 8.255 213 1HG LYS 26 1HG LYS 26 -21.756 -14.826 8.427 214 2HG LYS 26 2HG LYS 26 -22.103 -14.706 6.711 215 1HD LYS 26 1HD LYS 26 -24.236 -15.368 6.944 216 2HD LYS 26 2HD LYS 26 -23.796 -16.614 8.100 217 1HE LYS 26 1HE LYS 26 -23.519 -13.810 9.042 218 2HE LYS 26 2HE LYS 26 -25.177 -14.409 8.830 219 1HZ LYS 26 1HZ LYS 26 -24.270 -14.960 11.038 220 2HZ LYS 26 2HZ LYS 26 -23.013 -15.832 10.300 221 3HZ LYS 26 3HZ LYS 26 -24.621 -16.354 10.133 222 H GLY 27 H GLY 27 -18.103 -14.729 6.907 223 1HA GLY 27 1HA GLY 27 -17.167 -13.737 8.961 224 2HA GLY 27 2HA GLY 27 -17.596 -15.223 9.809 225 H GLU 28 H GLU 28 -15.691 -14.308 6.907 226 HA GLU 28 HA GLU 28 -13.490 -16.049 7.956 227 1HB GLU 28 1HB GLU 28 -15.191 -16.355 5.634 228 2HB GLU 28 2HB GLU 28 -13.517 -16.148 5.119 229 1HG GLU 28 1HG GLU 28 -14.352 -18.094 7.284 230 2HG GLU 28 2HG GLU 28 -14.206 -18.548 5.586 231 H LEU 29 H LEU 29 -11.641 -14.850 8.104 232 HA LEU 29 HA LEU 29 -11.398 -12.178 7.065 233 1HB LEU 29 1HB LEU 29 -10.253 -13.445 9.047 234 2HB LEU 29 2HB LEU 29 -9.108 -13.999 7.827 235 HG LEU 29 HG LEU 29 -8.316 -11.940 8.961 236 1HD1 LEU 29 1HD1 LEU 29 -9.041 -10.998 6.225 237 2HD1 LEU 29 2HD1 LEU 29 -8.135 -12.506 6.349 238 3HD1 LEU 29 3HD1 LEU 29 -7.471 -11.020 7.027 239 1HD2 LEU 29 1HD2 LEU 29 -10.110 -10.074 7.683 240 2HD2 LEU 29 2HD2 LEU 29 -9.717 -10.234 9.394 241 3HD2 LEU 29 3HD2 LEU 29 -11.027 -11.186 8.698 242 H VAL 30 H VAL 30 -10.818 -11.555 5.028 243 HA VAL 30 HA VAL 30 -9.965 -13.595 3.068 244 HB VAL 30 HB VAL 30 -10.645 -10.633 2.926 245 1HG1 VAL 30 1HG1 VAL 30 -9.586 -12.547 0.922 246 2HG1 VAL 30 2HG1 VAL 30 -9.485 -10.786 0.960 247 3HG1 VAL 30 3HG1 VAL 30 -10.958 -11.574 0.393 248 1HG2 VAL 30 1HG2 VAL 30 -12.292 -12.781 1.671 249 2HG2 VAL 30 2HG2 VAL 30 -12.801 -11.266 2.417 250 3HG2 VAL 30 3HG2 VAL 30 -12.355 -12.641 3.428 251 H GLU 31 H GLU 31 -8.735 -10.491 4.367 252 HA GLU 31 HA GLU 31 -5.972 -11.400 4.199 253 1HB GLU 31 1HB GLU 31 -7.289 -10.137 1.937 254 2HB GLU 31 2HB GLU 31 -5.940 -9.146 2.493 255 1HG GLU 31 1HG GLU 31 -4.619 -11.395 2.544 256 2HG GLU 31 2HG GLU 31 -5.908 -11.989 1.496 257 H GLU 32 H GLU 32 -4.529 -9.855 5.185 258 HA GLU 32 HA GLU 32 -5.779 -7.359 6.247 259 1HB GLU 32 1HB GLU 32 -4.905 -7.979 8.495 260 2HB GLU 32 2HB GLU 32 -6.050 -9.182 7.901 261 1HG GLU 32 1HG GLU 32 -4.079 -10.503 7.034 262 2HG GLU 32 2HG GLU 32 -3.025 -9.362 7.870 263 H CYS 33 H CYS 33 -4.331 -5.653 6.246 264 HA CYS 33 HA CYS 33 -1.413 -6.248 6.075 265 1HB CYS 33 1HB CYS 33 -3.221 -5.316 3.979 266 2HB CYS 33 2HB CYS 33 -1.899 -4.179 4.243 267 HG CYS 33 HG CYS 33 -0.663 -6.871 4.123 268 H LEU 34 H LEU 34 -0.480 -3.699 5.691 269 HA LEU 34 HA LEU 34 -1.318 -2.353 8.204 270 1HB LEU 34 1HB LEU 34 1.093 -3.041 7.180 271 2HB LEU 34 2HB LEU 34 0.957 -1.411 6.523 272 HG LEU 34 HG LEU 34 0.360 -0.654 8.888 273 1HD1 LEU 34 1HD1 LEU 34 -0.075 -3.139 9.540 274 2HD1 LEU 34 2HD1 LEU 34 0.736 -2.098 10.711 275 3HD1 LEU 34 3HD1 LEU 34 1.676 -3.230 9.738 276 1HD2 LEU 34 1HD2 LEU 34 3.039 -1.721 8.036 277 2HD2 LEU 34 2HD2 LEU 34 2.850 -1.026 9.646 278 3HD2 LEU 34 3HD2 LEU 34 2.517 -0.046 8.219 279 H CYS 35 H CYS 35 -1.254 0.124 8.095 280 HA CYS 35 HA CYS 35 -2.170 1.204 5.467 281 1HB CYS 35 1HB CYS 35 -3.598 1.335 8.148 282 2HB CYS 35 2HB CYS 35 -4.072 2.282 6.738 283 HG CYS 35 HG CYS 35 -3.923 -0.685 6.081 284 H ILE 36 H ILE 36 -2.665 3.762 6.055 285 HA ILE 36 HA ILE 36 -0.269 4.701 7.609 286 HB ILE 36 HB ILE 36 -1.523 5.739 5.041 287 1HG1 ILE 36 1HG1 ILE 36 1.179 4.483 5.617 288 2HG1 ILE 36 2HG1 ILE 36 -0.158 3.694 4.781 289 1HG2 ILE 36 1HG2 ILE 36 0.232 6.994 7.019 290 2HG2 ILE 36 2HG2 ILE 36 -0.641 7.724 5.672 291 3HG2 ILE 36 3HG2 ILE 36 0.935 6.980 5.402 292 1HD1 ILE 36 1HD1 ILE 36 -0.083 5.646 3.125 293 2HD1 ILE 36 2HD1 ILE 36 1.280 4.528 3.061 294 3HD1 ILE 36 3HD1 ILE 36 1.456 6.086 3.867 295 H VAL 37 H VAL 37 -0.560 6.692 8.774 296 HA VAL 37 HA VAL 37 -3.419 7.559 9.071 297 HB VAL 37 HB VAL 37 -1.217 7.368 11.161 298 1HG1 VAL 37 1HG1 VAL 37 -3.182 7.661 12.725 299 2HG1 VAL 37 2HG1 VAL 37 -4.167 8.045 11.314 300 3HG1 VAL 37 3HG1 VAL 37 -2.811 9.084 11.751 301 1HG2 VAL 37 1HG2 VAL 37 -3.353 5.485 10.249 302 2HG2 VAL 37 2HG2 VAL 37 -3.009 5.567 11.977 303 3HG2 VAL 37 3HG2 VAL 37 -1.729 5.135 10.844 304 H ARG 38 H ARG 38 -3.385 9.519 7.954 305 HA ARG 38 HA ARG 38 -1.442 11.570 8.946 306 1HB ARG 38 1HB ARG 38 -2.297 10.977 6.094 307 2HB ARG 38 2HB ARG 38 -1.295 12.346 6.566 308 1HG ARG 38 1HG ARG 38 -0.596 9.436 7.055 309 2HG ARG 38 2HG ARG 38 0.056 10.420 5.746 310 1HD ARG 38 1HD ARG 38 0.577 12.046 7.871 311 2HD ARG 38 2HD ARG 38 0.728 10.451 8.634 312 HE ARG 38 HE ARG 38 2.499 11.536 6.590 313 1HH1 ARG 38 1HH1 ARG 38 1.073 8.634 7.879 314 2HH1 ARG 38 2HH1 ARG 38 2.347 7.618 7.300 315 1HH2 ARG 38 1HH2 ARG 38 4.141 10.197 5.849 316 2HH2 ARG 38 2HH2 ARG 38 4.072 8.495 6.159 317 H HIS 39 H HIS 39 -2.343 13.665 9.130 318 HA HIS 39 HA HIS 39 -5.171 13.902 9.491 319 1HB HIS 39 1HB HIS 39 -2.982 15.963 9.027 320 2HB HIS 39 2HB HIS 39 -4.582 16.330 9.672 321 HD1 HIS 39 HD1 HIS 39 -1.698 16.523 11.187 322 HD2 HIS 39 HD2 HIS 39 -4.647 13.627 11.735 323 HE1 HIS 39 HE1 HIS 39 -1.320 15.541 13.491 324 H ASN 40 H ASN 40 -6.365 15.798 8.245 325 HA ASN 40 HA ASN 40 -6.689 14.977 5.504 326 1HB ASN 40 1HB ASN 40 -7.573 17.458 7.026 327 2HB ASN 40 2HB ASN 40 -8.268 16.902 5.504 328 1HD2 ASN 40 1HD2 ASN 40 -10.270 15.982 5.988 329 2HD2 ASN 40 2HD2 ASN 40 -10.560 14.902 7.265 330 H ASP 41 H ASP 41 -6.889 18.108 4.855 331 HA ASP 41 HA ASP 41 -5.523 19.713 3.807 332 1HB ASP 41 1HB ASP 41 -4.231 18.967 6.082 333 2HB ASP 41 2HB ASP 41 -3.032 18.488 4.881 334 H ASP 42 H ASP 42 -2.735 19.133 2.940 335 HA ASP 42 HA ASP 42 -3.092 18.293 0.322 336 1HB ASP 42 1HB ASP 42 -0.776 17.956 2.252 337 2HB ASP 42 2HB ASP 42 -0.623 17.658 0.520 338 H TRP 43 H TRP 43 -2.934 16.257 3.175 339 HA TRP 43 HA TRP 43 -2.369 13.760 1.840 340 1HB TRP 43 1HB TRP 43 -2.017 14.061 4.215 341 2HB TRP 43 2HB TRP 43 -3.685 14.573 4.452 342 HD1 TRP 43 HD1 TRP 43 -5.284 12.773 5.234 343 HE1 TRP 43 HE1 TRP 43 -5.303 10.195 5.250 344 HE3 TRP 43 HE3 TRP 43 -0.974 11.841 2.656 345 HZ2 TRP 43 HZ2 TRP 43 -3.705 8.030 4.300 346 HZ3 TRP 43 HZ3 TRP 43 -0.248 9.511 2.224 347 HH2 TRP 43 HH2 TRP 43 -1.607 7.605 3.041 348 H GLY 44 H GLY 44 -5.448 15.075 3.142 349 1HA GLY 44 1HA GLY 44 -7.116 13.051 2.058 350 2HA GLY 44 2HA GLY 44 -7.665 14.667 2.497 351 H THR 45 H THR 45 -5.582 15.773 0.529 352 HA THR 45 HA THR 45 -7.383 15.676 -1.819 353 HB THR 45 HB THR 45 -4.853 17.242 -1.163 354 HG1 THR 45 HG1 THR 45 -6.412 18.911 -0.813 355 1HG2 THR 45 1HG2 THR 45 -6.267 16.905 -3.623 356 2HG2 THR 45 2HG2 THR 45 -4.912 17.983 -3.286 357 3HG2 THR 45 3HG2 THR 45 -6.567 18.544 -3.045 358 H ALA 46 H ALA 46 -3.813 15.404 -1.385 359 HA ALA 46 HA ALA 46 -3.138 14.400 -3.906 360 1HB ALA 46 1HB ALA 46 -1.557 15.010 -2.111 361 2HB ALA 46 2HB ALA 46 -1.218 13.375 -2.678 362 3HB ALA 46 3HB ALA 46 -2.082 13.620 -1.160 363 H LEU 47 H LEU 47 -3.907 12.405 -1.027 364 HA LEU 47 HA LEU 47 -4.319 10.035 -2.767 365 1HB LEU 47 1HB LEU 47 -4.134 10.604 0.202 366 2HB LEU 47 2HB LEU 47 -4.678 9.035 -0.385 367 HG LEU 47 HG LEU 47 -2.280 8.940 0.036 368 1HD1 LEU 47 1HD1 LEU 47 -3.377 7.916 -2.099 369 2HD1 LEU 47 2HD1 LEU 47 -1.617 7.983 -1.999 370 3HD1 LEU 47 3HD1 LEU 47 -2.492 9.178 -2.956 371 1HD2 LEU 47 1HD2 LEU 47 -1.857 11.074 -2.051 372 2HD2 LEU 47 2HD2 LEU 47 -0.713 10.460 -0.856 373 3HD2 LEU 47 3HD2 LEU 47 -2.051 11.491 -0.348 374 H GLU 48 H GLU 48 -6.223 12.326 -2.874 375 HA GLU 48 HA GLU 48 -8.574 11.759 -1.324 376 1HB GLU 48 1HB GLU 48 -9.575 13.411 -2.838 377 2HB GLU 48 2HB GLU 48 -7.941 13.916 -2.438 378 1HG GLU 48 1HG GLU 48 -7.265 12.617 -4.603 379 2HG GLU 48 2HG GLU 48 -8.971 12.764 -5.020 380 H ASP 49 H ASP 49 -8.234 9.256 -1.969 381 HA ASP 49 HA ASP 49 -10.482 8.596 -3.700 382 1HB ASP 49 1HB ASP 49 -8.433 9.223 -5.171 383 2HB ASP 49 2HB ASP 49 -7.757 7.686 -4.635 384 H TYR 50 H TYR 50 -7.548 7.445 -2.036 385 HA TYR 50 HA TYR 50 -9.068 4.958 -1.317 386 1HB TYR 50 1HB TYR 50 -6.114 5.319 -1.946 387 2HB TYR 50 2HB TYR 50 -6.900 3.791 -1.551 388 HD1 TYR 50 HD1 TYR 50 -9.391 3.844 -3.021 389 HD2 TYR 50 HD2 TYR 50 -5.518 5.272 -4.209 390 HE1 TYR 50 HE1 TYR 50 -10.012 3.545 -5.403 391 HE2 TYR 50 HE2 TYR 50 -6.139 4.973 -6.591 392 HH TYR 50 HH TYR 50 -8.247 3.168 -7.727 393 H LEU 51 H LEU 51 -9.244 7.047 0.454 394 HA LEU 51 HA LEU 51 -7.261 6.309 2.580 395 1HB LEU 51 1HB LEU 51 -8.583 8.953 1.883 396 2HB LEU 51 2HB LEU 51 -7.618 8.700 3.335 397 HG LEU 51 HG LEU 51 -6.669 8.423 0.467 398 1HD1 LEU 51 1HD1 LEU 51 -6.125 10.598 0.686 399 2HD1 LEU 51 2HD1 LEU 51 -5.094 10.185 2.056 400 3HD1 LEU 51 3HD1 LEU 51 -6.784 10.614 2.321 401 1HD2 LEU 51 1HD2 LEU 51 -5.442 6.776 1.607 402 2HD2 LEU 51 2HD2 LEU 51 -5.416 7.700 3.108 403 3HD2 LEU 51 3HD2 LEU 51 -4.405 8.194 1.751 404 H PHE 52 H PHE 52 -8.285 5.213 4.191 405 HA PHE 52 HA PHE 52 -11.191 5.579 4.660 406 1HB PHE 52 1HB PHE 52 -9.005 3.755 5.717 407 2HB PHE 52 2HB PHE 52 -10.643 3.729 6.367 408 HD1 PHE 52 HD1 PHE 52 -12.350 2.521 5.281 409 HD2 PHE 52 HD2 PHE 52 -8.715 3.426 3.180 410 HE1 PHE 52 HE1 PHE 52 -13.077 1.075 3.402 411 HE2 PHE 52 HE2 PHE 52 -9.442 1.981 1.300 412 HZ PHE 52 HZ PHE 52 -11.623 0.805 1.411 413 H SER 53 H SER 53 -11.453 7.568 5.730 414 HA SER 53 HA SER 53 -9.594 8.229 7.948 415 1HB SER 53 1HB SER 53 -9.914 10.014 6.433 416 2HB SER 53 2HB SER 53 -11.634 9.670 6.254 417 HG SER 53 HG SER 53 -10.317 11.162 8.141 418 H ARG 54 H ARG 54 -10.406 8.873 10.021 419 HA ARG 54 HA ARG 54 -13.146 7.839 10.669 420 1HB ARG 54 1HB ARG 54 -10.521 7.085 11.578 421 2HB ARG 54 2HB ARG 54 -11.401 7.785 12.936 422 1HG ARG 54 1HG ARG 54 -13.143 6.196 12.779 423 2HG ARG 54 2HG ARG 54 -12.692 5.736 11.137 424 1HD ARG 54 1HD ARG 54 -11.469 4.044 12.028 425 2HD ARG 54 2HD ARG 54 -10.402 5.264 12.750 426 HE ARG 54 HE ARG 54 -11.522 4.934 14.812 427 1HH1 ARG 54 1HH1 ARG 54 -13.387 3.653 12.166 428 2HH1 ARG 54 2HH1 ARG 54 -14.573 2.940 13.203 429 1HH2 ARG 54 1HH2 ARG 54 -13.074 3.998 16.137 430 2HH2 ARG 54 2HH2 ARG 54 -14.399 3.132 15.434 431 H LYS 55 H LYS 55 -13.452 8.777 13.192 432 HA LYS 55 HA LYS 55 -13.688 11.651 12.802 433 1HB LYS 55 1HB LYS 55 -14.766 11.476 15.055 434 2HB LYS 55 2HB LYS 55 -15.384 10.257 13.940 435 1HG LYS 55 1HG LYS 55 -13.088 9.141 15.181 436 2HG LYS 55 2HG LYS 55 -14.054 9.870 16.463 437 1HD LYS 55 1HD LYS 55 -15.892 8.502 16.041 438 2HD LYS 55 2HD LYS 55 -15.420 8.212 14.367 439 1HE LYS 55 1HE LYS 55 -14.985 6.171 15.614 440 2HE LYS 55 2HE LYS 55 -13.414 6.922 15.277 441 1HZ LYS 55 1HZ LYS 55 -13.694 8.116 17.449 442 2HZ LYS 55 2HZ LYS 55 -13.463 6.439 17.591 443 3HZ LYS 55 3HZ LYS 55 -15.017 7.101 17.774 444 H ASN 56 H ASN 56 -11.337 12.065 12.608 445 HA ASN 56 HA ASN 56 -9.639 11.716 14.975 446 1HB ASN 56 1HB ASN 56 -9.469 14.413 14.832 447 2HB ASN 56 2HB ASN 56 -11.137 14.209 14.299 448 1HD2 ASN 56 1HD2 ASN 56 -12.701 13.647 15.888 449 2HD2 ASN 56 2HD2 ASN 56 -12.322 13.371 17.520 450 H MET 57 H MET 57 -9.704 11.287 11.918 451 HA MET 57 HA MET 57 -7.789 13.103 10.738 452 1HB MET 57 1HB MET 57 -5.805 11.583 10.936 453 2HB MET 57 2HB MET 57 -6.358 12.168 12.504 454 1HG MET 57 1HG MET 57 -7.840 9.812 11.947 455 2HG MET 57 2HG MET 57 -6.158 9.451 11.559 456 1HE MET 57 1HE MET 57 -4.292 10.349 12.883 457 2HE MET 57 2HE MET 57 -4.183 10.276 14.642 458 3HE MET 57 3HE MET 57 -4.810 11.726 13.857 459 H SER 58 H SER 58 -6.408 11.494 9.023 460 HA SER 58 HA SER 58 -8.480 9.766 7.719 461 1HB SER 58 1HB SER 58 -6.535 11.486 6.190 462 2HB SER 58 2HB SER 58 -8.118 10.896 5.685 463 HG SER 58 HG SER 58 -7.879 13.200 6.368 464 H ALA 59 H ALA 59 -7.664 7.824 6.887 465 HA ALA 59 HA ALA 59 -4.684 7.463 7.017 466 1HB ALA 59 1HB ALA 59 -5.699 4.970 7.418 467 2HB ALA 59 2HB ALA 59 -7.009 5.941 8.088 468 3HB ALA 59 3HB ALA 59 -5.377 6.094 8.738 469 H MET 60 H MET 60 -4.030 5.464 5.641 470 HA MET 60 HA MET 60 -5.583 5.505 3.074 471 1HB MET 60 1HB MET 60 -3.335 6.591 3.057 472 2HB MET 60 2HB MET 60 -2.620 5.070 3.590 473 1HG MET 60 1HG MET 60 -2.970 4.032 1.548 474 2HG MET 60 2HG MET 60 -4.363 5.041 1.157 475 1HE MET 60 1HE MET 60 -2.889 4.566 -1.092 476 2HE MET 60 2HE MET 60 -2.222 6.049 -1.774 477 3HE MET 60 3HE MET 60 -3.881 6.021 -1.178 478 H ALA 61 H ALA 61 -5.756 3.480 1.942 479 HA ALA 61 HA ALA 61 -5.708 1.122 3.724 480 1HB ALA 61 1HB ALA 61 -6.889 1.976 1.123 481 2HB ALA 61 2HB ALA 61 -7.639 1.101 2.458 482 3HB ALA 61 3HB ALA 61 -6.604 0.246 1.314 483 H LEU 62 H LEU 62 -3.423 0.717 3.908 484 HA LEU 62 HA LEU 62 -1.403 -0.321 3.276 485 1HB LEU 62 1HB LEU 62 -0.855 0.450 0.766 486 2HB LEU 62 2HB LEU 62 -2.213 1.533 1.068 487 HG LEU 62 HG LEU 62 -1.024 2.139 3.267 488 1HD1 LEU 62 1HD1 LEU 62 0.964 0.369 1.933 489 2HD1 LEU 62 2HD1 LEU 62 0.681 0.647 3.651 490 3HD1 LEU 62 3HD1 LEU 62 1.593 1.824 2.706 491 1HD2 LEU 62 1HD2 LEU 62 -0.697 3.063 0.584 492 2HD2 LEU 62 2HD2 LEU 62 0.867 3.183 1.391 493 3HD2 LEU 62 3HD2 LEU 62 -0.545 3.987 2.077 494 H GLY 63 H GLY 63 -3.132 -2.272 3.275 495 1HA GLY 63 1HA GLY 63 -2.325 -4.046 1.185 496 2HA GLY 63 2HA GLY 63 -3.621 -4.365 2.336 497 H PHE 64 H PHE 64 -5.213 -5.106 0.951 498 HA PHE 64 HA PHE 64 -5.812 -3.639 -1.543 499 1HB PHE 64 1HB PHE 64 -6.843 -6.136 -0.163 500 2HB PHE 64 2HB PHE 64 -7.525 -5.545 -1.678 501 HD1 PHE 64 HD1 PHE 64 -6.522 -6.119 -3.724 502 HD2 PHE 64 HD2 PHE 64 -4.268 -6.485 -0.085 503 HE1 PHE 64 HE1 PHE 64 -4.676 -7.201 -4.977 504 HE2 PHE 64 HE2 PHE 64 -2.422 -7.567 -1.338 505 HZ PHE 64 HZ PHE 64 -2.625 -7.925 -3.784 506 H GLY 65 H GLY 65 -6.278 -2.078 0.812 507 1HA GLY 65 1HA GLY 65 -9.160 -2.198 1.384 508 2HA GLY 65 2HA GLY 65 -8.018 -1.035 2.056 509 H ALA 66 H ALA 66 -7.029 -0.579 -0.819 510 HA ALA 66 HA ALA 66 -8.940 1.586 -1.423 511 1HB ALA 66 1HB ALA 66 -7.123 2.216 -3.003 512 2HB ALA 66 2HB ALA 66 -6.305 0.693 -2.657 513 3HB ALA 66 3HB ALA 66 -6.480 1.907 -1.390 514 H ILE 67 H ILE 67 -7.324 -0.923 -3.389 515 HA ILE 67 HA ILE 67 -8.735 -0.784 -5.735 516 HB ILE 67 HB ILE 67 -8.332 -3.312 -5.833 517 1HG1 ILE 67 1HG1 ILE 67 -6.865 -4.138 -3.910 518 2HG1 ILE 67 2HG1 ILE 67 -7.456 -2.763 -2.985 519 1HG2 ILE 67 1HG2 ILE 67 -6.132 -2.914 -6.315 520 2HG2 ILE 67 2HG2 ILE 67 -5.837 -2.092 -4.782 521 3HG2 ILE 67 3HG2 ILE 67 -6.632 -1.235 -6.103 522 1HD1 ILE 67 1HD1 ILE 67 -9.620 -4.214 -4.301 523 2HD1 ILE 67 2HD1 ILE 67 -9.444 -3.758 -2.606 524 3HD1 ILE 67 3HD1 ILE 67 -8.695 -5.237 -3.202 525 H PHE 68 H PHE 68 -10.110 -1.919 -2.692 526 HA PHE 68 HA PHE 68 -12.216 -3.549 -3.519 527 1HB PHE 68 1HB PHE 68 -11.825 -1.470 -1.398 528 2HB PHE 68 2HB PHE 68 -13.436 -2.148 -1.601 529 HD1 PHE 68 HD1 PHE 68 -12.958 -4.914 -2.343 530 HD2 PHE 68 HD2 PHE 68 -10.869 -2.459 0.494 531 HE1 PHE 68 HE1 PHE 68 -12.259 -6.944 -1.102 532 HE2 PHE 68 HE2 PHE 68 -10.169 -4.486 1.735 533 HZ PHE 68 HZ PHE 68 -10.865 -6.731 0.937 534 H ASN 69 H ASN 69 -14.414 -3.120 -4.162 535 HA ASN 69 HA ASN 69 -14.763 -0.473 -5.531 536 1HB ASN 69 1HB ASN 69 -15.407 -3.340 -6.212 537 2HB ASN 69 2HB ASN 69 -16.287 -2.031 -6.997 538 1HD2 ASN 69 1HD2 ASN 69 -15.031 -3.091 -8.947 539 2HD2 ASN 69 2HD2 ASN 69 -13.489 -2.453 -9.274 540 H HIS 70 H HIS 70 -17.361 -0.505 -6.166 541 HA HIS 70 HA HIS 70 -18.766 -0.584 -3.528 542 1HB HIS 70 1HB HIS 70 -18.571 1.550 -4.850 543 2HB HIS 70 2HB HIS 70 -19.471 0.778 -6.155 544 HD1 HIS 70 HD1 HIS 70 -21.590 2.201 -5.967 545 HD2 HIS 70 HD2 HIS 70 -20.542 0.367 -2.374 546 HE1 HIS 70 HE1 HIS 70 -23.548 2.534 -4.395 547 H SER 71 H SER 71 -20.968 -1.493 -3.508 548 HA SER 71 HA SER 71 -21.923 -2.961 -5.866 549 1HB SER 71 1HB SER 71 -20.195 -4.463 -5.054 550 2HB SER 71 2HB SER 71 -20.789 -4.324 -3.399 551 HG SER 71 HG SER 71 -21.812 -6.082 -3.992 552 H LYS 72 H LYS 72 -24.132 -3.363 -5.692 553 HA LYS 72 HA LYS 72 -25.740 -2.025 -3.795 554 1HB LYS 72 1HB LYS 72 -26.327 -4.527 -5.400 555 2HB LYS 72 2HB LYS 72 -27.518 -3.430 -4.727 556 1HG LYS 72 1HG LYS 72 -25.926 -1.689 -6.102 557 2HG LYS 72 2HG LYS 72 -25.809 -3.128 -7.118 558 1HD LYS 72 1HD LYS 72 -27.873 -2.735 -7.917 559 2HD LYS 72 2HD LYS 72 -28.508 -2.857 -6.275 560 1HE LYS 72 1HE LYS 72 -29.117 -0.657 -7.090 561 2HE LYS 72 2HE LYS 72 -27.767 -0.415 -5.965 562 1HZ LYS 72 1HZ LYS 72 -27.410 0.715 -8.111 563 2HZ LYS 72 2HZ LYS 72 -27.497 -0.784 -8.907 564 3HZ LYS 72 3HZ LYS 72 -26.234 -0.474 -7.814 565 H ASP 73 H ASP 73 -24.259 -5.222 -3.667 566 HA ASP 73 HA ASP 73 -25.380 -5.558 -0.904 567 1HB ASP 73 1HB ASP 73 -25.331 -7.309 -3.316 568 2HB ASP 73 2HB ASP 73 -25.016 -8.105 -1.774 569 HA PRO 74 HA PRO 74 -20.792 -5.402 -0.579 570 1HB PRO 74 1HB PRO 74 -21.604 -5.249 2.289 571 2HB PRO 74 2HB PRO 74 -20.459 -4.236 1.391 572 1HG PRO 74 1HG PRO 74 -22.898 -3.366 2.089 573 2HG PRO 74 2HG PRO 74 -22.105 -2.859 0.592 574 1HD PRO 74 1HD PRO 74 -24.360 -4.746 0.992 575 2HD PRO 74 2HD PRO 74 -23.998 -3.686 -0.385 576 H ASN 75 H ASN 75 -20.249 -7.554 -0.991 577 HA ASN 75 HA ASN 75 -21.254 -9.738 0.694 578 1HB ASN 75 1HB ASN 75 -19.159 -9.591 -1.507 579 2HB ASN 75 2HB ASN 75 -19.855 -11.079 -0.865 580 1HD2 ASN 75 1HD2 ASN 75 -20.404 -8.396 -3.039 581 2HD2 ASN 75 2HD2 ASN 75 -21.933 -8.892 -3.585 582 H ALA 76 H ALA 76 -18.463 -7.655 0.608 583 HA ALA 76 HA ALA 76 -17.323 -9.153 2.928 584 1HB ALA 76 1HB ALA 76 -15.090 -8.364 1.566 585 2HB ALA 76 2HB ALA 76 -16.196 -8.650 0.223 586 3HB ALA 76 3HB ALA 76 -15.837 -9.948 1.361 587 H ARG 77 H ARG 77 -16.473 -7.781 4.499 588 HA ARG 77 HA ARG 77 -16.448 -4.849 3.854 589 1HB ARG 77 1HB ARG 77 -18.114 -6.233 5.551 590 2HB ARG 77 2HB ARG 77 -16.836 -5.727 6.655 591 1HG ARG 77 1HG ARG 77 -17.105 -3.396 5.917 592 2HG ARG 77 2HG ARG 77 -18.356 -3.891 4.777 593 1HD ARG 77 1HD ARG 77 -19.932 -3.869 6.410 594 2HD ARG 77 2HD ARG 77 -18.925 -4.880 7.464 595 HE ARG 77 HE ARG 77 -17.675 -2.391 7.486 596 1HH1 ARG 77 1HH1 ARG 77 -20.870 -3.580 8.194 597 2HH1 ARG 77 2HH1 ARG 77 -21.187 -2.351 9.368 598 1HH2 ARG 77 1HH2 ARG 77 -18.110 -0.806 9.015 599 2HH2 ARG 77 2HH2 ARG 77 -19.637 -0.791 9.831 600 H HIS 78 H HIS 78 -15.187 -3.830 6.015 601 HA HIS 78 HA HIS 78 -12.615 -5.359 6.245 602 1HB HIS 78 1HB HIS 78 -11.504 -3.125 5.992 603 2HB HIS 78 2HB HIS 78 -12.445 -3.573 4.569 604 HD1 HIS 78 HD1 HIS 78 -14.915 -2.478 4.435 605 HD2 HIS 78 HD2 HIS 78 -12.302 -0.738 7.178 606 HE1 HIS 78 HE1 HIS 78 -15.898 -0.220 5.028 607 H GLU 79 H GLU 79 -11.231 -4.291 8.072 608 HA GLU 79 HA GLU 79 -12.867 -3.124 10.261 609 1HB GLU 79 1HB GLU 79 -13.060 -5.610 10.380 610 2HB GLU 79 2HB GLU 79 -11.303 -5.728 10.450 611 1HG GLU 79 1HG GLU 79 -11.395 -4.248 12.511 612 2HG GLU 79 2HG GLU 79 -13.146 -4.452 12.487 613 H LEU 80 H LEU 80 -11.601 -1.839 11.624 614 HA LEU 80 HA LEU 80 -8.710 -1.613 10.907 615 1HB LEU 80 1HB LEU 80 -10.903 0.162 11.832 616 2HB LEU 80 2HB LEU 80 -9.316 0.517 12.514 617 HG LEU 80 HG LEU 80 -9.685 0.074 9.551 618 1HD1 LEU 80 1HD1 LEU 80 -10.236 2.524 11.202 619 2HD1 LEU 80 2HD1 LEU 80 -11.128 1.892 9.818 620 3HD1 LEU 80 3HD1 LEU 80 -9.580 2.700 9.574 621 1HD2 LEU 80 1HD2 LEU 80 -7.472 0.461 11.240 622 2HD2 LEU 80 2HD2 LEU 80 -7.709 2.009 10.428 623 3HD2 LEU 80 3HD2 LEU 80 -7.481 0.541 9.478 624 H THR 81 H THR 81 -7.115 -1.870 12.500 625 HA THR 81 HA THR 81 -7.869 -3.387 14.885 626 HB THR 81 HB THR 81 -5.391 -3.436 15.168 627 HG1 THR 81 HG1 THR 81 -4.213 -1.992 14.222 628 1HG2 THR 81 1HG2 THR 81 -6.228 -3.807 12.277 629 2HG2 THR 81 2HG2 THR 81 -6.555 -4.968 13.563 630 3HG2 THR 81 3HG2 THR 81 -4.891 -4.614 13.097 631 H ALA 82 H ALA 82 -9.128 -1.740 16.044 632 HA ALA 82 HA ALA 82 -9.377 0.010 17.611 633 1HB ALA 82 1HB ALA 82 -7.965 -1.416 18.917 634 2HB ALA 82 2HB ALA 82 -7.244 0.188 19.052 635 3HB ALA 82 3HB ALA 82 -6.543 -1.006 17.958 636 H GLY 83 H GLY 83 -9.649 1.828 16.221 637 1HA GLY 83 1HA GLY 83 -9.061 4.030 15.601 638 2HA GLY 83 2HA GLY 83 -7.461 3.753 16.288 639 H LEU 84 H LEU 84 -6.266 4.519 14.522 640 HA LEU 84 HA LEU 84 -6.694 3.143 11.896 641 1HB LEU 84 1HB LEU 84 -6.147 5.850 12.804 642 2HB LEU 84 2HB LEU 84 -4.907 5.326 11.672 643 HG LEU 84 HG LEU 84 -6.560 4.809 9.987 644 1HD1 LEU 84 1HD1 LEU 84 -9.020 5.638 10.805 645 2HD1 LEU 84 2HD1 LEU 84 -8.397 4.963 12.310 646 3HD1 LEU 84 3HD1 LEU 84 -8.492 3.956 10.865 647 1HD2 LEU 84 1HD2 LEU 84 -7.519 7.029 9.612 648 2HD2 LEU 84 2HD2 LEU 84 -5.888 7.196 10.259 649 3HD2 LEU 84 3HD2 LEU 84 -7.283 7.443 11.309 650 H LYS 85 H LYS 85 -5.394 1.283 12.150 651 HA LYS 85 HA LYS 85 -2.463 1.802 12.324 652 1HB LYS 85 1HB LYS 85 -4.202 0.089 14.105 653 2HB LYS 85 2HB LYS 85 -2.503 -0.323 13.872 654 1HG LYS 85 1HG LYS 85 -3.374 2.458 14.672 655 2HG LYS 85 2HG LYS 85 -3.059 1.201 15.868 656 1HD LYS 85 1HD LYS 85 -0.790 1.150 15.419 657 2HD LYS 85 2HD LYS 85 -1.004 1.662 13.745 658 1HE LYS 85 1HE LYS 85 -1.875 3.902 14.915 659 2HE LYS 85 2HE LYS 85 -0.830 3.327 16.227 660 1HZ LYS 85 1HZ LYS 85 0.041 3.356 13.392 661 2HZ LYS 85 2HZ LYS 85 1.005 3.190 14.781 662 3HZ LYS 85 3HZ LYS 85 0.287 4.686 14.418 663 H ARG 86 H ARG 86 -4.882 -0.833 12.018 664 HA ARG 86 HA ARG 86 -3.427 -1.769 9.575 665 1HB ARG 86 1HB ARG 86 -3.604 -2.988 12.177 666 2HB ARG 86 2HB ARG 86 -4.482 -3.996 11.027 667 1HG ARG 86 1HG ARG 86 -2.236 -3.360 9.589 668 2HG ARG 86 2HG ARG 86 -1.588 -3.451 11.226 669 1HD ARG 86 1HD ARG 86 -3.461 -5.636 10.537 670 2HD ARG 86 2HD ARG 86 -1.944 -5.638 9.618 671 HE ARG 86 HE ARG 86 -1.304 -5.085 12.328 672 1HH1 ARG 86 1HH1 ARG 86 -2.608 -7.668 10.393 673 2HH1 ARG 86 2HH1 ARG 86 -2.007 -8.905 11.441 674 1HH2 ARG 86 1HH2 ARG 86 -0.534 -6.710 13.674 675 2HH2 ARG 86 2HH2 ARG 86 -0.842 -8.370 13.285 676 H MET 87 H MET 87 -4.909 -3.517 8.454 677 HA MET 87 HA MET 87 -7.801 -2.899 8.861 678 1HB MET 87 1HB MET 87 -6.013 -2.207 6.590 679 2HB MET 87 2HB MET 87 -7.586 -2.865 6.142 680 1HG MET 87 1HG MET 87 -8.566 -1.169 7.827 681 2HG MET 87 2HG MET 87 -6.987 -0.386 7.761 682 1HE MET 87 1HE MET 87 -8.964 -2.232 4.675 683 2HE MET 87 2HE MET 87 -10.122 -0.912 4.505 684 3HE MET 87 3HE MET 87 -9.953 -1.742 6.051 685 H ARG 88 H ARG 88 -8.964 -4.774 8.785 686 HA ARG 88 HA ARG 88 -7.729 -7.144 7.427 687 1HB ARG 88 1HB ARG 88 -9.716 -6.951 9.714 688 2HB ARG 88 2HB ARG 88 -9.029 -8.444 9.080 689 1HG ARG 88 1HG ARG 88 -6.879 -7.944 9.891 690 2HG ARG 88 2HG ARG 88 -7.241 -6.225 10.052 691 1HD ARG 88 1HD ARG 88 -8.943 -6.859 11.832 692 2HD ARG 88 2HD ARG 88 -8.265 -8.497 11.781 693 HE ARG 88 HE ARG 88 -6.237 -6.401 12.034 694 1HH1 ARG 88 1HH1 ARG 88 -8.431 -8.519 13.716 695 2HH1 ARG 88 2HH1 ARG 88 -7.512 -8.486 15.181 696 1HH2 ARG 88 1HH2 ARG 88 -5.063 -6.375 13.947 697 2HH2 ARG 88 2HH2 ARG 88 -5.620 -7.282 15.313 698 H ILE 89 H ILE 89 -8.999 -8.227 5.898 699 HA ILE 89 HA ILE 89 -11.591 -6.936 5.190 700 HB ILE 89 HB ILE 89 -9.697 -8.837 3.762 701 1HG1 ILE 89 1HG1 ILE 89 -10.335 -6.144 2.710 702 2HG1 ILE 89 2HG1 ILE 89 -9.420 -6.163 4.215 703 1HG2 ILE 89 1HG2 ILE 89 -12.117 -7.424 2.611 704 2HG2 ILE 89 2HG2 ILE 89 -12.156 -9.099 3.162 705 3HG2 ILE 89 3HG2 ILE 89 -11.105 -8.635 1.823 706 1HD1 ILE 89 1HD1 ILE 89 -8.103 -8.086 2.808 707 2HD1 ILE 89 2HD1 ILE 89 -7.625 -6.389 2.828 708 3HD1 ILE 89 3HD1 ILE 89 -8.605 -7.014 1.500 709 H PHE 90 H PHE 90 -13.285 -7.913 6.238 710 HA PHE 90 HA PHE 90 -13.196 -10.866 6.682 711 1HB PHE 90 1HB PHE 90 -14.434 -8.464 7.961 712 2HB PHE 90 2HB PHE 90 -15.316 -9.984 8.097 713 HD1 PHE 90 HD1 PHE 90 -14.112 -12.019 9.040 714 HD2 PHE 90 HD2 PHE 90 -12.510 -8.040 9.274 715 HE1 PHE 90 HE1 PHE 90 -12.579 -12.743 10.851 716 HE2 PHE 90 HE2 PHE 90 -10.977 -8.763 11.084 717 HZ PHE 90 HZ PHE 90 -11.011 -11.114 11.873 718 H THR 91 H THR 91 -15.449 -11.914 6.510 719 HA THR 91 HA THR 91 -16.866 -10.854 4.086 720 HB THR 91 HB THR 91 -17.359 -13.292 3.694 721 HG1 THR 91 HG1 THR 91 -16.880 -14.672 5.187 722 1HG2 THR 91 1HG2 THR 91 -15.459 -12.370 2.543 723 2HG2 THR 91 2HG2 THR 91 -14.951 -13.926 3.199 724 3HG2 THR 91 3HG2 THR 91 -14.471 -12.432 4.003 725 H ILE 92 H ILE 92 -18.875 -10.094 4.633 726 HA ILE 92 HA ILE 92 -20.143 -10.928 7.159 727 HB ILE 92 HB ILE 92 -21.692 -9.113 6.621 728 1HG1 ILE 92 1HG1 ILE 92 -20.351 -9.098 3.896 729 2HG1 ILE 92 2HG1 ILE 92 -22.006 -9.605 4.231 730 1HG2 ILE 92 1HG2 ILE 92 -19.557 -8.386 7.498 731 2HG2 ILE 92 2HG2 ILE 92 -20.028 -7.262 6.223 732 3HG2 ILE 92 3HG2 ILE 92 -18.811 -8.499 5.904 733 1HD1 ILE 92 1HD1 ILE 92 -22.709 -7.471 4.104 734 2HD1 ILE 92 2HD1 ILE 92 -21.067 -6.974 3.693 735 3HD1 ILE 92 3HD1 ILE 92 -21.583 -7.006 5.379 736 H LYS 93 H LYS 93 -19.943 -12.588 4.432 737 HA LYS 93 HA LYS 93 -22.348 -14.097 4.855 738 1HB LYS 93 1HB LYS 93 -23.461 -13.400 2.686 739 2HB LYS 93 2HB LYS 93 -23.427 -12.133 3.911 740 1HG LYS 93 1HG LYS 93 -21.914 -10.855 2.743 741 2HG LYS 93 2HG LYS 93 -21.110 -12.257 2.040 742 1HD LYS 93 1HD LYS 93 -22.225 -11.387 0.184 743 2HD LYS 93 2HD LYS 93 -23.395 -12.569 0.771 744 1HE LYS 93 1HE LYS 93 -24.422 -10.654 2.142 745 2HE LYS 93 2HE LYS 93 -23.429 -9.564 1.156 746 1HZ LYS 93 1HZ LYS 93 -25.675 -10.045 0.207 747 2HZ LYS 93 2HZ LYS 93 -25.203 -11.667 0.029 748 3HZ LYS 93 3HZ LYS 93 -24.388 -10.447 -0.826 749 HA PRO 94 HA PRO 94 -19.886 -17.113 2.816 750 1HB PRO 94 1HB PRO 94 -22.458 -17.933 1.665 751 2HB PRO 94 2HB PRO 94 -21.205 -18.927 2.404 752 1HG PRO 94 1HG PRO 94 -23.354 -18.294 3.746 753 2HG PRO 94 2HG PRO 94 -21.799 -18.275 4.535 754 1HD PRO 94 1HD PRO 94 -23.512 -16.010 3.646 755 2HD PRO 94 2HD PRO 94 -22.429 -16.130 5.047 756 H ILE 95 H ILE 95 -18.755 -17.050 0.852 757 HA ILE 95 HA ILE 95 -20.051 -15.516 -1.379 758 HB ILE 95 HB ILE 95 -17.125 -15.876 -0.630 759 1HG1 ILE 95 1HG1 ILE 95 -18.977 -13.500 -0.271 760 2HG1 ILE 95 2HG1 ILE 95 -18.409 -14.551 1.026 761 1HG2 ILE 95 1HG2 ILE 95 -18.266 -15.141 -3.068 762 2HG2 ILE 95 2HG2 ILE 95 -16.606 -14.827 -2.561 763 3HG2 ILE 95 3HG2 ILE 95 -17.851 -13.604 -2.309 764 1HD1 ILE 95 1HD1 ILE 95 -16.209 -13.570 -0.622 765 2HD1 ILE 95 2HD1 ILE 95 -16.416 -13.491 1.128 766 3HD1 ILE 95 3HD1 ILE 95 -17.131 -12.250 0.098 767 H ALA 96 H ALA 96 -20.041 -16.447 -3.422 768 HA ALA 96 HA ALA 96 -19.278 -19.299 -3.605 769 1HB ALA 96 1HB