NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
20082 | 2f09 | 6955 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H MET 1 9.999 -21.076 -12.724 2 HA MET 1 HA MET 1 10.093 -21.381 -15.030 3 1HB MET 1 1HB MET 1 9.161 -24.195 -14.426 4 2HB MET 1 2HB MET 1 9.171 -23.479 -16.029 5 1HG MET 1 1HG MET 1 11.606 -23.248 -15.890 6 2HG MET 1 2HG MET 1 11.575 -24.010 -14.303 7 1HE MET 1 1HE MET 1 13.144 -26.789 -16.576 8 2HE MET 1 2HE MET 1 13.346 -25.810 -15.122 9 3HE MET 1 3HE MET 1 13.382 -25.047 -16.714 10 H GLN 2 H GLN 2 8.490 -19.980 -15.387 11 HA GLN 2 HA GLN 2 5.795 -20.879 -14.761 12 1HB GLN 2 1HB GLN 2 6.959 -18.229 -13.936 13 2HB GLN 2 2HB GLN 2 5.236 -18.557 -13.978 14 1HG GLN 2 1HG GLN 2 5.551 -20.356 -12.344 15 2HG GLN 2 2HG GLN 2 7.273 -19.995 -12.294 16 1HE2 GLN 2 1HE2 GLN 2 4.111 -18.919 -11.466 17 2HE2 GLN 2 2HE2 GLN 2 4.559 -17.709 -10.334 18 H THR 3 H THR 3 4.371 -20.474 -16.238 19 HA THR 3 HA THR 3 5.126 -19.139 -18.728 20 HB THR 3 HB THR 3 2.405 -20.214 -18.055 21 HG1 THR 3 HG1 THR 3 4.803 -21.655 -18.096 22 1HG2 THR 3 1HG2 THR 3 4.178 -20.408 -20.497 23 2HG2 THR 3 2HG2 THR 3 2.883 -19.235 -20.258 24 3HG2 THR 3 3HG2 THR 3 2.507 -20.952 -20.386 25 H ASP 4 H ASP 4 4.207 -17.261 -19.368 26 HA ASP 4 HA ASP 4 3.105 -15.656 -17.223 27 1HB ASP 4 1HB ASP 4 3.781 -15.155 -20.103 28 2HB ASP 4 2HB ASP 4 2.900 -13.933 -19.170 29 H THR 5 H THR 5 0.890 -14.965 -17.179 30 HA THR 5 HA THR 5 -0.779 -16.034 -19.291 31 HB THR 5 HB THR 5 -1.166 -16.616 -16.335 32 HG1 THR 5 HG1 THR 5 -0.025 -17.866 -18.357 33 1HG2 THR 5 1HG2 THR 5 -3.350 -16.144 -17.419 34 2HG2 THR 5 2HG2 THR 5 -3.200 -17.838 -16.962 35 3HG2 THR 5 3HG2 THR 5 -2.980 -17.356 -18.646 36 H LEU 6 H LEU 6 -2.783 -14.943 -19.549 37 HA LEU 6 HA LEU 6 -2.607 -12.273 -18.669 38 1HB LEU 6 1HB LEU 6 -4.169 -13.725 -20.745 39 2HB LEU 6 2HB LEU 6 -4.772 -12.159 -20.267 40 HG LEU 6 HG LEU 6 -2.351 -11.432 -20.599 41 1HD1 LEU 6 1HD1 LEU 6 -2.309 -13.690 -22.507 42 2HD1 LEU 6 2HD1 LEU 6 -1.408 -13.571 -20.987 43 3HD1 LEU 6 3HD1 LEU 6 -1.101 -12.420 -22.286 44 1HD2 LEU 6 1HD2 LEU 6 -4.182 -10.517 -21.837 45 2HD2 LEU 6 2HD2 LEU 6 -4.176 -11.906 -22.939 46 3HD2 LEU 6 3HD2 LEU 6 -2.806 -10.788 -22.900 47 H GLU 7 H GLU 7 -5.637 -11.978 -18.758 48 HA GLU 7 HA GLU 7 -5.713 -11.430 -16.049 49 1HB GLU 7 1HB GLU 7 -6.660 -10.144 -17.882 50 2HB GLU 7 2HB GLU 7 