ALA 96 -21.180 -17.451 -4.755 770 2HB ALA 96 2HB ALA 96 -21.169 -19.212 -4.852 771 3HB ALA 96 3HB ALA 96 -20.291 -18.257 -6.047 772 H ILE 97 H ILE 97 -17.855 -20.082 -5.264 773 HA ILE 97 HA ILE 97 -15.429 -18.773 -5.674 774 HB ILE 97 HB ILE 97 -16.937 -20.761 -7.414 775 1HG1 ILE 97 1HG1 ILE 97 -14.804 -21.919 -5.928 776 2HG1 ILE 97 2HG1 ILE 97 -15.735 -20.919 -4.812 777 1HG2 ILE 97 1HG2 ILE 97 -14.077 -21.063 -7.481 778 2HG2 ILE 97 2HG2 ILE 97 -14.493 -19.412 -7.940 779 3HG2 ILE 97 3HG2 ILE 97 -15.182 -20.773 -8.824 780 1HD1 ILE 97 1HD1 ILE 97 -17.410 -22.490 -6.647 781 2HD1 ILE 97 2HD1 ILE 97 -17.529 -22.306 -4.897 782 3HD1 ILE 97 3HD1 ILE 97 -16.411 -23.483 -5.586 783 H GLY 98 H GLY 98 -18.440 -18.235 -7.376 784 1HA GLY 98 1HA GLY 98 -16.984 -16.544 -9.360 785 2HA GLY 98 2HA GLY 98 -18.580 -17.242 -9.633 786 H GLU 99 H GLU 99 -17.074 -15.222 -7.060 787 HA GLU 99 HA GLU 99 -19.444 -13.392 -7.353 788 1HB GLU 99 1HB GLU 99 -18.157 -14.746 -5.026 789 2HB GLU 99 2HB GLU 99 -18.722 -13.096 -4.761 790 1HG GLU 99 1HG GLU 99 -20.393 -15.377 -5.861 791 2HG GLU 99 2HG GLU 99 -20.489 -14.737 -4.220 792 H GLU 100 H GLU 100 -18.874 -11.188 -6.215 793 HA GLU 100 HA GLU 100 -16.060 -10.445 -6.947 794 1HB GLU 100 1HB GLU 100 -18.159 -9.668 -8.344 795 2HB GLU 100 2HB GLU 100 -18.407 -8.548 -7.004 796 1HG GLU 100 1HG GLU 100 -15.702 -8.285 -7.513 797 2HG GLU 100 2HG GLU 100 -16.373 -8.505 -9.128 798 H ILE 101 H ILE 101 -14.915 -9.585 -5.281 799 HA ILE 101 HA ILE 101 -16.304 -9.036 -2.726 800 HB ILE 101 HB ILE 101 -13.353 -9.034 -3.446 801 1HG1 ILE 101 1HG1 ILE 101 -15.116 -11.291 -2.449 802 2HG1 ILE 101 2HG1 ILE 101 -14.367 -11.184 -4.033 803 1HG2 ILE 101 1HG2 ILE 101 -12.931 -8.849 -1.214 804 2HG2 ILE 101 2HG2 ILE 101 -14.316 -9.847 -0.775 805 3HG2 ILE 101 3HG2 ILE 101 -14.546 -8.142 -1.166 806 1HD1 ILE 101 1HD1 ILE 101 -12.437 -12.030 -3.246 807 2HD1 ILE 101 2HD1 ILE 101 -13.242 -12.302 -1.701 808 3HD1 ILE 101 3HD1 ILE 101 -12.370 -10.796 -1.988 809 H THR 102 H THR 102 -16.932 -6.993 -2.296 810 HA THR 102 HA THR 102 -15.165 -4.711 -2.955 811 HB THR 102 HB THR 102 -17.025 -3.579 -4.128 812 HG1 THR 102 HG1 THR 102 -18.815 -4.432 -3.246 813 1HG2 THR 102 1HG2 THR 102 -16.942 -4.833 -6.154 814 2HG2 THR 102 2HG2 THR 102 -16.734 -6.354 -5.286 815 3HG2 THR 102 3HG2 THR 102 -15.425 -5.174 -5.322 816 H ILE 103 H ILE 103 -15.127 -3.478 -1.112 817 HA ILE 103 HA ILE 103 -17.207 -3.877 0.950 818 HB ILE 103 HB ILE 103 -15.612 -2.572 2.314 819 1HG1 ILE 103 1HG1 ILE 103 -13.450 -2.311 0.460 820 2HG1 ILE 103 2HG1 ILE 103 -14.871 -1.542 -0.246 821 1HG2 ILE 103 1HG2 ILE 103 -14.912 -4.956 0.774 822 2HG2 ILE 103 2HG2 ILE 103 -14.667 -4.619 2.488 823 3HG2 ILE 103 3HG2 ILE 103 -13.488 -4.059 1.301 824 1HD1 ILE 103 1HD1 ILE 103 -15.197 -0.404 2.027 825 2HD1 ILE 103 2HD1 ILE 103 -13.821 0.149 1.073 826 3HD1 ILE 103 3HD1 ILE 103 -13.570 -0.958 2.422 827 H SER 104 H SER 104 -18.276 -2.023 1.959 828 HA SER 104 HA SER 104 -19.209 -0.077 -0.031 829 1HB SER 104 1HB SER 104 -20.950 0.212 1.503 830 2HB SER 104 2HB SER 104 -20.425 -1.417 1.912 831 HG SER 104 HG SER 104 -20.064 -0.659 3.818 832 H TYR 105 H TYR 105 -19.678 2.104 1.774 833 HA TYR 105 HA TYR 105 -16.912 2.993 2.496 834 1HB TYR 105 1HB TYR 105 -18.983 4.555 0.906 835 2HB TYR 105 2HB TYR 105 -17.352 5.096 1.302 836 HD1 TYR 105 HD1 TYR 105 -15.587 2.951 0.770 837 HD2 TYR 105 HD2 TYR 105 -19.174 4.000 -1.348 838 HE1 TYR 105 HE1 TYR 105 -14.718 1.823 -1.261 839 HE2 TYR 105 HE2 TYR 105 -18.306 2.872 -3.378 840 HH TYR 105 HH TYR 105 -15.017 1.736 -3.584 841 H GLY 106 H GLY 106 -20.194 4.441 2.429 842 1HA GLY 106 1HA GLY 106 -20.929 4.324 5.078 843 2HA GLY 106 2HA GLY 106 -19.764 5.648 5.054 844 H ASP 107 H ASP 107 -21.737 6.930 5.703 845 HA ASP 107 HA ASP 107 -23.902 7.318 3.811 846 1HB ASP 107 1HB ASP 107 -23.118 8.077 6.461 847 2HB ASP 107 2HB ASP 107 -23.518 9.548 5.575 848 H ASP 108 H ASP 108 -20.753 8.814 4.324 849 HA ASP 108 HA ASP 108 -21.278 11.150 2.664 850 1HB ASP 108 1HB ASP 108 -18.803 9.786 3.774 851 2HB ASP 108 2HB ASP 108 -18.737 11.304 2.879 852 H TYR 109 H TYR 109 -18.821 8.605 2.124 853 HA TYR 109 HA TYR 109 -18.579 9.027 -0.673 854 1HB TYR 109 1HB TYR 109 -17.825 7.060 1.383 855 2HB TYR 109 2HB TYR 109 -17.985 6.353 -0.224 856 HD1 TYR 109 HD1 TYR 109 -16.898 9.787 0.798 857 HD2 TYR 109 HD2 TYR 109 -15.791 6.053 -1.014 858 HE1 TYR 109 HE1 TYR 109 -14.704 10.749 0.157 859 HE2 TYR 109 HE2 TYR 109 -13.597 7.015 -1.656 860 HH TYR 109 HH TYR 109 -12.144 9.217 -0.485 861 H TRP 110 H TRP 110 -20.568 9.066 -1.799 862 HA TRP 110 HA TRP 110 -22.508 8.185 -2.823 863 1HB TRP 110 1HB TRP 110 -20.554 5.940 -2.429 864 2HB TRP 110 2HB TRP 110 -22.162 5.548 -3.037 865 HD1 TRP 110 HD1 TRP 110 -19.526 8.287 -3.818 866 HE1 TRP 110 HE1 TRP 110 -19.384 8.544 -6.379 867 HE3 TRP 110 HE3 TRP 110 -22.997 4.825 -5.246 868 HZ2 TRP 110 HZ2 TRP 110 -20.584 7.429 -8.724 869 HZ3 TRP 110 HZ3 TRP 110 -23.478 4.443 -7.646 870 HH2 TRP 110 HH2 TRP 110 -22.277 5.738 -9.386 871 H LEU 111 H LEU 111 -24.080 6.036 -2.426 872 HA LEU 111 HA LEU 111 -25.387 6.537 0.078 873 1HB LEU 111 1HB LEU 111 -26.312 5.631 -2.127 874 2HB LEU 111 2HB LEU 111 -25.597 4.079 -1.691 875 HG LEU 111 HG LEU 111 -26.887 4.192 0.477 876 1HD1 LEU 111 1HD1 LEU 111 -27.898 6.673 -0.890 877 2HD1 LEU 111 2HD1 LEU 111 -27.420 6.451 0.793 878 3HD1 LEU 111 3HD1 LEU 111 -28.949 5.788 0.215 879 1HD2 LEU 111 1HD2 LEU 111 -27.652 3.252 -1.953 880 2HD2 LEU 111 2HD2 LEU 111 -28.961 4.390 -1.635 881 3HD2 LEU 111 3HD2 LEU 111 -28.634 3.081 -0.498 882 H SER 112 H SER 112 -25.628 5.019 1.878 883 HA SER 112 HA SER 112 -23.142 3.431 2.352 884 1HB SER 112 1HB SER 112 -24.115 5.383 3.820 885 2HB SER 112 2HB SER 112 -25.241 4.154 4.395 886 HG SER 112 HG SER 112 -23.607 3.858 5.732 887 H ARG 113 H ARG 113 -26.684 3.224 2.876 888 HA ARG 113 HA ARG 113 -26.414 0.258 3.017 889 1HB ARG 113 1HB ARG 113 -27.482 1.798 4.834 890 2HB ARG 113 2HB ARG 113 -28.844 1.909 3.718 891 1HG ARG 113 1HG ARG 113 -29.290 -0.406 3.849 892 2HG ARG 113 2HG ARG 113 -27.694 -0.767 4.507 893 1HD ARG 113 1HD ARG 113 -28.632 0.934 6.422 894 2HD ARG 113 2HD ARG 113 -30.141 0.157 5.905 895 HE ARG 113 HE ARG 113 -27.918 -1.161 7.266 896 1HH1 ARG 113 1HH1 ARG 113 -30.561 -1.559 5.037 897 2HH1 ARG 113 2HH1 ARG 113 -30.714 -3.254 5.350 898 1HH2 ARG 113 1HH2 ARG 113 -28.134 -3.361 7.655 899 2HH2 ARG 113 2HH2 ARG 113 -29.351 -4.268 6.820 900 HA PRO 114 HA PRO 114 -28.338 1.228 -1.108 901 1HB PRO 114 1HB PRO 114 -26.938 -0.743 -2.457 902 2HB PRO 114 2HB PRO 114 -26.381 0.932 -2.298 903 1HG PRO 114 1HG PRO 114 -25.562 -1.495 -0.786 904 2HG PRO 114 2HG PRO 114 -24.590 -0.118 -1.323 905 1HD PRO 114 1HD PRO 114 -25.440 -0.446 1.242 906 2HD PRO 114 2HD PRO 114 -25.139 1.143 0.510 907 H ARG 115 H ARG 115 -29.907 0.022 0.628 908 HA ARG 115 HA ARG 115 -30.255 -2.847 0.044 909 1HB ARG 115 1HB ARG 115 -30.681 -1.210 2.199 910 2HB ARG 115 2HB ARG 115 -32.311 -1.315 1.533 911 1HG ARG 115 1HG ARG 115 -31.991 -3.128 3.132 912 2HG ARG 115 2HG ARG 115 -32.085 -3.807 1.508 913 1HD ARG 115 1HD ARG 115 -29.770 -4.250 1.425 914 2HD ARG 115 2HD ARG 115 -29.412 -3.088 2.716 915 HE ARG 115 HE ARG 115 -30.016 -4.748 4.297 916 1HH1 ARG 115 1HH1 ARG 115 -31.172 -5.573 1.119 917 2HH1 ARG 115 2HH1 ARG 115 -31.718 -7.140 1.605 918 1HH2 ARG 115 1HH2 ARG 115 -30.731 -6.787 4.903 919 2HH2 ARG 115 2HH2 ARG 115 -31.470 -7.825 3.730 920 H LEU 116 H LEU 116 -30.990 -0.178 -1.727 921 HA LEU 116 HA LEU 116 -32.622 0.306 -3.359 922 1HB LEU 116 1HB LEU 116 -32.679 -2.715 -3.065 923 2HB LEU 116 2HB LEU 116 -33.605 -1.883 -4.310 924 HG LEU 116 HG LEU 116 -31.513 -2.575 -5.296 925 1HD1 LEU 116 1HD1 LEU 116 -30.676 0.204 -4.857 926 2HD1 LEU 116 2HD1 LEU 116 -32.382 0.045 -5.276 927 3HD1 LEU 116 3HD1 LEU 116 -31.145 -0.606 -6.351 928 1HD2 LEU 116 1HD2 LEU 116 -29.477 -2.498 -4.263 929 2HD2 LEU 116 2HD2 LEU 116 -30.468 -2.452 -2.805 930 3HD2 LEU 116 3HD2 LEU 116 -29.818 -0.957 -3.477 931 H THR 117 H THR 117 -35.119 -0.449 -3.885 932 HA THR 117 HA THR 117 -37.346 -0.270 -3.126 933 HB THR 117 HB THR 117 -36.092 -1.751 -0.783 934 HG1 THR 117 HG1 THR 117 -37.393 -2.793 -3.067 935 1HG2 THR 117 1HG2 THR 117 -38.239 -1.219 -0.045 936 2HG2 THR 117 2HG2 THR 117 -38.527 -2.754 -0.864 937 3HG2 THR 117 3HG2 THR 117 -38.912 -1.237 -1.675 938 H GLN 118 H GLN 118 -37.757 1.892 -2.695 939 HA GLN 118 HA GLN 118 -38.106 3.842 -1.418 940 1HB GLN 118 1HB GLN 118 -38.329 1.509 0.322 941 2HB GLN 118 2HB GLN 118 -37.784 2.925 1.219 942 1HG GLN 118 1HG GLN 118 -39.958 3.480 -0.690 943 2HG GLN 118 2HG GLN 118 -40.409 2.379 0.611 944 1HE2 GLN 118 1HE2 GLN 118 -40.778 3.297 2.667 945 2HE2 GLN 118 2HE2 GLN 118 -40.467 4.920 3.054 946 H ASN 119 H ASN 119 -35.955 2.323 0.963 947 HA ASN 119 HA ASN 119 -34.186 4.655 0.902 948 1HB ASN 119 1HB ASN 119 -34.941 3.131 2.875 949 2HB ASN 119 2HB ASN 119 -33.708 2.012 2.294 950 1HD2 ASN 119 1HD2 ASN 119 -31.614 2.386 3.060 951 2HD2 ASN 119 2HD2 ASN 119 -31.083 3.838 3.760 952 1H GLY 201 1H GLY 201 -17.408 22.273 -13.511 953 2H GLY 201 2H GLY 201 -19.016 22.592 -13.955 954 3H GLY 201 3H GLY 201 -17.930 21.953 -15.095 955 1HA GLY 201 1HA GLY 201 -19.238 20.141 -14.438 956 2HA GLY 201 2HA GLY 201 -17.705 19.964 -13.585 957 H LYS 202 H LYS 202 -17.802 19.799 -11.386 958 HA LYS 202 HA LYS 202 -20.442 20.042 -10.078 959 1HB LYS 202 1HB LYS 202 -18.190 18.394 -9.882 960 2HB LYS 202 2HB LYS 202 -18.118 19.382 -8.423 961 1HG LYS 202 1HG LYS 202 -20.667 18.817 -8.226 962 2HG LYS 202 2HG LYS 202 -20.279 17.489 -9.319 963 1HD LYS 202 1HD LYS 202 -19.164 16.339 -7.709 964 2HD LYS 202 2HD LYS 202 -18.379 17.792 -7.091 965 1HE LYS 202 1HE LYS 202 -19.858 16.995 -5.347 966 2HE LYS 202 2HE LYS 202 -20.644 18.415 -6.063 967 1HZ LYS 202 1HZ LYS 202 -22.174 16.526 -5.933 968 2HZ LYS 202 2HZ LYS 202 -21.110 15.585 -6.863 969 3HZ LYS 202 3HZ LYS 202 -21.862 16.944 -7.549 970 H ALA 203 H ALA 203 -20.684 22.372 -10.025 971 HA ALA 203 HA ALA 203 -20.398 24.526 -9.097 972 1HB ALA 203 1HB ALA 203 -19.420 22.552 -7.032 973 2HB ALA 203 2HB ALA 203 -20.913 23.490 -7.036 974 3HB ALA 203 3HB ALA 203 -19.375 24.282 -6.693 975 HA PRO 204 HA PRO 204 -15.853 24.279 -10.406 976 1HB PRO 204 1HB PRO 204 -16.238 26.114 -12.488 977 2HB PRO 204 2HB PRO 204 -16.167 24.354 -12.682 978 1HG PRO 204 1HG PRO 204 -18.520 26.158 -12.567 979 2HG PRO 204 2HG PRO 204 -18.280 24.671 -13.494 980 1HD PRO 204 1HD PRO 204 -19.807 24.783 -11.259 981 2HD PRO 204 2HD PRO 204 -18.912 23.326 -11.740 982 H ARG 205 H ARG 205 -17.675 27.278 -11.109 983 HA ARG 205 HA ARG 205 -17.396 29.466 -10.287 984 1HB ARG 205 1HB ARG 205 -16.882 27.624 -7.955 985 2HB ARG 205 2HB ARG 205 -16.759 29.370 -7.744 986 1HG ARG 205 1HG ARG 205 -19.141 28.878 -9.215 987 2HG ARG 205 2HG ARG 205 -19.127 27.743 -7.866 988 1HD ARG 205 1HD ARG 205 -18.523 30.689 -7.485 989 2HD ARG 205 2HD ARG 205 -20.167 30.034 -7.368 990 HE ARG 205 HE ARG 205 -18.017 29.607 -5.441 991 1HH1 ARG 205 1HH1 ARG 205 -20.884 28.255 -6.880 992 2HH1 ARG 205 2HH1 ARG 205 -21.222 27.242 -5.519 993 1HH2 ARG 205 1HH2 ARG 205 -18.477 28.283 -3.688 994 2HH2 ARG 205 2HH2 ARG 205 -19.871 27.256 -3.725 995 H LYS 206 H LYS 206 -14.828 28.217 -8.193 996 HA LYS 206 HA LYS 206 -12.747 29.285 -10.025 997 1HB LYS 206 1HB LYS 206 -13.383 30.281 -7.225 998 2HB LYS 206 2HB LYS 206 -11.909 30.700 -8.097 999 1HG LYS 206 1HG LYS 206 -13.461 31.492 -9.992 1000 2HG LYS 206 2HG LYS 206 -14.762 31.400 -8.804 1001 1HD LYS 206 1HD LYS 206 -12.239 32.859 -8.089 1002 2HD LYS 206 2HD LYS 206 -13.421 33.654 -9.129 1003 1HE LYS 206 1HE LYS 206 -14.661 34.154 -7.300 1004 2HE LYS 206 2HE LYS 206 -14.835 32.422 -6.956 1005 1HZ LYS 206 1HZ LYS 206 -12.439 34.052 -6.276 1006 2HZ LYS 206 2HZ LYS 206 -12.710 32.427 -5.860 1007 3HZ LYS 206 3HZ LYS 206 -13.664 33.652 -5.170 1008 H GLN 207 H GLN 207 -13.034 28.311 -6.581 1009 HA GLN 207 HA GLN 207 -10.835 26.331 -7.084 1010 1HB GLN 207 1HB GLN 207 -11.581 27.987 -4.646 1011 2HB GLN 207 2HB GLN 207 -10.294 26.781 -4.667 1012 1HG GLN 207 1HG GLN 207 -9.634 28.251 -6.862 1013 2HG GLN 207 2HG GLN 207 -10.360 29.497 -5.847 1014 1HE2 GLN 207 1HE2 GLN 207 -8.119 30.405 -5.600 1015 2HE2 GLN 207 2HE2 GLN 207 -7.047 29.687 -4.496 1016 H LEU 208 H LEU 208 -10.910 24.587 -5.220 1017 HA LEU 208 HA LEU 208 -13.643 23.924 -4.311 1018 1HB LEU 208 1HB LEU 208 -13.177 23.177 -6.769 1019 2HB LEU 208 2HB LEU 208 -12.130 21.959 -6.040 1020 HG LEU 208 HG LEU 208 -14.233 21.504 -4.511 1021 1HD1 LEU 208 1HD1 LEU 208 -15.951 22.883 -5.060 1022 2HD1 LEU 208 2HD1 LEU 208 -16.166 21.819 -6.451 1023 3HD1 LEU 208 3HD1 LEU 208 -15.230 23.305 -6.613 1024 1HD2 LEU 208 1HD2 LEU 208 -13.260 19.872 -6.065 1025 2HD2 LEU 208 2HD2 LEU 208 -14.073 20.655 -7.420 1026 3HD2 LEU 208 3HD2 LEU 208 -15.020 19.838 -6.177 1027 H ALA 209 H ALA 209 -11.818 24.440 -2.495 1028 HA ALA 209 HA ALA 209 -10.958 21.762 -1.497 1029 1HB ALA 209 1HB ALA 209 -9.214 23.358 -2.768 1030 2HB ALA 209 2HB ALA 209 -8.728 22.407 -1.365 1031 3HB ALA 209 3HB ALA 209 -9.129 24.114 -1.177 1032 H THR 210 H THR 210 -13.014 22.396 -0.211 1033 HA THR 210 HA THR 210 -12.305 24.248 2.040 1034 HB THR 210 HB THR 210 -14.766 24.514 2.230 1035 HG1 THR 210 HG1 THR 210 -14.904 22.906 -0.092 1036 1HG2 THR 210 1HG2 THR 210 -13.339 25.857 0.579 1037 2HG2 THR 210 2HG2 THR 210 -15.072 25.819 0.256 1038 3HG2 THR 210 3HG2 THR 210 -13.978 24.797 -0.677 1039 H LYS 211 H LYS 211 -14.378 21.380 1.424 1040 HA LYS 211 HA LYS 211 -13.146 19.847 3.568 1041 1HB LYS 211 1HB LYS 211 -15.175 19.948 5.045 1042 2HB LYS 211 2HB LYS 211 -14.386 21.516 4.873 1043 1HG LYS 211 1HG LYS 211 -16.115 22.403 3.658 1044 2HG LYS 211 2HG LYS 211 -16.475 20.872 2.860 1045 1HD LYS 211 1HD LYS 211 -18.292 21.512 4.407 1046 2HD LYS 211 2HD LYS 211 -17.502 20.028 4.940 1047 1HE LYS 211 1HE LYS 211 -16.804 21.000 6.875 1048 2HE LYS 211 2HE LYS 211 -16.214 22.436 6.017 1049 1HZ LYS 211 1HZ LYS 211 -18.067 23.123 7.315 1050 2HZ LYS 211 2HZ LYS 211 -19.012 21.809 6.799 1051 3HZ LYS 211 3HZ LYS 211 -18.611 23.048 5.708 1052 H ALA 212 H ALA 212 -13.974 17.680 3.607 1053 HA ALA 212 HA ALA 212 -16.371 16.877 2.199 1054 1HB ALA 212 1HB ALA 212 -15.255 17.398 0.191 1055 2HB ALA 212 2HB ALA 212 -14.883 15.685 0.381 1056 3HB ALA 212 3HB ALA 212 -13.686 16.901 0.826 1057 H ALA 213 H ALA 213 -16.857 15.231 3.611 1058 HA ALA 213 HA ALA 213 -15.042 13.716 5.161 1059 1HB ALA 213 1HB ALA 213 -17.435 13.838 5.598 1060 2HB ALA 213 2HB ALA 213 -17.027 12.147 5.305 1061 3HB ALA 213 3HB ALA 213 -17.799 13.101 4.037 1062 H ARG 214 H ARG 214 -14.409 11.435 4.896 1063 HA ARG 214 HA ARG 214 -14.107 10.654 2.014 1064 1HB ARG 214 1HB ARG 214 -12.305 10.090 4.401 1065 2HB ARG 214 2HB ARG 214 -11.948 9.707 2.717 1066 1HG ARG 214 1HG ARG 214 -12.327 12.262 2.316 1067 2HG ARG 214 2HG ARG 214 -12.069 12.401 4.054 1068 1HD ARG 214 1HD ARG 214 -9.980 10.777 3.371 1069 2HD ARG 214 2HD ARG 214 -10.123 11.773 1.911 1070 HE ARG 214 HE ARG 214 -9.302 12.718 4.540 1071 1HH1 ARG 214 1HH1 ARG 214 -10.965 13.572 1.603 1072 2HH1 ARG 214 2HH1 ARG 214 -10.663 15.264 1.794 1073 1HH2 ARG 214 1HH2 ARG 214 -8.922 14.919 4.765 1074 2HH2 ARG 214 2HH2 ARG 214 -9.515 16.023 3.570 1075 1HN MLZ 215 1HN MLZ 215 -12.936 8.056 2.955 1076 HA MLZ 215 HA MLZ 215 -15.254 6.427 2.890 1077 1HB MLZ 215 1HB MLZ 215 -12.385 6.207 3.200 1078 2HB MLZ 215 2HB MLZ 215 -13.183 5.077 4.293 1079 1HG MLZ 215 1HG MLZ 215 -14.585 4.949 1.829 1080 2HG MLZ 215 2HG MLZ 215 -13.557 3.709 2.545 1081 1HD MLZ 215 1HD MLZ 215 -12.350 6.015 1.025 1082 2HD MLZ 215 2HD MLZ 215 -11.655 4.429 1.358 1083 1HE MLZ 215 1HE MLZ 215 -13.550 5.248 -0.786 1084 2HE MLZ 215 2HE MLZ 215 -13.841 3.662 -0.046 1085 HZ MLZ 215 HZ MLZ 215 -11.705 2.943 -0.559 1086 1HCM MLZ 215 1HCM MLZ 215 -12.427 4.771 -2.789 1087 2HCM MLZ 215 2HCM MLZ 215 -13.089 3.160 -2.543 1088 3HCM MLZ 215 3HCM MLZ 215 -11.380 3.362 -2.908 1089 H SER 216 H SER 216 -16.835 6.331 4.432 1090 HA SER 216 HA SER 216 -17.864 6.197 6.553 1091 1HB SER 216 1HB SER 216 -15.961 7.703 8.070 1092 2HB SER 216 2HB SER 216 -16.003 8.386 6.445 1093 HG SER 216 HG SER 216 -17.596 9.258 7.888 1094 H ALA 217 H ALA 217 -15.466 4.371 5.799 1095 HA ALA 217 HA ALA 217 -14.329 2.589 6.847 1096 1HB ALA 217 1HB ALA 217 -12.675 3.599 8.022 1097 2HB ALA 217 2HB ALA 217 -13.786 3.940 9.348 1098 3HB ALA 217 3HB ALA 217 -13.628 5.082 8.013 1099 HA PRO 218 HA PRO 218 -16.760 0.386 9.758 1100 1HB PRO 218 1HB PRO 218 -14.713 0.409 11.911 1101 2HB PRO 218 2HB PRO 218 -15.431 -0.971 11.062 1102 1HG PRO 218 1HG PRO 218 -12.905 -0.162 10.627 1103 2HG PRO 218 2HG PRO 218 -13.907 -0.882 9.359 1104 1HD PRO 218 1HD PRO 218 -13.136 1.960 9.780 1105 2HD PRO 218 2HD PRO 218 -13.419 1.073 8.267 1106 H ALA 219 H ALA 219 -16.965 0.444 12.561 1107 HA ALA 219 HA ALA 219 -17.063 3.187 13.555 1108 1HB ALA 219 1HB ALA 219 -19.046 3.664 12.544 1109 2HB ALA 219 2HB ALA 219 -19.777 2.503 13.652 1110 3HB ALA 219 3HB ALA 219 -19.265 1.987 12.045 1111 H THR 220 H THR 220 -16.797 2.965 15.740 1112 HA THR 220 HA THR 220 -17.952 0.530 17.061 1113 HB THR 220 HB THR 220 -15.884 0.629 18.490 1114 HG1 THR 220 HG1 THR 220 -14.308 2.060 17.980 1115 1HG2 THR 220 1HG2 THR 220 -14.453 0.447 16.051 1116 2HG2 THR 220 2HG2 THR 220 -16.095 -0.100 15.710 1117 3HG2 THR 220 3HG2 THR 220 -15.153 -0.876 16.983 1118 H GLY 221 H GLY 221 -16.774 3.869 17.599 1119 1HA GLY 221 1HA GLY 221 -18.714 5.225 18.725 1120 2HA GLY 221 2HA GLY 221 -18.521 4.029 20.006 1121 1H MET 1 1H MET 1 3.034 -9.803 5.053 1122 2H MET 1 2H MET 1 4.486 -9.093 5.577 1123 3H MET 1 3H MET 1 3.030 -8.226 5.683 1124 HA MET 1 HA MET 1 3.729 -9.095 7.858 1125 1HB MET 1 1HB MET 1 1.250 -9.355 6.399 1126 2HB MET 1 2HB MET 1 1.362 -10.646 7.595 1127 1HG MET 1 1HG MET 1 0.509 -9.006 8.964 1128 2HG MET 1 2HG MET 1 2.216 -8.588 9.110 1129 1HE MET 1 1HE MET 1 2.455 -5.664 9.059 1130 2HE MET 1 2HE MET 1 1.385 -6.668 10.039 1131 3HE MET 1 3HE MET 1 0.754 -5.230 9.235 1132 H PHE 2 H PHE 2 2.931 -11.404 9.004 1133 HA PHE 2 HA PHE 2 5.014 -13.242 8.466 1134 1HB PHE 2 1HB PHE 2 3.466 -14.818 9.833 1135 2HB PHE 2 2HB PHE 2 4.055 -13.350 10.598 1136 HD1 PHE 2 HD1 PHE 2 1.417 -13.073 8.025 1137 HD2 PHE 2 HD2 PHE 2 2.222 -13.449 12.231 1138 HE1 PHE 2 HE1 PHE 2 -0.905 -12.390 8.531 1139 HE2 PHE 2 HE2 PHE 2 -0.105 -12.760 12.731 1140 HZ PHE 2 HZ PHE 2 -1.668 -12.231 10.883 1141 H ASN 3 H ASN 3 4.909 -13.564 6.127 1142 HA ASN 3 HA ASN 3 2.690 -15.314 5.178 1143 1HB ASN 3 1HB ASN 3 3.698 -13.171 4.027 1144 2HB ASN 3 2HB ASN 3 4.996 -14.262 3.539 1145 1HD2 ASN 3 1HD2 ASN 3 2.783 -12.951 1.885 1146 2HD2 ASN 3 2HD2 ASN 3 2.024 -14.244 1.089 1147 H ASP 4 H ASP 4 3.155 -17.418 4.380 1148 HA ASP 4 HA ASP 4 5.030 -19.019 5.662 1149 1HB ASP 4 1HB ASP 4 3.103 -19.771 4.300 1150 2HB ASP 4 2HB ASP 4 3.940 -19.259 2.834 1151 H ARG 5 H ARG 5 5.610 -16.875 2.945 1152 HA ARG 5 HA ARG 5 8.287 -18.105 2.487 1153 1HB ARG 5 1HB ARG 5 6.697 -15.984 0.997 1154 2HB ARG 5 2HB ARG 5 8.194 -16.723 0.430 1155 1HG ARG 5 1HG ARG 5 6.593 -18.905 1.068 1156 2HG ARG 5 2HG ARG 5 5.462 -17.762 0.344 1157 1HD ARG 5 1HD ARG 5 7.687 -17.593 -1.323 1158 2HD ARG 5 2HD ARG 5 7.583 -19.321 -0.938 1159 HE ARG 5 HE ARG 5 4.947 -18.372 -1.439 1160 1HH1 ARG 5 1HH1 ARG 5 7.951 -18.903 -3.115 1161 2HH1 ARG 5 2HH1 ARG 5 7.179 -19.191 -4.635 1162 1HH2 ARG 5 1HH2 ARG 5 3.968 -18.749 -3.423 1163 2HH2 ARG 5 2HH2 ARG 5 4.941 -19.105 -4.811 1164 H VAL 6 H VAL 6 6.761 -15.128 3.636 1165 HA VAL 6 HA VAL 6 9.392 -14.214 4.652 1166 HB VAL 6 HB VAL 6 7.662 -12.705 2.656 1167 1HG1 VAL 6 1HG1 VAL 6 9.766 -11.126 2.844 1168 2HG1 VAL 6 2HG1 VAL 6 9.924 -11.862 4.439 1169 3HG1 VAL 6 3HG1 VAL 6 8.454 -10.986 4.014 1170 1HG2 VAL 6 1HG2 VAL 6 9.898 -12.752 1.387 1171 2HG2 VAL 6 2HG2 VAL 6 9.011 -14.274 1.482 1172 3HG2 VAL 6 3HG2 VAL 6 10.394 -13.991 2.539 1173 H ILE 7 H ILE 7 9.121 -13.092 6.576 1174 HA ILE 7 HA ILE 7 6.303 -12.390 7.332 1175 HB ILE 7 HB ILE 7 7.239 -14.272 8.578 1176 1HG1 ILE 7 1HG1 ILE 7 7.617 -11.993 10.496 1177 2HG1 ILE 7 2HG1 ILE 7 6.032 -12.244 9.766 1178 1HG2 ILE 7 1HG2 ILE 7 9.554 -14.166 8.398 1179 2HG2 ILE 7 2HG2 ILE 7 9.333 -13.601 10.054 1180 3HG2 ILE 7 3HG2 ILE 7 9.606 -12.440 8.756 1181 1HD1 ILE 7 1HD1 ILE 7 7.619 -14.189 11.457 1182 2HD1 ILE 7 2HD1 ILE 7 6.216 -14.677 10.506 1183 3HD1 ILE 7 3HD1 ILE 7 6.034 -13.500 11.807 1184 H VAL 8 H VAL 8 6.088 -10.543 8.826 1185 HA VAL 8 HA VAL 8 7.945 -8.352 8.130 1186 HB VAL 8 HB VAL 8 5.480 -8.079 8.073 1187 1HG1 VAL 8 1HG1 VAL 8 5.092 -7.981 10.958 1188 2HG1 VAL 8 2HG1 VAL 8 5.582 -9.589 10.429 1189 3HG1 VAL 8 3HG1 VAL 8 4.149 -8.832 9.736 1190 1HG2 VAL 8 1HG2 VAL 8 7.160 -6.506 10.004 1191 2HG2 VAL 8 2HG2 VAL 8 5.436 -6.146 9.882 1192 3HG2 VAL 8 3HG2 VAL 8 6.467 -6.005 8.460 1193 H LYS 9 H LYS 9 9.619 -7.830 9.440 1194 HA LYS 9 HA LYS 9 9.359 -8.145 12.372 1195 1HB LYS 9 1HB LYS 9 11.000 -9.722 10.476 1196 2HB LYS 9 2HB LYS 9 11.800 -9.249 11.972 1197 1HG LYS 9 1HG LYS 9 9.968 -10.256 13.271 1198 2HG LYS 9 2HG LYS 9 9.124 -10.670 11.782 1199 1HD LYS 9 1HD LYS 9 10.893 -12.183 11.129 1200 2HD LYS 9 2HD LYS 9 11.901 -11.652 12.475 1201 1HE LYS 9 1HE LYS 9 9.829 -12.415 13.933 1202 2HE LYS 9 2HE LYS 9 9.475 -13.413 12.511 1203 1HZ LYS 9 1HZ LYS 9 10.960 -14.662 13.851 1204 2HZ LYS 9 2HZ LYS 9 11.983 -13.330 14.100 1205 3HZ LYS 9 3HZ LYS 9 11.891 -14.055 12.567 1206 H LYS 10 H LYS 10 11.501 -5.264 12.470 1207 HA LYS 10 HA LYS 10 10.308 -5.428 14.453 1208 1HB LYS 10 1HB LYS 10 8.608 -6.024 12.244 1209 2HB LYS 10 2HB LYS 10 8.134 -7.071 13.582 1210 1HG LYS 10 1HG LYS 10 6.956 -4.881 13.632 1211 2HG LYS 10 2HG LYS 10 7.940 -5.139 15.068 1212 1HD LYS 10 1HD LYS 10 9.644 -3.920 13.174 1213 2HD LYS 10 2HD LYS 10 8.123 -3.033 13.094 1214 1HE LYS 10 1HE LYS 10 9.155 -3.691 15.819 1215 2HE LYS 10 2HE LYS 10 9.994 -2.417 14.913 1216 1HZ LYS 10 1HZ LYS 10 7.920 -1.313 14.522 1217 2HZ LYS 10 2HZ LYS 10 8.040 -1.603 16.192 1218 3HZ LYS 10 3HZ LYS 10 7.040 -2.582 15.229 1219 H SER 11 H SER 11 12.138 -6.872 15.147 1220 HA SER 11 HA SER 11 11.075 -9.153 16.536 1221 1HB SER 11 1HB SER 11 11.992 -9.544 13.843 1222 2HB SER 11 2HB SER 11 13.057 -10.420 14.941 1223 HG SER 11 HG SER 11 11.037 -11.192 15.930 1224 HA PRO 12 HA PRO 12 15.808 -8.919 17.242 1225 1HB PRO 12 1HB PRO 12 16.673 -6.559 15.685 1226 2HB PRO 12 2HB PRO 12 17.375 -8.187 15.729 1227 1HG PRO 12 1HG PRO 12 16.035 -7.281 13.591 1228 2HG PRO 12 2HG PRO 12 15.967 -8.977 14.090 1229 1HD PRO 12 1HD PRO 12 13.973 -6.795 14.520 1230 2HD PRO 12 2HD PRO 12 13.720 -8.481 14.034 1231 H LEU 13 H LEU 13 14.123 -5.866 16.658 1232 HA LEU 13 HA LEU 13 14.044 -5.093 19.403 1233 1HB LEU 13 1HB LEU 13 16.530 -4.605 17.952 1234 2HB LEU 13 2HB LEU 13 15.831 -3.096 18.539 1235 HG LEU 13 HG LEU 13 15.861 -5.403 20.428 1236 1HD1 LEU 13 1HD1 LEU 13 18.254 -4.418 21.048 1237 2HD1 LEU 13 2HD1 LEU 13 18.292 -4.051 19.324 1238 3HD1 LEU 13 3HD1 LEU 13 18.087 -5.716 19.866 1239 1HD2 LEU 13 1HD2 LEU 13 16.534 -2.465 20.758 1240 2HD2 LEU 13 2HD2 LEU 13 16.203 -3.624 22.046 1241 3HD2 LEU 13 3HD2 LEU 13 14.914 -3.135 20.946 1242 H GLY 14 H GLY 14 14.198 -4.051 16.029 1243 1HA GLY 14 1HA GLY 14 11.689 -2.761 16.028 1244 2HA GLY 14 2HA GLY 14 12.888 -1.519 16.385 1245 H GLY 15 H GLY 15 12.387 -0.525 14.311 1246 1HA GLY 15 1HA GLY 15 12.910 -0.097 12.062 1247 2HA GLY 15 2HA GLY 15 14.151 -1.343 12.197 1248 H TYR 16 H TYR 16 10.791 -0.720 11.370 1249 HA TYR 16 HA TYR 16 9.875 -3.374 10.959 1250 1HB TYR 16 1HB TYR 16 9.212 -0.622 10.162 1251 2HB TYR 16 2HB TYR 16 8.692 -1.825 8.985 1252 HD1 TYR 16 HD1 TYR 16 7.752 -0.121 11.901 1253 HD2 TYR 16 HD2 TYR 16 7.614 -4.020 10.105 1254 HE1 TYR 16 HE1 TYR 16 5.846 -0.728 13.367 1255 HE2 TYR 16 HE2 TYR 16 5.708 -4.628 11.571 1256 HH TYR 16 HH TYR 16 3.838 -2.523 13.119 1257 H GLY 17 H GLY 17 11.487 -4.666 9.952 1258 1HA GLY 17 1HA GLY 17 12.052 -3.959 7.096 1259 2HA GLY 17 2HA GLY 17 13.227 -4.792 8.116 1260 H VAL 18 H VAL 18 12.558 -6.094 5.816 1261 HA VAL 18 HA VAL 18 10.344 -7.977 6.433 1262 HB VAL 18 HB VAL 18 12.213 -7.594 4.067 1263 1HG1 VAL 18 1HG1 VAL 18 9.715 -9.300 4.239 1264 2HG1 VAL 18 2HG1 VAL 18 11.349 -9.950 4.374 1265 3HG1 VAL 18 3HG1 VAL 18 10.829 -9.177 2.877 1266 1HG2 VAL 18 1HG2 VAL 18 9.331 -7.165 3.745 1267 2HG2 VAL 18 2HG2 VAL 18 10.682 -6.148 3.243 1268 3HG2 VAL 18 3HG2 VAL 18 10.077 -6.058 4.898 1269 H PHE 19 H PHE 19 10.721 -10.139 6.978 1270 HA PHE 19 HA PHE 19 13.573 -10.852 7.530 1271 1HB PHE 19 1HB PHE 19 11.026 -11.114 8.893 1272 2HB PHE 19 2HB PHE 19 11.788 -12.694 8.713 1273 HD1 PHE 19 HD1 PHE 19 12.974 -9.188 9.376 1274 HD2 PHE 19 HD2 PHE 19 13.078 -13.323 10.541 1275 HE1 PHE 19 HE1 PHE 19 14.546 -8.629 11.208 1276 HE2 PHE 19 HE2 PHE 19 14.652 -12.761 12.378 1277 HZ PHE 19 HZ PHE 19 15.384 -10.413 12.710 1278 H ALA 20 H ALA 20 14.484 -12.497 6.391 1279 HA ALA 20 HA ALA 20 12.901 -13.834 4.301 1280 1HB ALA 20 1HB ALA 20 15.652 -14.715 4.629 1281 2HB ALA 20 2HB ALA 20 15.555 -12.956 4.724 1282 3HB ALA 20 3HB ALA 20 14.939 -13.797 3.302 1283 H ARG 21 H ARG 21 11.564 -15.247 5.607 1284 HA ARG 21 HA ARG 21 12.635 -17.129 7.522 1285 1HB ARG 21 1HB ARG 21 10.186 -16.210 6.819 1286 2HB ARG 21 2HB ARG 21 10.184 -17.728 5.923 1287 1HG ARG 21 1HG ARG 21 10.231 -19.016 7.837 1288 2HG ARG 21 2HG ARG 21 11.121 -17.802 8.757 1289 1HD ARG 21 1HD ARG 21 9.140 -17.201 9.694 1290 2HD ARG 21 2HD ARG 21 8.646 -16.598 8.101 1291 HE ARG 21 HE ARG 21 8.261 -19.327 7.896 1292 1HH1 ARG 21 1HH1 ARG 21 7.245 -16.891 10.167 1293 2HH1 ARG 21 2HH1 ARG 21 5.782 -17.720 10.570 1294 1HH2 ARG 21 1HH2 ARG 21 6.355 -20.384 8.436 1295 2HH2 ARG 21 2HH2 ARG 21 5.279 -19.683 9.598 1296 H LYS 22 H LYS 22 12.721 -16.962 4.081 1297 HA LYS 22 HA LYS 22 13.253 -19.895 3.829 1298 1HB LYS 22 1HB LYS 22 11.984 -17.771 2.240 1299 2HB LYS 22 2HB LYS 22 13.132 -18.719 1.300 1300 1HG LYS 22 1HG LYS 22 11.970 -20.745 1.721 1301 2HG LYS 22 2HG LYS 22 11.068 -20.042 3.063 1302 1HD LYS 22 1HD LYS 22 9.894 -18.546 1.472 1303 2HD LYS 22 2HD LYS 22 10.779 -19.286 0.138 1304 1HE LYS 22 1HE LYS 22 9.544 -21.335 1.787 1305 2HE LYS 22 2HE LYS 22 8.333 -20.176 1.207 1306 1HZ LYS 22 1HZ LYS 22 9.259 -20.380 -1.019 1307 2HZ LYS 22 2HZ LYS 22 8.772 -21.904 -0.450 1308 3HZ LYS 22 3HZ LYS 22 10.419 -21.489 -0.464 1309 H SER 23 H SER 23 16.437 -19.153 2.060 1310 HA SER 23 HA SER 23 13.887 -20.724 1.961 1311 1HB SER 23 1HB SER 23 16.328 -21.797 0.716 1312 2HB SER 23 2HB SER 23 16.519 -21.444 2.433 1313 HG SER 23 HG SER 23 15.712 -23.543 2.101 1314 H PHE 24 H PHE 24 16.087 -18.724 0.145 1315 HA PHE 24 HA PHE 24 14.480 -19.260 -2.332 1316 1HB PHE 24 1HB PHE 24 15.743 -16.749 -1.177 1317 2HB PHE 24 2HB PHE 24 15.041 -16.821 -2.793 1318 HD1 PHE 24 HD1 PHE 24 12.605 -18.061 -2.783 1319 HD2 PHE 24 HD2 PHE 24 14.365 -15.895 0.482 1320 HE1 PHE 24 HE1 PHE 24 10.351 -17.675 -1.823 1321 HE2 PHE 24 HE2 PHE 24 12.112 -15.509 1.442 1322 HZ PHE 24 HZ PHE 24 10.105 -16.399 0.289 1323 H GLU 25 H GLU 25 15.700 -18.810 -4.369 1324 HA GLU 25 HA GLU 25 18.583 -19.566 -4.081 1325 1HB GLU 25 1HB GLU 25 16.439 -20.626 -5.534 1326 2HB GLU 25 2HB GLU 25 17.363 -19.728 -6.739 1327 1HG GLU 25 1HG GLU 25 19.411 -20.929 -5.516 1328 2HG GLU 25 2HG GLU 25 18.162 -22.107 -5.116 1329 H LYS 26 H LYS 26 19.776 -18.727 -6.259 1330 HA LYS 26 HA LYS 26 19.767 -15.824 -6.083 1331 1HB LYS 26 1HB LYS 26 21.676 -17.541 -6.553 1332 2HB LYS 26 2HB LYS 26 21.095 -17.502 -8.218 1333 1HG LYS 26 1HG LYS 26 21.490 -15.131 -8.380 1334 2HG LYS 26 2HG LYS 26 21.813 -15.012 -6.651 1335 1HD LYS 26 1HD LYS 26 23.948 -15.731 -6.877 1336 2HD LYS 26 2HD LYS 26 23.499 -16.971 -8.047 1337 1HE LYS 26 1HE LYS 26 23.286 -14.151 -8.982 1338 2HE LYS 26 2HE LYS 26 24.926 -14.789 -8.753 1339 1HZ LYS 26 1HZ LYS 26 24.026 -15.315 -10.969 1340 2HZ LYS 26 2HZ LYS 26 22.744 -16.160 -10.244 1341 3HZ LYS 26 3HZ LYS 26 24.338 -16.718 -10.065 1342 H GLY 27 H GLY 27 17.829 -14.955 -6.892 1343 1HA GLY 27 1HA GLY 27 16.933 -13.938 -8.953 1344 2HA GLY 27 2HA GLY 27 17.337 -15.432 -9.800 1345 H GLU 28 H GLU 28 15.427 -14.480 -6.913 1346 HA GLU 28 HA GLU 28 13.196 -16.170 -7.985 1347 1HB GLU 28 1HB GLU 28 14.870 -16.518 -5.649 1348 2HB GLU 28 2HB GLU 28 13.197 -16.274 -5.148 1349 1HG GLU 28 1HG GLU 28 14.008 -18.235 -7.310 1350 2HG GLU 28 2HG GLU 28 13.836 -18.688 -5.614 1351 H LEU 29 H LEU 29 11.376 -14.929 -8.147 1352 HA LEU 29 HA LEU 29 11.184 -12.254 -7.105 1353 1HB LEU 29 1HB LEU 29 10.028 -13.492 -9.100 1354 2HB LEU 29 2HB LEU 29 8.861 -14.023 -7.891 1355 HG LEU 29 HG LEU 29 8.125 -11.945 -9.028 1356 1HD1 LEU 29 1HD1 LEU 29 8.846 -11.024 -6.283 1357 2HD1 LEU 29 2HD1 LEU 29 7.908 -12.511 -6.419 1358 3HD1 LEU 29 3HD1 LEU 29 7.283 -11.009 -7.099 1359 1HD2 LEU 29 1HD2 LEU 29 9.948 -10.122 -7.730 1360 2HD2 LEU 29 2HD2 LEU 29 9.567 -10.271 -9.445 1361 3HD2 LEU 29 3HD2 LEU 29 10.850 -11.252 -8.739 1362 H VAL 30 H VAL 30 10.599 -11.623 -5.072 1363 HA VAL 30 HA VAL 30 9.684 -13.647 -3.124 1364 HB VAL 30 HB VAL 30 10.428 -10.701 -2.969 1365 1HG1 VAL 30 1HG1 VAL 30 9.308 -12.594 -0.979 1366 2HG1 VAL 30 2HG1 VAL 30 9.248 -10.832 -1.014 1367 3HG1 VAL 30 3HG1 VAL 30 10.698 -11.653 -0.436 1368 1HG2 VAL 30 1HG2 VAL 30 12.016 -12.887 -1.705 1369 2HG2 VAL 30 2HG2 VAL 30 12.565 -11.382 -2.443 1370 3HG2 VAL 30 3HG2 VAL 30 12.098 -12.745 -3.461 1371 H GLU 31 H GLU 31 8.535 -10.513 -4.428 1372 HA GLU 31 HA GLU 31 5.751 -11.362 -4.286 1373 1HB GLU 31 1HB GLU 31 7.075 -10.132 -2.010 1374 2HB GLU 31 2HB GLU 31 5.754 -9.111 -2.576 1375 1HG GLU 31 1HG GLU 31 4.384 -11.329 -2.643 1376 2HG GLU 31 2HG GLU 31 5.649 -11.953 -1.584 1377 H GLU 32 H GLU 32 4.351 -9.783 -5.282 1378 HA GLU 32 HA GLU 32 5.666 -7.314 -6.328 1379 1HB GLU 32 1HB GLU 32 4.799 -7.910 -8.585 1380 2HB GLU 32 2HB GLU 32 5.911 -9.139 -7.982 1381 1HG GLU 32 1HG GLU 32 3.904 -10.417 -7.136 1382 2HG GLU 32 2HG GLU 32 2.882 -9.252 -7.979 1383 H CYS 33 H CYS 33 4.256 -5.576 -6.336 1384 HA CYS 33 HA CYS 33 1.324 -6.106 -6.192 1385 1HB CYS 33 1HB CYS 33 3.134 -5.218 -4.078 1386 2HB CYS 33 2HB CYS 33 1.840 -4.051 -4.351 1387 HG CYS 33 HG CYS 33 0.544 -6.716 -4.248 1388 H LEU 34 H LEU 34 0.444 -3.537 -5.811 1389 HA LEU 34 HA LEU 34 1.336 -2.206 -8.314 1390 1HB LEU 34 1HB LEU 34 -1.099 -2.842 -7.312 1391 2HB LEU 34 2HB LEU 34 -0.933 -1.216 -6.651 1392 HG LEU 34 HG LEU 34 -0.299 -0.470 -9.010 1393 1HD1 LEU 34 1HD1 LEU 34 0.086 -2.962 -9.662 1394 2HD1 LEU 34 2HD1 LEU 34 -0.691 -1.901 -10.838 1395 3HD1 LEU 34 3HD1 LEU 34 -1.664 -3.014 -9.876 1396 1HD2 LEU 34 1HD2 LEU 34 -3.008 -1.477 -8.184 1397 2HD2 LEU 34 2HD2 LEU 34 -2.789 -0.784 -9.791 1398 3HD2 LEU 34 3HD2 LEU 34 -2.447 0.185 -8.358 1399 H CYS 35 H CYS 35 1.325 0.272 -8.201 1400 HA CYS 35 HA CYS 35 2.241 1.326 -5.562 1401 1HB CYS 35 1HB CYS 35 3.696 1.430 -8.230 1402 2HB CYS 35 2HB CYS 35 4.178 2.364 -6.814 1403 HG CYS 35 HG CYS 35 3.957 -0.599 -6.164 1404 H ILE 36 H ILE 36 2.795 3.876 -6.144 1405 HA ILE 36 HA ILE 36 0.437 4.870 -7.715 1406 HB ILE 36 HB ILE 36 1.691 5.874 -5.134 1407 1HG1 ILE 36 1HG1 ILE 36 -1.033 4.679 -5.736 1408 2HG1 ILE 36 2HG1 ILE 36 0.279 3.860 -4.888 1409 1HG2 ILE 36 1HG2 ILE 36 -0.018 7.171 -7.124 1410 2HG2 ILE 36 2HG2 ILE 36 0.859 7.880 -5.768 1411 3HG2 ILE 36 3HG2 ILE 36 -0.735 7.170 -5.513 1412 1HD1 ILE 36 1HD1 ILE 36 0.232 5.810 -3.230 1413 2HD1 ILE 36 2HD1 ILE 36 -1.155 4.722 -3.180 1414 3HD1 ILE 36 3HD1 ILE 36 -1.289 6.285 -3.985 1415 H VAL 37 H VAL 37 0.783 6.855 -8.873 1416 HA VAL 37 HA VAL 37 3.664 7.658 -9.142 1417 HB VAL 37 HB VAL 37 1.477 7.521 -11.253 1418 1HG1 VAL 37 1HG1 VAL 37 3.461 7.773 -12.798 1419 2HG1 VAL 37 2HG1 VAL 37 4.442 8.132 -11.377 1420 3HG1 VAL 37 3HG1 VAL 37 3.113 9.201 -11.825 1421 1HG2 VAL 37 1HG2 VAL 37 3.561 5.589 -10.325 1422 2HG2 VAL 37 2HG2 VAL 37 3.233 5.682 -12.055 1423 3HG2 VAL 37 3HG2 VAL 37 1.935 5.278 -10.933 1424 H ARG 38 H ARG 38 3.663 9.617 -8.021 1425 HA ARG 38 HA ARG 38 1.775 11.712 -9.026 1426 1HB ARG 38 1HB ARG 38 2.592 11.096 -6.169 1427 2HB ARG 38 2HB ARG 38 1.624 12.487 -6.647 1428 1HG ARG 38 1HG ARG 38 0.864 9.594 -7.148 1429 2HG ARG 38 2HG ARG 38 0.223 10.590 -5.842 1430 1HD ARG 38 1HD ARG 38 -0.242 12.231 -7.970 1431 2HD ARG 38 2HD ARG 38 -0.422 10.641 -8.737 1432 HE ARG 38 HE ARG 38 -2.187 11.761 -6.706 1433 1HH1 ARG 38 1HH1 ARG 38 -0.814 8.830 -7.988 1434 2HH1 ARG 38 2HH1 ARG 38 -2.116 7.843 -7.422 1435 1HH2 ARG 38 1HH2 ARG 38 -3.865 10.459 -5.982 1436 2HH2 ARG 38 2HH2 ARG 38 -3.831 8.755 -6.295 1437 H HIS 39 H HIS 39 2.724 13.787 -9.198 1438 HA HIS 39 HA HIS 39 5.559 13.962 -9.534 1439 1HB HIS 39 1HB HIS 39 3.413 16.070 -9.085 1440 2HB HIS 39 2HB HIS 39 5.026 16.402 -9.715 1441 HD1 HIS 39 HD1 HIS 39 2.161 16.662 -11.256 1442 HD2 HIS 39 HD2 HIS 39 5.049 13.702 -11.783 1443 HE1 HIS 39 HE1 HIS 39 1.782 15.694 -13.565 1444 H ASN 40 H ASN 40 6.785 15.828 -8.273 1445 HA ASN 40 HA ASN 40 7.066 14.996 -5.532 1446 1HB ASN 40 1HB ASN 40 8.018 17.460 -7.041 1447 2HB ASN 40 2HB ASN 40 8.686 16.885 -5.514 1448 1HD2 ASN 40 1HD2 ASN 40 10.672 15.922 -5.982 1449 2HD2 ASN 40 2HD2 ASN 40 10.949 14.838 -7.259 1450 H ASP 41 H ASP 41 7.329 18.120 -4.874 1451 HA ASP 41 HA ASP 41 5.990 19.753 -3.835 1452 1HB ASP 41 1HB ASP 41 4.702 19.040 -6.124 1453 2HB ASP 41 2HB ASP 41 3.482 18.586 -4.934 1454 H ASP 42 H ASP 42 3.181 19.234 -2.994 1455 HA ASP 42 HA ASP 42 3.497 18.382 -0.375 1456 1HB ASP 42 1HB ASP 42 1.191 18.099 -2.326 1457 2HB ASP 42 2HB ASP 42 1.016 17.802 -0.596 1458 H TRP 43 H TRP 43 3.318 16.354 -3.233 1459 HA TRP 43 HA TRP 43 2.687 13.868 -1.908 1460 1HB TRP 43 1HB TRP 43 2.363 14.182 -4.286 1461 2HB TRP 43 2HB TRP 43 4.043 14.657 -4.507 1462 HD1 TRP 43 HD1 TRP 43 5.610 12.822 -5.278 1463 HE1 TRP 43 HE1 TRP 43 5.571 10.245 -5.299 1464 HE3 TRP 43 HE3 TRP 43 1.257 11.983 -2.740 1465 HZ2 TRP 43 HZ2 TRP 43 3.917 8.115 -4.369 1466 HZ3 TRP 43 HZ3 TRP 43 0.475 9.668 -2.321 1467 HH2 TRP 43 HH2 TRP 43 1.799 7.734 -3.129 1468 H GLY 44 H GLY 44 5.806 15.117 -3.181 1469 1HA GLY 44 1HA GLY 44 7.419 13.054 -2.086 1470 2HA GLY 44 2HA GLY 44 8.007 14.659 -2.517 1471 H THR 45 H THR 45 5.931 15.805 -0.566 1472 HA THR 45 HA THR 45 7.705 15.671 1.797 1473 HB THR 45 HB THR 45 5.219 17.289 1.123 1474 HG1 THR 45 HG1 THR 45 6.819 18.924 0.791 1475 1HG2 THR 45 1HG2 THR 45 6.604 16.916 3.595 1476 2HG2 THR 45 2HG2 THR 45 5.277 18.024 3.249 1477 3HG2 THR 45 3HG2 THR 45 6.946 18.549 3.023 1478 H ALA 46 H ALA 46 4.137 15.474 1.332 1479 HA ALA 46 HA ALA 46 3.417 14.480 3.844 1480 1HB ALA 46 1HB ALA 46 1.867 15.129 2.037 1481 2HB ALA 46 2HB ALA 46 1.486 13.501 2.599 1482 3HB ALA 46 3HB ALA 46 2.369 13.730 1.089 1483 H LEU 47 H LEU 47 4.172 12.474 0.968 1484 HA LEU 47 HA LEU 47 4.513 10.094 2.711 1485 1HB LEU 47 1HB LEU 47 4.367 10.672 -0.260 1486 2HB LEU 47 2HB LEU 47 4.870 9.090 0.328 1487 HG LEU 47 HG LEU 47 2.475 9.049 -0.115 1488 1HD1 LEU 47 1HD1 LEU 47 3.530 7.996 2.027 1489 2HD1 LEU 47 2HD1 LEU 47 1.773 8.103 1.912 1490 3HD1 LEU 47 3HD1 LEU 47 2.666 9.276 2.879 1491 1HD2 LEU 47 1HD2 LEU 47 2.081 11.188 1.973 1492 2HD2 LEU 47 2HD2 LEU 47 0.935 10.602 0.767 1493 3HD2 LEU 47 3HD2 LEU 47 2.300 11.604 0.273 1494 H GLU 48 H GLU 48 6.465 12.340 2.837 1495 HA GLU 48 HA GLU 48 8.818 11.724 1.307 1496 1HB GLU 48 1HB GLU 48 9.846 13.343 2.836 1497 2HB GLU 48 2HB GLU 48 8.227 13.894 2.419 1498 1HG GLU 48 1HG GLU 48 7.498 12.605 4.575 1499 2HG GLU 48 2HG GLU 48 9.203 12.712 5.010 1500 H ASP 49 H ASP 49 8.417 9.228 1.943 1501 HA ASP 49 HA ASP 49 10.634 8.516 3.693 1502 1HB ASP 49 1HB ASP 49 8.586 9.185 5.147 1503 2HB ASP 49 2HB ASP 49 7.879 7.664 4.602 1504 H TYR 50 H TYR 50 7.690 7.433 2.001 1505 HA TYR 50 HA TYR 50 9.161 4.914 1.291 1506 1HB TYR 50 1HB TYR 50 6.210 5.339 1.894 1507 2HB TYR 50 2HB TYR 50 6.965 3.795 1.503 1508 HD1 TYR 50 HD1 TYR 50 9.443 3.789 2.995 1509 HD2 TYR 50 HD2 TYR 50 5.593 5.301 4.151 1510 HE1 TYR 50 HE1 TYR 50 10.036 3.473 5.382 1511 HE2 TYR 50 HE2 TYR 50 6.185 4.985 6.538 1512 HH TYR 50 HH TYR 50 8.240 3.135 7.690 1513 H LEU 51 H LEU 51 9.400 7.001 -0.476 1514 HA LEU 51 HA LEU 51 7.418 6.312 -2.620 1515 1HB LEU 51 1HB LEU 51 8.793 8.924 -1.906 1516 2HB LEU 51 2HB LEU 51 7.835 8.696 -3.367 1517 HG LEU 51 HG LEU 51 6.855 8.435 -0.508 1518 1HD1 LEU 51 1HD1 LEU 51 6.360 10.621 -0.727 1519 2HD1 LEU 51 2HD1 LEU 51 5.333 10.234 -2.108 1520 3HD1 LEU 51 3HD1 LEU 51 7.034 10.626 -2.357 1521 1HD2 LEU 51 1HD2 LEU 51 5.601 6.817 -1.662 1522 2HD2 LEU 51 2HD2 LEU 51 5.610 7.744 -3.162 1523 3HD2 LEU 51 3HD2 LEU 51 4.598 8.259 -1.813 1524 H PHE 52 H PHE 52 8.432 5.195 -4.223 1525 HA PHE 52 HA PHE 52 11.350 5.498 -4.667 1526 1HB PHE 52 1HB PHE 52 9.133 3.725 -5.745 1527 2HB PHE 52 2HB PHE 52 10.776 3.664 -6.382 1528 HD1 PHE 52 HD1 PHE 52 12.446 2.416 -5.283 1529 HD2 PHE 52 HD2 PHE 52 8.813 3.398 -3.212 1530 HE1 PHE 52 HE1 PHE 52 13.124 0.952 -3.400 1531 HE2 PHE 52 HE2 PHE 52 9.491 1.934 -1.329 1532 HZ PHE 52 HZ PHE 52 11.646 0.710 -1.423 1533 H SER 53 H SER 53 11.665 7.483 -5.730 1534 HA SER 53 HA SER 53 9.842 8.189 -7.963 1535 1HB SER 53 1HB SER 53 10.187 9.964 -6.442 1536 2HB SER 53 2HB SER 53 11.898 9.581 -6.248 1537 HG SER 53 HG SER 53 10.631 11.106 -8.144 1538 H ARG 54 H ARG 54 10.685 8.819 -10.028 1539 HA ARG 54 HA ARG 54 13.408 7.729 -10.656 1540 1HB ARG 54 1HB ARG 54 10.775 7.029 -11.586 1541 2HB ARG 54 2HB ARG 54 11.682 7.713 -12.936 1542 1HG ARG 54 1HG ARG 54 13.387 6.086 -12.766 1543 2HG ARG 54 2HG ARG 54 12.912 5.633 -11.129 1544 1HD ARG 54 1HD ARG 54 11.659 3.971 -12.034 1545 2HD ARG 54 2HD ARG 54 10.626 5.215 -12.763 1546 HE ARG 54 HE ARG 54 11.757 4.864 -14.816 1547 1HH1 ARG 54 1HH1 ARG 54 13.569 3.537 -12.156 1548 2HH1 ARG 54 2HH1 ARG 54 14.748 2.800 -13.185 1549 1HH2 ARG 54 1HH2 ARG 54 13.300 3.897 -16.129 1550 2HH2 ARG 54 2HH2 ARG 54 14.599 3.000 -15.416 1551 H LYS 55 H LYS 55 13.760 8.658 -13.170 1552 HA LYS 55 HA LYS 55 14.062 11.530 -12.782 1553 1HB LYS 55 1HB LYS 55 15.148 11.333 -15.021 1554 2HB LYS 55 2HB LYS 55 15.730 10.099 -13.903 1555 1HG LYS 55 1HG LYS 55 13.420 9.036 -15.163 1556 2HG LYS 55 2HG LYS 55 14.412 9.746 -16.437 1557 1HD LYS 55 1HD LYS 55 16.216 8.336 -15.999 1558 2HD LYS 55 2HD LYS 55 15.722 8.055 -14.330 1559 1HE LYS 55 1HE LYS 55 15.254 6.025 -15.585 1560 2HE LYS 55 2HE LYS 55 13.697 6.811 -15.261 1561 1HZ LYS 55 1HZ LYS 55 14.022 8.002 -17.427 1562 2HZ LYS 55 2HZ LYS 55 13.756 6.331 -17.575 1563 3HZ LYS 55 3HZ LYS 55 15.325 6.959 -17.743 1564 H ASN 56 H ASN 56 11.709 11.995 -12.595 1565 HA ASN 56 HA ASN 56 10.028 11.687 -14.981 1566 1HB ASN 56 1HB ASN 56 9.915 14.387 -14.835 1567 2HB ASN 56 2HB ASN 56 11.574 14.145 -14.288 1568 1HD2 ASN 56 1HD2 ASN 56 13.138 13.551 -15.864 1569 2HD2 ASN 56 2HD2 ASN 56 12.768 13.287 -17.500 1570 H MET 57 H MET 57 10.042 11.253 -11.932 1571 HA MET 57 HA MET 57 8.167 13.108 -10.760 1572 1HB MET 57 1HB MET 57 6.153 11.632 -10.978 1573 2HB MET 57 2HB MET 57 6.732 12.207 -12.540 1574 1HG MET 57 1HG MET 57 8.158 9.819 -11.974 1575 2HG MET 57 2HG MET 57 6.466 9.493 -11.602 1576 1HE MET 57 1HE MET 57 4.632 10.436 -12.941 1577 2HE MET 57 2HE MET 57 4.537 10.368 -14.701 1578 3HE MET 57 3HE MET 57 5.189 11.802 -13.908 1579 H SER 58 H SER 58 6.738 11.526 -9.059 1580 HA SER 58 HA SER 58 8.760 9.750 -7.742 1581 1HB SER 58 1HB SER 58 6.840 11.510 -6.226 1582 2HB SER 58 2HB SER 58 8.405 10.884 -5.708 1583 HG SER 58 HG SER 58 8.223 13.194 -6.388 1584 H ALA 59 H ALA 59 7.892 7.827 -6.920 1585 HA ALA 59 HA ALA 59 4.908 7.531 -7.077 1586 1HB ALA 59 1HB ALA 59 5.870 5.017 -7.474 1587 2HB ALA 59 2HB ALA 59 7.208 5.960 -8.130 1588 3HB ALA 59 3HB ALA 59 5.585 6.150 -8.794 1589 H MET 60 H MET 60 4.196 5.545 -5.711 1590 HA MET 60 HA MET 60 5.728 5.545 -3.130 1591 1HB MET 60 1HB MET 60 3.504 6.681 -3.132 1592 2HB MET 60 2HB MET 60 2.759 5.178 -3.673 1593 1HG MET 60 1HG MET 60 3.069 4.129 -1.631 1594 2HG MET 60 2HG MET 60 4.480 5.106 -1.226 1595 1HE MET 60 1HE MET 60 2.976 4.660 1.010 1596 2HE MET 60 2HE MET 60 2.336 6.156 1.689 1597 3HE MET 60 3HE MET 60 4.000 6.093 1.107 1598 H ALA 61 H ALA 61 5.844 3.512 -2.003 1599 HA ALA 61 HA ALA 61 5.762 1.161 -3.787 1600 1HB ALA 61 1HB ALA 61 6.938 1.985 -1.174 1601 2HB ALA 61 2HB ALA 61 7.680 1.096 -2.505 1602 3HB ALA 61 3HB ALA 61 6.616 0.262 -1.372 1603 H LEU 62 H LEU 62 3.469 0.809 -3.994 1604 HA LEU 62 HA LEU 62 1.421 -0.185 -3.381 1605 1HB LEU 62 1HB LEU 62 0.868 0.593 -0.875 1606 2HB LEU 62 2HB LEU 62 2.252 1.646 -1.162 1607 HG LEU 62 HG LEU 62 1.097 2.283 -3.370 1608 1HD1 LEU 62 1HD1 LEU 62 -0.942 0.555 -2.058 1609 2HD1 LEU 62 2HD1 LEU 62 -0.638 0.830 -3.773 1610 3HD1 LEU 62 3HD1 LEU 62 -1.532 2.025 -2.833 1611 1HD2 LEU 62 1HD2 LEU 62 0.766 3.209 -0.689 1612 2HD2 LEU 62 2HD2 LEU 62 -0.788 3.365 -1.510 1613 3HD2 LEU 62 3HD2 LEU 62 0.648 4.139 -2.181 1614 H GLY 63 H GLY 63 3.106 -2.174 -3.369 1615 1HA GLY 63 1HA GLY 63 2.242 -3.934 -1.290 1616 2HA GLY 63 2HA GLY 63 3.541 -4.279 -2.430 1617 H PHE 64 H PHE 64 5.103 -5.058 -1.032 1618 HA PHE 64 HA PHE 64 5.712 -3.610 1.470 1619 1HB PHE 64 1HB PHE 64 6.700 -6.126 0.094 1620 2HB PHE 64 2HB PHE 64 7.381 -5.553 1.616 1621 HD1 PHE 64 HD1 PHE 64 6.348 -6.108 3.652 1622 HD2 PHE 64 HD2 PHE 64 4.119 -6.417 -0.007 1623 HE1 PHE 64 HE1 PHE 64 4.466 -7.151 4.886 1624 HE2 PHE 64 HE2 PHE 64 2.237 -7.460 1.227 1625 HZ PHE 64 HZ PHE 64 2.411 -7.827 3.674 1626 H GLY 65 H GLY 65 6.233 -2.055 -0.877 1627 1HA GLY 65 1HA GLY 65 9.117 -2.237 -1.424 1628 2HA GLY 65 2HA GLY 65 8.007 -1.048 -2.104 1629 H ALA 66 H ALA 66 7.003 -0.576 0.763 1630 HA ALA 66 HA ALA 66 8.957 1.545 1.388 1631 1HB ALA 66 1HB ALA 66 7.140 2.212 2.953 1632 2HB ALA 66 2HB ALA 66 6.292 0.709 2.597 1633 3HB ALA 66 3HB ALA 66 6.505 1.921 1.334 1634 H ILE 67 H ILE 67 7.267 -0.931 3.334 1635 HA ILE 67 HA ILE 67 8.656 -0.830 5.693 1636 HB ILE 67 HB ILE 67 8.200 -3.346 5.783 1637 1HG1 ILE 67 1HG1 ILE 67 6.732 -4.136 3.845 1638 2HG1 ILE 67 2HG1 ILE 67 7.362 -2.773 2.928 1639 1HG2 ILE 67 1HG2 ILE 67 6.005 -2.900 6.246 1640 2HG2 ILE 67 2HG2 ILE 67 5.742 -2.069 4.712 1641 3HG2 ILE 67 3HG2 ILE 67 6.545 -1.233 6.042 1642 1HD1 ILE 67 1HD1 ILE 67 9.481 -4.274 4.261 1643 2HD1 ILE 67 2HD1 ILE 67 9.331 -3.811 2.565 1644 3HD1 ILE 67 3HD1 ILE 67 8.544 -5.274 3.151 1645 H PHE 68 H PHE 68 10.036 -1.988 2.661 1646 HA PHE 68 HA PHE 68 12.098 -3.665 3.503 1647 1HB PHE 68 1HB PHE 68 11.772 -1.574 1.383 1648 2HB PHE 68 2HB PHE 68 13.367 -2.288 1.599 1649 HD1 PHE 68 HD1 PHE 68 12.820 -5.044 2.331 1650 HD2 PHE 68 HD2 PHE 68 10.812 -2.538 -0.519 1651 HE1 PHE 68 HE1 PHE 68 12.088 -7.056 1.080 1652 HE2 PHE 68 HE2 PHE 68 10.079 -4.547 -1.770 1653 HZ PHE 68 HZ PHE 68 10.717 -6.808 -0.971 1654 H ASN 69 H ASN 69 14.302 -3.285 4.165 1655 HA ASN 69 HA ASN 69 14.694 -0.649 5.543 1656 1HB ASN 69 1HB ASN 69 15.269 -3.530 6.224 1657 2HB ASN 69 2HB ASN 69 16.171 -2.244 7.019 1658 1HD2 ASN 69 1HD2 ASN 69 14.876 -3.275 8.958 1659 2HD2 ASN 69 2HD2 ASN 69 13.346 -2.608 9.273 1660 H HIS 70 H HIS 70 17.287 -0.742 6.203 1661 HA HIS 70 HA HIS 70 18.712 -0.848 3.575 1662 1HB HIS 70 1HB HIS 70 18.552 1.288 4.900 1663 2HB HIS 70 2HB HIS 70 19.423 0.495 6.212 1664 HD1 HIS 70 HD1 HIS 70 21.576 1.871 6.046 1665 HD2 HIS 70 HD2 HIS 70 20.519 0.068 2.438 1666 HE1 HIS 70 HE1 HIS 70 23.554 2.163 4.492 1667 H SER 71 H SER 71 20.894 -1.804 3.574 1668 HA SER 71 HA SER 71 21.795 -3.298 5.938 1669 1HB SER 71 1HB SER 71 20.041 -4.759 5.107 1670 2HB SER 71 2HB SER 71 20.653 -4.630 3.458 1671 HG SER 71 HG SER 71 21.631 -6.412 4.056 1672 H LYS 72 H LYS 72 23.996 -3.749 5.781 1673 HA LYS 72 HA LYS 72 25.638 -2.439 3.892 1674 1HB LYS 72 1HB LYS 72 26.152 -4.966 5.501 1675 2HB LYS 72 2HB LYS 72 27.388 -3.894 4.847 1676 1HG LYS 72 1HG LYS 72 25.825 -2.116 6.211 1677 2HG LYS 72 2HG LYS 72 25.667 -3.554 7.222 1678 1HD LYS 72 1HD LYS 72 27.730 -3.203 8.047 1679 2HD LYS 72 2HD LYS 72 28.398 -3.335 6.420 1680 1HE LYS 72 1HE LYS 72 29.027 -1.153 7.230 1681 2HE LYS 72 2HE LYS 72 27.692 -0.882 6.094 1682 1HZ LYS 72 1HZ LYS 72 27.341 0.252 8.240 1683 2HZ LYS 72 2HZ LYS 72 27.388 -1.250 9.032 1684 3HZ LYS 72 3HZ LYS 72 26.143 -0.910 7.928 1685 H ASP 73 H ASP 73 24.098 -5.606 3.754 1686 HA ASP 73 HA ASP 73 25.238 -5.961 1.001 1687 1HB ASP 73 1HB ASP 73 25.128 -7.715 3.409 1688 2HB ASP 73 2HB ASP 73 24.809 -8.501 1.862 1689 HA PRO 74 HA PRO 74 20.657 -5.702 0.636 1690 1HB PRO 74 1HB PRO 74 21.498 -5.563 -2.225 1691 2HB PRO 74 2HB PRO 74 20.368 -4.527 -1.335 1692 1HG PRO 74 1HG PRO 74 22.831 -3.710 -2.010 1693 2HG PRO 74 2HG PRO 74 22.036 -3.188 -0.519 1694 1HD PRO 74 1HD PRO 74 24.253 -5.124 -0.902 1695 2HD PRO 74 2HD PRO 74 23.902 -4.058 0.474 1696 H ASN 75 H ASN 75 20.063 -7.844 1.038 1697 HA ASN 75 HA ASN 75 21.034 -10.046 -0.642 1698 1HB ASN 75 1HB ASN 75 18.923 -9.857 1.541 1699 2HB ASN 75 2HB ASN 75 19.592 -11.358 0.902 1700 1HD2 ASN 75 1HD2 ASN 75 20.181 -8.692 3.086 1701 2HD2 ASN 75 2HD2 ASN 75 21.693 -9.223 3.645 1702 H ALA 76 H ALA 76 18.289 -7.901 -0.576 1703 HA ALA 76 HA ALA 76 17.137 -9.369 -2.909 1704 1HB ALA 76 1HB ALA 76 14.910 -8.534 -1.566 1705 2HB ALA 76 2HB ALA 76 15.998 -8.846 -0.214 1706 3HB ALA 76 3HB ALA 76 15.620 -10.134 -1.358 1707 H ARG 77 H ARG 77 16.332 -7.976 -4.485 1708 HA ARG 77 HA ARG 77 16.366 -5.046 -3.835 1709 1HB ARG 77 1HB ARG 77 18.016 -6.463 -5.519 1710 2HB ARG 77 2HB ARG 77 16.760 -5.927 -6.634 1711 1HG ARG 77 1HG ARG 77 17.074 -3.603 -5.890 1712 2HG ARG 77 2HG ARG 77 18.303 -4.129 -4.739 1713 1HD ARG 77 1HD ARG 77 19.894 -4.139 -6.358 1714 2HD ARG 77 2HD ARG 77 18.874 -5.125 -7.422 1715 HE ARG 77 HE ARG 77 17.681 -2.609 -7.451 1716 1HH1 ARG 77 1HH1 ARG 77 20.854 -3.868 -8.132 1717 2HH1 ARG 77 2HH1 ARG 77 21.208 -2.644 -9.302 1718 1HH2 ARG 77 1HH2 ARG 77 18.164 -1.031 -8.972 1719 2HH2 ARG 77 2HH2 ARG 77 19.698 -1.049 -9.775 1720 H HIS 78 H HIS 78 15.148 -3.995 -6.004 1721 HA HIS 78 HA HIS 78 12.546 -5.466 -6.262 1722 1HB HIS 78 1HB HIS 78 11.482 -3.208 -6.013 1723 2HB HIS 78 2HB HIS 78 12.400 -3.680 -4.583 1724 HD1 HIS 78 HD1 HIS 78 14.892 -2.639 -4.424 1725 HD2 HIS 78 HD2 HIS 78 12.343 -0.837 -7.187 1726 HE1 HIS 78 HE1 HIS 78 15.930 -0.403 -5.004 1727 H GLU 79 H GLU 79 11.200 -4.365 -8.097 1728 HA GLU 79 HA GLU 79 12.881 -3.230 -10.268 1729 1HB GLU 79 1HB GLU 79 13.023 -5.718 -10.391 1730 2HB GLU 79 2HB GLU 79 11.264 -5.799 -10.477 1731 1HG GLU 79 1HG GLU 79 11.405 -4.317 -12.534 1732 2HG GLU 79 2HG GLU 79 13.152 -4.560 -12.496 1733 H LEU 80 H LEU 80 11.657 -1.914 -11.641 1734 HA LEU 80 HA LEU 80 8.766 -1.626 -10.950 1735 1HB LEU 80 1HB LEU 80 11.005 0.102 -11.851 1736 2HB LEU 80 2HB LEU 80 9.433 0.493 -12.547 1737 HG LEU 80 HG LEU 80 9.766 0.037 -9.582 1738 1HD1 LEU 80 1HD1 LEU 80 10.386 2.476 -11.223 1739 2HD1 LEU 80 2HD1 LEU 80 11.251 1.823 -9.832 1740 3HD1 LEU 80 3HD1 LEU 80 9.719 2.665 -9.602 1741 1HD2 LEU 80 1HD2 LEU 80 7.577 0.476 -11.289 1742 2HD2 LEU 80 2HD2 LEU 80 7.841 2.017 -10.473 1743 3HD2 LEU 80 3HD2 LEU 80 7.572 0.552 -9.527 1744 H THR 81 H THR 81 7.180 -1.845 -12.557 1745 HA THR 81 HA THR 81 7.920 -3.373 -14.938 1746 HB THR 81 HB THR 81 5.445 -3.367 -15.244 1747 HG1 THR 81 HG1 THR 81 4.290 -1.898 -14.305 1748 1HG2 THR 81 1HG2 THR 81 6.247 -3.762 -12.346 1749 2HG2 THR 81 2HG2 THR 81 6.560 -4.927 -13.632 1750 3HG2 THR 81 3HG2 THR 81 4.901 -4.537 -13.180 1751 H ALA 82 H ALA 82 9.227 -1.753 -16.083 1752 HA ALA 82 HA ALA 82 9.528 -0.005 -17.644 1753 1HB ALA 82 1HB ALA 82 8.097 -1.397 -18.966 1754 2HB ALA 82 2HB ALA 82 7.412 0.222 -19.103 1755 3HB ALA 82 3HB ALA 82 6.676 -0.958 -18.019 1756 H GLY 83 H GLY 83 9.828 1.804 -16.248 1757 1HA GLY 83 1HA GLY 83 9.283 4.017 -15.629 1758 2HA GLY 83 2HA GLY 83 7.684 3.777 -16.331 1759 H LEU 84 H LEU 84 6.491 4.566 -14.573 1760 HA LEU 84 HA LEU 84 6.865 3.176 -11.947 1761 1HB LEU 84 1HB LEU 84 6.390 5.896 -12.857 1762 2HB LEU 84 2HB LEU 84 5.125 5.399 -11.736 1763 HG LEU 84 HG LEU 84 6.750 4.841 -10.036 1764 1HD1 LEU 84 1HD1 LEU 84 9.236 5.617 -10.831 1765 2HD1 LEU 84 2HD1 LEU 84 8.611 4.958 -12.343 1766 3HD1 LEU 84 3HD1 LEU 84 8.671 3.947 -10.898 1767 1HD2 LEU 84 1HD2 LEU 84 7.756 7.038 -9.647 1768 2HD2 LEU 84 2HD2 LEU 84 6.134 7.242 -10.309 1769 3HD2 LEU 84 3HD2 LEU 84 7.543 7.461 -11.346 1770 H LYS 85 H LYS 85 5.526 1.346 -12.216 1771 HA LYS 85 HA LYS 85 2.609 1.927 -12.416 1772 1HB LYS 85 1HB LYS 85 4.325 0.182 -14.184 1773 2HB LYS 85 2HB LYS 85 2.616 -0.193 -13.967 1774 1HG LYS 85 1HG LYS 85 3.555 2.570 -14.753 1775 2HG LYS 85 2HG LYS 85 3.223 1.323 -15.954 1776 1HD LYS 85 1HD LYS 85 0.950 1.322 -15.526 1777 2HD LYS 85 2HD LYS 85 1.159 1.826 -13.849 1778 1HE LYS 85 1HE LYS 85 2.091 4.048 -15.007 1779 2HE LYS 85 2HE LYS 85 1.045 3.498 -16.330 1780 1HZ LYS 85 1HZ LYS 85 0.149 3.541 -13.502 1781 2HZ LYS 85 2HZ LYS 85 -0.805 3.400 -14.900 1782 3HZ LYS 85 3HZ LYS 85 -0.058 4.879 -14.528 1783 H ARG 86 H ARG 86 4.966 -0.758 -12.093 1784 HA ARG 86 HA ARG 86 3.469 -1.666 -9.665 1785 1HB ARG 86 1HB ARG 86 3.642 -2.885 -12.268 1786 2HB ARG 86 2HB ARG 86 4.487 -3.914 -11.112 1787 1HG ARG 86 1HG ARG 86 2.243 -3.231 -9.693 1788 2HG ARG 86 2HG ARG 86 1.607 -3.305 -11.335 1789 1HD ARG 86 1HD ARG 86 3.425 -5.532 -10.634 1790 2HD ARG 86 2HD ARG 86 1.900 -5.502 -9.728 1791 HE ARG 86 HE ARG 86 1.297 -4.929 -12.444 1792 1HH1 ARG 86 1HH1 ARG 86 2.526 -7.544 -10.502 1793 2HH1 ARG 86 2HH1 ARG 86 1.907 -8.765 -11.558 1794 1HH2 ARG 86 1HH2 ARG 86 0.503 -6.535 -13.800 1795 2HH2 ARG 86 2HH2 ARG 86 0.771 -8.201 -13.411 1796 H MET 87 H MET 87 4.902 -3.449 -8.535 1797 HA MET 87 HA MET 87 7.811 -2.895 -8.915 1798 1HB MET 87 1HB MET 87 6.018 -2.167 -6.658 1799 2HB MET 87 2HB MET 87 7.571 -2.861 -6.197 1800 1HG MET 87 1HG MET 87 8.604 -1.184 -7.871 1801 2HG MET 87 2HG MET 87 7.042 -0.366 -7.816 1802 1HE MET 87 1HE MET 87 8.950 -2.260 -4.717 1803 2HE MET 87 2HE MET 87 10.136 -0.967 -4.534 1804 3HE MET 87 3HE MET 87 9.961 -1.791 -6.084 1805 H ARG 88 H ARG 88 8.930 -4.795 -8.831 1806 HA ARG 88 HA ARG 88 7.631 -7.140 -7.483 1807 1HB ARG 88 1HB ARG 88 9.641 -6.983 -9.759 1808 2HB ARG 88 2HB ARG 88 8.917 -8.465 -9.135 1809 1HG ARG 88 1HG ARG 88 6.785 -7.915 -9.963 1810 2HG ARG 88 2HG ARG 88 7.186 -6.204 -10.119 1811 1HD ARG 88 1HD ARG 88 8.888 -6.874 -11.889 1812 2HD ARG 88 2HD ARG 88 8.175 -8.497 -11.842 1813 HE ARG 88 HE ARG 88 6.196 -6.356 -12.109 1814 1HH1 ARG 88 1HH1 ARG 88 8.357 -8.518 -13.775 1815 2HH1 ARG 88 2HH1 ARG 88 7.453 -8.463 -15.248 1816 1HH2 ARG 88 1HH2 ARG 88 5.041 -6.300 -14.032 1817 2HH2 ARG 88 2HH2 ARG 88 5.590 -7.217 -15.395 1818 H ILE 89 H ILE 89 8.863 -8.253 -5.952 1819 HA ILE 89 HA ILE 89 11.477 -7.021 -5.218 1820 HB ILE 89 HB ILE 89 9.528 -8.882 -3.811 1821 1HG1 ILE 89 1HG1 ILE 89 10.216 -6.207 -2.746 1822 2HG1 ILE 89 2HG1 ILE 89 9.315 -6.202 -4.260 1823 1HG2 ILE 89 1HG2 ILE 89 11.968 -7.526 -2.635 1824 2HG2 ILE 89 2HG2 ILE 89 11.975 -9.200 -3.189 1825 3HG2 ILE 89 3HG2 ILE 89 10.923 -8.716 -1.859 1826 1HD1 ILE 89 1HD1 ILE 89 7.943 -8.099 -2.868 1827 2HD1 ILE 89 2HD1 ILE 89 7.502 -6.391 -2.890 1828 3HD1 ILE 89 3HD1 ILE 89 8.456 -7.040 -1.555 1829 H PHE 90 H PHE 90 13.157 -8.034 -6.253 1830 HA PHE 90 HA PHE 90 13.006 -10.984 -6.704 1831 1HB PHE 90 1HB PHE 90 14.309 -8.607 -7.966 1832 2HB PHE 90 2HB PHE 90 15.159 -10.146 -8.098 1833 HD1 PHE 90 HD1 PHE 90 13.918 -12.152 -9.055 1834 HD2 PHE 90 HD2 PHE 90 12.407 -8.138 -9.297 1835 HE1 PHE 90 HE1 PHE 90 12.385 -12.838 -10.881 1836 HE2 PHE 90 HE2 PHE 90 10.875 -8.824 -11.121 1837 HZ PHE 90 HZ PHE 90 10.864 -11.173 -11.914 1838 H THR 91 H THR 91 15.234 -12.081 -6.513 1839 HA THR 91 HA THR 91 16.653 -11.058 -4.075 1840 HB THR 91 HB THR 91 17.088 -13.507 -3.683 1841 HG1 THR 91 HG1 THR 91 16.592 -14.873 -5.183 1842 1HG2 THR 91 1HG2 THR 91 15.199 -12.545 -2.548 1843 2HG2 THR 91 2HG2 THR 91 14.662 -14.088 -3.211 1844 3HG2 THR 91 3HG2 THR 91 14.223 -12.582 -4.017 1845 H ILE 92 H ILE 92 18.683 -10.341 -4.602 1846 HA ILE 92 HA ILE 92 19.953 -11.198 -7.118 1847 HB ILE 92 HB ILE 92 21.538 -9.419 -6.563 1848 1HG1 ILE 92 1HG1 ILE 92 20.174 -9.380 -3.851 1849 2HG1 ILE 92 2HG1 ILE 92 21.820 -9.924 -4.172 1850 1HG2 ILE 92 1HG2 ILE 92 19.429 -8.644 -7.458 1851 2HG2 ILE 92 2HG2 ILE 92 19.912 -7.533 -6.176 1852 3HG2 ILE 92 3HG2 ILE 92 18.666 -8.743 -5.871 1853 1HD1 ILE 92 1HD1 ILE 92 22.569 -7.805 -4.034 1854 2HD1 ILE 92 2HD1 ILE 92 20.935 -7.273 -3.637 1855 3HD1 ILE 92 3HD1 ILE 92 21.465 -7.313 -5.318 1856 H LYS 93 H LYS 93 19.694 -12.859 -4.398 1857 HA LYS 93 HA LYS 93 22.068 -14.421 -4.801 1858 1HB LYS 93 1HB LYS 93 23.177 -13.752 -2.622 1859 2HB LYS 93 2HB LYS 93 23.182 -12.483 -3.845 1860 1HG LYS 93 1HG LYS 93 21.687 -11.174 -2.687 1861 2HG LYS 93 2HG LYS 93 20.846 -12.558 -1.995 1862 1HD LYS 93 1HD LYS 93 21.963 -11.717 -0.126 1863 2HD LYS 93 2HD LYS 93 23.112 -12.923 -0.705 1864 1HE LYS 93 1HE LYS 93 24.194 -11.029 -2.063 1865 2HE LYS 93 2HE LYS 93 23.217 -9.919 -1.084 1866 1HZ LYS 93 1HZ LYS 93 25.443 -10.452 -0.116 1867 2HZ LYS 93 2HZ LYS 93 24.933 -12.063 0.054 1868 3HZ LYS 93 3HZ LYS 93 24.138 -10.827 0.904 1869 HA PRO 94 HA PRO 94 19.478 -17.364 -2.786 1870 1HB PRO 94 1HB PRO 94 22.077 -18.271 -1.605 1871 2HB PRO 94 2HB PRO 94 20.798 -19.232 -2.372 1872 1HG PRO 94 1HG PRO 94 23.001 -18.653 -3.697 1873 2HG PRO 94 2HG PRO 94 21.431 -18.591 -4.504 1874 1HD PRO 94 1HD PRO 94 23.178 -16.359 -3.586 1875 2HD PRO 94 2HD PRO 94 22.105 -16.450 -4.999 1876 H ILE 95 H ILE 95 18.375 -17.297 -0.835 1877 HA ILE 95 HA ILE 95 19.685 -15.800 1.410 1878 HB ILE 95 HB ILE 95 16.758 -16.093 0.633 1879 1HG1 ILE 95 1HG1 ILE 95 18.666 -13.757 0.295 1880 2HG1 ILE 95 2HG1 ILE 95 18.086 -14.794 -1.008 1881 1HG2 ILE 95 1HG2 ILE 95 17.893 -15.388 3.083 1882 2HG2 ILE 95 2HG2 ILE 95 16.245 -15.036 2.562 1883 3HG2 ILE 95 3HG2 ILE 95 17.520 -13.840 2.324 1884 1HD1 ILE 95 1HD1 ILE 95 15.894 -13.767 0.622 1885 2HD1 ILE 95 2HD1 ILE 95 16.118 -13.689 -1.126 1886 3HD1 ILE 95 3HD1 ILE 95 16.851 -12.467 -0.088 1887 H ALA 96 H ALA 96 19.635 -16.734 3.450 1888 HA ALA 96 HA ALA 96 18.808 -19.568 3.621 1889 1HB ALA 96 1HB ALA 96 20.741 -17.765 4.791 1890 2HB ALA 96 2HB ALA 96 20.690 -19.525 4.884 1891 3HB ALA 96 3HB ALA 96 19.823 -18.553 6.073 1892 H ILE 97 H ILE 97 17.353 -20.323 5.264 1893 HA ILE 97 HA ILE 97 14.951 -18.964 5.655 1894 HB ILE 97 HB ILE 97 16.401 -20.984 7.406 1895 1HG1 ILE 97 1HG1 ILE 97 14.257 -22.092 5.899 1896 2HG1 ILE 97 2HG1 ILE 97 15.219 -21.112 4.793 1897 1HG2 ILE 97 1HG2 ILE 97 13.534 -21.223 7.446 1898 2HG2 ILE 97 2HG2 ILE 97 13.983 -19.583 7.912 1899 3HG2 ILE 97 3HG2 ILE 97 14.634 -20.961 8.799 1900 1HD1 ILE 97 1HD1 ILE 97 16.842 -22.722 6.639 1901 2HD1 ILE 97 2HD1 ILE 97 16.981 -22.538 4.891 1902 3HD1 ILE 97 3HD1 ILE 97 15.831 -23.692 5.567 1903 H GLY 98 H GLY 98 17.960 -18.493 7.385 1904 1HA GLY 98 1HA GLY 98 16.525 -16.773 9.360 1905 2HA GLY 98 2HA GLY 98 18.101 -17.507 9.646 1906 H GLU 99 H GLU 99 16.669 -15.444 7.070 1907 HA GLU 99 HA GLU 99 19.072 -13.671 7.382 1908 1HB GLU 99 1HB GLU 99 17.776 -14.994 5.041 1909 2HB GLU 99 2HB GLU 99 18.379 -13.357 4.784 1910 1HG GLU 99 1HG GLU 99 19.992 -15.676 5.893 1911 2HG GLU 99 2HG GLU 99 20.115 -15.034 4.255 1912 H GLU 100 H GLU 100 18.561 -11.455 6.245 1913 HA GLU 100 HA GLU 100 15.758 -10.650 6.957 1914 1HB GLU 100 1HB GLU 100 17.862 -9.923 8.368 1915 2HB GLU 100 2HB GLU 100 18.146 -8.807 7.032 1916 1HG GLU 100 1HG GLU 100 15.443 -8.485 7.518 1917 2HG GLU 100 2HG GLU 100 16.095 -8.723 9.139 1918 H ILE 101 H ILE 101 14.644 -9.762 5.278 1919 HA ILE 101 HA ILE 101 16.072 -9.243 2.737 1920 HB ILE 101 HB ILE 101 13.115 -9.174 3.429 1921 1HG1 ILE 101 1HG1 ILE 101 14.834 -11.469 2.438 1922 2HG1 ILE 101 2HG1 ILE 101 14.077 -11.352 4.025 1923 1HG2 ILE 101 1HG2 ILE 101 12.716 -8.973 1.191 1924 2HG2 ILE 101 2HG2 ILE 101 14.083 -9.999 0.758 1925 3HG2 ILE 101 3HG2 ILE 101 14.347 -8.303 1.161 1926 1HD1 ILE 101 1HD1 ILE 101 12.133 -12.148 3.216 1927 2HD1 ILE 101 2HD1 ILE 101 12.945 -12.436 1.677 1928 3HD1 ILE 101 3HD1 ILE 101 12.105 -10.911 1.959 1929 H THR 102 H THR 102 16.751 -7.211 2.314 1930 HA THR 102 HA THR 102 15.026 -4.893 2.963 1931 HB THR 102 HB THR 102 16.900 -3.803 4.154 1932 HG1 THR 102 HG1 THR 102 18.678 -4.694 3.287 1933 1HG2 THR 102 1HG2 THR 102 16.772 -5.059 6.178 1934 2HG2 THR 102 2HG2 THR 102 16.539 -6.574 5.305 1935 3HG2 THR 102 3HG2 THR 102 15.254 -5.366 5.334 1936 H ILE 103 H ILE 103 15.030 -3.654 1.119 1937 HA ILE 103 HA ILE 103 17.117 -4.099 -0.921 1938 HB ILE 103 HB ILE 103 15.568 -2.754 -2.298 1939 1HG1 ILE 103 1HG1 ILE 103 13.395 -2.447 -0.462 1940 2HG1 ILE 103 2HG1 ILE 103 14.827 -1.711 0.257 1941 1HG2 ILE 103 1HG2 ILE 103 14.801 -5.124 -0.769 1942 2HG2 ILE 103 2HG2 ILE 103 14.579 -4.778 -2.484 1943 3HG2 ILE 103 3HG2 ILE 103 13.402 -4.194 -1.307 1944 1HD1 ILE 103 1HD1 ILE 103 15.198 -0.577 -2.010 1945 2HD1 ILE 103 2HD1 ILE 103 13.827 0.005 -1.067 1946 3HD1 ILE 103 3HD1 ILE 103 13.563 -1.094 -2.421 1947 H SER 104 H SER 104 18.241 -2.265 -1.919 1948 HA SER 104 HA SER 104 19.198 -0.343 0.084 1949 1HB SER 104 1HB SER 104 20.961 -0.086 -1.435 1950 2HB SER 104 2HB SER 104 20.403 -1.705 -1.851 1951 HG SER 104 HG SER 104 20.074 -0.937 -3.758 1952 H TYR 105 H TYR 105 19.731 1.831 -1.713 1953 HA TYR 105 HA TYR 105 16.993 2.782 -2.457 1954 1HB TYR 105 1HB TYR 105 19.083 4.295 -0.845 1955 2HB TYR 105 2HB TYR 105 17.469 4.872 -1.255 1956 HD1 TYR 105 HD1 TYR 105 15.651 2.767 -0.742 1957 HD2 TYR 105 HD2 TYR 105 19.242 3.732 1.409 1958 HE1 TYR 105 HE1 TYR 105 14.740 1.655 1.278 1959 HE2 TYR 105 HE2 TYR 105 18.330 2.620 3.429 1960 HH TYR 105 HH TYR 105 15.016 1.556 3.603 1961 H GLY 106 H GLY 106 20.305 4.156 -2.358 1962 1HA GLY 106 1HA GLY 106 21.061 4.028 -5.001 1963 2HA GLY 106 2HA GLY 106 19.925 5.377 -4.984 1964 H ASP 107 H ASP 107 21.932 6.617 -5.613 1965 HA ASP 107 HA ASP 107 24.088 6.952 -3.701 1966 1HB ASP 107 1HB ASP 107 23.345 7.733 -6.356 1967 2HB ASP 107 2HB ASP 107 23.770 9.194 -5.464 1968 H ASP 108 H ASP 108 20.978 8.520 -4.239 1969 HA ASP 108 HA ASP 108 21.540 10.840 -2.570 1970 1HB ASP 108 1HB ASP 108 19.045 9.534 -3.705 1971 2HB ASP 108 2HB ASP 108 19.005 11.051 -2.806 1972 H TYR 109 H TYR 109 19.023 8.349 -2.056 1973 HA TYR 109 HA TYR 109 18.765 8.772 0.740 1974 1HB TYR 109 1HB TYR 109 17.985 6.825 -1.328 1975 2HB TYR 109 2HB TYR 109 18.116 6.112 0.279 1976 HD1 TYR 109 HD1 TYR 109 17.114 9.571 -0.745 1977 HD2 TYR 109 HD2 TYR 109 15.908 5.860 1.049 1978 HE1 TYR 109 HE1 TYR 109 14.937 10.581 -0.121 1979 HE2 TYR 109 HE2 TYR 109 13.731 6.869 1.673 1980 HH TYR 109 HH TYR 109 12.338 9.105 0.495 1981 H TRP 110 H TRP 110 20.744 8.764 1.882 1982 HA TRP 110 HA TRP 110 22.654 7.839 2.922 1983 1HB TRP 110 1HB TRP 110 20.655 5.638 2.506 1984 2HB TRP 110 2HB TRP 110 22.248 5.209 3.128 1985 HD1 TRP 110 HD1 TRP 110 19.667 8.005 3.890 1986 HE1 TRP 110 HE1 TRP 110 19.507 8.261 6.451 1987 HE3 TRP 110 HE3 TRP 110 23.047 4.464 5.342 1988 HZ2 TRP 110 HZ2 TRP 110 20.662 7.115 8.804 1989 HZ3 TRP 110 HZ3 TRP 110 23.498 4.067 7.746 1990 HH2 TRP 110 HH2 TRP 110 22.310 5.386 9.478 1991 H LEU 111 H LEU 111 24.182 5.656 2.535 1992 HA LEU 111 HA LEU 111 25.521 6.133 0.044 1993 1HB LEU 111 1HB LEU 111 26.407 5.202 2.255 1994 2HB LEU 111 2HB LEU 111 25.661 3.667 1.809 1995 HG LEU 111 HG LEU 111 26.973 3.754 -0.347 1996 1HD1 LEU 111 1HD1 LEU 111 28.026 6.210 1.034 1997 2HD1 LEU 111 2HD1 LEU 111 27.559 6.002 -0.653 1998 3HD1 LEU 111 3HD1 LEU 111 29.067 5.304 -0.064 1999 1HD2 LEU 111 1HD2 LEU 111 27.695 2.794 2.088 2000 2HD2 LEU 111 2HD2 LEU 111 29.032 3.903 1.784 2001 3HD2 LEU 111 3HD2 LEU 111 28.686 2.604 0.641 2002 H SER 112 H SER 112 25.745 4.613 -1.758 2003 HA SER 112 HA SER 112 23.229 3.082 -2.256 2004 1HB SER 112 1HB SER 112 24.258 5.014 -3.712 2005 2HB SER 112 2HB SER 112 25.361 3.761 -4.280 2006 HG SER 112 HG SER 112 23.733 3.504 -5.632 2007 H ARG 113 H ARG 113 26.770 2.801 -2.749 2008 HA ARG 113 HA ARG 113 26.436 -0.167 -2.899 2009 1HB ARG 113 1HB ARG 113 27.554 1.356 -4.703 2010 2HB ARG 113 2HB ARG 113 28.907 1.435 -3.575 2011 1HG ARG 113 1HG ARG 113 29.304 -0.890 -3.707 2012 2HG ARG 113 2HG ARG 113 27.706 -1.213 -4.379 2013 1HD ARG 113 1HD ARG 113 28.699 0.469 -6.283 2014 2HD ARG 113 2HD ARG 113 30.185 -0.341 -5.754 2015 HE ARG 113 HE ARG 113 27.945 -1.607 -7.138 2016 1HH1 ARG 113 1HH1 ARG 113 30.559 -2.068 -4.886 2017 2HH1 ARG 113 2HH1 ARG 113 30.677 -3.765 -5.200 2018 1HH2 ARG 113 1HH2 ARG 113 28.116 -3.811 -7.528 2019 2HH2 ARG 113 2HH2 ARG 113 29.305 -4.746 -6.684 2020 HA PRO 114 HA PRO 114 28.344 0.757 1.245 2021 1HB PRO 114 1HB PRO 114 26.888 -1.185 2.577 2022 2HB PRO 114 2HB PRO 114 26.370 0.503 2.417 2023 1HG PRO 114 1HG PRO 114 25.511 -1.903 0.893 2024 2HG PRO 114 2HG PRO 114 24.565 -0.506 1.424 2025 1HD PRO 114 1HD PRO 114 25.430 -0.848 -1.134 2026 2HD PRO 114 2HD PRO 114 25.158 0.746 -0.401 2027 H ARG 115 H ARG 115 29.901 -0.480 -0.479 2028 HA ARG 115 HA ARG 115 30.180 -3.358 0.102 2029 1HB ARG 115 1HB ARG 115 30.661 -1.727 -2.046 2030 2HB ARG 115 2HB ARG 115 32.283 -1.869 -1.366 2031 1HG ARG 115 1HG ARG 115 31.936 -3.672 -2.971 2032 2HG ARG 115 2HG ARG 115 32.002 -4.356 -1.347 2033 1HD ARG 115 1HD ARG 115 29.676 -4.747 -1.286 2034 2HD ARG 115 2HD ARG 115 29.355 -3.575 -2.579 2035 HE ARG 115 HE ARG 115 29.936 -5.245 -4.157 2036 1HH1 ARG 115 1HH1 ARG 115 31.046 -6.101 -0.971 2037 2HH1 ARG 115 2HH1 ARG 115 31.561 -7.680 -1.454 2038 1HH2 ARG 115 1HH2 ARG 115 30.612 -7.299 -4.760 2039 2HH2 ARG 115 2HH2 ARG 115 31.318 -8.355 -3.583 2040 H LEU 116 H LEU 116 30.958 -0.709 1.884 2041 HA LEU 116 HA LEU 116 32.586 -0.264 3.532 2042 1HB LEU 116 1HB LEU 116 32.578 -3.285 3.233 2043 2HB LEU 116 2HB LEU 116 33.512 -2.477 4.488 2044 HG LEU 116 HG LEU 116 31.396 -3.123 5.454 2045 1HD1 LEU 116 1HD1 LEU 116 30.626 -0.325 5.013 2046 2HD1 LEU 116 2HD1 LEU 116 32.324 -0.523 5.447 2047 3HD1 LEU 116 3HD1 LEU 116 31.063 -1.149 6.510 2048 1HD2 LEU 116 1HD2 LEU 116 29.371 -2.999 4.403 2049 2HD2 LEU 116 2HD2 LEU 116 30.376 -2.973 2.953 2050 3HD2 LEU 116 3HD2 LEU 116 29.753 -1.465 3.623 2051 H THR 117 H THR 117 35.061 -1.075 4.079 2052 HA THR 117 HA THR 117 37.298 -0.944 3.340 2053 HB THR 117 HB THR 117 36.032 -2.393 0.983 2054 HG1 THR 117 HG1 THR 117 37.289 -3.469 3.276 2055 1HG2 THR 117 1HG2 THR 117 38.197 -1.908 0.265 2056 2HG2 THR 117 2HG2 THR 117 38.444 -3.451 1.083 2057 3HG2 THR 117 3HG2 THR 117 38.855 -1.943 1.901 2058 H GLN 118 H GLN 118 37.761 1.208 2.918 2059 HA GLN 118 HA GLN 118 38.164 3.152 1.646 2060 1HB GLN 118 1HB GLN 118 38.351 0.818 -0.096 2061 2HB GLN 118 2HB GLN 118 37.845 2.248 -0.995 2062 1HG GLN 118 1HG GLN 118 40.013 2.751 0.935 2063 2HG GLN 118 2HG GLN 118 40.452 1.642 -0.364 2064 1HE2 GLN 118 1HE2 GLN 118 40.860 2.555 -2.415 2065 2HE2 GLN 118 2HE2 GLN 118 40.588 4.186 -2.802 2066 H ASN 119 H ASN 119 36.002 1.686 -0.756 2067 HA ASN 119 HA ASN 119 34.284 4.056 -0.706 2068 1HB ASN 119 1HB ASN 119 35.023 2.520 -2.675 2069 2HB ASN 119 2HB ASN 119 33.760 1.427 -2.107 2070 1HD2 ASN 119 1HD2 ASN 119 31.682 1.849 -2.891 2071 2HD2 ASN 119 2HD2 ASN 119 31.189 3.314 -3.592 2072 1H GLY 201 1H GLY 201 17.773 22.018 13.592 2073 2H GLY 201 2H GLY 201 19.384 22.299 14.052 2074 3H GLY 201 3H GLY 201 18.275 21.683 15.180 2075 1HA GLY 201 1HA GLY 201 19.547 19.843 14.532 2076 2HA GLY 201 2HA GLY 201 18.018 19.703 13.665 2077 H LYS 202 H LYS 202 18.131 19.539 11.466 2078 HA LYS 202 HA LYS 202 20.788 19.726 10.182 2079 1HB LYS 202 1HB LYS 202 18.502 18.128 9.963 2080 2HB LYS 202 2HB LYS 202 18.464 19.120 8.505 2081 1HG LYS 202 1HG LYS 202 21.002 18.499 8.330 2082 2HG LYS 202 2HG LYS 202 20.575 17.178 9.417 2083 1HD LYS 202 1HD LYS 202 19.448 16.056 7.795 2084 2HD LYS 202 2HD LYS 202 18.702 17.528 7.172 2085 1HE LYS 202 1HE LYS 202 20.179 16.700 5.440 2086 2HE LYS 202 2HE LYS 202 20.989 18.101 6.166 2087 1HZ LYS 202 1HZ LYS 202 22.478 16.179 6.045 2088 2HZ LYS 202 2HZ LYS 202 21.385 15.260 6.965 2089 3HZ LYS 202 3HZ LYS 202 22.161 16.602 7.659 2090 H ALA 203 H ALA 203 21.082 22.050 10.136 2091 HA ALA 203 HA ALA 203 20.852 24.211 9.210 2092 1HB ALA 203 1HB ALA 203 19.849 22.263 7.132 2093 2HB ALA 203 2HB ALA 203 21.363 23.168 7.151 2094 3HB ALA 203 3HB ALA 203 19.846 23.994 6.796 2095 HA PRO 204 HA PRO 204 16.291 24.063 10.478 2096 1HB PRO 204 1HB PRO 204 16.699 25.885 12.567 2097 2HB PRO 204 2HB PRO 204 16.586 24.127 12.756 2098 1HG PRO 204 1HG PRO 204 18.980 25.878 12.666 2099 2HG PRO 204 2HG PRO 204 18.699 24.395 13.588 2100 1HD PRO 204 1HD PRO 204 20.248 24.478 11.367 2101 2HD PRO 204 2HD PRO 204 19.316 23.040 11.837 2102 H ARG 205 H ARG 205 18.173 27.019 11.203 2103 HA ARG 205 HA ARG 205 17.950 29.214 10.383 2104 1HB ARG 205 1HB ARG 205 17.416 27.388 8.043 2105 2HB ARG 205 2HB ARG 205 17.334 29.137 7.834 2106 1HG ARG 205 1HG ARG 205 19.691 28.590 9.326 2107 2HG ARG 205 2HG ARG 205 19.664 27.458 7.974 2108 1HD ARG 205 1HD ARG 205 19.129 30.418 7.593 2109 2HD ARG 205 2HD ARG 205 20.759 29.726 7.490 2110 HE ARG 205 HE ARG 205 18.617 29.350 5.542 2111 1HH1 ARG 205 1HH1 ARG 205 21.441 27.932 7.004 2112 2HH1 ARG 205 2HH1 ARG 205 21.768 26.914 5.645 2113 1HH2 ARG 205 1HH2 ARG 205 19.064 28.019 3.791 2114 2HH2 ARG 205 2HH2 ARG 205 20.434 26.961 3.839 2115 H LYS 206 H LYS 206 15.374 28.027 8.264 2116 HA LYS 206 HA LYS 206 13.300 29.137 10.079 2117 1HB LYS 206 1HB LYS 206 13.984 30.124 7.287 2118 2HB LYS 206 2HB LYS 206 12.512 30.574 8.147 2119 1HG LYS 206 1HG LYS 206 14.064 31.328 10.057 2120 2HG LYS 206 2HG LYS 206 15.373 31.209 8.881 2121 1HD LYS 206 1HD LYS 206 12.890 32.725 8.146 2122 2HD LYS 206 2HD LYS 206 14.079 33.492 9.198 2123 1HE LYS 206 1HE LYS 206 15.347 33.967 7.381 2124 2HE LYS 206 2HE LYS 206 15.485 32.233 7.035 2125 1HZ LYS 206 1HZ LYS 206 13.132 33.916 6.338 2126 2HZ LYS 206 2HZ LYS 206 13.371 32.287 5.920 2127 3HZ LYS 206 3HZ LYS 206 14.358 33.491 5.241 2128 H GLN 207 H GLN 207 13.596 28.163 6.636 2129 HA GLN 207 HA GLN 207 11.349 26.231 7.116 2130 1HB GLN 207 1HB GLN 207 12.154 27.875 4.687 2131 2HB GLN 207 2HB GLN 207 10.841 26.698 4.694 2132 1HG GLN 207 1HG GLN 207 10.194 28.179 6.887 2133 2HG GLN 207 2HG GLN 207 10.956 29.410 5.880 2134 1HE2 GLN 207 1HE2 GLN 207 8.739 30.368 5.615 2135 2HE2 GLN 207 2HE2 GLN 207 7.661 29.676 4.501 2136 H LEU 208 H LEU 208 11.403 24.490 5.248 2137 HA LEU 208 HA LEU 208 14.128 23.768 4.363 2138 1HB LEU 208 1HB LEU 208 13.623 23.027 6.815 2139 2HB LEU 208 2HB LEU 208 12.557 21.834 6.074 2140 HG LEU 208 HG LEU 208 14.663 21.336 4.563 2141 1HD1 LEU 208 1HD1 LEU 208 16.406 22.674 5.130 2142 2HD1 LEU 208 2HD1 LEU 208 16.585 21.604 6.520 2143 3HD1 LEU 208 3HD1 LEU 208 15.681 23.109 6.678 2144 1HD2 LEU 208 1HD2 LEU 208 13.640 19.722 6.105 2145 2HD2 LEU 208 2HD2 LEU 208 14.458 20.485 7.469 2146 3HD2 LEU 208 3HD2 LEU 208 15.398 19.649 6.232 2147 H ALA 209 H ALA 209 12.332 24.328 2.531 2148 HA ALA 209 HA ALA 209 11.422 21.672 1.520 2149 1HB ALA 209 1HB ALA 209 9.702 23.303 2.780 2150 2HB ALA 209 2HB ALA 209 9.208 22.366 1.370 2151 3HB ALA 209 3HB ALA 209 9.648 24.064 1.189 2152 H THR 210 H THR 210 13.502 22.262 0.254 2153 HA THR 210 HA THR 210 12.855 24.133 -1.999 2154 HB THR 210 HB THR 210 15.323 24.345 -2.166 2155 HG1 THR 210 HG1 THR 210 15.404 22.729 0.153 2156 1HG2 THR 210 1HG2 THR 210 13.910 25.716 -0.526 2157 2HG2 THR 210 2HG2 THR 210 15.640 25.640 -0.187 2158 3HG2 THR 210 3HG2 THR 210 14.516 24.640 0.733 2159 H LYS 211 H LYS 211 14.858 21.218 -1.371 2160 HA LYS 211 HA LYS 211 13.611 19.717 -3.528 2161 1HB LYS 211 1HB LYS 211 15.655 19.776 -4.987 2162 2HB LYS 211 2HB LYS 211 14.899 21.361 -4.819 2163 1HG LYS 211 1HG LYS 211 16.637 22.207 -3.587 2164 2HG LYS 211 2HG LYS 211 16.956 20.667 -2.789 2165 1HD LYS 211 1HD LYS 211 18.800 21.269 -4.318 2166 2HD LYS 211 2HD LYS 211 17.982 19.804 -4.861 2167 1HE LYS 211 1HE LYS 211 17.324 20.795 -6.800 2168 2HE LYS 211 2HE LYS 211 16.757 22.242 -5.946 2169 1HZ LYS 211 1HZ LYS 211 18.638 22.890 -7.225 2170 2HZ LYS 211 2HZ LYS 211 19.548 21.554 -6.703 2171 3HZ LYS 211 3HZ LYS 211 19.165 22.800 -5.614 2172 H ALA 212 H ALA 212 14.392 17.533 -3.564 2173 HA ALA 212 HA ALA 212 16.758 16.674 -2.137 2174 1HB ALA 212 1HB ALA 212 15.635 17.216 -0.137 2175 2HB ALA 212 2HB ALA 212 15.227 15.512 -0.335 2176 3HB ALA 212 3HB ALA 212 14.062 16.755 -0.788 2177 H ALA 213 H ALA 213 17.219 15.020 -3.548 2178 HA ALA 213 HA ALA 213 15.385 13.548 -5.117 2179 1HB ALA 213 1HB ALA 213 17.784 13.618 -5.532 2180 2HB ALA 213 2HB ALA 213 17.335 11.937 -5.246 2181 3HB ALA 213 3HB ALA 213 18.117 12.870 -3.970 2182 H ARG 214 H ARG 214 14.698 11.282 -4.863 2183 HA ARG 214 HA ARG 214 14.354 10.502 -1.985 2184 1HB ARG 214 1HB ARG 214 12.562 9.983 -4.389 2185 2HB ARG 214 2HB ARG 214 12.182 9.604 -2.710 2186 1HG ARG 214 1HG ARG 214 12.613 12.150 -2.299 2187 2HG ARG 214 2HG ARG 214 12.374 12.298 -4.040 2188 1HD ARG 214 1HD ARG 214 10.243 10.720 -3.378 2189 2HD ARG 214 2HD ARG 214 10.395 11.710 -1.915 2190 HE ARG 214 HE ARG 214 9.618 12.677 -4.549 2191 1HH1 ARG 214 1HH1 ARG 214 11.274 13.488 -1.596 2192 2HH1 ARG 214 2HH1 ARG 214 11.011 15.187 -1.786 2193 1HH2 ARG 214 1HH2 ARG 214 9.290 14.887 -4.773 2194 2HH2 ARG 214 2HH2 ARG 214 9.897 15.975 -3.570 2195 1HN MLZ 215 1HN MLZ 215 13.137 7.934 -2.939 2196 HA MLZ 215 HA MLZ 215 15.415 6.253 -2.859 2197 1HB MLZ 215 1HB MLZ 215 12.544 6.098 -3.195 2198 2HB MLZ 215 2HB MLZ 215 13.327 4.952 -4.283 2199 1HG MLZ 215 1HG MLZ 215 14.704 4.788 -1.807 2200 2HG MLZ 215 2HG MLZ 215 13.654 3.573 -2.534 2201 1HD MLZ 215 1HD MLZ 215 12.485 5.902 -1.020 2202 2HD MLZ 215 2HD MLZ 215 11.758 4.332 -1.362 2203 1HE MLZ 215 1HE MLZ 215 13.652 5.105 0.800 2204 2HE MLZ 215 2HE MLZ 215 13.915 3.515 0.059 2205 HZ MLZ 215 HZ MLZ 215 11.758 2.843 0.553 2206 1HCM MLZ 215 1HCM MLZ 215 12.500 4.652 2.789 2207 2HCM MLZ 215 2HCM MLZ 215 13.131 3.023 2.545 2208 3HCM MLZ 215 3HCM MLZ 215 11.419 3.263 2.896 2209 H SER 216 H SER 216 17.007 6.126 -4.387 2210 HA SER 216 HA SER 216 18.051 5.972 -6.499 2211 1HB SER 216 1HB SER 216 16.195 7.522 -8.029 2212 2HB SER 216 2HB SER 216 16.239 8.201 -6.402 2213 HG SER 216 HG SER 216 17.863 9.040 -7.831 2214 H ALA 217 H ALA 217 15.607 4.197 -5.770 2215 HA ALA 217 HA ALA 217 14.440 2.443 -6.832 2216 1HB ALA 217 1HB ALA 217 12.819 3.492 -8.019 2217 2HB ALA 217 2HB ALA 217 13.950 3.811 -9.335 2218 3HB ALA 217 3HB ALA 217 13.806 4.953 -7.999 2219 HA PRO 218 HA PRO 218 16.847 0.192 -9.725 2220 1HB PRO 218 1HB PRO 218 14.820 0.264 -11.896 2221 2HB PRO 218 2HB PRO 218 15.500 -1.133 -11.043 2222 1HG PRO 218 1HG PRO 218 12.989 -0.268 -10.630 2223 2HG PRO 218 2HG PRO 218 13.963 -1.013 -9.355 2224 1HD PRO 218 1HD PRO 218 13.259 1.846 -9.776 2225 2HD PRO 218 2HD PRO 218 13.509 0.950 -8.263 2226 H ALA 219 H ALA 219 17.079 0.250 -12.526 2227 HA ALA 219 HA ALA 219 17.246 2.993 -13.513 2228 1HB ALA 219 1HB ALA 219 19.230 3.423 -12.484 2229 2HB ALA 219 2HB ALA 219 19.945 2.248 -13.588 2230 3HB ALA 219 3HB ALA 219 19.407 1.741 -11.987 2231 H THR 220 H THR 220 16.995 2.780 -15.701 2232 HA THR 220 HA THR 220 18.107 0.322 -17.017 2233 HB THR 220 HB THR 220 16.055 0.470 -18.464 2234 HG1 THR 220 HG1 THR 220 14.507 1.935 -17.966 2235 1HG2 THR 220 1HG2 THR 220 14.599 0.315 -16.038 2236 2HG2 THR 220 2HG2 THR 220 16.224 -0.269 -15.683 2237 3HG2 THR 220 3HG2 THR 220 15.278 -1.021 -16.967 2238 H GLY 221 H GLY 221 17.008 3.687 -17.558 2239 1HA GLY 221 1HA GLY 221 18.990 5.003 -18.665 2240 2HA GLY 221 2HA GLY 221 18.779 3.813 -19.950 2241 1HN SAH 301 1HN SAH 301 -11.711 -0.035 -8.433 2242 2HN SAH 301 2HN SAH 301 -10.585 0.709 -9.466 2243 HA SAH 301 HA SAH 301 -10.623 2.626 -7.736 2244 1HB SAH 301 1HB SAH 301 -11.737 0.184 -6.310 2245 2HB SAH 301 2HB SAH 301 -11.123 1.607 -5.468 2246 1HG SAH 301 1HG SAH 301 -13.715 1.341 -6.145 2247 2HG SAH 301 2HG SAH 301 -13.114 2.084 -7.625 2248 1H5* SAH 301 1H5* SAH 301 -15.136 2.709 -5.584 2249 2H5* SAH 301 2H5* SAH 301 -14.820 3.945 -4.365 2250 H4* SAH 301 H4* SAH 301 -14.672 5.576 -6.242 2251 H3* SAH 301 H3* SAH 301 -16.939 4.353 -4.929 2252 *HO3 SAH 301 *HO3 SAH 301 -16.152 6.520 -4.708 2253 H2* SAH 301 H2* SAH 301 -18.316 3.897 -6.632 2254 *HO2 SAH 301 *HO2 SAH 301 -19.257 5.628 -7.305 2255 H1* SAH 301 H1* SAH 301 -16.830 4.774 -8.929 2256 H8 SAH 301 H8 SAH 301 -15.597 1.551 -7.526 2257 1HN6 SAH 301 1HN6 SAH 301 -19.625 -1.502 -9.964 2258 2HN6 SAH 301 2HN6 SAH 301 -20.150 -1.313 -8.306 2259 H2 SAH 301 H2 SAH 301 -21.126 3.094 -10.348 2260 1HN SAH 302 1HN SAH 302 11.625 -0.145 8.417 2261 2HN SAH 302 2HN SAH 302 10.509 0.618 9.444 2262 HA SAH 302 HA SAH 302 10.607 2.539 7.719 2263 1HB SAH 302 1HB SAH 302 11.677 0.074 6.298 2264 2HB SAH 302 2HB SAH 302 11.102 1.511 5.453 2265 1HG SAH 302 1HG SAH 302 13.682 1.186 6.151 2266 2HG SAH 302 2HG SAH 302 13.088 1.942 7.629 2267 1H5* SAH 302 1H5* SAH 302 15.138 2.523 5.606 2268 2H5* SAH 302 2H5* SAH 302 14.861 3.767 4.387 2269 H4* SAH 302 H4* SAH 302 14.733 5.399 6.266 2270 H3* SAH 302 H3* SAH 302 16.983 4.127 4.971 2271 *HO3 SAH 302 *HO3 SAH 302 16.246 6.312 4.748 2272 H2* SAH 302 H2* SAH 302 18.334 3.638 6.685 2273 *HO2 SAH 302 *HO2 SAH 302 19.307 5.346 7.370 2274 H1* SAH 302 H1* SAH 302 16.847 4.544 8.970 2275 H8 SAH 302 H8 SAH 302 15.555 1.351 7.551 2276 1HN6 SAH 302 1HN6 SAH 302 19.494 -1.795 10.017 2277 2HN6 SAH 302 2HN6 SAH 302 20.037 -1.615 8.364 2278 H2 SAH 302 H2 SAH 302 21.093 2.766 10.424 Start of MODEL 20 1 1H MET 1 1H MET 1 -2.814 -7.262 -5.469 2 2H MET 1 2H MET 1 -2.816 -8.589 -4.408 3 3H MET 1 3H MET 1 -4.154 -8.303 -5.414 4 HA MET 1 HA MET 1 -2.487 -8.571 -7.344 5 1HB MET 1 1HB MET 1 -1.105 -9.741 -4.915 6 2HB MET 1 2HB MET 1 -0.602 -10.072 -6.565 7 1HG MET 1 1HG MET 1 -0.866 -7.279 -5.499 8 2HG MET 1 2HG MET 1 0.638 -8.183 -5.397 9 1HE MET 1 1HE MET 1 -1.682 -6.105 -8.213 10 2HE MET 1 2HE MET 1 -0.124 -5.280 -8.155 11 3HE MET 1 3HE MET 1 -0.951 -5.709 -6.657 12 H PHE 2 H PHE 2 -1.782 -11.278 -7.531 13 HA PHE 2 HA PHE 2 -4.457 -12.535 -7.385 14 1HB PHE 2 1HB PHE 2 -3.295 -14.296 -8.762 15 2HB PHE 2 2HB PHE 2 -3.210 -12.686 -9.469 16 HD1 PHE 2 HD1 PHE 2 -1.310 -15.196 -7.479 17 HD2 PHE 2 HD2 PHE 2 -1.119 -11.606 -9.829 18 HE1 PHE 2 HE1 PHE 2 1.166 -15.341 -7.499 19 HE2 PHE 2 HE2 PHE 2 1.356 -11.750 -9.849 20 HZ PHE 2 HZ PHE 2 2.498 -13.617 -8.683 21 H ASN 3 H ASN 3 -4.980 -14.107 -5.929 22 HA ASN 3 HA ASN 3 -2.855 -15.578 -4.480 23 1HB ASN 3 1HB ASN 3 -3.993 -13.212 -3.498 24 2HB ASN 3 2HB ASN 3 -4.866 -14.492 -2.654 25 1HD2 ASN 3 1HD2 ASN 3 -3.016 -16.437 -2.179 26 2HD2 ASN 3 2HD2 ASN 3 -1.689 -15.838 -1.308 27 H ASP 4 H ASP 4 -3.586 -17.614 -3.842 28 HA ASP 4 HA ASP 4 -5.761 -18.877 -5.021 29 1HB ASP 4 1HB ASP 4 -3.750 -19.697 -3.561 30 2HB ASP 4 2HB ASP 4 -4.872 -19.529 -2.211 31 H ARG 5 H ARG 5 -5.732 -17.348 -1.779 32 HA ARG 5 HA ARG 5 -8.531 -17.937 -1.264 33 1HB ARG 5 1HB ARG 5 -6.446 -16.088 -0.061 34 2HB ARG 5 2HB ARG 5 -8.061 -16.275 0.622 35 1HG ARG 5 1HG ARG 5 -7.173 -18.895 0.211 36 2HG ARG 5 2HG ARG 5 -5.757 -18.045 0.828 37 1HD ARG 5 1HD ARG 5 -8.410 -17.609 2.176 38 2HD ARG 5 2HD ARG 5 -7.483 -19.077 2.536 39 HE ARG 5 HE ARG 5 -6.771 -16.394 3.363 40 1HH1 ARG 5 1HH1 ARG 5 -5.465 -19.420 2.241 41 2HH1 ARG 5 2HH1 ARG 5 -3.937 -19.172 3.012 42 1HH2 ARG 5 1HH2 ARG 5 -4.780 -16.096 4.355 43 2HH2 ARG 5 2HH2 ARG 5 -3.550 -17.305 4.200 44 H VAL 6 H VAL 6 -6.754 -15.172 -2.597 45 HA VAL 6 HA VAL 6 -9.305 -14.049 -3.595 46 HB VAL 6 HB VAL 6 -7.409 -12.614 -1.694 47 1HG1 VAL 6 1HG1 VAL 6 -9.513 -11.671 -3.560 48 2HG1 VAL 6 2HG1 VAL 6 -8.115 -10.812 -2.913 49 3HG1 VAL 6 3HG1 VAL 6 -9.572 -10.991 -1.934 50 1HG2 VAL 6 1HG2 VAL 6 -10.228 -13.679 -1.433 51 2HG2 VAL 6 2HG2 VAL 6 -9.578 -12.459 -0.337 52 3HG2 VAL 6 3HG2 VAL 6 -8.828 -14.053 -0.427 53 H ILE 7 H ILE 7 -8.961 -13.126 -5.580 54 HA ILE 7 HA ILE 7 -6.118 -12.605 -6.374 55 HB ILE 7 HB ILE 7 -7.140 -14.517 -7.490 56 1HG1 ILE 7 1HG1 ILE 7 -7.242 -12.161 -9.397 57 2HG1 ILE 7 2HG1 ILE 7 -5.740 -12.892 -8.835 58 1HG2 ILE 7 1HG2 ILE 7 -9.428 -12.612 -7.755 59 2HG2 ILE 7 2HG2 ILE 7 -9.440 -14.333 -7.357 60 3HG2 ILE 7 3HG2 ILE 7 -9.199 -13.812 -9.027 61 1HD1 ILE 7 1HD1 ILE 7 -5.929 -14.392 -10.503 62 2HD1 ILE 7 2HD1 ILE 7 -7.539 -13.798 -10.918 63 3HD1 ILE 7 3HD1 ILE 7 -7.348 -15.043 -9.681 64 H VAL 8 H VAL 8 -5.771 -10.797 -7.832 65 HA VAL 8 HA VAL 8 -7.610 -8.551 -7.302 66 HB VAL 8 HB VAL 8 -5.114 -8.427 -7.090 67 1HG1 VAL 8 1HG1 VAL 8 -5.016 -9.888 -9.365 68 2HG1 VAL 8 2HG1 VAL 8 -3.682 -8.869 -8.830 69 3HG1 VAL 8 3HG1 VAL 8 -4.812 -8.275 -10.045 70 1HG2 VAL 8 1HG2 VAL 8 -6.679 -6.666 -8.942 71 2HG2 VAL 8 2HG2 VAL 8 -4.943 -6.387 -8.780 72 3HG2 VAL 8 3HG2 VAL 8 -5.986 -6.296 -7.361 73 H LYS 9 H LYS 9 -9.191 -8.016 -8.729 74 HA LYS 9 HA LYS 9 -8.693 -8.274 -11.625 75 1HB LYS 9 1HB LYS 9 -10.718 -9.781 -10.004 76 2HB LYS 9 2HB LYS 9 -11.006 -9.464 -11.714 77 1HG LYS 9 1HG LYS 9 -8.757 -10.484 -12.200 78 2HG LYS 9 2HG LYS 9 -8.647 -10.937 -10.502 79 1HD LYS 9 1HD LYS 9 -10.352 -12.512 -10.678 80 2HD LYS 9 2HD LYS 9 -11.085 -11.713 -12.069 81 1HE LYS 9 1HE LYS 9 -9.676 -12.757 -13.567 82 2HE LYS 9 2HE LYS 9 -8.311 -12.754 -12.437 83 1HZ LYS 9 1HZ LYS 9 -9.235 -14.989 -12.703 84 2HZ LYS 9 2HZ LYS 9 -10.759 -14.433 -12.202 85 3HZ LYS 9 3HZ LYS 9 -9.454 -14.429 -11.115 86 H LYS 10 H LYS 10 -10.752 -5.337 -11.762 87 HA LYS 10 HA LYS 10 -9.185 -5.292 -13.471 88 1HB LYS 10 1HB LYS 10 -7.924 -6.059 -11.078 89 2HB LYS 10 2HB LYS 10 -7.280 -7.145 -12.309 90 1HG LYS 10 1HG LYS 10 -7.357 -4.116 -12.473 91 2HG LYS 10 2HG LYS 10 -5.923 -5.102 -12.189 92 1HD LYS 10 1HD LYS 10 -7.664 -5.315 -14.663 93 2HD LYS 10 2HD LYS 10 -6.176 -4.375 -14.581 94 1HE LYS 10 1HE LYS 10 -5.806 -7.094 -13.567 95 2HE LYS 10 2HE LYS 10 -6.341 -7.071 -15.258 96 1HZ LYS 10 1HZ LYS 10 -4.636 -5.452 -15.758 97 2HZ LYS 10 2HZ LYS 10 -3.913 -6.814 -15.047 98 3HZ LYS 10 3HZ LYS 10 -4.147 -5.402 -14.133 99 H SER 11 H SER 11 -11.004 -6.716 -14.492 100 HA SER 11 HA SER 11 -9.704 -8.847 -15.905 101 1HB SER 11 1HB SER 11 -11.471 -9.415 -13.608 102 2HB SER 11 2HB SER 11 -11.650 -10.453 -15.023 103 HG SER 11 HG SER 11 -9.410 -10.863 -14.913 104 HA PRO 12 HA PRO 12 -14.077 -8.508 -17.654 105 1HB PRO 12 1HB PRO 12 -15.938 -7.078 -16.229 106 2HB PRO 12 2HB PRO 12 -15.644 -8.808 -15.958 107 1HG PRO 12 1HG PRO 12 -14.562 -6.452 -14.461 108 2HG PRO 12 2HG PRO 12 -15.234 -7.955 -13.832 109 1HD PRO 12 1HD PRO 12 -12.631 -7.506 -13.945 110 2HD PRO 12 2HD PRO 12 -13.322 -9.121 -14.202 111 H LEU 13 H LEU 13 -12.033 -6.689 -18.151 112 HA LEU 13 HA LEU 13 -11.555 -4.522 -18.970 113 1HB LEU 13 1HB LEU 13 -13.866 -5.696 -20.081 114 2HB LEU 13 2HB LEU 13 -14.293 -4.007 -19.804 115 HG LEU 13 HG LEU 13 -11.798 -3.709 -20.837 116 1HD1 LEU 13 1HD1 LEU 13 -11.123 -5.433 -22.142 117 2HD1 LEU 13 2HD1 LEU 13 -12.744 -5.679 -22.791 118 3HD1 LEU 13 3HD1 LEU 13 -12.292 -6.405 -21.248 119 1HD2 LEU 13 1HD2 LEU 13 -12.882 -2.893 -22.769 120 2HD2 LEU 13 2HD2 LEU 13 -14.119 -2.768 -21.519 121 3HD2 LEU 13 3HD2 LEU 13 -14.160 -4.104 -22.670 122 H GLY 14 H GLY 14 -12.681 -4.713 -16.135 123 1HA GLY 14 1HA GLY 14 -14.133 -2.129 -15.945 124 2HA GLY 14 2HA GLY 14 -13.967 -3.308 -14.644 125 H GLY 15 H GLY 15 -12.837 -2.303 -13.041 126 1HA GLY 15 1HA GLY 15 -10.341 -0.853 -13.828 127 2HA GLY 15 2HA GLY 15 -11.368 -0.313 -12.500 128 H TYR 16 H TYR 16 -11.013 -1.191 -10.483 129 HA TYR 16 HA TYR 16 -9.312 -3.642 -10.292 130 1HB TYR 16 1HB TYR 16 -8.676 -0.864 -9.670 131 2HB TYR 16 2HB TYR 16 -8.502 -1.890 -8.246 132 HD1 TYR 16 HD1 TYR 16 -7.397 -1.365 -11.744 133 HD2 TYR 16 HD2 TYR 16 -6.781 -3.566 -8.108 134 HE1 TYR 16 HE1 TYR 16 -5.252 -2.236 -12.635 135 HE2 TYR 16 HE2 TYR 16 -4.637 -4.437 -8.997 136 HH TYR 16 HH TYR 16 -3.814 -4.577 -11.993 137 H GLY 17 H GLY 17 -10.694 -5.016 -9.217 138 1HA GLY 17 1HA GLY 17 -11.876 -4.029 -6.658 139 2HA GLY 17 2HA GLY 17 -12.861 -4.973 -7.777 140 H VAL 18 H VAL 18 -12.625 -6.128 -5.339 141 HA VAL 18 HA VAL 18 -10.277 -7.966 -5.438 142 HB VAL 18 HB VAL 18 -12.464 -7.403 -3.402 143 1HG1 VAL 18 1HG1 VAL 18 -11.161 -8.821 -1.873 144 2HG1 VAL 18 2HG1 VAL 18 -10.005 -9.166 -3.160 145 3HG1 VAL 18 3HG1 VAL 18 -11.664 -9.753 -3.283 146 1HG2 VAL 18 1HG2 VAL 18 -9.622 -6.522 -3.792 147 2HG2 VAL 18 2HG2 VAL 18 -10.269 -6.650 -2.157 148 3HG2 VAL 18 3HG2 VAL 18 -11.030 -5.569 -3.324 149 H PHE 19 H PHE 19 -10.593 -9.855 -6.568 150 HA PHE 19 HA PHE 19 -13.338 -10.850 -7.034 151 1HB PHE 19 1HB PHE 19 -10.678 -11.041 -8.214 152 2HB PHE 19 2HB PHE 19 -11.429 -12.631 -8.076 153 HD1 PHE 19 HD1 PHE 19 -12.886 -9.230 -8.676 154 HD2 PHE 19 HD2 PHE 19 -12.283 -13.205 -10.183 155 HE1 PHE 19 HE1 PHE 19 -14.325 -8.708 -10.627 156 HE2 PHE 19 HE2 PHE 19 -13.723 -12.685 -12.133 157 HZ PHE 19 HZ PHE 19 -14.740 -10.435 -12.358 158 H ALA 20 H ALA 20 -14.239 -12.405 -5.763 159 HA ALA 20 HA ALA 20 -12.596 -13.680 -3.667 160 1HB ALA 20 1HB ALA 20 -15.327 -14.531 -3.686 161 2HB ALA 20 2HB ALA 20 -15.303 -12.813 -4.084 162 3HB ALA 20 3HB ALA 20 -14.563 -13.383 -2.589 163 H ARG 21 H ARG 21 -11.378 -15.181 -5.035 164 HA ARG 21 HA ARG 21 -12.528 -17.103 -6.797 165 1HB ARG 21 1HB ARG 21 -10.086 -16.423 -6.329 166 2HB ARG 21 2HB ARG 21 -10.177 -17.540 -4.979 167 1HG ARG 21 1HG ARG 21 -10.266 -19.400 -6.332 168 2HG ARG 21 2HG ARG 21 -11.123 -18.543 -7.614 169 1HD ARG 21 1HD ARG 21 -9.115 -18.456 -8.690 170 2HD ARG 21 2HD ARG 21 -8.639 -17.253 -7.477 171 HE ARG 21 HE ARG 21 -7.379 -18.937 -6.383 172 1HH1 ARG 21 1HH1 ARG 21 -9.630 -20.333 -8.641 173 2HH1 ARG 21 2HH1 ARG 21 -9.002 -21.932 -8.448 174 1HH2 ARG 21 1HH2 ARG 21 -6.581 -21.024 -6.149 175 2HH2 ARG 21 2HH2 ARG 21 -7.289 -22.323 -7.049 176 H LYS 22 H LYS 22 -12.596 -16.808 -3.346 177 HA LYS 22 HA LYS 22 -13.577 -19.612 -3.018 178 1HB LYS 22 1HB LYS 22 -12.689 -17.483 -1.026 179 2HB LYS 22 2HB LYS 22 -13.044 -19.162 -0.637 180 1HG LYS 22 1HG LYS 22 -11.137 -18.971 -2.821 181 2HG LYS 22 2HG LYS 22 -10.556 -18.140 -1.377 182 1HD LYS 22 1HD LYS 22 -11.351 -20.284 -0.118 183 2HD LYS 22 2HD LYS 22 -11.313 -21.037 -1.712 184 1HE LYS 22 1HE LYS 22 -8.975 -19.611 -0.386 185 2HE LYS 22 2HE LYS 22 -9.150 -21.367 -0.568 186 1HZ LYS 22 1HZ LYS 22 -9.476 -20.909 -3.007 187 2HZ LYS 22 2HZ LYS 22 -7.904 -20.630 -2.426 188 3HZ LYS 22 3HZ LYS 22 -8.949 -19.322 -2.712 189 H SER 23 H SER 23 -16.670 -18.385 -1.380 190 HA SER 23 HA SER 23 -14.437 -20.372 -1.269 191 1HB SER 23 1HB SER 23 -16.712 -21.126 -1.926 192 2HB SER 23 2HB SER 23 -16.235 -21.838 -0.385 193 HG SER 23 HG SER 23 -18.141 -19.891 -0.946 194 H PHE 24 H PHE 24 -16.251 -18.020 0.577 195 HA PHE 24 HA PHE 24 -14.604 -18.719 2.989 196 1HB PHE 24 1HB PHE 24 -15.642 -16.113 1.828 197 2HB PHE 24 2HB PHE 24 -14.945 -16.218 3.444 198 HD1 PHE 24 HD1 PHE 24 -12.757 -18.130 3.111 199 HD2 PHE 24 HD2 PHE 24 -14.075 -14.991 0.494 200 HE1 PHE 24 HE1 PHE 24 -10.480 -17.985 2.138 201 HE2 PHE 24 HE2 PHE 24 -11.800 -14.844 -0.478 202 HZ PHE 24 HZ PHE 24 -10.002 -16.341 0.344 203 H GLU 25 H GLU 25 -15.643 -18.389 5.067 204 HA GLU 25 HA GLU 25 -18.596 -18.790 4.957 205 1HB GLU 25 1HB GLU 25 -16.686 -20.213 6.175 206 2HB GLU 25 2HB GLU 25 -16.919 -19.005 7.437 207 1HG GLU 25 1HG GLU 25 -19.514 -19.695 6.692 208 2HG GLU 25 2HG GLU 25 -18.647 -21.230 6.660 209 H LYS 26 H LYS 26 -19.868 -17.654 6.688 210 HA LYS 26 HA LYS 26 -19.465 -14.827 6.650 211 1HB LYS 26 1HB LYS 26 -21.596 -16.137 7.005 212 2HB LYS 26 2HB LYS 26 -21.029 -16.520 8.626 213 1HG LYS 26 1HG LYS 26 -20.774 -13.983 8.959 214 2HG LYS 26 2HG LYS 26 -21.733 -13.815 7.490 215 1HD LYS 26 1HD LYS 26 -23.532 -15.168 8.512 216 2HD LYS 26 2HD LYS 26 -22.578 -15.310 9.990 217 1HE LYS 26 1HE LYS 26 -23.022 -13.144 10.635 218 2HE LYS 26 2HE LYS 26 -23.019 -12.542 8.967 219 1HZ LYS 26 1HZ LYS 26 -25.099 -14.390 9.998 220 2HZ LYS 26 2HZ LYS 26 -25.138 -13.463 8.576 221 3HZ LYS 26 3HZ LYS 26 -25.270 -12.703 10.089 222 H GLY 27 H GLY 27 -17.210 -14.596 7.405 223 1HA GLY 27 1HA GLY 27 -16.485 -13.497 9.634 224 2HA GLY 27 2HA GLY 27 -16.872 -15.068 10.335 225 H GLU 28 H GLU 28 -15.237 -14.294 7.257 226 HA GLU 28 HA GLU 28 -12.881 -15.859 8.262 227 1HB GLU 28 1HB GLU 28 -14.470 -15.805 5.740 228 2HB GLU 28 2HB GLU 28 -12.731 -16.041 5.565 229 1HG GLU 28 1HG GLU 28 -13.136 -17.776 7.549 230 2HG GLU 28 2HG GLU 28 -14.763 -17.797 6.875 231 H LEU 29 H LEU 29 -11.268 -14.395 8.704 232 HA LEU 29 HA LEU 29 -11.038 -11.747 7.784 233 1HB LEU 29 1HB LEU 29 -9.788 -13.074 9.618 234 2HB LEU 29 2HB LEU 29 -8.717 -13.623 8.332 235 HG LEU 29 HG LEU 29 -7.854 -11.611 9.557 236 1HD1 LEU 29 1HD1 LEU 29 -8.449 -10.621 6.813 237 2HD1 LEU 29 2HD1 LEU 29 -7.646 -12.186 6.942 238 3HD1 LEU 29 3HD1 LEU 29 -6.903 -10.752 7.653 239 1HD2 LEU 29 1HD2 LEU 29 -9.603 -9.720 8.193 240 2HD2 LEU 29 2HD2 LEU 29 -9.119 -9.775 9.888 241 3HD2 LEU 29 3HD2 LEU 29 -10.491 -10.733 9.332 242 H VAL 30 H VAL 30 -10.908 -11.093 5.682 243 HA VAL 30 HA VAL 30 -9.737 -12.859 3.622 244 HB VAL 30 HB VAL 30 -10.982 -10.085 3.524 245 1HG1 VAL 30 1HG1 VAL 30 -9.457 -11.093 1.591 246 2HG1 VAL 30 2HG1 VAL 30 -10.949 -10.232 1.211 247 3HG1 VAL 30 3HG1 VAL 30 -10.926 -11.996 1.220 248 1HG2 VAL 30 1HG2 VAL 30 -12.105 -12.874 3.380 249 2HG2 VAL 30 2HG2 VAL 30 -12.911 -11.550 2.539 250 3HG2 VAL 30 3HG2 VAL 30 -12.702 -11.486 4.289 251 H GLU 31 H GLU 31 -7.587 -12.481 4.987 252 HA GLU 31 HA GLU 31 -5.414 -11.560 5.005 253 1HB GLU 31 1HB GLU 31 -6.186 -11.795 2.455 254 2HB GLU 31 2HB GLU 31 -6.107 -10.034 2.516 255 1HG GLU 31 1HG GLU 31 -3.815 -10.013 2.879 256 2HG GLU 31 2HG GLU 31 -3.816 -11.605 3.638 257 H GLU 32 H GLU 32 -4.259 -9.434 5.219 258 HA GLU 32 HA GLU 32 -6.034 -7.072 5.575 259 1HB GLU 32 1HB GLU 32 -5.187 -6.815 7.897 260 2HB GLU 32 2HB GLU 32 -6.021 -8.356 7.697 261 1HG GLU 32 1HG GLU 32 -3.570 -9.186 7.054 262 2HG GLU 32 2HG GLU 32 -3.103 -7.807 8.050 263 H CYS 33 H CYS 33 -4.659 -5.085 6.063 264 HA CYS 33 HA CYS 33 -1.802 -5.330 5.291 265 1HB CYS 33 1HB CYS 33 -2.165 -3.691 3.444 266 2HB CYS 33 2HB CYS 33 -3.087 -5.173 3.187 267 HG CYS 33 HG CYS 33 -4.481 -2.686 4.467 268 H LEU 34 H LEU 34 -0.914 -2.895 5.191 269 HA LEU 34 HA LEU 34 -1.764 -1.630 7.741 270 1HB LEU 34 1HB LEU 34 0.574 -1.159 5.852 271 2HB LEU 34 2HB LEU 34 0.395 -0.432 7.448 272 HG LEU 34 HG LEU 34 0.112 -3.369 7.408 273 1HD1 LEU 34 1HD1 LEU 34 2.010 -2.599 5.707 274 2HD1 LEU 34 2HD1 LEU 34 2.275 -3.949 6.811 275 3HD1 LEU 34 3HD1 LEU 34 2.920 -2.353 7.198 276 1HD2 LEU 34 1HD2 LEU 34 1.025 -3.172 9.519 277 2HD2 LEU 34 2HD2 LEU 34 0.402 -1.533 9.334 278 3HD2 LEU 34 3HD2 LEU 34 2.109 -1.866 9.043 279 H CYS 35 H CYS 35 -1.361 0.958 7.515 280 HA CYS 35 HA CYS 35 -2.531 2.002 4.991 281 1HB CYS 35 1HB CYS 35 -3.778 2.056 7.755 282 2HB CYS 35 2HB CYS 35 -4.260 3.194 6.498 283 HG CYS 35 HG CYS 35 -5.805 1.345 5.854 284 H ILE 36 H ILE 36 -2.775 4.526 5.294 285 HA ILE 36 HA ILE 36 -0.300 5.483 6.703 286 HB ILE 36 HB ILE 36 -1.897 6.581 4.358 287 1HG1 ILE 36 1HG1 ILE 36 0.856 5.313 4.493 288 2HG1 ILE 36 2HG1 ILE 36 -0.594 4.530 3.866 289 1HG2 ILE 36 1HG2 ILE 36 0.810 7.531 5.301 290 2HG2 ILE 36 2HG2 ILE 36 -0.679 8.247 5.917 291 3HG2 ILE 36 3HG2 ILE 36 -0.307 8.331 4.196 292 1HD1 ILE 36 1HD1 ILE 36 0.193 7.199 2.750 293 2HD1 ILE 36 2HD1 ILE 36 -0.662 5.870 1.969 294 3HD1 ILE 36 3HD1 ILE 36 1.080 5.768 2.225 295 H VAL 37 H VAL 37 -0.504 7.198 8.180 296 HA VAL 37 HA VAL 37 -3.310 8.118 8.722 297 HB VAL 37 HB VAL 37 -0.934 7.804 10.591 298 1HG1 VAL 37 1HG1 VAL 37 -2.431 9.469 11.456 299 2HG1 VAL 37 2HG1 VAL 37 -2.782 7.977 12.329 300 3HG1 VAL 37 3HG1 VAL 37 -3.845 8.507 11.024 301 1HG2 VAL 37 1HG2 VAL 37 -2.738 5.977 11.429 302 2HG2 VAL 37 2HG2 VAL 37 -1.466 5.597 10.266 303 3HG2 VAL 37 3HG2 VAL 37 -3.094 5.970 9.701 304 H ARG 38 H ARG 38 -3.538 10.215 8.065 305 HA ARG 38 HA ARG 38 -1.429 12.177 8.821 306 1HB ARG 38 1HB ARG 38 -2.154 11.196 6.138 307 2HB ARG 38 2HB ARG 38 -2.173 12.955 6.267 308 1HG ARG 38 1HG ARG 38 0.136 11.234 7.209 309 2HG ARG 38 2HG ARG 38 0.067 11.983 5.613 310 1HD ARG 38 1HD ARG 38 -0.505 13.835 7.850 311 2HD ARG 38 2HD ARG 38 1.152 13.205 7.812 312 HE ARG 38 HE ARG 38 0.414 13.889 5.150 313 1HH1 ARG 38 1HH1 ARG 38 1.023 15.414 8.220 314 2HH1 ARG 38 2HH1 ARG 38 1.559 16.894 7.503 315 1HH2 ARG 38 1HH2 ARG 38 1.113 15.819 4.243 316 2HH2 ARG 38 2HH2 ARG 38 1.611 17.124 5.268 317 H HIS 39 H HIS 39 -2.260 14.390 8.838 318 HA HIS 39 HA HIS 39 -5.104 14.537 9.543 319 1HB HIS 39 1HB HIS 39 -2.625 16.138 9.742 320 2HB HIS 39 2HB HIS 39 -4.089 17.100 9.537 321 HD1 HIS 39 HD1 HIS 39 -3.900 17.900 12.040 322 HD2 HIS 39 HD2 HIS 39 -4.444 13.793 11.580 323 HE1 HIS 39 HE1 HIS 39 -4.538 17.002 14.321 324 H ASN 40 H ASN 40 -6.270 16.617 8.605 325 HA ASN 40 HA ASN 40 -6.713 16.208 5.807 326 1HB ASN 40 1HB ASN 40 -8.133 18.242 6.113 327 2HB ASN 40 2HB ASN 40 -8.357 17.081 7.418 328 1HD2 ASN 40 1HD2 ASN 40 -8.868 18.577 9.103 329 2HD2 ASN 40 2HD2 ASN 40 -7.775 19.750 9.661 330 H ASP 41 H ASP 41 -6.713 19.368 5.476 331 HA ASP 41 HA ASP 41 -5.275 20.983 4.546 332 1HB ASP 41 1HB ASP 41 -4.030 20.052 6.743 333 2HB ASP 41 2HB ASP 41 -2.879 19.486 5.532 334 H ASP 42 H ASP 42 -2.510 20.308 3.619 335 HA ASP 42 HA ASP 42 -2.905 19.742 0.935 336 1HB ASP 42 1HB ASP 42 -0.502 19.000 1.017 337 2HB ASP 42 2HB ASP 42 -0.792 20.485 1.922 338 H TRP 43 H TRP 43 -2.410 17.350 3.539 339 HA TRP 43 HA TRP 43 -2.318 15.013 1.899 340 1HB TRP 43 1HB TRP 43 -1.673 15.028 4.243 341 2HB TRP 43 2HB TRP 43 -3.275 15.575 4.729 342 HD1 TRP 43 HD1 TRP 43 -5.018 13.779 5.255 343 HE1 TRP 43 HE1 TRP 43 -5.125 11.215 5.024 344 HE3 TRP 43 HE3 TRP 43 -0.737 12.954 2.597 345 HZ2 TRP 43 HZ2 TRP 43 -3.598 9.095 3.865 346 HZ3 TRP 43 HZ3 TRP 43 -0.090 10.654 1.942 347 HH2 TRP 43 HH2 TRP 43 -1.512 8.725 2.572 348 H GLY 44 H GLY 44 -5.027 16.885 3.222 349 1HA GLY 44 1HA GLY 44 -7.094 15.013 2.556 350 2HA GLY 44 2HA GLY 44 -7.334 16.740 2.819 351 H THR 45 H THR 45 -5.505 17.599 0.727 352 HA THR 45 HA THR 45 -7.326 17.299 -1.560 353 HB THR 45 HB THR 45 -4.699 18.770 -1.136 354 HG1 THR 45 HG1 THR 45 -5.907 20.250 -0.290 355 1HG2 THR 45 1HG2 THR 45 -4.767 19.363 -3.310 356 2HG2 THR 45 2HG2 THR 45 -6.456 19.849 -3.170 357 3HG2 THR 45 3HG2 THR 45 -6.049 18.170 -3.538 358 H ALA 46 H ALA 46 -3.783 16.814 -1.158 359 HA ALA 46 HA ALA 46 -3.209 15.575 -3.591 360 1HB ALA 46 1HB ALA 46 -1.617 16.221 -1.772 361 2HB ALA 46 2HB ALA 46 -1.321 14.584 -2.358 362 3HB ALA 46 3HB ALA 46 -2.166 14.835 -0.831 363 H LEU 47 H LEU 47 -3.939 13.782 -0.568 364 HA LEU 47 HA LEU 47 -4.602 11.380 -2.175 365 1HB LEU 47 1HB LEU 47 -4.326 11.982 0.792 366 2HB LEU 47 2HB LEU 47 -4.766 10.395 0.170 367 HG LEU 47 HG LEU 47 -2.405 10.328 0.540 368 1HD1 LEU 47 1HD1 LEU 47 -2.182 10.977 -2.333 369 2HD1 LEU 47 2HD1 LEU 47 -3.459 9.830 -1.928 370 3HD1 LEU 47 3HD1 LEU 47 -1.788 9.486 -1.480 371 1HD2 LEU 47 1HD2 LEU 47 -0.947 12.061 0.206 372 2HD2 LEU 47 2HD2 LEU 47 -2.425 13.007 0.365 373 3HD2 LEU 47 3HD2 LEU 47 -1.786 12.632 -1.236 374 H GLU 48 H GLU 48 -6.372 13.840 -2.111 375 HA GLU 48 HA GLU 48 -8.621 13.681 -0.514 376 1HB GLU 48 1HB GLU 48 -9.812 14.615 -2.548 377 2HB GLU 48 2HB GLU 48 -8.300 15.425 -2.149 378 1HG GLU 48 1HG GLU 48 -8.198 15.095 -4.489 379 2HG GLU 48 2HG GLU 48 -7.194 13.812 -3.831 380 H ASP 49 H ASP 49 -7.711 11.370 -2.998 381 HA ASP 49 HA ASP 49 -10.345 10.015 -2.675 382 1HB ASP 49 1HB ASP 49 -9.666 8.961 -4.853 383 2HB ASP 49 2HB ASP 49 -9.772 10.715 -4.956 384 H TYR 50 H TYR 50 -10.138 7.586 -2.759 385 HA TYR 50 HA TYR 50 -9.317 5.595 -1.768 386 1HB TYR 50 1HB TYR 50 -6.701 6.923 -2.581 387 2HB TYR 50 2HB TYR 50 -6.958 5.197 -2.343 388 HD1 TYR 50 HD1 TYR 50 -9.235 4.371 -3.688 389 HD2 TYR 50 HD2 TYR 50 -6.611 7.584 -4.803 390 HE1 TYR 50 HE1 TYR 50 -9.983 4.165 -6.044 391 HE2 TYR 50 HE2 TYR 50 -7.358 7.378 -7.158 392 HH TYR 50 HH TYR 50 -9.464 4.753 -8.195 393 H LEU 51 H LEU 51 -9.590 8.066 -0.072 394 HA LEU 51 HA LEU 51 -7.478 7.484 1.974 395 1HB LEU 51 1HB LEU 51 -7.990 9.791 0.678 396 2HB LEU 51 2HB LEU 51 -9.148 9.967 1.992 397 HG LEU 51 HG LEU 51 -7.351 9.638 3.640 398 1HD1 LEU 51 1HD1 LEU 51 -5.485 8.550 3.010 399 2HD1 LEU 51 2HD1 LEU 51 -5.031 9.954 2.046 400 3HD1 LEU 51 3HD1 LEU 51 -5.962 8.647 1.315 401 1HD2 LEU 51 1HD2 LEU 51 -6.869 11.842 3.536 402 2HD2 LEU 51 2HD2 LEU 51 -7.724 11.865 1.993 403 3HD2 LEU 51 3HD2 LEU 51 -5.974 11.639 2.029 404 H PHE 52 H PHE 52 -8.292 6.309 3.655 405 HA PHE 52 HA PHE 52 -11.183 6.385 4.299 406 1HB PHE 52 1HB PHE 52 -8.749 4.803 5.164 407 2HB PHE 52 2HB PHE 52 -10.280 4.656 6.027 408 HD1 PHE 52 HD1 PHE 52 -9.074 4.751 2.466 409 HD2 PHE 52 HD2 PHE 52 -11.685 2.934 5.352 410 HE1 PHE 52 HE1 PHE 52 -9.901 3.186 0.730 411 HE2 PHE 52 HE2 PHE 52 -12.512 1.367 3.616 412 HZ PHE 52 HZ PHE 52 -11.621 1.493 1.305 413 H SER 53 H SER 53 -11.714 8.218 5.490 414 HA SER 53 HA SER 53 -9.779 9.140 7.569 415 1HB SER 53 1HB SER 53 -10.572 10.658 5.725 416 2HB SER 53 2HB SER 53 -12.212 10.496 6.353 417 HG SER 53 HG SER 53 -11.611 12.157 7.503 418 H ARG 54 H ARG 54 -10.554 9.659 9.683 419 HA ARG 54 HA ARG 54 -13.228 8.511 10.398 420 1HB ARG 54 1HB ARG 54 -12.067 7.636 12.450 421 2HB ARG 54 2HB ARG 54 -11.426 6.940 10.962 422 1HG ARG 54 1HG ARG 54 -9.477 8.269 11.041 423 2HG ARG 54 2HG ARG 54 -10.199 9.418 12.167 424 1HD ARG 54 1HD ARG 54 -9.711 6.519 12.913 425 2HD ARG 54 2HD ARG 54 -8.515 7.796 13.205 426 HE ARG 54 HE ARG 54 -10.997 8.764 14.152 427 1HH1 ARG 54 1HH1 ARG 54 -8.770 6.178 14.838 428 2HH1 ARG 54 2HH1 ARG 54 -9.196 6.108 16.512 429 1HH2 ARG 54 1HH2 ARG 54 -11.533 8.654 16.329 430 2HH2 ARG 54 2HH2 ARG 54 -10.748 7.498 17.353 431 H LYS 55 H LYS 55 -13.478 9.218 12.958 432 HA LYS 55 HA LYS 55 -13.587 12.125 12.885 433 1HB LYS 55 1HB LYS 55 -14.595 9.850 14.454 434 2HB LYS 55 2HB LYS 55 -14.218 11.250 15.458 435 1HG LYS 55 1HG LYS 55 -15.800 11.566 12.912 436 2HG LYS 55 2HG LYS 55 -16.596 11.093 14.413 437 1HD LYS 55 1HD LYS 55 -15.114 13.165 15.322 438 2HD LYS 55 2HD LYS 55 -15.363 13.690 13.657 439 1HE LYS 55 1HE LYS 55 -17.617 12.785 15.483 440 2HE LYS 55 2HE LYS 55 -17.172 14.483 15.224 441 1HZ LYS 55 1HZ LYS 55 -17.316 13.947 12.772 442 2HZ LYS 55 2HZ LYS 55 -18.798 13.994 13.602 443 3HZ LYS 55 3HZ LYS 55 -18.089 12.500 13.214 444 H ASN 56 H ASN 56 -11.228 12.454 12.715 445 HA ASN 56 HA ASN 56 -9.502 11.760 14.965 446 1HB ASN 56 1HB ASN 56 -9.850 14.675 14.625 447 2HB ASN 56 2HB ASN 56 -11.187 13.821 15.384 448 1HD2 ASN 56 1HD2 ASN 56 -7.575 13.736 15.589 449 2HD2 ASN 56 2HD2 ASN 56 -7.532 13.674 17.285 450 H MET 57 H MET 57 -9.625 11.718 11.917 451 HA MET 57 HA MET 57 -7.745 13.660 10.903 452 1HB MET 57 1HB MET 57 -5.742 12.233 10.891 453 2HB MET 57 2HB MET 57 -6.310 12.470 12.541 454 1HG MET 57 1HG MET 57 -7.716 10.231 11.604 455 2HG MET 57 2HG MET 57 -6.071 10.024 11.018 456 1HE MET 57 1HE MET 57 -3.857 10.348 14.001 457 2HE MET 57 2HE MET 57 -4.729 11.879 13.909 458 3HE MET 57 3HE MET 57 -4.235 11.055 12.430 459 H SER 58 H SER 58 -6.403 12.161 8.996 460 HA SER 58 HA SER 58 -8.542 10.625 7.575 461 1HB SER 58 1HB SER 58 -6.732 12.696 6.298 462 2HB SER 58 2HB SER 58 -8.179 11.961 5.609 463 HG SER 58 HG SER 58 -9.003 13.766 6.368 464 H ALA 59 H ALA 59 -7.618 8.610 7.362 465 HA ALA 59 HA ALA 59 -4.688 8.416 6.821 466 1HB ALA 59 1HB ALA 59 -6.858 6.604 7.889 467 2HB ALA 59 2HB ALA 59 -5.344 7.077 8.661 468 3HB ALA 59 3HB ALA 59 -5.330 5.924 7.327 469 H MET 60 H MET 60 -4.168 6.466 5.292 470 HA MET 60 HA MET 60 -5.965 6.652 2.896 471 1HB MET 60 1HB MET 60 -3.294 7.291 3.213 472 2HB MET 60 2HB MET 60 -3.198 5.641 2.609 473 1HG MET 60 1HG MET 60 -5.171 6.856 1.032 474 2HG MET 60 2HG MET 60 -3.911 8.080 1.189 475 1HE MET 60 1HE MET 60 -2.274 7.620 -1.626 476 2HE MET 60 2HE MET 60 -3.807 8.185 -0.959 477 3HE MET 60 3HE MET 60 -3.785 6.861 -2.125 478 H ALA 61 H ALA 61 -6.074 4.642 1.577 479 HA ALA 61 HA ALA 61 -6.269 2.235 3.265 480 1HB ALA 61 1HB ALA 61 -6.649 1.737 0.465 481 2HB ALA 61 2HB ALA 61 -7.370 3.304 0.832 482 3HB ALA 61 3HB ALA 61 -7.889 1.867 1.713 483 H LEU 62 H LEU 62 -4.009 1.933 3.742 484 HA LEU 62 HA LEU 62 -1.924 0.881 3.383 485 1HB LEU 62 1HB LEU 62 -2.093 2.619 0.933 486 2HB LEU 62 2HB LEU 62 -1.896 3.288 2.528 487 HG LEU 62 HG LEU 62 -0.028 1.364 1.122 488 1HD1 LEU 62 1HD1 LEU 62 1.135 3.832 2.054 489 2HD1 LEU 62 2HD1 LEU 62 -0.271 4.195 1.050 490 3HD1 LEU 62 3HD1 LEU 62 1.045 3.213 0.407 491 1HD2 LEU 62 1HD2 LEU 62 -0.429 2.123 3.901 492 2HD2 LEU 62 2HD2 LEU 62 1.224 2.384 3.348 493 3HD2 LEU 62 3HD2 LEU 62 0.495 0.784 3.229 494 H GLY 63 H GLY 63 -2.819 -1.279 2.877 495 1HA GLY 63 1HA GLY 63 -1.812 -2.337 0.424 496 2HA GLY 63 2HA GLY 63 -2.860 -3.206 1.544 497 H PHE 64 H PHE 64 -4.509 -4.006 0.325 498 HA PHE 64 HA PHE 64 -5.553 -2.547 -1.997 499 1HB PHE 64 1HB PHE 64 -6.444 -5.093 -0.589 500 2HB PHE 64 2HB PHE 64 -6.923 -4.593 -2.210 501 HD1 PHE 64 HD1 PHE 64 -4.980 -4.121 -3.902 502 HD2 PHE 64 HD2 PHE 64 -4.542 -6.430 -0.305 503 HE1 PHE 64 HE1 PHE 64 -2.943 -5.187 -4.833 504 HE2 PHE 64 HE2 PHE 64 -2.505 -7.495 -1.237 505 HZ PHE 64 HZ PHE 64 -1.706 -6.873 -3.501 506 H GLY 65 H GLY 65 -5.986 -0.907 0.186 507 1HA GLY 65 1HA GLY 65 -8.737 -1.389 1.159 508 2HA GLY 65 2HA GLY 65 -7.669 -0.089 1.689 509 H ALA 66 H ALA 66 -7.025 0.484 -1.224 510 HA ALA 66 HA ALA 66 -9.302 2.317 -1.670 511 1HB ALA 66 1HB ALA 66 -7.634 3.027 -3.550 512 2HB ALA 66 2HB ALA 66 -6.509 1.925 -2.757 513 3HB ALA 66 3HB ALA 66 -7.157 3.307 -1.875 514 H ILE 67 H ILE 67 -7.716 -0.442 -3.261 515 HA ILE 67 HA ILE 67 -9.031 -0.354 -5.763 516 HB ILE 67 HB ILE 67 -8.561 -2.838 -5.717 517 1HG1 ILE 67 1HG1 ILE 67 -7.046 -3.031 -3.361 518 2HG1 ILE 67 2HG1 ILE 67 -8.565 -2.281 -2.870 519 1HG2 ILE 67 1HG2 ILE 67 -6.764 -1.492 -6.459 520 2HG2 ILE 67 2HG2 ILE 67 -6.054 -2.499 -5.196 521 3HG2 ILE 67 3HG2 ILE 67 -6.487 -0.825 -4.849 522 1HD1 ILE 67 1HD1 ILE 67 -8.182 -4.909 -4.320 523 2HD1 ILE 67 2HD1 ILE 67 -9.747 -4.104 -4.205 524 3HD1 ILE 67 3HD1 ILE 67 -8.923 -4.645 -2.742 525 H PHE 68 H PHE 68 -10.303 -1.157 -2.622 526 HA PHE 68 HA PHE 68 -12.460 -2.864 -3.289 527 1HB PHE 68 1HB PHE 68 -11.953 -0.717 -1.227 528 2HB PHE 68 2HB PHE 68 -13.496 -1.571 -1.260 529 HD1 PHE 68 HD1 PHE 68 -12.834 -4.279 -1.998 530 HD2 PHE 68 HD2 PHE 68 -10.671 -1.571 0.539 531 HE1 PHE 68 HE1 PHE 68 -11.802 -6.204 -0.824 532 HE2 PHE 68 HE2 PHE 68 -9.638 -3.496 1.713 533 HZ PHE 68 HZ PHE 68 -10.204 -5.813 1.031 534 H ASN 69 H ASN 69 -14.119 -2.503 -4.696 535 HA ASN 69 HA ASN 69 -14.710 0.238 -5.620 536 1HB ASN 69 1HB ASN 69 -15.834 -2.495 -6.346 537 2HB ASN 69 2HB ASN 69 -16.088 -1.008 -7.261 538 1HD2 ASN 69 1HD2 ASN 69 -14.863 -3.074 -8.645 539 2HD2 ASN 69 2HD2 ASN 69 -13.207 -2.754 -8.848 540 H HIS 70 H HIS 70 -17.226 0.601 -5.966 541 HA HIS 70 HA HIS 70 -18.482 0.296 -3.285 542 1HB HIS 70 1HB HIS 70 -18.159 2.502 -4.554 543 2HB HIS 70 2HB HIS 70 -19.385 1.924 -5.682 544 HD1 HIS 70 HD1 HIS 70 -19.009 2.415 -1.912 545 HD2 HIS 70 HD2 HIS 70 -21.952 2.524 -4.863 546 HE1 HIS 70 HE1 HIS 70 -21.144 3.154 -0.768 547 H SER 71 H SER 71 -19.738 -1.532 -3.123 548 HA SER 71 HA SER 71 -21.402 -2.303 -5.498 549 1HB SER 71 1HB SER 71 -19.729 -3.963 -4.917 550 2HB SER 71 2HB SER 71 -20.171 -3.881 -3.211 551 HG SER 71 HG SER 71 -21.333 -5.552 -3.835 552 H LYS 72 H LYS 72 -23.576 -3.094 -5.000 553 HA LYS 72 HA LYS 72 -24.921 -1.555 -2.941 554 1HB LYS 72 1HB LYS 72 -25.772 -3.839 -4.761 555 2HB LYS 72 2HB LYS 72 -26.888 -2.857 -3.813 556 1HG LYS 72 1HG LYS 72 -25.030 -1.222 -5.364 557 2HG LYS 72 2HG LYS 72 -25.993 -2.286 -6.388 558 1HD LYS 72 1HD LYS 72 -27.960 -1.231 -5.863 559 2HD LYS 72 2HD LYS 72 -27.454 -0.893 -4.208 560 1HE LYS 72 1HE LYS 72 -25.752 0.758 -5.355 561 2HE LYS 72 2HE LYS 72 -26.888 0.673 -6.714 562 1HZ LYS 72 1HZ LYS 72 -28.692 1.211 -5.219 563 2HZ LYS 72 2HZ LYS 72 -27.497 2.412 -5.099 564 3HZ LYS 72 3HZ LYS 72 -27.637 1.231 -3.887 565 H ASP 73 H ASP 73 -23.551 -4.763 -3.099 566 HA ASP 73 HA ASP 73 -24.589 -5.288 -0.336 567 1HB ASP 73 1HB ASP 73 -24.297 -7.215 -2.673 568 2HB ASP 73 2HB ASP 73 -24.859 -7.651 -1.059 569 HA PRO 74 HA PRO 74 -19.938 -5.592 -0.672 570 1HB PRO 74 1HB PRO 74 -19.524 -4.338 1.777 571 2HB PRO 74 2HB PRO 74 -19.523 -3.504 0.213 572 1HG PRO 74 1HG PRO 74 -21.665 -3.689 2.267 573 2HG PRO 74 2HG PRO 74 -21.223 -2.337 1.215 574 1HD PRO 74 1HD PRO 74 -23.380 -3.920 0.764 575 2HD PRO 74 2HD PRO 74 -22.471 -3.133 -0.543 576 H ASN 75 H ASN 75 -20.128 -7.871 -0.299 577 HA ASN 75 HA ASN 75 -21.009 -9.009 2.205 578 1HB ASN 75 1HB ASN 75 -19.231 -10.116 -0.001 579 2HB ASN 75 2HB ASN 75 -20.133 -11.070 1.174 580 1HD2 ASN 75 1HD2 ASN 75 -22.554 -9.382 1.099 581 2HD2 ASN 75 2HD2 ASN 75 -23.283 -9.645 -0.410 582 H ALA 76 H ALA 76 -18.071 -7.477 1.266 583 HA ALA 76 HA ALA 76 -16.634 -8.771 3.557 584 1HB ALA 76 1HB ALA 76 -15.386 -7.247 1.262 585 2HB ALA 76 2HB ALA 76 -15.854 -8.937 1.074 586 3HB ALA 76 3HB ALA 76 -14.650 -8.484 2.281 587 H ARG 77 H ARG 77 -16.551 -7.426 5.304 588 HA ARG 77 HA ARG 77 -16.726 -4.481 4.884 589 1HB ARG 77 1HB ARG 77 -17.890 -6.292 6.646 590 2HB ARG 77 2HB ARG 77 -16.625 -5.548 7.624 591 1HG ARG 77 1HG ARG 77 -17.677 -3.365 6.338 592 2HG ARG 77 2HG ARG 77 -19.109 -4.373 6.550 593 1HD ARG 77 1HD ARG 77 -18.825 -4.444 8.929 594 2HD ARG 77 2HD ARG 77 -17.181 -3.785 8.819 595 HE ARG 77 HE ARG 77 -18.964 -1.964 7.538 596 1HH1 ARG 77 1HH1 ARG 77 -18.216 -3.200 10.705 597 2HH1 ARG 77 2HH1 ARG 77 -18.728 -1.757 11.510 598 1HH2 ARG 77 1HH2 ARG 77 -19.624 -0.102 8.605 599 2HH2 ARG 77 2HH2 ARG 77 -19.520 -0.015 10.332 600 H HIS 78 H HIS 78 -15.302 -3.214 6.550 601 HA HIS 78 HA HIS 78 -12.564 -4.441 6.568 602 1HB HIS 78 1HB HIS 78 -11.795 -2.092 6.252 603 2HB HIS 78 2HB HIS 78 -12.885 -2.594 4.960 604 HD1 HIS 78 HD1 HIS 78 -15.133 -1.398 4.770 605 HD2 HIS 78 HD2 HIS 78 -12.990 -0.273 8.164 606 HE1 HIS 78 HE1 HIS 78 -16.350 0.591 5.758 607 H GLU 79 H GLU 79 -11.295 -4.098 8.437 608 HA GLU 79 HA GLU 79 -12.697 -2.838 10.772 609 1HB GLU 79 1HB GLU 79 -12.515 -5.447 10.530 610 2HB GLU 79 2HB GLU 79 -10.825 -5.200 10.963 611 1HG GLU 79 1HG GLU 79 -11.603 -3.934 12.993 612 2HG GLU 79 2HG GLU 79 -13.255 -4.399 12.588 613 H LEU 80 H LEU 80 -11.391 -1.489 12.018 614 HA LEU 80 HA LEU 80 -8.540 -1.216 11.134 615 1HB LEU 80 1HB LEU 80 -10.760 0.630 11.825 616 2HB LEU 80 2HB LEU 80 -9.173 1.107 12.424 617 HG LEU 80 HG LEU 80 -9.320 0.160 9.604 618 1HD1 LEU 80 1HD1 LEU 80 -11.321 1.722 10.051 619 2HD1 LEU 80 2HD1 LEU 80 -10.228 2.175 8.743 620 3HD1 LEU 80 3HD1 LEU 80 -10.118 2.987 10.305 621 1HD2 LEU 80 1HD2 LEU 80 -7.178 0.835 10.201 622 2HD2 LEU 80 2HD2 LEU 80 -7.769 2.095 11.283 623 3HD2 LEU 80 3HD2 LEU 80 -7.818 2.338 9.536 624 H THR 81 H THR 81 -6.975 -1.549 12.664 625 HA THR 81 HA THR 81 -7.497 -2.701 15.201 626 HB THR 81 HB THR 81 -5.074 -2.130 15.573 627 HG1 THR 81 HG1 THR 81 -5.179 -0.917 13.032 628 1HG2 THR 81 1HG2 THR 81 -6.232 -3.742 13.563 629 2HG2 THR 81 2HG2 THR 81 -4.622 -3.906 14.265 630 3HG2 THR 81 3HG2 THR 81 -4.854 -2.940 12.808 631 H ALA 82 H ALA 82 -6.064 -1.311 17.101 632 HA ALA 82 HA ALA 82 -7.962 0.723 17.941 633 1HB ALA 82 1HB ALA 82 -5.570 -0.718 18.930 634 2HB ALA 82 2HB ALA 82 -7.061 -0.311 19.780 635 3HB ALA 82 3HB ALA 82 -5.785 0.895 19.611 636 H GLY 83 H GLY 83 -7.252 1.815 15.627 637 1HA GLY 83 1HA GLY 83 -6.301 4.364 16.108 638 2HA GLY 83 2HA GLY 83 -4.837 3.439 15.779 639 H LEU 84 H LEU 84 -4.254 3.941 13.715 640 HA LEU 84 HA LEU 84 -6.201 3.399 11.533 641 1HB LEU 84 1HB LEU 84 -5.775 5.946 12.552 642 2HB LEU 84 2HB LEU 84 -4.658 5.889 11.193 643 HG LEU 84 HG LEU 84 -6.474 5.235 9.687 644 1HD1 LEU 84 1HD1 LEU 84 -7.966 5.040 12.275 645 2HD1 LEU 84 2HD1 LEU 84 -8.020 3.978 10.868 646 3HD1 LEU 84 3HD1 LEU 84 -8.854 5.530 10.832 647 1HD2 LEU 84 1HD2 LEU 84 -7.528 7.341 9.562 648 2HD2 LEU 84 2HD2 LEU 84 -6.022 7.690 10.413 649 3HD2 LEU 84 3HD2 LEU 84 -7.531 7.544 11.314 650 H LYS 85 H LYS 85 -3.609 2.237 12.592 651 HA LYS 85 HA LYS 85 -1.756 2.818 10.335 652 1HB LYS 85 1HB LYS 85 -1.507 1.312 12.963 653 2HB LYS 85 2HB LYS 85 -0.184 1.510 11.814 654 1HG LYS 85 1HG LYS 85 -0.684 4.044 11.982 655 2HG LYS 85 2HG LYS 85 -1.598 3.628 13.432 656 1HD LYS 85 1HD LYS 85 0.617 2.279 14.021 657 2HD LYS 85 2HD LYS 85 1.348 3.456 12.929 658 1HE LYS 85 1HE LYS 85 -0.054 5.192 14.365 659 2HE LYS 85 2HE LYS 85 0.020 3.905 15.584 660 1HZ LYS 85 1HZ LYS 85 1.968 5.442 15.613 661 2HZ LYS 85 2HZ LYS 85 2.375 4.890 14.059 662 3HZ LYS 85 3HZ LYS 85 2.384 3.813 15.372 663 H ARG 86 H ARG 86 -3.564 0.131 11.827 664 HA ARG 86 HA ARG 86 -3.027 -1.461 9.347 665 1HB ARG 86 1HB ARG 86 -2.011 -1.867 11.962 666 2HB ARG 86 2HB ARG 86 -3.249 -3.099 11.727 667 1HG ARG 86 1HG ARG 86 -1.746 -2.916 9.308 668 2HG ARG 86 2HG ARG 86 -0.600 -3.024 10.644 669 1HD ARG 86 1HD ARG 86 -2.318 -4.925 11.455 670 2HD ARG 86 2HD ARG 86 -2.609 -5.026 9.708 671 HE ARG 86 HE ARG 86 0.171 -4.861 9.981 672 1HH1 ARG 86 1HH1 ARG 86 -2.359 -6.973 11.103 673 2HH1 ARG 86 2HH1 ARG 86 -1.327 -8.360 11.159 674 1HH2 ARG 86 1HH2 ARG 86 1.490 -6.674 10.062 675 2HH2 ARG 86 2HH2 ARG 86 0.837 -8.194 10.574 676 H MET 87 H MET 87 -4.767 -2.743 8.671 677 HA MET 87 HA MET 87 -7.156 -3.003 10.399 678 1HB MET 87 1HB MET 87 -8.484 -2.131 8.309 679 2HB MET 87 2HB MET 87 -7.742 -0.957 9.389 680 1HG MET 87 1HG MET 87 -6.102 -0.390 7.865 681 2HG MET 87 2HG MET 87 -6.126 -1.971 7.083 682 1HE MET 87 1HE MET 87 -8.211 -2.299 4.653 683 2HE MET 87 2HE MET 87 -9.586 -2.128 5.743 684 3HE MET 87 3HE MET 87 -8.115 -2.925 6.299 685 H ARG 88 H ARG 88 -8.471 -4.771 9.772 686 HA ARG 88 HA ARG 88 -7.292 -6.508 7.628 687 1HB ARG 88 1HB ARG 88 -8.993 -7.234 10.040 688 2HB ARG 88 2HB ARG 88 -8.128 -8.355 8.990 689 1HG ARG 88 1HG ARG 88 -6.489 -8.198 10.565 690 2HG ARG 88 2HG ARG 88 -6.104 -6.681 9.752 691 1HD ARG 88 1HD ARG 88 -6.891 -5.422 11.493 692 2HD ARG 88 2HD ARG 88 -8.286 -6.489 11.749 693 HE ARG 88 HE ARG 88 -5.711 -6.711 13.083 694 1HH1 ARG 88 1HH1 ARG 88 -8.402 -8.512 11.804 695 2HH1 ARG 88 2HH1 ARG 88 -8.150 -9.853 12.866 696 1HH2 ARG 88 1HH2 ARG 88 -5.404 -8.465 14.450 697 2HH2 ARG 88 2HH2 ARG 88 -6.466 -9.829 14.353 698 H ILE 89 H ILE 89 -8.892 -7.852 6.436 699 HA ILE 89 HA ILE 89 -11.493 -6.404 6.104 700 HB ILE 89 HB ILE 89 -9.806 -8.142 4.265 701 1HG1 ILE 89 1HG1 ILE 89 -10.599 -5.335 3.643 702 2HG1 ILE 89 2HG1 ILE 89 -9.384 -5.564 4.900 703 1HG2 ILE 89 1HG2 ILE 89 -11.477 -7.536 2.520 704 2HG2 ILE 89 2HG2 ILE 89 -12.471 -6.778 3.764 705 3HG2 ILE 89 3HG2 ILE 89 -12.184 -8.517 3.803 706 1HD1 ILE 89 1HD1 ILE 89 -7.901 -6.670 3.419 707 2HD1 ILE 89 2HD1 ILE 89 -8.539 -5.325 2.473 708 3HD1 ILE 89 3HD1 ILE 89 -9.171 -6.953 2.227 709 H PHE 90 H PHE 90 -13.355 -7.535 6.562 710 HA PHE 90 HA PHE 90 -13.086 -10.479 7.088 711 1HB PHE 90 1HB PHE 90 -14.583 -8.206 8.391 712 2HB PHE 90 2HB PHE 90 -15.163 -9.859 8.587 713 HD1 PHE 90 HD1 PHE 90 -14.007 -11.436 9.977 714 HD2 PHE 90 HD2 PHE 90 -12.293 -7.580 9.171 715 HE1 PHE 90 HE1 PHE 90 -12.309 -11.821 11.743 716 HE2 PHE 90 HE2 PHE 90 -10.595 -7.966 10.937 717 HZ PHE 90 HZ PHE 90 -10.603 -10.086 12.223 718 H THR 91 H THR 91 -15.521 -11.417 7.065 719 HA THR 91 HA THR 91 -16.843 -10.418 4.562 720 HB THR 91 HB THR 91 -17.285 -12.853 4.128 721 HG1 THR 91 HG1 THR 91 -16.181 -14.336 5.434 722 1HG2 THR 91 1HG2 THR 91 -14.333 -12.504 4.611 723 2HG2 THR 91 2HG2 THR 91 -15.161 -11.518 3.405 724 3HG2 THR 91 3HG2 THR 91 -15.148 -13.275 3.249 725 H ILE 92 H ILE 92 -18.690 -9.444 5.393 726 HA ILE 92 HA ILE 92 -20.069 -10.198 7.770 727 HB ILE 92 HB ILE 92 -21.863 -8.782 6.773 728 1HG1 ILE 92 1HG1 ILE 92 -20.228 -8.366 4.316 729 2HG1 ILE 92 2HG1 ILE 92 -21.187 -9.842 4.399 730 1HG2 ILE 92 1HG2 ILE 92 -20.623 -6.812 6.853 731 2HG2 ILE 92 2HG2 ILE 92 -19.274 -7.505 5.950 732 3HG2 ILE 92 3HG2 ILE 92 -19.517 -7.935 7.644 733 1HD1 ILE 92 1HD1 ILE 92 -22.063 -7.038 4.117 734 2HD1 ILE 92 2HD1 ILE 92 -22.980 -7.972 5.299 735 3HD1 ILE 92 3HD1 ILE 92 -22.876 -8.525 3.627 736 H LYS 93 H LYS 93 -19.992 -11.702 4.658 737 HA LYS 93 HA LYS 93 -22.013 -13.671 5.572 738 1HB LYS 93 1HB LYS 93 -23.260 -13.415 3.451 739 2HB LYS 93 2HB LYS 93 -23.207 -11.880 4.317 740 1HG LYS 93 1HG LYS 93 -22.255 -10.926 2.515 741 2HG LYS 93 2HG LYS 93 -20.873 -12.005 2.702 742 1HD LYS 93 1HD LYS 93 -21.575 -12.584 0.563 743 2HD LYS 93 2HD LYS 93 -22.485 -13.748 1.526 744 1HE LYS 93 1HE LYS 93 -23.871 -11.169 1.248 745 2HE LYS 93 2HE LYS 93 -23.609 -11.997 -0.300 746 1HZ LYS 93 1HZ LYS 93 -24.893 -13.068 2.154 747 2HZ LYS 93 2HZ LYS 93 -24.361 -14.073 0.892 748 3HZ LYS 93 3HZ LYS 93 -25.574 -12.919 0.605 749 HA PRO 94 HA PRO 94 -19.300 -16.530 3.634 750 1HB PRO 94 1HB PRO 94 -21.549 -17.948 2.436 751 2HB PRO 94 2HB PRO 94 -20.414 -18.514 3.655 752 1HG PRO 94 1HG PRO 94 -22.986 -17.950 4.214 753 2HG PRO 94 2HG PRO 94 -21.681 -17.717 5.374 754 1HD PRO 94 1HD PRO 94 -23.141 -15.704 3.738 755 2HD PRO 94 2HD PRO 94 -22.521 -15.584 5.397 756 H ILE 95 H ILE 95 -18.150 -16.318 1.742 757 HA ILE 95 HA ILE 95 -19.527 -15.053 -0.574 758 HB ILE 95 HB ILE 95 -16.596 -15.547 0.068 759 1HG1 ILE 95 1HG1 ILE 95 -18.327 -13.073 0.384 760 2HG1 ILE 95 2HG1 ILE 95 -17.694 -14.061 1.701 761 1HG2 ILE 95 1HG2 ILE 95 -17.027 -15.247 -2.338 762 2HG2 ILE 95 2HG2 ILE 95 -16.208 -13.832 -1.677 763 3HG2 ILE 95 3HG2 ILE 95 -17.940 -13.776 -1.998 764 1HD1 ILE 95 1HD1 ILE 95 -16.218 -12.170 1.455 765 2HD1 ILE 95 2HD1 ILE 95 -16.106 -12.416 -0.288 766 3HD1 ILE 95 3HD1 ILE 95 -15.371 -13.579 0.816 767 H ALA 96 H ALA 96 -19.187 -15.906 -2.727 768 HA ALA 96 HA ALA 96 -18.787 -18.871 -2.753 769 1HB ALA 96 1HB ALA 96 -20.982 -18.096 -3.437 770 2HB ALA 96 2HB ALA 96 -20.134 -18.605 -4.897 771 3HB ALA 96 3HB ALA 96 -20.273 -16.888 -4.511 772 H ILE 97 H ILE 97 -17.632 -19.792 -4.573 773 HA ILE 97 HA ILE 97 -15.191 -18.501 -5.272 774 HB ILE 97 HB ILE 97 -16.708 -20.732 -6.680 775 1HG1 ILE 97 1HG1 ILE 97 -14.715 -21.762 -4.972 776 2HG1 ILE 97 2HG1 ILE 97 -15.571 -20.550 -4.025 777 1HG2 ILE 97 1HG2 ILE 97 -14.344 -19.489 -7.404 778 2HG2 ILE 97 2HG2 ILE 97 -14.821 -21.121 -7.872 779 3HG2 ILE 97 3HG2 ILE 97 -13.786 -20.874 -6.465 780 1HD1 ILE 97 1HD1 ILE 97 -16.440 -23.111 -4.325 781 2HD1 ILE 97 2HD1 ILE 97 -17.285 -22.329 -5.660 782 3HD1 ILE 97 3HD1 ILE 97 -17.516 -21.750 -4.011 783 H GLY 98 H GLY 98 -15.310 -16.546 -6.381 784 1HA GLY 98 1HA GLY 98 -15.306 -15.596 -8.653 785 2HA GLY 98 2HA GLY 98 -16.697 -16.614 -9.025 786 H GLU 99 H GLU 99 -16.388 -14.843 -5.998 787 HA GLU 99 HA GLU 99 -18.819 -13.282 -6.747 788 1HB GLU 99 1HB GLU 99 -18.250 -14.853 -4.619 789 2HB GLU 99 2HB GLU 99 -17.641 -13.321 -4.004 790 1HG GLU 99 1HG GLU 99 -20.398 -13.626 -5.218 791 2HG GLU 99 2HG GLU 99 -20.091 -13.817 -3.492 792 H GLU 100 H GLU 100 -18.840 -10.960 -6.278 793 HA GLU 100 HA GLU 100 -16.199 -9.699 -6.670 794 1HB GLU 100 1HB GLU 100 -18.786 -9.248 -7.540 795 2HB GLU 100 2HB GLU 100 -18.591 -8.015 -6.296 796 1HG GLU 100 1HG GLU 100 -16.225 -8.246 -7.995 797 2HG GLU 100 2HG GLU 100 -17.670 -7.853 -8.925 798 H ILE 101 H ILE 101 -15.014 -9.166 -4.893 799 HA ILE 101 HA ILE 101 -16.366 -8.719 -2.289 800 HB ILE 101 HB ILE 101 -13.468 -9.032 -3.154 801 1HG1 ILE 101 1HG1 ILE 101 -15.373 -10.883 -1.691 802 2HG1 ILE 101 2HG1 ILE 101 -14.816 -11.077 -3.353 803 1HG2 ILE 101 1HG2 ILE 101 -14.570 -7.948 -0.737 804 2HG2 ILE 101 2HG2 ILE 101 -12.877 -8.252 -1.124 805 3HG2 ILE 101 3HG2 ILE 101 -13.849 -9.514 -0.368 806 1HD1 ILE 101 1HD1 ILE 101 -12.899 -12.044 -2.664 807 2HD1 ILE 101 2HD1 ILE 101 -13.569 -12.067 -1.033 808 3HD1 ILE 101 3HD1 ILE 101 -12.568 -10.712 -1.557 809 H THR 102 H THR 102 -16.631 -6.714 -1.477 810 HA THR 102 HA THR 102 -14.800 -4.504 -2.180 811 HB THR 102 HB THR 102 -16.822 -3.132 -2.894 812 HG1 THR 102 HG1 THR 102 -18.445 -4.378 -2.032 813 1HG2 THR 102 1HG2 THR 102 -16.665 -3.842 -5.121 814 2HG2 THR 102 2HG2 THR 102 -16.573 -5.545 -4.672 815 3HG2 THR 102 3HG2 THR 102 -15.182 -4.491 -4.422 816 H ILE 103 H ILE 103 -15.508 -2.487 -0.859 817 HA ILE 103 HA ILE 103 -16.880 -3.347 1.668 818 HB ILE 103 HB ILE 103 -15.163 -2.009 2.837 819 1HG1 ILE 103 1HG1 ILE 103 -13.205 -1.669 0.837 820 2HG1 ILE 103 2HG1 ILE 103 -14.707 -1.039 0.162 821 1HG2 ILE 103 1HG2 ILE 103 -13.377 -3.611 1.151 822 2HG2 ILE 103 2HG2 ILE 103 -14.823 -4.487 1.652 823 3HG2 ILE 103 3HG2 ILE 103 -13.751 -3.787 2.865 824 1HD1 ILE 103 1HD1 ILE 103 -15.029 0.283 2.270 825 2HD1 ILE 103 2HD1 ILE 103 -13.591 0.754 1.365 826 3HD1 ILE 103 3HD1 ILE 103 -13.437 -0.256 2.802 827 H SER 104 H SER 104 -17.209 -1.358 -0.899 828 HA SER 104 HA SER 104 -18.389 0.651 -1.265 829 1HB SER 104 1HB SER 104 -20.350 0.694 -0.017 830 2HB SER 104 2HB SER 104 -19.800 -0.926 0.389 831 HG SER 104 HG SER 104 -20.274 1.028 2.041 832 H TYR 105 H TYR 105 -19.162 2.536 0.862 833 HA TYR 105 HA TYR 105 -16.465 3.415 1.822 834 1HB TYR 105 1HB TYR 105 -18.619 5.085 0.474 835 2HB TYR 105 2HB TYR 105 -17.062 5.684 1.045 836 HD1 TYR 105 HD1 TYR 105 -15.163 3.651 0.254 837 HD2 TYR 105 HD2 TYR 105 -18.612 5.094 -1.859 838 HE1 TYR 105 HE1 TYR 105 -14.130 2.972 -1.897 839 HE2 TYR 105 HE2 TYR 105 -17.580 4.416 -4.009 840 HH TYR 105 HH TYR 105 -15.571 2.416 -4.532 841 H GLY 106 H GLY 106 -19.683 4.984 2.041 842 1HA GLY 106 1HA GLY 106 -20.191 4.171 4.750 843 2HA GLY 106 2HA GLY 106 -19.398 5.745 4.741 844 H ASP 107 H ASP 107 -21.443 6.578 5.646 845 HA ASP 107 HA ASP 107 -23.807 6.563 3.869 846 1HB ASP 107 1HB ASP 107 -23.145 7.667 6.618 847 2HB ASP 107 2HB ASP 107 -24.715 7.904 5.851 848 H ASP 108 H ASP 108 -21.119 8.111 3.386 849 HA ASP 108 HA ASP 108 -22.461 10.688 2.677 850 1HB ASP 108 1HB ASP 108 -20.505 10.218 4.694 851 2HB ASP 108 2HB ASP 108 -19.688 11.068 3.384 852 H TYR 109 H TYR 109 -19.393 8.862 2.306 853 HA TYR 109 HA TYR 109 -18.604 10.020 -0.169 854 1HB TYR 109 1HB TYR 109 -17.704 8.121 1.661 855 2HB TYR 109 2HB TYR 109 -17.963 7.179 0.194 856 HD1 TYR 109 HD1 TYR 109 -16.828 10.708 0.777 857 HD2 TYR 109 HD2 TYR 109 -15.927 6.855 -0.895 858 HE1 TYR 109 HE1 TYR 109 -14.727 11.614 -0.181 859 HE2 TYR 109 HE2 TYR 109 -13.827 7.761 -1.853 860 HH TYR 109 HH TYR 109 -12.255 10.030 -1.012 861 H TRP 110 H TRP 110 -19.716 9.931 -2.068 862 HA TRP 110 HA TRP 110 -21.040 9.118 -3.835 863 1HB TRP 110 1HB TRP 110 -19.545 6.825 -2.667 864 2HB TRP 110 2HB TRP 110 -20.883 6.405 -3.736 865 HD1 TRP 110 HD1 TRP 110 -17.735 8.643 -3.726 866 HE1 TRP 110 HE1 TRP 110 -16.863 8.817 -6.145 867 HE3 TRP 110 HE3 TRP 110 -21.381 6.030 -6.167 868 HZ2 TRP 110 HZ2 TRP 110 -17.613 7.961 -8.770 869 HZ3 TRP 110 HZ3 TRP 110 -21.277 5.725 -8.624 870 HH2 TRP 110 HH2 TRP 110 -19.400 6.686 -9.928 871 H LEU 111 H LEU 111 -21.686 6.293 -1.792 872 HA LEU 111 HA LEU 111 -24.513 6.457 -2.153 873 1HB LEU 111 1HB LEU 111 -22.711 4.624 -1.283 874 2HB LEU 111 2HB LEU 111 -23.388 5.121 0.263 875 HG LEU 111 HG LEU 111 -25.654 4.621 -0.552 876 1HD1 LEU 111 1HD1 LEU 111 -24.160 4.230 -3.113 877 2HD1 LEU 111 2HD1 LEU 111 -25.732 4.981 -2.834 878 3HD1 LEU 111 3HD1 LEU 111 -25.577 3.223 -2.813 879 1HD2 LEU 111 1HD2 LEU 111 -25.464 2.208 -0.616 880 2HD2 LEU 111 2HD2 LEU 111 -24.223 2.823 0.476 881 3HD2 LEU 111 3HD2 LEU 111 -23.788 2.311 -1.154 882 H SER 112 H SER 112 -25.188 5.977 0.738 883 HA SER 112 HA SER 112 -24.658 8.437 2.190 884 1HB SER 112 1HB SER 112 -26.635 8.345 0.096 885 2HB SER 112 2HB SER 112 -27.454 8.592 1.643 886 HG SER 112 HG SER 112 -25.898 10.287 2.031 887 H ARG 113 H ARG 113 -27.047 5.826 1.651 888 HA ARG 113 HA ARG 113 -27.093 5.406 4.618 889 1HB ARG 113 1HB ARG 113 -29.306 5.744 2.599 890 2HB ARG 113 2HB ARG 113 -29.593 4.792 4.056 891 1HG ARG 113 1HG ARG 113 -28.260 7.407 4.477 892 2HG ARG 113 2HG ARG 113 -29.938 7.485 3.939 893 1HD ARG 113 1HD ARG 113 -29.956 5.484 5.893 894 2HD ARG 113 2HD ARG 113 -28.884 6.733 6.555 895 HE ARG 113 HE ARG 113 -31.746 7.029 6.042 896 1HH1 ARG 113 1HH1 ARG 113 -28.678 8.661 6.239 897 2HH1 ARG 113 2HH1 ARG 113 -29.392 10.196 6.591 898 1HH2 ARG 113 1HH2 ARG 113 -32.651 9.032 6.501 899 2HH2 ARG 113 2HH2 ARG 113 -31.625 10.407 6.739 900 HA PRO 114 HA PRO 114 -26.365 1.243 3.287 901 1HB PRO 114 1HB PRO 114 -26.623 -0.001 5.705 902 2HB PRO 114 2HB PRO 114 -25.220 1.005 5.301 903 1HG PRO 114 1HG PRO 114 -27.567 1.617 7.008 904 2HG PRO 114 2HG PRO 114 -25.890 2.152 7.161 905 1HD PRO 114 1HD PRO 114 -27.995 3.657 6.125 906 2HD PRO 114 2HD PRO 114 -26.270 4.003 5.904 907 H ARG 115 H ARG 115 -28.580 1.427 2.155 908 HA ARG 115 HA ARG 115 -30.369 -0.656 3.223 909 1HB ARG 115 1HB ARG 115 -32.301 0.867 3.234 910 2HB ARG 115 2HB ARG 115 -31.044 1.453 4.325 911 1HG ARG 115 1HG ARG 115 -30.191 2.852 2.377 912 2HG ARG 115 2HG ARG 115 -31.677 2.413 1.548 913 1HD ARG 115 1HD ARG 115 -31.562 3.776 4.259 914 2HD ARG 115 2HD ARG 115 -31.895 4.607 2.728 915 HE ARG 115 HE ARG 115 -33.747 2.863 4.161 916 1HH1 ARG 115 1HH1 ARG 115 -32.759 4.052 1.042 917 2HH1 ARG 115 2HH1 ARG 115 -34.306 3.773 0.323 918 1HH2 ARG 115 1HH2 ARG 115 -35.748 2.510 3.204 919 2HH2 ARG 115 2HH2 ARG 115 -35.987 2.907 1.535 920 H LEU 116 H LEU 116 -30.936 -1.895 1.496 921 HA LEU 116 HA LEU 116 -31.109 -0.566 -1.190 922 1HB LEU 116 1HB LEU 116 -29.654 -2.902 -0.140 923 2HB LEU 116 2HB LEU 116 -30.561 -3.256 -1.610 924 HG LEU 116 HG LEU 116 -28.286 -2.471 -2.152 925 1HD1 LEU 116 1HD1 LEU 116 -29.506 -0.083 -3.110 926 2HD1 LEU 116 2HD1 LEU 116 -30.752 -1.330 -3.075 927 3HD1 LEU 116 3HD1 LEU 116 -29.263 -1.597 -3.981 928 1HD2 LEU 116 1HD2 LEU 116 -28.537 -0.867 0.035 929 2HD2 LEU 116 2HD2 LEU 116 -28.857 0.294 -1.255 930 3HD2 LEU 116 3HD2 LEU 116 -27.340 -0.606 -1.234 931 H THR 117 H THR 117 -32.024 -3.728 0.229 932 HA THR 117 HA THR 117 -34.737 -3.373 -0.997 933 HB THR 117 HB THR 117 -33.197 -5.872 -0.194 934 HG1 THR 117 HG1 THR 117 -32.357 -5.781 -2.104 935 1HG2 THR 117 1HG2 THR 117 -35.680 -6.098 -0.194 936 2HG2 THR 117 2HG2 THR 117 -34.920 -7.064 -1.459 937 3HG2 THR 117 3HG2 THR 117 -35.707 -5.539 -1.867 938 H GLN 118 H GLN 118 -32.975 -4.308 1.933 939 HA GLN 118 HA GLN 118 -35.278 -3.618 3.604 940 1HB GLN 118 1HB GLN 118 -35.172 -6.167 2.506 941 2HB GLN 118 2HB GLN 118 -34.456 -6.401 4.101 942 1HG GLN 118 1HG GLN 118 -36.391 -5.636 5.213 943 2HG GLN 118 2HG GLN 118 -37.019 -4.848 3.765 944 1HE2 GLN 118 1HE2 GLN 118 -39.026 -6.212 4.272 945 2HE2 GLN 118 2HE2 GLN 118 -39.063 -7.813 3.710 946 H ASN 119 H ASN 119 -34.348 -5.364 5.789 947 HA ASN 119 HA ASN 119 -31.522 -4.890 6.260 948 1HB ASN 119 1HB ASN 119 -32.850 -2.617 6.370 949 2HB ASN 119 2HB ASN 119 -33.379 -3.213 7.944 950 1HD2 ASN 119 1HD2 ASN 119 -32.069 -2.300 9.534 951 2HD2 ASN 119 2HD2 ASN 119 -30.387 -2.105 9.419 952 1H GLY 201 1H GLY 201 -18.287 20.783 -22.628 953 2H GLY 201 2H GLY 201 -17.426 21.737 -23.737 954 3H GLY 201 3H GLY 201 -17.901 22.391 -22.243 955 1HA GLY 201 1HA GLY 201 -15.886 20.262 -22.702 956 2HA GLY 201 2HA GLY 201 -15.586 21.897 -22.114 957 H LYS 202 H LYS 202 -17.096 22.426 -20.109 958 HA LYS 202 HA LYS 202 -17.452 21.975 -17.817 959 1HB LYS 202 1HB LYS 202 -18.776 20.106 -19.499 960 2HB LYS 202 2HB LYS 202 -18.132 19.181 -18.142 961 1HG LYS 202 1HG LYS 202 -19.313 20.478 -16.551 962 2HG LYS 202 2HG LYS 202 -19.618 21.773 -17.709 963 1HD LYS 202 1HD LYS 202 -20.671 19.119 -18.488 964 2HD LYS 202 2HD LYS 202 -21.441 19.844 -17.077 965 1HE LYS 202 1HE LYS 202 -21.088 21.882 -19.081 966 2HE LYS 202 2HE LYS 202 -21.909 20.487 -19.807 967 1HZ LYS 202 1HZ LYS 202 -22.634 21.824 -17.247 968 2HZ LYS 202 2HZ LYS 202 -23.388 20.434 -17.867 969 3HZ LYS 202 3HZ LYS 202 -23.512 21.910 -18.698 970 H ALA 203 H ALA 203 -17.017 19.804 -16.223 971 HA ALA 203 HA ALA 203 -14.642 18.290 -16.737 972 1HB ALA 203 1HB ALA 203 -13.092 19.928 -16.497 973 2HB ALA 203 2HB ALA 203 -13.571 20.044 -14.803 974 3HB ALA 203 3HB ALA 203 -14.327 21.088 -16.007 975 HA PRO 204 HA PRO 204 -15.521 18.115 -12.036 976 1HB PRO 204 1HB PRO 204 -17.470 19.829 -11.062 977 2HB PRO 204 2HB PRO 204 -15.733 20.179 -11.023 978 1HG PRO 204 1HG PRO 204 -17.825 21.149 -12.896 979 2HG PRO 204 2HG PRO 204 -16.412 21.992 -12.248 980 1HD PRO 204 1HD PRO 204 -16.533 20.983 -14.772 981 2HD PRO 204 2HD PRO 204 -15.019 21.156 -13.863 982 H ARG 205 H ARG 205 -18.093 18.830 -14.300 983 HA ARG 205 HA ARG 205 -20.116 17.716 -14.765 984 1HB ARG 205 1HB ARG 205 -18.219 15.739 -13.596 985 2HB ARG 205 2HB ARG 205 -19.908 15.239 -13.666 986 1HG ARG 205 1HG ARG 205 -19.250 16.516 -16.142 987 2HG ARG 205 2HG ARG 205 -18.008 15.314 -15.795 988 1HD ARG 205 1HD ARG 205 -19.515 13.836 -16.692 989 2HD ARG 205 2HD ARG 205 -20.322 13.963 -15.117 990 HE ARG 205 HE ARG 205 -21.093 16.181 -16.765 991 1HH1 ARG 205 1HH1 ARG 205 -21.539 12.745 -16.433 992 2HH1 ARG 205 2HH1 ARG 205 -23.106 12.767 -17.165 993 1HH2 ARG 205 1HH2 ARG 205 -23.128 16.184 -17.711 994 2HH2 ARG 205 2HH2 ARG 205 -24.001 14.698 -17.884 995 H LYS 206 H LYS 206 -19.637 15.973 -11.717 996 HA LYS 206 HA LYS 206 -21.482 17.756 -10.262 997 1HB LYS 206 1HB LYS 206 -22.191 15.126 -11.504 998 2HB LYS 206 2HB LYS 206 -22.875 15.482 -9.918 999 1HG LYS 206 1HG LYS 206 -23.261 17.859 -11.248 1000 2HG LYS 206 2HG LYS 206 -23.488 16.679 -12.539 1001 1HD LYS 206 1HD LYS 206 -24.886 16.603 -9.847 1002 2HD LYS 206 2HD LYS 206 -25.614 17.170 -11.350 1003 1HE LYS 206 1HE LYS 206 -24.459 14.608 -11.876 1004 2HE LYS 206 2HE LYS 206 -25.432 14.474 -10.398 1005 1HZ LYS 206 1HZ LYS 206 -26.702 14.254 -12.547 1006 2HZ LYS 206 2HZ LYS 206 -26.364 15.893 -12.836 1007 3HZ LYS 206 3HZ LYS 206 -27.285 15.441 -11.482 1008 H GLN 207 H GLN 207 -20.465 14.317 -10.090 1009 HA GLN 207 HA GLN 207 -19.359 14.904 -7.362 1010 1HB GLN 207 1HB GLN 207 -21.495 13.343 -8.013 1011 2HB GLN 207 2HB GLN 207 -20.199 12.153 -8.126 1012 1HG GLN 207 1HG GLN 207 -20.535 11.956 -5.878 1013 2HG GLN 207 2HG GLN 207 -19.524 13.399 -5.802 1014 1HE2 GLN 207 1HE2 GLN 207 -22.996 12.476 -6.171 1015 2HE2 GLN 207 2HE2 GLN 207 -23.593 13.816 -5.318 1016 H LEU 208 H LEU 208 -17.705 15.209 -9.627 1017 HA LEU 208 HA LEU 208 -16.225 12.709 -10.089 1018 1HB LEU 208 1HB LEU 208 -16.275 15.532 -11.048 1019 2HB LEU 208 2HB LEU 208 -14.731 14.692 -11.185 1020 HG LEU 208 HG LEU 208 -16.094 14.396 -13.228 1021 1HD1 LEU 208 1HD1 LEU 208 -14.739 12.455 -11.829 1022 2HD1 LEU 208 2HD1 LEU 208 -15.367 12.255 -13.465 1023 3HD1 LEU 208 3HD1 LEU 208 -16.307 11.688 -12.085 1024 1HD2 LEU 208 1HD2 LEU 208 -18.265 14.482 -11.733 1025 2HD2 LEU 208 2HD2 LEU 208 -18.033 12.736 -11.648 1026 3HD2 LEU 208 3HD2 LEU 208 -18.255 13.520 -13.212 1027 H ALA 209 H ALA 209 -15.379 15.919 -8.717 1028 HA ALA 209 HA ALA 209 -13.073 14.646 -7.318 1029 1HB ALA 209 1HB ALA 209 -12.300 16.966 -7.123 1030 2HB ALA 209 2HB ALA 209 -13.862 17.559 -7.689 1031 3HB ALA 209 3HB ALA 209 -12.806 16.669 -8.787 1032 H THR 210 H THR 210 -14.275 13.661 -5.565 1033 HA THR 210 HA THR 210 -16.062 15.269 -3.897 1034 HB THR 210 HB THR 210 -15.743 13.085 -2.470 1035 HG1 THR 210 HG1 THR 210 -14.706 11.474 -3.476 1036 1HG2 THR 210 1HG2 THR 210 -17.750 12.877 -3.499 1037 2HG2 THR 210 2HG2 THR 210 -16.898 11.903 -4.697 1038 3HG2 THR 210 3HG2 THR 210 -17.154 13.624 -4.982 1039 H LYS 211 H LYS 211 -15.015 16.922 -2.789 1040 HA LYS 211 HA LYS 211 -12.371 16.422 -1.546 1041 1HB LYS 211 1HB LYS 211 -13.873 18.621 -2.615 1042 2HB LYS 211 2HB LYS 211 -13.505 18.981 -0.928 1043 1HG LYS 211 1HG LYS 211 -11.196 18.898 -1.278 1044 2HG LYS 211 2HG LYS 211 -11.350 17.885 -2.713 1045 1HD LYS 211 1HD LYS 211 -12.760 20.336 -3.181 1046 2HD LYS 211 2HD LYS 211 -11.145 20.727 -2.589 1047 1HE LYS 211 1HE LYS 211 -10.481 18.782 -4.336 1048 2HE LYS 211 2HE LYS 211 -11.955 19.378 -5.123 1049 1HZ LYS 211 1HZ LYS 211 -11.112 21.628 -4.946 1050 2HZ LYS 211 2HZ LYS 211 -9.983 20.667 -5.775 1051 3HZ LYS 211 3HZ LYS 211 -9.715 21.081 -4.149 1052 H ALA 212 H ALA 212 -15.399 17.947 -0.370 1053 HA ALA 212 HA ALA 212 -14.819 17.556 2.402 1054 1HB ALA 212 1HB ALA 212 -17.422 17.877 2.463 1055 2HB ALA 212 2HB ALA 212 -17.270 18.089 0.719 1056 3HB ALA 212 3HB ALA 212 -16.431 19.184 1.818 1057 H ALA 213 H ALA 213 -15.826 16.024 3.883 1058 HA ALA 213 HA ALA 213 -16.501 13.869 4.563 1059 1HB ALA 213 1HB ALA 213 -18.463 13.229 3.545 1060 2HB ALA 213 2HB ALA 213 -17.769 13.330 1.927 1061 3HB ALA 213 3HB ALA 213 -18.309 14.794 2.747 1062 H ARG 214 H ARG 214 -15.810 11.680 4.332 1063 HA ARG 214 HA ARG 214 -14.188 11.011 1.919 1064 1HB ARG 214 1HB ARG 214 -13.337 11.350 4.775 1065 2HB ARG 214 2HB ARG 214 -12.554 10.087 3.826 1066 1HG ARG 214 1HG ARG 214 -11.914 11.727 2.122 1067 2HG ARG 214 2HG ARG 214 -12.761 13.000 3.002 1068 1HD ARG 214 1HD ARG 214 -11.241 12.543 4.972 1069 2HD ARG 214 2HD ARG 214 -10.313 11.456 3.922 1070 HE ARG 214 HE ARG 214 -9.471 13.366 2.806 1071 1HH1 ARG 214 1HH1 ARG 214 -12.355 14.151 4.591 1072 2HH1 ARG 214 2HH1 ARG 214 -12.237 15.843 4.252 1073 1HH2 ARG 214 1HH2 ARG 214 -9.339 15.566 2.379 1074 2HH2 ARG 214 2HH2 ARG 214 -10.543 16.640 3.009 1075 1HN MLZ 215 1HN MLZ 215 -13.192 8.578 2.776 1076 HA MLZ 215 HA MLZ 215 -15.399 6.799 2.519 1077 1HB MLZ 215 1HB MLZ 215 -12.518 6.755 2.884 1078 2HB MLZ 215 2HB MLZ 215 -13.271 5.472 3.832 1079 1HG MLZ 215 1HG MLZ 215 -14.635 5.405 1.397 1080 2HG MLZ 215 2HG MLZ 215 -13.379 4.281 1.915 1081 1HD MLZ 215 1HD MLZ 215 -12.812 6.909 0.516 1082 2HD MLZ 215 2HD MLZ 215 -11.657 5.626 0.874 1083 1HE MLZ 215 1HE MLZ 215 -13.913 5.607 -1.142 1084 2HE MLZ 215 2HE MLZ 215 -13.179 4.101 -0.559 1085 HZ MLZ 215 HZ MLZ 215 -11.036 4.857 -1.220 1086 1HCM MLZ 215 1HCM MLZ 215 -11.337 5.223 -3.626 1087 2HCM MLZ 215 2HCM MLZ 215 -13.055 5.450 -3.319 1088 3HCM MLZ 215 3HCM MLZ 215 -12.302 3.893 -2.997 1089 H SER 216 H SER 216 -16.915 6.252 4.024 1090 HA SER 216 HA SER 216 -17.905 5.789 6.118 1091 1HB SER 216 1HB SER 216 -17.314 8.359 5.945 1092 2HB SER 216 2HB SER 216 -17.847 7.694 7.489 1093 HG SER 216 HG SER 216 -15.774 7.646 8.197 1094 H ALA 217 H ALA 217 -17.164 5.623 8.639 1095 HA ALA 217 HA ALA 217 -14.539 4.172 8.695 1096 1HB ALA 217 1HB ALA 217 -14.185 5.710 10.339 1097 2HB ALA 217 2HB ALA 217 -15.313 4.761 11.307 1098 3HB ALA 217 3HB ALA 217 -15.892 6.152 10.390 1099 HA PRO 218 HA PRO 218 -16.568 0.469 9.876 1100 1HB PRO 218 1HB PRO 218 -15.100 -0.373 12.080 1101 2HB PRO 218 2HB PRO 218 -14.587 -0.583 10.398 1102 1HG PRO 218 1HG PRO 218 -13.727 1.421 12.403 1103 2HG PRO 218 2HG PRO 218 -12.806 0.657 11.107 1104 1HD PRO 218 1HD PRO 218 -13.764 3.214 11.013 1105 2HD PRO 218 2HD PRO 218 -13.449 2.217 9.583 1106 H ALA 219 H ALA 219 -15.533 1.585 13.110 1107 HA ALA 219 HA ALA 219 -18.403 1.983 13.842 1108 1HB ALA 219 1HB ALA 219 -16.658 -0.193 14.542 1109 2HB ALA 219 2HB ALA 219 -18.328 0.066 15.048 1110 3HB ALA 219 3HB ALA 219 -17.004 0.735 16.002 1111 H THR 220 H THR 220 -18.338 4.155 14.373 1112 HA THR 220 HA THR 220 -16.923 5.023 16.736 1113 HB THR 220 HB THR 220 -15.042 4.840 15.136 1114 HG1 THR 220 HG1 THR 220 -14.781 6.496 16.535 1115 1HG2 THR 220 1HG2 THR 220 -15.062 5.770 13.018 1116 2HG2 THR 220 2HG2 THR 220 -16.176 7.057 13.481 1117 3HG2 THR 220 3HG2 THR 220 -16.782 5.425 13.199 1118 H GLY 221 H GLY 221 -19.618 5.192 15.657 1119 1HA GLY 221 1HA GLY 221 -19.954 8.024 14.876 1120 2HA GLY 221 2HA GLY 221 -21.235 6.813 14.944 1121 1H MET 1 1H MET 1 2.767 -7.288 5.345 1122 2H MET 1 2H MET 1 2.787 -8.614 4.283 1123 3H MET 1 3H MET 1 4.112 -8.324 5.304 1124 HA MET 1 HA MET 1 2.424 -8.598 7.216 1125 1HB MET 1 1HB MET 1 1.071 -9.775 4.767 1126 2HB MET 1 2HB MET 1 0.552 -10.114 6.416 1127 1HG MET 1 1HG MET 1 0.819 -7.302 5.348 1128 2HG MET 1 2HG MET 1 -0.682 -8.219 5.232 1129 1HE MET 1 1HE MET 1 1.600 -6.135 8.077 1130 2HE MET 1 2HE MET 1 0.040 -5.315 8.001 1131 3HE MET 1 3HE MET 1 0.887 -5.740 6.513 1132 H PHE 2 H PHE 2 1.726 -11.308 7.393 1133 HA PHE 2 HA PHE 2 4.406 -12.556 7.277 1134 1HB PHE 2 1HB PHE 2 3.233 -14.321 8.640 1135 2HB PHE 2 2HB PHE 2 3.133 -12.711 9.345 1136 HD1 PHE 2 HD1 PHE 2 1.266 -15.228 7.333 1137 HD2 PHE 2 HD2 PHE 2 1.036 -11.639 9.682 1138 HE1 PHE 2 HE1 PHE 2 -1.209 -15.380 7.324 1139 HE2 PHE 2 HE2 PHE 2 -1.439 -11.792 9.673 1140 HZ PHE 2 HZ PHE 2 -2.561 -13.662 8.493 1141 H ASN 3 H ASN 3 4.951 -14.127 5.827 1142 HA ASN 3 HA ASN 3 2.847 -15.603 4.352 1143 1HB ASN 3 1HB ASN 3 3.989 -13.233 3.384 1144 2HB ASN 3 2HB ASN 3 4.876 -14.509 2.550 1145 1HD2 ASN 3 1HD2 ASN 3 3.039 -16.460 2.052 1146 2HD2 ASN 3 2HD2 ASN 3 1.719 -15.864 1.165 1147 H ASP 4 H ASP 4 3.593 -17.635 3.720 1148 HA ASP 4 HA ASP 4 5.759 -18.892 4.925 1149 1HB ASP 4 1HB ASP 4 3.766 -19.718 3.440 1150 2HB ASP 4 2HB ASP 4 4.905 -19.545 2.104 1151 H ARG 5 H ARG 5 5.762 -17.362 1.683 1152 HA ARG 5 HA ARG 5 8.568 -17.941 1.201 1153 1HB ARG 5 1HB ARG 5 6.491 -16.098 -0.025 1154 2HB ARG 5 2HB ARG 5 8.115 -16.279 -0.690 1155 1HG ARG 5 1HG ARG 5 7.231 -18.903 -0.291 1156 2HG ARG 5 2HG ARG 5 5.819 -18.057 -0.923 1157 1HD ARG 5 1HD ARG 5 8.487 -17.611 -2.240 1158 2HD ARG 5 2HD ARG 5 7.569 -19.082 -2.612 1159 HE ARG 5 HE ARG 5 6.858 -16.401 -3.446 1160 1HH1 ARG 5 1HH1 ARG 5 5.549 -19.431 -2.341 1161 2HH1 ARG 5 2HH1 ARG 5 4.029 -19.188 -3.129 1162 1HH2 ARG 5 1HH2 ARG 5 4.877 -16.108 -4.460 1163 2HH2 ARG 5 2HH2 ARG 5 3.649 -17.322 -4.321 1164 H VAL 6 H VAL 6 6.768 -15.181 2.511 1165 HA VAL 6 HA VAL 6 9.305 -14.051 3.537 1166 HB VAL 6 HB VAL 6 7.424 -12.622 1.620 1167 1HG1 VAL 6 1HG1 VAL 6 9.503 -11.673 3.512 1168 2HG1 VAL 6 2HG1 VAL 6 8.110 -10.819 2.848 1169 3HG1 VAL 6 3HG1 VAL 6 9.579 -10.992 1.887 1170 1HG2 VAL 6 1HG2 VAL 6 10.249 -13.677 1.392 1171 2HG2 VAL 6 2HG2 VAL 6 9.609 -12.459 0.289 1172 3HG2 VAL 6 3HG2 VAL 6 8.863 -14.055 0.369 1173 H ILE 7 H ILE 7 8.932 -13.131 5.524 1174 HA ILE 7 HA ILE 7 6.078 -12.620 6.286 1175 HB ILE 7 HB ILE 7 7.091 -14.530 7.418 1176 1HG1 ILE 7 1HG1 ILE 7 7.166 -12.174 9.322 1177 2HG1 ILE 7 2HG1 ILE 7 5.672 -12.910 8.742 1178 1HG2 ILE 7 1HG2 ILE 7 9.371 -12.616 7.707 1179 2HG2 ILE 7 2HG2 ILE 7 9.393 -14.334 7.309 1180 3HG2 ILE 7 3HG2 ILE 7 9.132 -13.817 8.975 1181 1HD1 ILE 7 1HD1 ILE 7 5.849 -14.412 10.411 1182 2HD1 ILE 7 2HD1 ILE 7 7.450 -13.812 10.844 1183 3HD1 ILE 7 3HD1 ILE 7 7.279 -15.056 9.605 1184 H VAL 8 H VAL 8 5.708 -10.813 7.739 1185 HA VAL 8 HA VAL 8 7.546 -8.561 7.234 1186 HB VAL 8 HB VAL 8 5.052 -8.445 6.993 1187 1HG1 VAL 8 1HG1 VAL 8 4.933 -9.909 9.264 1188 2HG1 VAL 8 2HG1 VAL 8 3.602 -8.893 8.715 1189 3HG1 VAL 8 3HG1 VAL 8 4.716 -8.297 9.944 1190 1HG2 VAL 8 1HG2 VAL 8 6.591 -6.681 8.864 1191 2HG2 VAL 8 2HG2 VAL 8 4.857 -6.406 8.682 1192 3HG2 VAL 8 3HG2 VAL 8 5.916 -6.311 7.275 1193 H LYS 9 H LYS 9 9.108 -8.020 8.679 1194 HA LYS 9 HA LYS 9 8.577 -8.282 11.569 1195 1HB LYS 9 1HB LYS 9 10.625 -9.783 9.970 1196 2HB LYS 9 2HB LYS 9 10.893 -9.466 11.684 1197 1HG LYS 9 1HG LYS 9 8.639 -10.492 12.145 1198 2HG LYS 9 2HG LYS 9 8.553 -10.946 10.444 1199 1HD LYS 9 1HD LYS 9 10.261 -12.515 10.639 1200 2HD LYS 9 2HD LYS 9 10.976 -11.714 12.039 1201 1HE LYS 9 1HE LYS 9 9.555 -12.764 13.521 1202 2HE LYS 9 2HE LYS 9 8.201 -12.766 12.374 1203 1HZ LYS 9 1HZ LYS 9 9.129 -14.998 12.649 1204 2HZ LYS 9 2HZ LYS 9 10.658 -14.436 12.166 1205 3HZ LYS 9 3HZ LYS 9 9.365 -14.436 11.064 1206 H LYS 10 H LYS 10 10.629 -5.340 11.730 1207 HA LYS 10 HA LYS 10 9.039 -5.301 13.422 1208 1HB LYS 10 1HB LYS 10 7.808 -6.071 11.013 1209 2HB LYS 10 2HB LYS 10 7.153 -7.160 12.236 1210 1HG LYS 10 1HG LYS 10 7.218 -4.131 12.403 1211 2HG LYS 10 2HG LYS 10 5.791 -5.122 12.102 1212 1HD LYS 10 1HD LYS 10 7.504 -5.331 14.596 1213 2HD LYS 10 2HD LYS 10 6.013 -4.395 14.497 1214 1HE LYS 10 1HE LYS 10 5.661 -7.116 13.478 1215 2HE LYS 10 2HE LYS 10 6.179 -7.091 15.174 1216 1HZ LYS 10 1HZ LYS 10 4.463 -5.478 15.656 1217 2HZ LYS 10 2HZ LYS 10 3.752 -6.842 14.936 1218 3HZ LYS 10 3HZ LYS 10 3.993 -5.429 14.025 1219 H SER 11 H SER 11 10.847 -6.724 14.468 1220 HA SER 11 HA SER 11 9.497 -8.871 15.872 1221 1HB SER 11 1HB SER 11 11.330 -9.411 13.587 1222 2HB SER 11 2HB SER 11 11.501 -10.454 15.000 1223 HG SER 11 HG SER 11 9.263 -10.874 14.862 1224 HA PRO 12 HA PRO 12 13.890 -8.503 17.658 1225 1HB PRO 12 1HB PRO 12 15.768 -7.067 16.261 1226 2HB PRO 12 2HB PRO 12 15.482 -8.797 15.982 1227 1HG PRO 12 1HG PRO 12 14.439 -6.434 14.467 1228 2HG PRO 12 2HG PRO 12 15.125 -7.943 13.848 1229 1HD PRO 12 1HD PRO 12 12.489 -7.501 13.931 1230 2HD PRO 12 2HD PRO 12 13.180 -9.115 14.195 1231 H LEU 13 H LEU 13 11.836 -6.692 18.133 1232 HA LEU 13 HA LEU 13 11.342 -4.527 18.948 1233 1HB LEU 13 1HB LEU 13 13.644 -5.694 20.086 1234 2HB LEU 13 2HB LEU 13 14.068 -4.003 19.815 1235 HG LEU 13 HG LEU 13 11.560 -3.714 20.819 1236 1HD1 LEU 13 1HD1 LEU 13 10.875 -5.441 22.114 1237 2HD1 LEU 13 2HD1 LEU 13 12.489 -5.683 22.782 1238 3HD1 LEU 13 3HD1 LEU 13 12.058 -6.410 21.235 1239 1HD2 LEU 13 1HD2 LEU 13 12.618 -2.896 22.764 1240 2HD2 LEU 13 2HD2 LEU 13 13.870 -2.767 21.528 1241 3HD2 LEU 13 3HD2 LEU 13 13.902 -4.102 22.679 1242 H GLY 14 H GLY 14 12.502 -4.712 16.126 1243 1HA GLY 14 1HA GLY 14 13.947 -2.124 15.955 1244 2HA GLY 14 2HA GLY 14 13.800 -3.303 14.652 1245 H GLY 15 H GLY 15 12.686 -2.301 13.036 1246 1HA GLY 15 1HA GLY 15 10.175 -0.859 13.795 1247 2HA GLY 15 2HA GLY 15 11.217 -0.315 12.480 1248 H TYR 16 H TYR 16 10.887 -1.192 10.457 1249 HA TYR 16 HA TYR 16 9.197 -3.649 10.246 1250 1HB TYR 16 1HB TYR 16 8.559 -0.873 9.617 1251 2HB TYR 16 2HB TYR 16 8.405 -1.898 8.191 1252 HD1 TYR 16 HD1 TYR 16 7.257 -1.379 11.677 1253 HD2 TYR 16 HD2 TYR 16 6.692 -3.580 8.032 1254 HE1 TYR 16 HE1 TYR 16 5.105 -2.257 12.541 1255 HE2 TYR 16 HE2 TYR 16 4.540 -4.458 8.896 1256 HH TYR 16 HH TYR 16 3.683 -4.603 11.882 1257 H GLY 17 H GLY 17 10.596 -5.018 9.187 1258 1HA GLY 17 1HA GLY 17 11.803 -4.026 6.642 1259 2HA GLY 17 2HA GLY 17 12.779 -4.968 7.772 1260 H VAL 18 H VAL 18 12.565 -6.118 5.339 1261 HA VAL 18 HA VAL 18 10.233 -7.970 5.400 1262 HB VAL 18 HB VAL 18 12.442 -7.395 3.391 1263 1HG1 VAL 18 1HG1 VAL 18 11.162 -8.816 1.845 1264 2HG1 VAL 18 2HG1 VAL 18 9.992 -9.167 3.118 1265 3HG1 VAL 18 3HG1 VAL 18 11.651 -9.748 3.260 1266 1HG2 VAL 18 1HG2 VAL 18 9.593 -6.524 3.748 1267 2HG2 VAL 18 2HG2 VAL 18 10.259 -6.649 2.120 1268 3HG2 VAL 18 3HG2 VAL 18 11.003 -5.566 3.297 1269 H PHE 19 H PHE 19 10.544 -9.854 6.534 1270 HA PHE 19 HA PHE 19 13.285 -10.842 7.032 1271 1HB PHE 19 1HB PHE 19 10.612 -11.042 8.179 1272 2HB PHE 19 2HB PHE 19 11.370 -12.630 8.049 1273 HD1 PHE 19 HD1 PHE 19 12.810 -9.224 8.667 1274 HD2 PHE 19 HD2 PHE 19 12.204 -13.204 10.163 1275 HE1 PHE 19 HE1 PHE 19 14.223 -8.699 10.636 1276 HE2 PHE 19 HE2 PHE 19 13.618 -12.680 12.132 1277 HZ PHE 19 HZ PHE 19 14.627 -10.426 12.369 1278 H ALA 20 H ALA 20 14.208 -12.393 5.770 1279 HA ALA 20 HA ALA 20 12.591 -13.671 3.654 1280 1HB ALA 20 1HB ALA 20 15.325 -14.514 3.704 1281 2HB ALA 20 2HB ALA 20 15.291 -12.797 4.102 1282 3HB ALA 20 3HB ALA 20 14.569 -13.368 2.599 1283 H ARG 21 H ARG 21 11.362 -15.178 5.007 1284 HA ARG 21 HA ARG 21 12.506 -17.095 6.786 1285 1HB ARG 21 1HB ARG 21 10.058 -16.427 6.282 1286 2HB ARG 21 2HB ARG 21 10.163 -17.548 4.926 1287 1HG ARG 21 1HG ARG 21 10.249 -19.402 6.289 1288 2HG ARG 21 2HG ARG 21 11.088 -18.542 7.580 1289 1HD ARG 21 1HD ARG 21 9.068 -18.463 8.633 1290 2HD ARG 21 2HD ARG 21 8.602 -17.261 7.414 1291 HE ARG 21 HE ARG 21 7.360 -18.948 6.305 1292 1HH1 ARG 21 1HH1 ARG 21 9.590 -20.338 8.589 1293 2HH1 ARG 21 2HH1 ARG 21 8.969 -21.940 8.387 1294 1HH2 ARG 21 1HH2 ARG 21 6.572 -21.037 6.061 1295 2HH2 ARG 21 2HH2 ARG 21 7.274 -22.335 6.968 1296 H LYS 22 H LYS 22 12.606 -16.799 3.331 1297 HA LYS 22 HA LYS 22 13.599 -19.601 3.012 1298 1HB LYS 22 1HB LYS 22 12.727 -17.473 1.012 1299 2HB LYS 22 2HB LYS 22 13.093 -19.151 0.626 1300 1HG LYS 22 1HG LYS 22 11.160 -18.967 2.787 1301 2HG LYS 22 2HG LYS 22 10.592 -18.138 1.337 1302 1HD LYS 22 1HD LYS 22 11.409 -20.278 0.087 1303 2HD LYS 22 2HD LYS 22 11.355 -21.032 1.679 1304 1HE LYS 22 1HE LYS 22 9.029 -19.613 0.327 1305 2HE LYS 22 2HE LYS 22 9.206 -21.368 0.510 1306 1HZ LYS 22 1HZ LYS 22 9.503 -20.911 2.953 1307 2HZ LYS 22 2HZ LYS 22 7.937 -20.637 2.354 1308 3HZ LYS 22 3HZ LYS 22 8.974 -19.325 2.652 1309 H SER 23 H SER 23 16.707 -18.362 1.411 1310 HA SER 23 HA SER 23 14.482 -20.356 1.273 1311 1HB SER 23 1HB SER 23 16.752 -21.103 1.957 1312 2HB SER 23 2HB SER 23 16.295 -21.816 0.410 1313 HG SER 23 HG SER 23 18.188 -19.863 0.993 1314 H PHE 24 H PHE 24 16.305 -17.996 -0.552 1315 HA PHE 24 HA PHE 24 14.692 -18.700 -2.980 1316 1HB PHE 24 1HB PHE 24 15.709 -16.092 -1.807 1317 2HB PHE 24 2HB PHE 24 15.031 -16.198 -3.431 1318 HD1 PHE 24 HD1 PHE 24 12.846 -18.118 -3.125 1319 HD2 PHE 24 HD2 PHE 24 14.123 -14.975 -0.491 1320 HE1 PHE 24 HE1 PHE 24 10.558 -17.980 -2.179 1321 HE2 PHE 24 HE2 PHE 24 11.836 -14.836 0.455 1322 HZ PHE 24 HZ PHE 24 10.053 -16.339 -0.389 1323 H GLU 25 H GLU 25 15.755 -18.366 -5.048 1324 HA GLU 25 HA GLU 25 18.707 -18.758 -4.903 1325 1HB GLU 25 1HB GLU 25 16.817 -20.187 -6.144 1326 2HB GLU 25 2HB GLU 25 17.062 -18.977 -7.403 1327 1HG GLU 25 1HG GLU 25 19.650 -19.658 -6.627 1328 2HG GLU 25 2HG GLU 25 18.787 -21.196 -6.606 1329 H LYS 26 H LYS 26 19.998 -17.615 -6.618 1330 HA LYS 26 HA LYS 26 19.584 -14.790 -6.583 1331 1HB LYS 26 1HB LYS 26 21.724 -16.094 -6.915 1332 2HB LYS 26 2HB LYS 26 21.176 -16.476 -8.545 1333 1HG LYS 26 1HG LYS 26 20.917 -13.942 -8.878 1334 2HG LYS 26 2HG LYS 26 21.858 -13.770 -7.397 1335 1HD LYS 26 1HD LYS 26 23.675 -15.115 -8.400 1336 2HD LYS 26 2HD LYS 26 22.738 -15.260 -9.887 1337 1HE LYS 26 1HE LYS 26 23.182 -13.093 -10.526 1338 2HE LYS 26 2HE LYS 26 23.158 -12.492 -8.857 1339 1HZ LYS 26 1HZ LYS 26 25.255 -14.333 -9.865 1340 2HZ LYS 26 2HZ LYS 26 25.275 -13.406 -8.442 1341 3HZ LYS 26 3HZ LYS 26 25.422 -12.645 -9.953 1342 H GLY 27 H GLY 27 17.337 -14.566 -7.365 1343 1HA GLY 27 1HA GLY 27 16.635 -13.468 -9.602 1344 2HA GLY 27 2HA GLY 27 17.035 -15.038 -10.299 1345 H GLU 28 H GLU 28 15.361 -14.270 -7.239 1346 HA GLU 28 HA GLU 28 13.021 -15.841 -8.274 1347 1HB GLU 28 1HB GLU 28 14.582 -15.785 -5.732 1348 2HB GLU 28 2HB GLU 28 12.842 -16.027 -5.577 1349 1HG GLU 28 1HG GLU 28 13.276 -17.759 -7.559 1350 2HG GLU 28 2HG GLU 28 14.896 -17.777 -6.863 1351 H LEU 29 H LEU 29 11.410 -14.383 -8.732 1352 HA LEU 29 HA LEU 29 11.161 -11.737 -7.814 1353 1HB LEU 29 1HB LEU 29 9.937 -13.067 -9.663 1354 2HB LEU 29 2HB LEU 29 8.852 -13.620 -8.390 1355 HG LEU 29 HG LEU 29 7.997 -11.611 -9.624 1356 1HD1 LEU 29 1HD1 LEU 29 8.557 -10.620 -6.873 1357 2HD1 LEU 29 2HD1 LEU 29 7.760 -12.188 -7.012 1358 3HD1 LEU 29 3HD1 LEU 29 7.022 -10.756 -7.730 1359 1HD2 LEU 29 1HD2 LEU 29 9.726 -9.716 -8.239 1360 2HD2 LEU 29 2HD2 LEU 29 9.261 -9.771 -9.939 1361 3HD2 LEU 29 3HD2 LEU 29 10.629 -10.725 -9.368 1362 H VAL 30 H VAL 30 11.004 -11.085 -5.713 1363 HA VAL 30 HA VAL 30 9.815 -12.856 -3.668 1364 HB VAL 30 HB VAL 30 11.050 -10.078 -3.553 1365 1HG1 VAL 30 1HG1 VAL 30 9.505 -11.092 -1.639 1366 2HG1 VAL 30 2HG1 VAL 30 10.990 -10.227 -1.241 1367 3HG1 VAL 30 3HG1 VAL 30 10.973 -11.990 -1.252 1368 1HG2 VAL 30 1HG2 VAL 30 12.180 -12.864 -3.398 1369 2HG2 VAL 30 2HG2 VAL 30 12.972 -11.537 -2.547 1370 3HG2 VAL 30 3HG2 VAL 30 12.783 -11.473 -4.299 1371 H GLU 31 H GLU 31 7.680 -12.484 -5.058 1372 HA GLU 31 HA GLU 31 5.504 -11.570 -5.101 1373 1HB GLU 31 1HB GLU 31 6.247 -11.804 -2.542 1374 2HB GLU 31 2HB GLU 31 6.163 -10.043 -2.603 1375 1HG GLU 31 1HG GLU 31 3.875 -10.030 -2.992 1376 2HG GLU 31 2HG GLU 31 3.891 -11.622 -3.752 1377 H GLU 32 H GLU 32 4.345 -9.448 -5.327 1378 HA GLU 32 HA GLU 32 6.116 -7.080 -5.660 1379 1HB GLU 32 1HB GLU 32 5.295 -6.824 -7.992 1380 2HB GLU 32 2HB GLU 32 6.132 -8.362 -7.784 1381 1HG GLU 32 1HG GLU 32 3.676 -9.201 -7.169 1382 2HG GLU 32 2HG GLU 32 3.216 -7.823 -8.170 1383 H CYS 33 H CYS 33 4.739 -5.097 -6.162 1384 HA CYS 33 HA CYS 33 1.874 -5.352 -5.425 1385 1HB CYS 33 1HB CYS 33 2.211 -3.713 -3.573 1386 2HB CYS 33 2HB CYS 33 3.135 -5.192 -3.307 1387 HG CYS 33 HG CYS 33 4.536 -2.700 -4.568 1388 H LEU 34 H LEU 34 0.978 -2.920 -5.334 1389 HA LEU 34 HA LEU 34 1.853 -1.650 -7.874 1390 1HB LEU 34 1HB LEU 34 -0.508 -1.188 -6.011 1391 2HB LEU 34 2HB LEU 34 -0.312 -0.459 -7.605 1392 HG LEU 34 HG LEU 34 -0.020 -3.395 -7.563 1393 1HD1 LEU 34 1HD1 LEU 34 -1.940 -2.633 -5.884 1394 2HD1 LEU 34 2HD1 LEU 34 -2.188 -3.983 -6.992 1395 3HD1 LEU 34 3HD1 LEU 34 -2.834 -2.389 -7.385 1396 1HD2 LEU 34 1HD2 LEU 34 -0.909 -3.201 -9.685 1397 2HD2 LEU 34 2HD2 LEU 34 -0.294 -1.559 -9.491 1398 3HD2 LEU 34 3HD2 LEU 34 -2.003 -1.898 -9.220 1399 H CYS 35 H CYS 35 1.439 0.936 -7.651 1400 HA CYS 35 HA CYS 35 2.577 1.981 -5.114 1401 1HB CYS 35 1HB CYS 35 3.856 2.042 -7.862 1402 2HB CYS 35 2HB CYS 35 4.320 3.180 -6.599 1403 HG CYS 35 HG CYS 35 5.863 1.336 -5.937 1404 H ILE 36 H ILE 36 2.809 4.509 -5.412 1405 HA ILE 36 HA ILE 36 0.354 5.458 -6.849 1406 HB ILE 36 HB ILE 36 1.920 6.559 -4.484 1407 1HG1 ILE 36 1HG1 ILE 36 -0.827 5.282 -4.652 1408 2HG1 ILE 36 2HG1 ILE 36 0.619 4.503 -4.009 1409 1HG2 ILE 36 1HG2 ILE 36 -0.779 7.501 -5.458 1410 2HG2 ILE 36 2HG2 ILE 36 0.715 8.222 -6.056 1411 3HG2 ILE 36 3HG2 ILE 36 0.322 8.305 -4.339 1412 1HD1 ILE 36 1HD1 ILE 36 -0.192 7.169 -2.900 1413 2HD1 ILE 36 2HD1 ILE 36 0.660 5.842 -2.110 1414 3HD1 ILE 36 3HD1 ILE 36 -1.079 5.735 -2.387 1415 H VAL 37 H VAL 37 0.571 7.173 -8.323 1416 HA VAL 37 HA VAL 37 3.379 8.103 -8.830 1417 HB VAL 37 HB VAL 37 1.024 7.784 -10.728 1418 1HG1 VAL 37 1HG1 VAL 37 2.527 9.454 -11.574 1419 2HG1 VAL 37 2HG1 VAL 37 2.894 7.964 -12.444 1420 3HG1 VAL 37 3HG1 VAL 37 3.939 8.497 -11.126 1421 1HG2 VAL 37 1HG2 VAL 37 2.843 5.962 -11.545 1422 2HG2 VAL 37 2HG2 VAL 37 1.560 5.578 -10.396 1423 3HG2 VAL 37 3HG2 VAL 37 3.181 5.955 -9.813 1424 H ARG 38 H ARG 38 3.593 10.200 -8.169 1425 HA ARG 38 HA ARG 38 1.486 12.156 -8.949 1426 1HB ARG 38 1HB ARG 38 2.183 11.176 -6.258 1427 2HB ARG 38 2HB ARG 38 2.198 12.934 -6.386 1428 1HG ARG 38 1HG ARG 38 -0.095 11.207 -7.356 1429 2HG ARG 38 2HG ARG 38 -0.046 11.955 -5.759 1430 1HD ARG 38 1HD ARG 38 0.546 13.810 -7.988 1431 2HD ARG 38 2HD ARG 38 -1.110 13.174 -7.970 1432 HE ARG 38 HE ARG 38 -0.405 13.860 -5.299 1433 1HH1 ARG 38 1HH1 ARG 38 -0.983 15.385 -8.375 1434 2HH1 ARG 38 2HH1 ARG 38 -1.533 16.862 -7.663 1435 1HH2 ARG 38 1HH2 ARG 38 -1.121 15.787 -4.399 1436 2HH2 ARG 38 2HH2 ARG 38 -1.611 17.090 -5.429 1437 H HIS 39 H HIS 39 2.310 14.372 -8.955 1438 HA HIS 39 HA HIS 39 5.161 14.528 -9.627 1439 1HB HIS 39 1HB HIS 39 2.680 16.122 -9.854 1440 2HB HIS 39 2HB HIS 39 4.138 17.088 -9.631 1441 HD1 HIS 39 HD1 HIS 39 3.975 17.889 -12.136 1442 HD2 HIS 39 HD2 HIS 39 4.527 13.783 -11.672 1443 HE1 HIS 39 HE1 HIS 39 4.643 16.995 -14.409 1444 H ASN 40 H ASN 40 6.310 16.612 -8.674 1445 HA ASN 40 HA ASN 40 6.721 16.202 -5.871 1446 1HB ASN 40 1HB ASN 40 8.138 18.242 -6.159 1447 2HB ASN 40 2HB ASN 40 8.381 17.081 -7.462 1448 1HD2 ASN 40 1HD2 ASN 40 8.907 18.580 -9.141 1449 2HD2 ASN 40 2HD2 ASN 40 7.817 19.750 -9.710 1450 H ASP 41 H ASP 41 6.707 19.362 -5.538 1451 HA ASP 41 HA ASP 41 5.253 20.972 -4.625 1452 1HB ASP 41 1HB ASP 41 4.036 20.038 -6.837 1453 2HB ASP 41 2HB ASP 41 2.874 19.468 -5.640 1454 H ASP 42 H ASP 42 2.479 20.287 -3.731 1455 HA ASP 42 HA ASP 42 2.845 19.721 -1.042 1456 1HB ASP 42 1HB ASP 42 0.445 18.971 -1.152 1457 2HB ASP 42 2HB ASP 42 0.741 20.457 -2.053 1458 H TRP 43 H TRP 43 2.389 17.329 -3.653 1459 HA TRP 43 HA TRP 43 2.285 14.990 -2.016 1460 1HB TRP 43 1HB TRP 43 1.667 15.006 -4.367 1461 2HB TRP 43 2HB TRP 43 3.274 15.558 -4.833 1462 HD1 TRP 43 HD1 TRP 43 5.028 13.767 -5.340 1463 HE1 TRP 43 HE1 TRP 43 5.140 11.203 -5.109 1464 HE3 TRP 43 HE3 TRP 43 0.718 12.927 -2.733 1465 HZ2 TRP 43 HZ2 TRP 43 3.608 9.079 -3.970 1466 HZ3 TRP 43 HZ3 TRP 43 0.070 10.624 -2.088 1467 HH2 TRP 43 HH2 TRP 43 1.507 8.700 -2.702 1468 H GLY 44 H GLY 44 5.003 16.872 -3.306 1469 1HA GLY 44 1HA GLY 44 7.068 15.007 -2.616 1470 2HA GLY 44 2HA GLY 44 7.305 16.735 -2.875 1471 H THR 45 H THR 45 5.449 17.584 -0.802 1472 HA THR 45 HA THR 45 7.244 17.290 1.504 1473 HB THR 45 HB THR 45 4.618 18.753 1.049 1474 HG1 THR 45 HG1 THR 45 5.830 20.238 0.219 1475 1HG2 THR 45 1HG2 THR 45 4.657 19.347 3.223 1476 2HG2 THR 45 2HG2 THR 45 6.347 19.839 3.104 1477 3HG2 THR 45 3HG2 THR 45 5.940 18.162 3.467 1478 H ALA 46 H ALA 46 3.709 16.794 1.059 1479 HA ALA 46 HA ALA 46 3.109 15.552 3.485 1480 1HB ALA 46 1HB ALA 46 1.537 16.196 1.647 1481 2HB ALA 46 2HB ALA 46 1.239 14.557 2.228 1482 3HB ALA 46 3HB ALA 46 2.102 14.812 0.712 1483 H LEU 47 H LEU 47 3.884 13.765 0.468 1484 HA LEU 47 HA LEU 47 4.535 11.365 2.085 1485 1HB LEU 47 1HB LEU 47 4.290 11.965 -0.886 1486 2HB LEU 47 2HB LEU 47 4.727 10.380 -0.260 1487 HG LEU 47 HG LEU 47 2.372 10.306 -0.658 1488 1HD1 LEU 47 1HD1 LEU 47 2.113 10.952 2.213 1489 2HD1 LEU 47 2HD1 LEU 47 3.398 9.809 1.821 1490 3HD1 LEU 47 3HD1 LEU 47 1.734 9.460 1.353 1491 1HD2 LEU 47 1HD2 LEU 47 0.905 12.034 -0.340 1492 2HD2 LEU 47 2HD2 LEU 47 2.382 12.984 -0.481 1493 3HD2 LEU 47 3HD2 LEU 47 1.725 12.607 1.112 1494 H GLU 48 H GLU 48 6.295 13.827 2.040 1495 HA GLU 48 HA GLU 48 8.564 13.677 0.467 1496 1HB GLU 48 1HB GLU 48 9.728 14.615 2.518 1497 2HB GLU 48 2HB GLU 48 8.218 15.420 2.103 1498 1HG GLU 48 1HG GLU 48 8.087 15.086 4.444 1499 2HG GLU 48 2HG GLU 48 7.100 13.794 3.770 1500 H ASP 49 H ASP 49 7.624 11.377 2.942 1501 HA ASP 49 HA ASP 49 10.273 10.017 2.650 1502 1HB ASP 49 1HB ASP 49 9.577 8.955 4.821 1503 2HB ASP 49 2HB ASP 49 9.672 10.712 4.924 1504 H TYR 50 H TYR 50 10.081 7.576 2.728 1505 HA TYR 50 HA TYR 50 9.271 5.592 1.727 1506 1HB TYR 50 1HB TYR 50 6.642 6.912 2.510 1507 2HB TYR 50 2HB TYR 50 6.907 5.187 2.274 1508 HD1 TYR 50 HD1 TYR 50 9.171 4.368 3.646 1509 HD2 TYR 50 HD2 TYR 50 6.524 7.571 4.732 1510 HE1 TYR 50 HE1 TYR 50 9.892 4.163 6.010 1511 HE2 TYR 50 HE2 TYR 50 7.244 7.366 7.096 1512 HH TYR 50 HH TYR 50 9.346 4.747 8.156 1513 H LEU 51 H LEU 51 9.557 8.066 0.035 1514 HA LEU 51 HA LEU 51 7.470 7.478 -2.035 1515 1HB LEU 51 1HB LEU 51 7.959 9.786 -0.731 1516 2HB LEU 51 2HB LEU 51 9.132 9.967 -2.032 1517 HG LEU 51 HG LEU 51 7.356 9.633 -3.701 1518 1HD1 LEU 51 1HD1 LEU 51 5.485 8.538 -3.093 1519 2HD1 LEU 51 2HD1 LEU 51 5.015 9.941 -2.134 1520 3HD1 LEU 51 3HD1 LEU 51 5.943 8.636 -1.393 1521 1HD2 LEU 51 1HD2 LEU 51 6.866 11.836 -3.602 1522 2HD2 LEU 51 2HD2 LEU 51 7.703 11.860 -2.049 1523 3HD2 LEU 51 3HD2 LEU 51 5.955 11.631 -2.105 1524 H PHE 52 H PHE 52 8.306 6.306 -3.706 1525 HA PHE 52 HA PHE 52 11.204 6.393 -4.317 1526 1HB PHE 52 1HB PHE 52 8.787 4.803 -5.211 1527 2HB PHE 52 2HB PHE 52 10.328 4.662 -6.056 1528 HD1 PHE 52 HD1 PHE 52 9.080 4.751 -2.509 1529 HD2 PHE 52 HD2 PHE 52 11.731 2.944 -5.366 1530 HE1 PHE 52 HE1 PHE 52 9.893 3.188 -0.765 1531 HE2 PHE 52 HE2 PHE 52 12.544 1.380 -3.621 1532 HZ PHE 52 HZ PHE 52 11.624 1.502 -1.321 1533 H SER 53 H SER 53 11.742 8.231 -5.499 1534 HA SER 53 HA SER 53 9.831 9.146 -7.602 1535 1HB SER 53 1HB SER 53 10.597 10.665 -5.747 1536 2HB SER 53 2HB SER 53 12.245 10.509 -6.356 1537 HG SER 53 HG SER 53 11.652 12.169 -7.512 1538 H ARG 54 H ARG 54 10.628 9.668 -9.705 1539 HA ARG 54 HA ARG 54 13.314 8.532 -10.394 1540 1HB ARG 54 1HB ARG 54 12.180 7.651 -12.456 1541 2HB ARG 54 2HB ARG 54 11.523 6.952 -10.975 1542 1HG ARG 54 1HG ARG 54 9.571 8.275 -11.077 1543 2HG ARG 54 2HG ARG 54 10.304 9.426 -12.194 1544 1HD ARG 54 1HD ARG 54 9.834 6.527 -12.948 1545 2HD ARG 54 2HD ARG 54 8.637 7.801 -13.253 1546 HE ARG 54 HE ARG 54 11.127 8.778 -14.170 1547 1HH1 ARG 54 1HH1 ARG 54 8.917 6.185 -14.883 1548 2HH1 ARG 54 2HH1 ARG 54 9.362 6.117 -16.553 1549 1HH2 ARG 54 1HH2 ARG 54 11.688 8.670 -16.340 1550 2HH2 ARG 54 2HH2 ARG 54 10.920 7.513 -17.374 1551 H LYS 55 H LYS 55 13.595 9.236 -12.945 1552 HA LYS 55 HA LYS 55 13.698 12.148 -12.879 1553 1HB LYS 55 1HB LYS 55 14.726 9.875 -14.432 1554 2HB LYS 55 2HB LYS 55 14.355 11.275 -15.439 1555 1HG LYS 55 1HG LYS 55 15.906 11.594 -12.873 1556 2HG LYS 55 2HG LYS 55 16.722 11.126 -14.365 1557 1HD LYS 55 1HD LYS 55 15.243 13.193 -15.290 1558 2HD LYS 55 2HD LYS 55 15.470 13.717 -13.621 1559 1HE LYS 55 1HE LYS 55 17.749 12.822 -15.422 1560 2HE LYS 55 2HE LYS 55 17.295 14.517 -15.166 1561 1HZ LYS 55 1HZ LYS 55 17.413 13.980 -12.713 1562 2HZ LYS 55 2HZ LYS 55 18.903 14.033 -13.526 1563 3HZ LYS 55 3HZ LYS 55 18.195 12.536 -13.147 1564 H ASN 56 H ASN 56 11.326 12.468 -12.723 1565 HA ASN 56 HA ASN 56 9.628 11.757 -14.996 1566 1HB ASN 56 1HB ASN 56 9.967 14.693 -14.653 1567 2HB ASN 56 2HB ASN 56 11.317 13.840 -15.398 1568 1HD2 ASN 56 1HD2 ASN 56 7.706 13.739 -15.644 1569 2HD2 ASN 56 2HD2 ASN 56 7.683 13.678 -17.340 1570 H MET 57 H MET 57 9.705 11.725 -11.954 1571 HA MET 57 HA MET 57 7.824 13.672 -10.957 1572 1HB MET 57 1HB MET 57 5.821 12.228 -10.967 1573 2HB MET 57 2HB MET 57 6.407 12.468 -12.611 1574 1HG MET 57 1HG MET 57 7.810 10.230 -11.659 1575 2HG MET 57 2HG MET 57 6.155 10.007 -11.095 1576 1HE MET 57 1HE MET 57 3.980 10.339 -14.102 1577 2HE MET 57 2HE MET 57 4.845 11.872 -13.999 1578 3HE MET 57 3HE MET 57 4.338 11.046 -12.526 1579 H SER 58 H SER 58 6.462 12.157 -9.066 1580 HA SER 58 HA SER 58 8.590 10.627 -7.622 1581 1HB SER 58 1HB SER 58 6.757 12.691 -6.365 1582 2HB SER 58 2HB SER 58 8.199 11.960 -5.659 1583 HG SER 58 HG SER 58 9.026 13.769 -6.407 1584 H ALA 59 H ALA 59 7.670 8.609 -7.419 1585 HA ALA 59 HA ALA 59 4.734 8.404 -6.913 1586 1HB ALA 59 1HB ALA 59 6.924 6.601 -7.955 1587 2HB ALA 59 2HB ALA 59 5.418 7.071 -8.745 1588 3HB ALA 59 3HB ALA 59 5.392 5.916 -7.413 1589 H MET 60 H MET 60 4.201 6.452 -5.392 1590 HA MET 60 HA MET 60 5.970 6.639 -2.974 1591 1HB MET 60 1HB MET 60 3.307 7.278 -3.325 1592 2HB MET 60 2HB MET 60 3.200 5.626 -2.723 1593 1HG MET 60 1HG MET 60 5.154 6.843 -1.120 1594 2HG MET 60 2HG MET 60 3.892 8.062 -1.291 1595 1HE MET 60 1HE MET 60 2.224 7.595 1.505 1596 2HE MET 60 2HE MET 60 3.762 8.165 0.857 1597 3HE MET 60 3HE MET 60 3.731 6.840 2.021 1598 H ALA 61 H ALA 61 6.072 4.631 -1.658 1599 HA ALA 61 HA ALA 61 6.297 2.222 -3.339 1600 1HB ALA 61 1HB ALA 61 6.642 1.727 -0.537 1601 2HB ALA 61 2HB ALA 61 7.363 3.297 -0.894 1602 3HB ALA 61 3HB ALA 61 7.897 1.861 -1.770 1603 H LEU 62 H LEU 62 4.040 1.917 -3.849 1604 HA LEU 62 HA LEU 62 1.952 0.861 -3.510 1605 1HB LEU 62 1HB LEU 62 2.109 2.601 -1.038 1606 2HB LEU 62 2HB LEU 62 1.912 3.266 -2.652 1607 HG LEU 62 HG LEU 62 0.030 1.333 -1.271 1608 1HD1 LEU 62 1HD1 LEU 62 -1.132 3.796 -2.217 1609 2HD1 LEU 62 2HD1 LEU 62 0.260 4.163 -1.195 1610 3HD1 LEU 62 3HD1 LEU 62 -1.058 3.176 -0.568 1611 1HD2 LEU 62 1HD2 LEU 62 0.447 2.091 -4.065 1612 2HD2 LEU 62 2HD2 LEU 62 -1.208 2.349 -3.515 1613 3HD2 LEU 62 3HD2 LEU 62 -0.477 0.749 -3.393 1614 H GLY 63 H GLY 63 2.851 -1.299 -2.997 1615 1HA GLY 63 1HA GLY 63 1.819 -2.362 -0.557 1616 2HA GLY 63 2HA GLY 63 2.882 -3.227 -1.665 1617 H PHE 64 H PHE 64 4.520 -4.022 -0.427 1618 HA PHE 64 HA PHE 64 5.533 -2.561 1.908 1619 1HB PHE 64 1HB PHE 64 6.447 -5.104 0.509 1620 2HB PHE 64 2HB PHE 64 6.906 -4.603 2.135 1621 HD1 PHE 64 HD1 PHE 64 4.941 -4.139 3.805 1622 HD2 PHE 64 HD2 PHE 64 4.553 -6.446 0.202 1623 HE1 PHE 64 HE1 PHE 64 2.897 -5.211 4.711 1624 HE2 PHE 64 HE2 PHE 64 2.509 -7.518 1.109 1625 HZ PHE 64 HZ PHE 64 1.681 -6.901 3.364 1626 H GLY 65 H GLY 65 5.985 -0.917 -0.268 1627 1HA GLY 65 1HA GLY 65 8.749 -1.391 -1.209 1628 2HA GLY 65 2HA GLY 65 7.682 -0.095 -1.752 1629 H ALA 66 H ALA 66 7.003 0.474 1.155 1630 HA ALA 66 HA ALA 66 9.269 2.316 1.627 1631 1HB ALA 66 1HB ALA 66 7.576 3.019 3.488 1632 2HB ALA 66 2HB ALA 66 6.465 1.913 2.681 1633 3HB ALA 66 3HB ALA 66 7.119 3.299 1.808 1634 H ILE 67 H ILE 67 7.673 -0.450 3.198 1635 HA ILE 67 HA ILE 67 8.958 -0.359 5.715 1636 HB ILE 67 HB ILE 67 8.497 -2.844 5.663 1637 1HG1 ILE 67 1HG1 ILE 67 7.010 -3.041 3.288 1638 2HG1 ILE 67 2HG1 ILE 67 8.532 -2.286 2.815 1639 1HG2 ILE 67 1HG2 ILE 67 6.687 -1.505 6.384 1640 2HG2 ILE 67 2HG2 ILE 67 5.995 -2.514 5.113 1641 3HG2 ILE 67 3HG2 ILE 67 6.427 -0.838 4.772 1642 1HD1 ILE 67 1HD1 ILE 67 8.141 -4.916 4.260 1643 2HD1 ILE 67 2HD1 ILE 67 9.704 -4.106 4.163 1644 3HD1 ILE 67 3HD1 ILE 67 8.899 -4.649 2.691 1645 H PHE 68 H PHE 68 10.270 -1.156 2.589 1646 HA PHE 68 HA PHE 68 12.425 -2.856 3.280 1647 1HB PHE 68 1HB PHE 68 11.934 -0.710 1.214 1648 2HB PHE 68 2HB PHE 68 13.479 -1.558 1.264 1649 HD1 PHE 68 HD1 PHE 68 12.818 -4.270 1.993 1650 HD2 PHE 68 HD2 PHE 68 10.676 -1.567 -0.568 1651 HE1 PHE 68 HE1 PHE 68 11.806 -6.197 0.806 1652 HE2 PHE 68 HE2 PHE 68 9.663 -3.495 -1.755 1653 HZ PHE 68 HZ PHE 68 10.228 -5.810 -1.067 1654 H ASN 69 H ASN 69 14.065 -2.491 4.707 1655 HA ASN 69 HA ASN 69 14.637 0.251 5.639 1656 1HB ASN 69 1HB ASN 69 15.760 -2.478 6.377 1657 2HB ASN 69 2HB ASN 69 16.000 -0.991 7.295 1658 1HD2 ASN 69 1HD2 ASN 69 14.767 -3.061 8.665 1659 2HD2 ASN 69 2HD2 ASN 69 13.108 -2.749 8.849 1660 H HIS 70 H HIS 70 17.148 0.623 6.015 1661 HA HIS 70 HA HIS 70 18.436 0.323 3.348 1662 1HB HIS 70 1HB HIS 70 18.091 2.527 4.614 1663 2HB HIS 70 2HB HIS 70 19.305 1.952 5.757 1664 HD1 HIS 70 HD1 HIS 70 18.971 2.445 1.983 1665 HD2 HIS 70 HD2 HIS 70 21.879 2.561 4.968 1666 HE1 HIS 70 HE1 HIS 70 21.117 3.192 0.864 1667 H SER 71 H SER 71 19.699 -1.500 3.200 1668 HA SER 71 HA SER 71 21.338 -2.267 5.594 1669 1HB SER 71 1HB SER 71 19.677 -3.933 4.992 1670 2HB SER 71 2HB SER 71 20.139 -3.848 3.292 1671 HG SER 71 HG SER 71 21.299 -5.516 3.928 1672 H LYS 72 H LYS 72 23.520 -3.051 5.120 1673 HA LYS 72 HA LYS 72 24.884 -1.506 3.079 1674 1HB LYS 72 1HB LYS 72 25.721 -3.789 4.906 1675 2HB LYS 72 2HB LYS 72 26.845 -2.802 3.972 1676 1HG LYS 72 1HG LYS 72 24.964 -1.174 5.503 1677 2HG LYS 72 2HG LYS 72 25.918 -2.236 6.538 1678 1HD LYS 72 1HD LYS 72 27.887 -1.175 6.036 1679 2HD LYS 72 2HD LYS 72 27.400 -0.837 4.375 1680 1HE LYS 72 1HE LYS 72 25.679 0.808 5.503 1681 2HE LYS 72 2HE LYS 72 26.800 0.726 6.876 1682 1HZ LYS 72 1HZ LYS 72 28.619 1.271 5.402 1683 2HZ LYS 72 2HZ LYS 72 27.422 2.468 5.269 1684 3HZ LYS 72 3HZ LYS 72 27.580 1.287 4.058 1685 H ASP 73 H ASP 73 23.523 -4.719 3.219 1686 HA ASP 73 HA ASP 73 24.595 -5.239 0.468 1687 1HB ASP 73 1HB ASP 73 24.282 -7.169 2.800 1688 2HB ASP 73 2HB ASP 73 24.864 -7.601 1.192 1689 HA PRO 74 HA PRO 74 19.942 -5.558 0.749 1690 1HB PRO 74 1HB PRO 74 19.552 -4.304 -1.703 1691 2HB PRO 74 2HB PRO 74 19.530 -3.471 -0.139 1692 1HG PRO 74 1HG PRO 74 21.696 -3.648 -2.168 1693 2HG PRO 74 2HG PRO 74 21.237 -2.298 -1.121 1694 1HD PRO 74 1HD PRO 74 23.395 -3.874 -0.646 1695 2HD PRO 74 2HD PRO 74 22.467 -3.091 0.651 1696 H ASN 75 H ASN 75 20.143 -7.836 0.377 1697 HA ASN 75 HA ASN 75 21.057 -8.970 -2.117 1698 1HB ASN 75 1HB ASN 75 19.256 -10.084 0.067 1699 2HB ASN 75 2HB ASN 75 20.176 -11.035 -1.098 1700 1HD2 ASN 75 1HD2 ASN 75 22.590 -9.338 -0.994 1701 2HD2 ASN 75 2HD2 ASN 75 23.303 -9.600 0.524 1702 H ALA 76 H ALA 76 18.103 -7.448 -1.212 1703 HA ALA 76 HA ALA 76 16.695 -8.746 -3.519 1704 1HB ALA 76 1HB ALA 76 15.418 -7.227 -1.239 1705 2HB ALA 76 2HB ALA 76 15.889 -8.915 -1.046 1706 3HB ALA 76 3HB ALA 76 14.698 -8.466 -2.267 1707 H ARG 77 H ARG 77 16.632 -7.399 -5.267 1708 HA ARG 77 HA ARG 77 16.791 -4.454 -4.843 1709 1HB ARG 77 1HB ARG 77 17.981 -6.260 -6.592 1710 2HB ARG 77 2HB ARG 77 16.725 -5.520 -7.585 1711 1HG ARG 77 1HG ARG 77 17.755 -3.334 -6.286 1712 2HG ARG 77 2HG ARG 77 19.193 -4.337 -6.481 1713 1HD ARG 77 1HD ARG 77 18.936 -4.408 -8.863 1714 2HD ARG 77 2HD ARG 77 17.289 -3.754 -8.772 1715 HE ARG 77 HE ARG 77 19.052 -1.929 -7.470 1716 1HH1 ARG 77 1HH1 ARG 77 18.344 -3.164 -10.646 1717 2HH1 ARG 77 2HH1 ARG 77 18.861 -1.720 -11.444 1718 1HH2 ARG 77 1HH2 ARG 77 19.717 -0.064 -8.528 1719 2HH2 ARG 77 2HH2 ARG 77 19.633 0.024 -10.255 1720 H HIS 78 H HIS 78 15.382 -3.191 -6.525 1721 HA HIS 78 HA HIS 78 12.648 -4.428 -6.575 1722 1HB HIS 78 1HB HIS 78 11.868 -2.081 -6.267 1723 2HB HIS 78 2HB HIS 78 12.944 -2.580 -4.963 1724 HD1 HIS 78 HD1 HIS 78 15.187 -1.377 -4.746 1725 HD2 HIS 78 HD2 HIS 78 13.080 -0.257 -8.164 1726 HE1 HIS 78 HE1 HIS 78 16.408 0.617 -5.719 1727 H GLU 79 H GLU 79 11.400 -4.087 -8.459 1728 HA GLU 79 HA GLU 79 12.825 -2.821 -10.776 1729 1HB GLU 79 1HB GLU 79 12.651 -5.430 -10.538 1730 2HB GLU 79 2HB GLU 79 10.964 -5.190 -10.991 1731 1HG GLU 79 1HG GLU 79 11.761 -3.919 -13.011 1732 2HG GLU 79 2HG GLU 79 13.410 -4.379 -12.587 1733 H LEU 80 H LEU 80 11.530 -1.476 -12.038 1734 HA LEU 80 HA LEU 80 8.668 -1.212 -11.187 1735 1HB LEU 80 1HB LEU 80 10.893 0.639 -11.852 1736 2HB LEU 80 2HB LEU 80 9.310 1.113 -12.469 1737 HG LEU 80 HG LEU 80 9.425 0.165 -9.647 1738 1HD1 LEU 80 1HD1 LEU 80 11.426 1.734 -10.070 1739 2HD1 LEU 80 2HD1 LEU 80 10.317 2.184 -8.774 1740 3HD1 LEU 80 3HD1 LEU 80 10.223 2.996 -10.337 1741 1HD2 LEU 80 1HD2 LEU 80 7.287 0.834 -10.267 1742 2HD2 LEU 80 2HD2 LEU 80 7.884 2.098 -11.341 1743 3HD2 LEU 80 3HD2 LEU 80 7.915 2.339 -9.594 1744 H THR 81 H THR 81 7.122 -1.550 -12.735 1745 HA THR 81 HA THR 81 7.678 -2.699 -15.265 1746 HB THR 81 HB THR 81 5.257 -2.135 -15.666 1747 HG1 THR 81 HG1 THR 81 5.328 -0.924 -13.123 1748 1HG2 THR 81 1HG2 THR 81 6.396 -3.744 -13.645 1749 2HG2 THR 81 2HG2 THR 81 4.795 -3.913 -14.364 1750 3HG2 THR 81 3HG2 THR 81 5.009 -2.947 -12.905 1751 H ALA 82 H ALA 82 6.262 -1.311 -17.182 1752 HA ALA 82 HA ALA 82 8.163 0.729 -17.999 1753 1HB ALA 82 1HB ALA 82 5.787 -0.719 -19.018 1754 2HB ALA 82 2HB ALA 82 7.286 -0.306 -19.849 1755 3HB ALA 82 3HB ALA 82 6.005 0.895 -19.694 1756 H GLY 83 H GLY 83 7.422 1.817 -15.693 1757 1HA GLY 83 1HA GLY 83 6.468 4.364 -16.183 1758 2HA GLY 83 2HA GLY 83 5.003 3.433 -15.872 1759 H LEU 84 H LEU 84 4.395 3.933 -13.815 1760 HA LEU 84 HA LEU 84 6.318 3.393 -11.613 1761 1HB LEU 84 1HB LEU 84 5.900 5.940 -12.634 1762 2HB LEU 84 2HB LEU 84 4.764 5.880 -11.289 1763 HG LEU 84 HG LEU 84 6.563 5.230 -9.760 1764 1HD1 LEU 84 1HD1 LEU 84 8.086 5.042 -12.331 1765 2HD1 LEU 84 2HD1 LEU 84 8.127 3.980 -10.924 1766 3HD1 LEU 84 3HD1 LEU 84 8.956 5.535 -10.878 1767 1HD2 LEU 84 1HD2 LEU 84 7.610 7.340 -9.621 1768 2HD2 LEU 84 2HD2 LEU 84 6.113 7.683 -10.488 1769 3HD2 LEU 84 3HD2 LEU 84 7.632 7.543 -11.373 1770 H LYS 85 H LYS 85 3.743 2.225 -12.700 1771 HA LYS 85 HA LYS 85 1.861 2.796 -10.463 1772 1HB LYS 85 1HB LYS 85 1.648 1.294 -13.097 1773 2HB LYS 85 2HB LYS 85 0.311 1.487 -11.963 1774 1HG LYS 85 1HG LYS 85 0.805 4.023 -12.124 1775 2HG LYS 85 2HG LYS 85 1.737 3.611 -13.563 1776 1HD LYS 85 1HD LYS 85 -0.466 2.255 -14.178 1777 2HD LYS 85 2HD LYS 85 -1.214 3.428 -13.095 1778 1HE LYS 85 1HE LYS 85 0.198 5.170 -14.513 1779 2HE LYS 85 2HE LYS 85 0.144 3.884 -15.734 1780 1HZ LYS 85 1HZ LYS 85 -1.809 5.414 -15.784 1781 2HZ LYS 85 2HZ LYS 85 -2.233 4.860 -14.236 1782 3HZ LYS 85 3HZ LYS 85 -2.222 3.784 -15.550 1783 H ARG 86 H ARG 86 3.696 0.119 -11.937 1784 HA ARG 86 HA ARG 86 3.135 -1.476 -9.464 1785 1HB ARG 86 1HB ARG 86 2.150 -1.884 -12.091 1786 2HB ARG 86 2HB ARG 86 3.390 -3.112 -11.843 1787 1HG ARG 86 1HG ARG 86 1.858 -2.936 -9.442 1788 2HG ARG 86 2HG ARG 86 0.728 -3.047 -10.791 1789 1HD ARG 86 1HD ARG 86 2.462 -4.942 -11.582 1790 2HD ARG 86 2HD ARG 86 2.732 -5.043 -9.832 1791 HE ARG 86 HE ARG 86 -0.045 -4.887 -10.138 1792 1HH1 ARG 86 1HH1 ARG 86 2.505 -6.990 -11.231 1793 2HH1 ARG 86 2HH1 ARG 86 1.479 -8.379 -11.300 1794 1HH2 ARG 86 1HH2 ARG 86 -1.357 -6.704 -10.235 1795 2HH2 ARG 86 2HH2 ARG 86 -0.692 -8.222 -10.740 1796 H MET 87 H MET 87 4.866 -2.755 -8.770 1797 HA MET 87 HA MET 87 7.281 -3.005 -10.469 1798 1HB MET 87 1HB MET 87 8.586 -2.128 -8.363 1799 2HB MET 87 2HB MET 87 7.848 -0.957 -9.451 1800 1HG MET 87 1HG MET 87 6.188 -0.397 -7.946 1801 2HG MET 87 2HG MET 87 6.210 -1.979 -7.164 1802 1HE MET 87 1HE MET 87 8.266 -2.301 -4.710 1803 2HE MET 87 2HE MET 87 9.654 -2.124 -5.784 1804 3HE MET 87 3HE MET 87 8.191 -2.926 -6.358 1805 H ARG 88 H ARG 88 8.594 -4.768 -9.828 1806 HA ARG 88 HA ARG 88 7.395 -6.507 -7.698 1807 1HB ARG 88 1HB ARG 88 9.127 -7.229 -10.091 1808 2HB ARG 88 2HB ARG 88 8.254 -8.353 -9.052 1809 1HG ARG 88 1HG ARG 88 6.633 -8.201 -10.645 1810 2HG ARG 88 2HG ARG 88 6.233 -6.686 -9.836 1811 1HD ARG 88 1HD ARG 88 7.037 -5.423 -11.568 1812 2HD ARG 88 2HD ARG 88 8.436 -6.486 -11.808 1813 HE ARG 88 HE ARG 88 5.879 -6.716 -13.172 1814 1HH1 ARG 88 1HH1 ARG 88 8.561 -8.508 -11.862 1815 2HH1 ARG 88 2HH1 ARG 88 8.326 -9.850 -12.928 1816 1HH2 ARG 88 1HH2 ARG 88 5.594 -8.469 -14.543 1817 2HH2 ARG 88 2HH2 ARG 88 6.660 -9.830 -14.435 1818 H ILE 89 H ILE 89 8.986 -7.849 -6.489 1819 HA ILE 89 HA ILE 89 11.579 -6.394 -6.125 1820 HB ILE 89 HB ILE 89 9.876 -8.138 -4.307 1821 1HG1 ILE 89 1HG1 ILE 89 10.653 -5.329 -3.675 1822 2HG1 ILE 89 2HG1 ILE 89 9.453 -5.561 -4.946 1823 1HG2 ILE 89 1HG2 ILE 89 11.524 -7.528 -2.543 1824 2HG2 ILE 89 2HG2 ILE 89 12.530 -6.766 -3.775 1825 3HG2 ILE 89 3HG2 ILE 89 12.250 -8.506 -3.818 1826 1HD1 ILE 89 1HD1 ILE 89 7.956 -6.674 -3.482 1827 2HD1 ILE 89 2HD1 ILE 89 8.579 -5.327 -2.529 1828 3HD1 ILE 89 3HD1 ILE 89 9.213 -6.953 -2.276 1829 H PHE 90 H PHE 90 13.449 -7.519 -6.563 1830 HA PHE 90 HA PHE 90 13.196 -10.463 -7.093 1831 1HB PHE 90 1HB PHE 90 14.701 -8.184 -8.377 1832 2HB PHE 90 2HB PHE 90 15.288 -9.835 -8.567 1833 HD1 PHE 90 HD1 PHE 90 14.154 -11.415 -9.972 1834 HD2 PHE 90 HD2 PHE 90 12.418 -7.566 -9.183 1835 HE1 PHE 90 HE1 PHE 90 12.478 -11.805 -11.758 1836 HE2 PHE 90 HE2 PHE 90 10.742 -7.956 -10.970 1837 HZ PHE 90 HZ PHE 90 10.772 -10.075 -12.257 1838 H THR 91 H THR 91 15.635 -11.392 -7.042 1839 HA THR 91 HA THR 91 16.923 -10.391 -4.524 1840 HB THR 91 HB THR 91 17.368 -12.825 -4.086 1841 HG1 THR 91 HG1 THR 91 16.284 -14.311 -5.405 1842 1HG2 THR 91 1HG2 THR 91 14.421 -12.485 -4.602 1843 2HG2 THR 91 2HG2 THR 91 15.231 -11.497 -3.387 1844 3HG2 THR 91 3HG2 THR 91 15.222 -13.254 -3.232 1845 H ILE 92 H ILE 92 18.776 -9.410 -5.332 1846 HA ILE 92 HA ILE 92 20.185 -10.157 -7.693 1847 HB ILE 92 HB ILE 92 21.964 -8.738 -6.674 1848 1HG1 ILE 92 1HG1 ILE 92 20.298 -8.328 -4.237 1849 2HG1 ILE 92 2HG1 ILE 92 21.264 -9.801 -4.309 1850 1HG2 ILE 92 1HG2 ILE 92 20.719 -6.771 -6.768 1851 2HG2 ILE 92 2HG2 ILE 92 19.363 -7.468 -5.883 1852 3HG2 ILE 92 3HG2 ILE 92 19.626 -7.897 -7.573 1853 1HD1 ILE 92 1HD1 ILE 92 22.127 -6.995 -4.015 1854 2HD1 ILE 92 2HD1 ILE 92 23.061 -7.925 -5.187 1855 3HD1 ILE 92 3HD1 ILE 92 22.938 -8.479 -3.517 1856 H LYS 93 H LYS 93 20.077 -11.664 -4.584 1857 HA LYS 93 HA LYS 93 22.115 -13.627 -5.475 1858 1HB LYS 93 1HB LYS 93 23.337 -13.368 -3.339 1859 2HB LYS 93 2HB LYS 93 23.289 -11.832 -4.205 1860 1HG LYS 93 1HG LYS 93 22.313 -10.883 -2.414 1861 2HG LYS 93 2HG LYS 93 20.936 -11.966 -2.618 1862 1HD LYS 93 1HD LYS 93 21.616 -12.544 -0.470 1863 2HD LYS 93 2HD LYS 93 22.540 -13.704 -1.424 1864 1HE LYS 93 1HE LYS 93 23.915 -11.122 -1.128 1865 2HE LYS 93 2HE LYS 93 23.637 -11.951 0.416 1866 1HZ LYS 93 1HZ LYS 93 24.953 -13.016 -2.023 1867 2HZ LYS 93 2HZ LYS 93 24.410 -14.024 -0.768 1868 3HZ LYS 93 3HZ LYS 93 25.615 -12.866 -0.467 1869 HA PRO 94 HA PRO 94 19.378 -16.486 -3.577 1870 1HB PRO 94 1HB PRO 94 21.640 -17.916 -2.334 1871 2HB PRO 94 2HB PRO 94 20.511 -18.478 -3.576 1872 1HG PRO 94 1HG PRO 94 23.090 -17.907 -4.106 1873 2HG PRO 94 2HG PRO 94 21.795 -17.677 -5.287 1874 1HD PRO 94 1HD PRO 94 23.229 -15.657 -3.630 1875 2HD PRO 94 2HD PRO 94 22.626 -15.534 -5.296 1876 H ILE 95 H ILE 95 18.216 -16.288 -1.691 1877 HA ILE 95 HA ILE 95 19.562 -15.020 0.641 1878 HB ILE 95 HB ILE 95 16.641 -15.523 -0.035 1879 1HG1 ILE 95 1HG1 ILE 95 18.367 -13.044 -0.330 1880 2HG1 ILE 95 2HG1 ILE 95 17.753 -14.033 -1.655 1881 1HG2 ILE 95 1HG2 ILE 95 17.043 -15.223 2.375 1882 2HG2 ILE 95 2HG2 ILE 95 16.227 -13.811 1.706 1883 3HG2 ILE 95 3HG2 ILE 95 17.955 -13.750 2.047 1884 1HD1 ILE 95 1HD1 ILE 95 16.267 -12.148 -1.425 1885 2HD1 ILE 95 2HD1 ILE 95 16.136 -12.395 0.316 1886 3HD1 ILE 95 3HD1 ILE 95 15.418 -13.559 -0.797 1887 H ALA 96 H ALA 96 19.199 -15.876 2.791 1888 HA ALA 96 HA ALA 96 18.810 -18.843 2.809 1889 1HB ALA 96 1HB ALA 96 20.994 -18.062 3.519 1890 2HB ALA 96 2HB ALA 96 20.130 -18.575 4.968 1891 3HB ALA 96 3HB ALA 96 20.270 -16.859 4.586 1892 H ILE 97 H ILE 97 17.637 -19.768 4.614 1893 HA ILE 97 HA ILE 97 15.183 -18.485 5.286 1894 HB ILE 97 HB ILE 97 16.691 -20.712 6.710 1895 1HG1 ILE 97 1HG1 ILE 97 14.721 -21.748 4.977 1896 2HG1 ILE 97 2HG1 ILE 97 15.586 -20.532 4.040 1897 1HG2 ILE 97 1HG2 ILE 97 14.314 -19.478 7.408 1898 2HG2 ILE 97 2HG2 ILE 97 14.792 -21.108 7.881 1899 3HG2 ILE 97 3HG2 ILE 97 13.771 -20.865 6.463 1900 1HD1 ILE 97 1HD1 ILE 97 16.459 -23.091 4.351 1901 2HD1 ILE 97 2HD1 ILE 97 17.285 -22.307 5.697 1902 3HD1 ILE 97 3HD1 ILE 97 17.534 -21.726 4.050 1903 H GLY 98 H GLY 98 15.283 -16.531 6.397 1904 1HA GLY 98 1HA GLY 98 15.249 -15.583 8.670 1905 2HA GLY 98 2HA GLY 98 16.640 -16.596 9.058 1906 H GLU 99 H GLU 99 16.359 -14.827 6.034 1907 HA GLU 99 HA GLU 99 18.776 -13.254 6.805 1908 1HB GLU 99 1HB GLU 99 18.236 -14.825 4.668 1909 2HB GLU 99 2HB GLU 99 17.634 -13.291 4.045 1910 1HG GLU 99 1HG GLU 99 20.374 -13.590 5.297 1911 2HG GLU 99 2HG GLU 99 20.090 -13.784 3.568 1912 H GLU 100 H GLU 100 18.794 -10.934 6.341 1913 HA GLU 100 HA GLU 100 16.145 -9.680 6.702 1914 1HB GLU 100 1HB GLU 100 18.721 -9.223 7.601 1915 2HB GLU 100 2HB GLU 100 18.537 -7.989 6.355 1916 1HG GLU 100 1HG GLU 100 16.152 -8.229 8.027 1917 2HG GLU 100 2HG GLU 100 17.585 -7.832 8.974 1918 H ILE 101 H ILE 101 14.974 -9.151 4.912 1919 HA ILE 101 HA ILE 101 16.361 -8.701 2.324 1920 HB ILE 101 HB ILE 101 13.454 -9.021 3.153 1921 1HG1 ILE 101 1HG1 ILE 101 15.382 -10.865 1.712 1922 2HG1 ILE 101 2HG1 ILE 101 14.806 -11.062 3.367 1923 1HG2 ILE 101 1HG2 ILE 101 14.581 -7.932 0.750 1924 2HG2 ILE 101 2HG2 ILE 101 12.884 -8.241 1.117 1925 3HG2 ILE 101 3HG2 ILE 101 13.869 -9.500 0.372 1926 1HD1 ILE 101 1HD1 ILE 101 12.900 -12.035 2.655 1927 2HD1 ILE 101 2HD1 ILE 101 13.589 -12.054 1.032 1928 3HD1 ILE 101 3HD1 ILE 101 12.578 -10.703 1.545 1929 H THR 102 H THR 102 16.631 -6.691 1.512 1930 HA THR 102 HA THR 102 14.782 -4.490 2.197 1931 HB THR 102 HB THR 102 16.791 -3.110 2.936 1932 HG1 THR 102 HG1 THR 102 18.429 -4.350 2.093 1933 1HG2 THR 102 1HG2 THR 102 16.611 -3.822 5.161 1934 2HG2 THR 102 2HG2 THR 102 16.530 -5.525 4.710 1935 3HG2 THR 102 3HG2 THR 102 15.138 -4.475 4.443 1936 H ILE 103 H ILE 103 15.499 -2.468 0.885 1937 HA ILE 103 HA ILE 103 16.899 -3.326 -1.628 1938 HB ILE 103 HB ILE 103 15.188 -1.991 -2.824 1939 1HG1 ILE 103 1HG1 ILE 103 13.213 -1.656 -0.837 1940 2HG1 ILE 103 2HG1 ILE 103 14.706 -1.023 -0.145 1941 1HG2 ILE 103 1HG2 ILE 103 13.395 -3.597 -1.148 1942 2HG2 ILE 103 2HG2 ILE 103 14.849 -4.468 -1.633 1943 3HG2 ILE 103 3HG2 ILE 103 13.789 -3.773 -2.858 1944 1HD1 ILE 103 1HD1 ILE 103 15.048 0.303 -2.247 1945 2HD1 ILE 103 2HD1 ILE 103 13.598 0.768 -1.358 1946 3HD1 ILE 103 3HD1 ILE 103 13.463 -0.242 -2.798 1947 H SER 104 H SER 104 17.205 -1.334 0.957 1948 HA SER 104 HA SER 104 18.366 0.681 1.328 1949 1HB SER 104 1HB SER 104 20.343 0.734 0.104 1950 2HB SER 104 2HB SER 104 19.802 -0.891 -0.309 1951 HG SER 104 HG SER 104 20.287 1.064 -1.956 1952 H TYR 105 H TYR 105 19.156 2.568 -0.789 1953 HA TYR 105 HA TYR 105 16.468 3.439 -1.781 1954 1HB TYR 105 1HB TYR 105 18.600 5.115 -0.407 1955 2HB TYR 105 2HB TYR 105 17.048 5.709 -0.995 1956 HD1 TYR 105 HD1 TYR 105 15.147 3.669 -0.227 1957 HD2 TYR 105 HD2 TYR 105 18.567 5.122 1.927 1958 HE1 TYR 105 HE1 TYR 105 14.091 2.986 1.911 1959 HE2 TYR 105 HE2 TYR 105 17.511 4.440 4.064 1960 HH TYR 105 HH TYR 105 15.503 2.433 4.563 1961 H GLY 106 H GLY 106 19.683 5.014 -1.964 1962 1HA GLY 106 1HA GLY 106 20.226 4.208 -4.664 1963 2HA GLY 106 2HA GLY 106 19.427 5.780 -4.664 1964 H ASP 107 H ASP 107 21.480 6.620 -5.544 1965 HA ASP 107 HA ASP 107 23.822 6.612 -3.739 1966 1HB ASP 107 1HB ASP 107 23.190 7.715 -6.495 1967 2HB ASP 107 2HB ASP 107 24.750 7.958 -5.710 1968 H ASP 108 H ASP 108 21.125 8.151 -3.286 1969 HA ASP 108 HA ASP 108 22.450 10.732 -2.560 1970 1HB ASP 108 1HB ASP 108 20.519 10.257 -4.601 1971 2HB ASP 108 2HB ASP 108 19.683 11.104 -3.299 1972 H TYR 109 H TYR 109 19.386 8.895 -2.226 1973 HA TYR 109 HA TYR 109 18.562 10.050 0.240 1974 1HB TYR 109 1HB TYR 109 17.690 8.149 -1.602 1975 2HB TYR 109 2HB TYR 109 17.935 7.207 -0.132 1976 HD1 TYR 109 HD1 TYR 109 16.794 10.732 -0.727 1977 HD2 TYR 109 HD2 TYR 109 15.887 6.876 0.933 1978 HE1 TYR 109 HE1 TYR 109 14.680 11.631 0.208 1979 HE2 TYR 109 HE2 TYR 109 13.773 7.774 1.867 1980 HH TYR 109 HH TYR 109 12.204 10.039 1.009 1981 H TRP 110 H TRP 110 19.652 9.964 2.152 1982 HA TRP 110 HA TRP 110 20.958 9.153 3.934 1983 1HB TRP 110 1HB TRP 110 19.484 6.856 2.747 1984 2HB TRP 110 2HB TRP 110 20.811 6.440 3.830 1985 HD1 TRP 110 HD1 TRP 110 17.656 8.668 3.785 1986 HE1 TRP 110 HE1 TRP 110 16.755 8.837 6.195 1987 HE3 TRP 110 HE3 TRP 110 21.282 6.065 6.267 1988 HZ2 TRP 110 HZ2 TRP 110 17.477 7.982 8.827 1989 HZ3 TRP 110 HZ3 TRP 110 21.150 5.758 8.723 1990 HH2 TRP 110 HH2 TRP 110 19.255 6.712 10.005 1991 H LEU 111 H LEU 111 21.636 6.332 1.897 1992 HA LEU 111 HA LEU 111 24.459 6.504 2.290 1993 1HB LEU 111 1HB LEU 111 22.670 4.663 1.400 1994 2HB LEU 111 2HB LEU 111 23.366 5.166 -0.139 1995 HG LEU 111 HG LEU 111 25.625 4.674 0.703 1996 1HD1 LEU 111 1HD1 LEU 111 24.101 4.274 3.245 1997 2HD1 LEU 111 2HD1 LEU 111 25.674 5.029 2.988 1998 3HD1 LEU 111 3HD1 LEU 111 25.525 3.272 2.961 1999 1HD2 LEU 111 1HD2 LEU 111 25.442 2.260 0.762 2000 2HD2 LEU 111 2HD2 LEU 111 24.212 2.872 -0.344 2001 3HD2 LEU 111 3HD2 LEU 111 23.759 2.357 1.280 2002 H SER 112 H SER 112 25.169 6.029 -0.592 2003 HA SER 112 HA SER 112 24.648 8.487 -2.049 2004 1HB SER 112 1HB SER 112 26.607 8.409 0.064 2005 2HB SER 112 2HB SER 112 27.438 8.654 -1.473 2006 HG SER 112 HG SER 112 25.880 10.342 -1.876 2007 H ARG 113 H ARG 113 27.039 5.884 -1.484 2008 HA ARG 113 HA ARG 113 27.121 5.467 -4.450 2009 1HB ARG 113 1HB ARG 113 29.309 5.810 -2.406 2010 2HB ARG 113 2HB ARG 113 29.617 4.860 -3.859 2011 1HG ARG 113 1HG ARG 113 28.280 7.471 -4.294 2012 2HG ARG 113 2HG ARG 113 29.951 7.555 -3.737 2013 1HD ARG 113 1HD ARG 113 29.999 5.555 -5.692 2014 2HD ARG 113 2HD ARG 113 28.931 6.800 -6.366 2015 HE ARG 113 HE ARG 113 31.786 7.106 -5.819 2016 1HH1 ARG 113 1HH1 ARG 113 28.714 8.727 -6.050 2017 2HH1 ARG 113 2HH1 ARG 113 29.427 10.265 -6.394 2018 1HH2 ARG 113 1HH2 ARG 113 32.689 9.112 -6.266 2019 2HH2 ARG 113 2HH2 ARG 113 31.661 10.484 -6.516 2020 HA PRO 114 HA PRO 114 26.391 1.301 -3.131 2021 1HB PRO 114 1HB PRO 114 26.682 0.059 -5.547 2022 2HB PRO 114 2HB PRO 114 25.271 1.060 -5.158 2023 1HG PRO 114 1HG PRO 114 27.636 1.680 -6.837 2024 2HG PRO 114 2HG PRO 114 25.958 2.210 -7.010 2025 1HD PRO 114 1HD PRO 114 28.045 3.722 -5.948 2026 2HD PRO 114 2HD PRO 114 26.314 4.061 -5.748 2027 H ARG 115 H ARG 115 28.594 1.490 -1.973 2028 HA ARG 115 HA ARG 115 30.393 -0.600 -3.029 2029 1HB ARG 115 1HB ARG 115 32.329 0.942 -3.007 2030 2HB ARG 115 2HB ARG 115 31.084 1.526 -4.112 2031 1HG ARG 115 1HG ARG 115 30.203 2.924 -2.173 2032 2HG ARG 115 2HG ARG 115 31.685 2.504 -1.318 2033 1HD ARG 115 1HD ARG 115 31.593 3.851 -4.042 2034 2HD ARG 115 2HD ARG 115 31.904 4.684 -2.507 2035 HE ARG 115 HE ARG 115 33.778 2.945 -3.918 2036 1HH1 ARG 115 1HH1 ARG 115 32.749 4.129 -0.810 2037 2HH1 ARG 115 2HH1 ARG 115 34.289 3.854 -0.073 2038 1HH2 ARG 115 1HH2 ARG 115 35.769 2.598 -2.937 2039 2HH2 ARG 115 2HH2 ARG 115 35.987 2.994 -1.265 2040 H LEU 116 H LEU 116 30.951 -1.826 -1.288 2041 HA LEU 116 HA LEU 116 31.089 -0.496 1.401 2042 1HB LEU 116 1HB LEU 116 29.653 -2.836 0.332 2043 2HB LEU 116 2HB LEU 116 30.545 -3.188 1.813 2044 HG LEU 116 HG LEU 116 28.261 -2.411 2.329 2045 1HD1 LEU 116 1HD1 LEU 116 29.462 -0.020 3.302 2046 2HD1 LEU 116 2HD1 LEU 116 30.713 -1.263 3.281 2047 3HD1 LEU 116 3HD1 LEU 116 29.214 -1.535 4.169 2048 1HD2 LEU 116 1HD2 LEU 116 28.533 -0.804 0.146 2049 2HD2 LEU 116 2HD2 LEU 116 28.833 0.356 1.440 2050 3HD2 LEU 116 3HD2 LEU 116 27.319 -0.548 1.400 2051 H THR 117 H THR 117 32.031 -3.654 -0.009 2052 HA THR 117 HA THR 117 34.728 -3.291 1.248 2053 HB THR 117 HB THR 117 33.206 -5.794 0.426 2054 HG1 THR 117 HG1 THR 117 32.343 -5.707 2.326 2055 1HG2 THR 117 1HG2 THR 117 35.689 -6.012 0.455 2056 2HG2 THR 117 2HG2 THR 117 34.918 -6.982 1.711 2057 3HG2 THR 117 3HG2 THR 117 35.695 -5.454 2.128 2058 H GLN 118 H GLN 118 33.004 -4.230 -1.703 2059 HA GLN 118 HA GLN 118 35.323 -3.531 -3.347 2060 1HB GLN 118 1HB GLN 118 35.213 -6.081 -2.251 2061 2HB GLN 118 2HB GLN 118 34.516 -6.317 -3.854 2062 1HG GLN 118 1HG GLN 118 36.462 -5.544 -4.944 2063 2HG GLN 118 2HG GLN 118 37.070 -4.756 -3.488 2064 1HE2 GLN 118 1HE2 GLN 118 39.088 -6.113 -3.972 2065 2HE2 GLN 118 2HE2 GLN 118 39.123 -7.714 -3.410 2066 H ASN 119 H ASN 119 34.425 -5.279 -5.542 2067 HA ASN 119 HA ASN 119 31.603 -4.814 -6.047 2068 1HB ASN 119 1HB ASN 119 32.924 -2.537 -6.141 2069 2HB ASN 119 2HB ASN 119 33.474 -3.130 -7.708 2070 1HD2 ASN 119 1HD2 ASN 119 32.180 -2.220 -9.313 2071 2HD2 ASN 119 2HD2 ASN 119 30.496 -2.031 -9.217 2072 1H GLY 201 1H GLY 201 17.947 20.797 22.699 2073 2H GLY 201 2H GLY 201 17.070 21.749 23.799 2074 3H GLY 201 3H GLY 201 17.560 22.404 22.311 2075 1HA GLY 201 1HA GLY 201 15.547 20.268 22.745 2076 2HA GLY 201 2HA GLY 201 15.249 21.903 22.155 2077 H LYS 202 H LYS 202 16.780 22.438 20.168 2078 HA LYS 202 HA LYS 202 17.164 21.990 17.880 2079 1HB LYS 202 1HB LYS 202 18.475 20.124 19.576 2080 2HB LYS 202 2HB LYS 202 17.850 19.198 18.211 2081 1HG LYS 202 1HG LYS 202 19.046 20.500 16.635 2082 2HG LYS 202 2HG LYS 202 19.333 21.795 17.798 2083 1HD LYS 202 1HD LYS 202 20.385 19.144 18.587 2084 2HD LYS 202 2HD LYS 202 21.169 19.872 17.185 2085 1HE LYS 202 1HE LYS 202 20.785 21.908 19.186 2086 2HE LYS 202 2HE LYS 202 21.602 20.515 19.921 2087 1HZ LYS 202 1HZ LYS 202 22.353 21.856 17.370 2088 2HZ LYS 202 2HZ LYS 202 23.105 20.469 17.998 2089 3HZ LYS 202 3HZ LYS 202 23.214 21.945 18.831 2090 H ALA 203 H ALA 203 16.755 19.818 16.279 2091 HA ALA 203 HA ALA 203 14.379 18.296 16.765 2092 1HB ALA 203 1HB ALA 203 12.827 19.930 16.507 2093 2HB ALA 203 2HB ALA 203 13.326 20.048 14.820 2094 3HB ALA 203 3HB ALA 203 14.064 21.094 16.033 2095 HA PRO 204 HA PRO 204 15.314 18.128 12.075 2096 1HB PRO 204 1HB PRO 204 17.269 19.848 11.125 2097 2HB PRO 204 2HB PRO 204 15.531 20.192 11.065 2098 1HG PRO 204 1HG PRO 204 17.598 21.169 12.963 2099 2HG PRO 204 2HG PRO 204 16.190 22.006 12.299 2100 1HD PRO 204 1HD PRO 204 16.284 20.996 14.824 2101 2HD PRO 204 2HD PRO 204 14.780 21.165 13.897 2102 H ARG 205 H ARG 205 17.857 18.850 14.369 2103 HA ARG 205 HA ARG 205 19.878 17.741 14.857 2104 1HB ARG 205 1HB ARG 205 18.001 15.760 13.665 2105 2HB ARG 205 2HB ARG 205 19.691 15.265 13.754 2106 1HG ARG 205 1HG ARG 205 19.000 16.538 16.223 2107 2HG ARG 205 2HG ARG 205 17.766 15.332 15.861 2108 1HD ARG 205 1HD ARG 205 19.267 13.859 16.774 2109 2HD ARG 205 2HD ARG 205 20.092 13.989 15.209 2110 HE ARG 205 HE ARG 205 20.837 16.209 16.867 2111 1HH1 ARG 205 1HH1 ARG 205 21.298 12.774 16.539 2112 2HH1 ARG 205 2HH1 ARG 205 22.856 12.800 17.289 2113 1HH2 ARG 205 1HH2 ARG 205 22.860 16.218 17.837 2114 2HH2 ARG 205 2HH2 ARG 205 23.736 14.735 18.019 2115 H LYS 206 H LYS 206 19.441 15.998 11.803 2116 HA LYS 206 HA LYS 206 21.296 17.789 10.371 2117 1HB LYS 206 1HB LYS 206 22.000 15.160 11.619 2118 2HB LYS 206 2HB LYS 206 22.701 15.519 10.041 2119 1HG LYS 206 1HG LYS 206 23.064 17.897 11.377 2120 2HG LYS 206 2HG LYS 206 23.279 16.717 12.670 2121 1HD LYS 206 1HD LYS 206 24.708 16.647 9.995 2122 2HD LYS 206 2HD LYS 206 25.418 17.215 11.506 2123 1HE LYS 206 1HE LYS 206 24.265 14.649 12.017 2124 2HE LYS 206 2HE LYS 206 25.255 14.520 10.551 2125 1HZ LYS 206 1HZ LYS 206 26.500 14.302 12.714 2126 2HZ LYS 206 2HZ LYS 206 26.154 15.940 12.999 2127 3HZ LYS 206 3HZ LYS 206 27.093 15.492 11.657 2128 H GLN 207 H GLN 207 20.292 14.347 10.185 2129 HA GLN 207 HA GLN 207 19.217 14.932 7.444 2130 1HB GLN 207 1HB GLN 207 21.350 13.377 8.119 2131 2HB GLN 207 2HB GLN 207 20.057 12.182 8.216 2132 1HG GLN 207 1HG GLN 207 20.420 11.988 5.971 2133 2HG GLN 207 2HG GLN 207 19.405 13.428 5.885 2134 1HE2 GLN 207 1HE2 GLN 207 22.876 12.516 6.294 2135 2HE2 GLN 207 2HE2 GLN 207 23.478 13.859 5.449 2136 H LEU 208 H LEU 208 17.535 15.229 9.690 2137 HA LEU 208 HA LEU 208 16.058 12.724 10.133 2138 1HB LEU 208 1HB LEU 208 16.088 15.547 11.094 2139 2HB LEU 208 2HB LEU 208 14.545 14.702 11.213 2140 HG LEU 208 HG LEU 208 15.885 14.409 13.271 2141 1HD1 LEU 208 1HD1 LEU 208 14.553 12.464 11.855 2142 2HD1 LEU 208 2HD1 LEU 208 15.162 12.266 13.499 2143 3HD1 LEU 208 3HD1 LEU 208 16.120 11.703 12.129 2144 1HD2 LEU 208 1HD2 LEU 208 18.073 14.503 11.802 2145 2HD2 LEU 208 2HD2 LEU 208 17.848 12.756 11.712 2146 3HD2 LEU 208 3HD2 LEU 208 18.049 13.541 13.279 2147 H ALA 209 H ALA 209 15.218 15.932 8.753 2148 HA ALA 209 HA ALA 209 12.932 14.653 7.327 2149 1HB ALA 209 1HB ALA 209 12.155 16.970 7.124 2150 2HB ALA 209 2HB ALA 209 13.707 17.569 7.709 2151 3HB ALA 209 3HB ALA 209 12.642 16.674 8.793 2152 H THR 210 H THR 210 14.158 13.673 5.587 2153 HA THR 210 HA THR 210 15.959 15.288 3.941 2154 HB THR 210 HB THR 210 15.665 13.104 2.509 2155 HG1 THR 210 HG1 THR 210 14.621 11.489 3.502 2156 1HG2 THR 210 1HG2 THR 210 17.659 12.902 3.561 2157 2HG2 THR 210 2HG2 THR 210 16.797 11.924 4.749 2158 3HG2 THR 210 3HG2 THR 210 17.044 13.646 5.037 2159 H LYS 211 H LYS 211 14.920 16.938 2.822 2160 HA LYS 211 HA LYS 211 12.292 16.430 1.547 2161 1HB LYS 211 1HB LYS 211 13.775 18.633 2.635 2162 2HB LYS 211 2HB LYS 211 13.425 18.993 0.944 2163 1HG LYS 211 1HG LYS 211 11.113 18.903 1.267 2164 2HG LYS 211 2HG LYS 211 11.253 17.889 2.704 2165 1HD LYS 211 1HD LYS 211 12.649 20.345 3.189 2166 2HD LYS 211 2HD LYS 211 11.040 20.730 2.578 2167 1HE LYS 211 1HE LYS 211 10.362 18.782 4.317 2168 2HE LYS 211 2HE LYS 211 11.825 19.383 5.121 2169 1HZ LYS 211 1HZ LYS 211 10.976 21.630 4.936 2170 2HZ LYS 211 2HZ LYS 211 9.841 20.665 5.751 2171 3HZ LYS 211 3HZ LYS 211 9.591 21.079 4.123 2172 H ALA 212 H ALA 212 15.329 17.966 0.408 2173 HA ALA 212 HA ALA 212 14.783 17.575 -2.371 2174 1HB ALA 212 1HB ALA 212 17.385 17.904 -2.402 2175 2HB ALA 212 2HB ALA 212 17.211 18.114 -0.659 2176 3HB ALA 212 3HB ALA 212 16.382 19.208 -1.767 2177 H ALA 213 H ALA 213 15.812 16.047 -3.842 2178 HA ALA 213 HA ALA 213 16.502 13.895 -4.515 2179 1HB ALA 213 1HB ALA 213 18.453 13.260 -3.473 2180 2HB ALA 213 2HB ALA 213 17.740 13.358 -1.863 2181 3HB ALA 213 3HB ALA 213 18.286 14.825 -2.677 2182 H ARG 214 H ARG 214 15.816 11.703 -4.292 2183 HA ARG 214 HA ARG 214 14.167 11.027 -1.899 2184 1HB ARG 214 1HB ARG 214 13.348 11.366 -4.765 2185 2HB ARG 214 2HB ARG 214 12.559 10.099 -3.826 2186 1HG ARG 214 1HG ARG 214 11.893 11.736 -2.129 2187 2HG ARG 214 2HG ARG 214 12.747 13.012 -2.997 2188 1HD ARG 214 1HD ARG 214 11.250 12.552 -4.985 2189 2HD ARG 214 2HD ARG 214 10.313 11.461 -3.947 2190 HE ARG 214 HE ARG 214 9.453 13.368 -2.840 2191 1HH1 ARG 214 1HH1 ARG 214 12.355 14.163 -4.590 2192 2HH1 ARG 214 2HH1 ARG 214 12.228 15.854 -4.252 2193 1HH2 ARG 214 1HH2 ARG 214 9.309 15.567 -2.414 2194 2HH2 ARG 214 2HH2 ARG 214 10.517 16.645 -3.029 2195 1HN MLZ 215 1HN MLZ 215 13.190 8.592 -2.768 2196 HA MLZ 215 HA MLZ 215 15.399 6.820 -2.488 2197 1HB MLZ 215 1HB MLZ 215 12.523 6.766 -2.886 2198 2HB MLZ 215 2HB MLZ 215 13.291 5.486 -3.826 2199 1HG MLZ 215 1HG MLZ 215 14.626 5.423 -1.375 2200 2HG MLZ 215 2HG MLZ 215 13.381 4.295 -1.909 2201 1HD MLZ 215 1HD MLZ 215 12.788 6.921 -0.514 2202 2HD MLZ 215 2HD MLZ 215 11.642 5.633 -0.887 2203 1HE MLZ 215 1HE MLZ 215 13.874 5.621 1.155 2204 2HE MLZ 215 2HE MLZ 215 13.152 4.113 0.563 2205 HZ MLZ 215 HZ MLZ 215 10.999 4.861 1.201 2206 1HCM MLZ 215 1HCM MLZ 215 11.270 5.228 3.608 2207 2HCM MLZ 215 2HCM MLZ 215 12.993 5.462 3.317 2208 3HCM MLZ 215 3HCM MLZ 215 12.248 3.899 2.985 2209 H SER 216 H SER 216 16.935 6.279 -3.975 2210 HA SER 216 HA SER 216 17.950 5.820 -6.058 2211 1HB SER 216 1HB SER 216 17.348 8.388 -5.890 2212 2HB SER 216 2HB SER 216 17.902 7.726 -7.428 2213 HG SER 216 HG SER 216 15.837 7.672 -8.160 2214 H ALA 217 H ALA 217 17.240 5.653 -8.587 2215 HA ALA 217 HA ALA 217 14.620 4.194 -8.674 2216 1HB ALA 217 1HB ALA 217 14.280 5.732 -10.322 2217 2HB ALA 217 2HB ALA 217 15.422 4.787 -11.277 2218 3HB ALA 217 3HB ALA 217 15.986 6.179 -10.353 2219 HA PRO 218 HA PRO 218 16.674 0.498 -9.834 2220 1HB PRO 218 1HB PRO 218 15.236 -0.348 -12.055 2221 2HB PRO 218 2HB PRO 218 14.703 -0.560 -10.379 2222 1HG PRO 218 1HG PRO 218 13.861 1.440 -12.400 2223 2HG PRO 218 2HG PRO 218 12.927 0.674 -11.111 2224 1HD PRO 218 1HD PRO 218 13.875 3.236 -11.000 2225 2HD PRO 218 2HD PRO 218 13.547 2.238 -9.570 2226 H ALA 219 H ALA 219 15.673 1.613 -13.079 2227 HA ALA 219 HA ALA 219 18.551 2.021 -13.777 2228 1HB ALA 219 1HB ALA 219 16.822 -0.160 -14.499 2229 2HB ALA 219 2HB ALA 219 18.496 0.104 -14.985 2230 3HB ALA 219 3HB ALA 219 17.181 0.769 -15.955 2231 H THR 220 H THR 220 18.485 4.193 -14.308 2232 HA THR 220 HA THR 220 17.095 5.058 -16.687 2233 HB THR 220 HB THR 220 15.196 4.868 -15.108 2234 HG1 THR 220 HG1 THR 220 14.946 6.523 -16.510 2235 1HG2 THR 220 1HG2 THR 220 15.189 5.796 -12.990 2236 2HG2 THR 220 2HG2 THR 220 16.303 7.087 -13.439 2237 3HG2 THR 220 3HG2 THR 220 16.912 5.457 -13.151 2238 H GLY 221 H GLY 221 19.777 5.234 -15.576 2239 1HA GLY 221 1HA GLY 221 20.094 8.067 -14.790 2240 2HA GLY 221 2HA GLY 221 21.379 6.861 -14.843 2241 1HN SAH 301 1HN SAH 301 -11.418 -0.145 -8.558 2242 2HN SAH 301 2HN SAH 301 -10.320 0.453 -9.714 2243 HA SAH 301 HA SAH 301 -10.687 2.721 -8.534 2244 1HB SAH 301 1HB SAH 301 -11.831 0.583 -6.749 2245 2HB SAH 301 2HB SAH 301 -11.075 1.998 -6.017 2246 1HG SAH 301 1HG SAH 301 -13.700 1.857 -6.887 2247 2HG SAH 301 2HG SAH 301 -12.887 2.674 -8.222 2248 1H5* SAH 301 1H5* SAH 301 -15.150 3.666 -6.446 2249 2H5* SAH 301 2H5* SAH 301 -14.757 5.276 -5.842 2250 H4* SAH 301 H4* SAH 301 -13.703 5.684 -8.085 2251 H3* SAH 301 H3* SAH 301 -16.426 5.791 -7.150 2252 *HO3 SAH 301 *HO3 SAH 301 -14.722 7.402 -8.058 2253 H2* SAH 301 H2* SAH 301 -17.568 4.754 -8.770 2254 *HO2 SAH 301 *HO2 SAH 301 -16.813 6.894 -9.931 2255 H1* SAH 301 H1* SAH 301 -15.527 4.033 -10.661 2256 H8 SAH 301 H8 SAH 301 -15.510 1.785 -7.716 2257 1HN6 SAH 301 1HN6 SAH 301 -19.634 -1.264 -9.260 2258 2HN6 SAH 301 2HN6 SAH 301 -20.756 -0.176 -8.473 2259 H2 SAH 301 H2 SAH 301 -19.945 2.749 -12.225 2260 1HN SAH 302 1HN SAH 302 11.306 -0.140 8.538 2261 2HN SAH 302 2HN SAH 302 10.199 0.451 9.682 2262 HA SAH 302 HA SAH 302 10.571 2.720 8.508 2263 1HB SAH 302 1HB SAH 302 11.742 0.587 6.736 2264 2HB SAH 302 2HB SAH 302 10.991 1.999 5.995 2265 1HG SAH 302 1HG SAH 302 13.606 1.866 6.895 2266 2HG SAH 302 2HG SAH 302 12.775 2.679 8.221 2267 1H5* SAH 302 1H5* SAH 302 15.055 3.681 6.472 2268 2H5* SAH 302 2H5* SAH 302 14.664 5.289 5.865 2269 H4* SAH 302 H4* SAH 302 13.583 5.693 8.095 2270 H3* SAH 302 H3* SAH 302 16.317 5.809 7.192 2271 *HO3 SAH 302 *HO3 SAH 302 14.597 7.413 8.081 2272 H2* SAH 302 H2* SAH 302 17.443 4.775 8.825 2273 *HO2 SAH 302 *HO2 SAH 302 16.667 6.912 9.978 2274 H1* SAH 302 H1* SAH 302 15.382 4.046 10.692 2275 H8 SAH 302 H8 SAH 302 15.407 1.800 7.745 2276 1HN6 SAH 302 1HN6 SAH 302 19.523 -1.237 9.336 2277 2HN6 SAH 302 2HN6 SAH 302 20.650 -0.145 8.563 2278 H2 SAH 302 H2 SAH 302 19.786 2.776 12.306
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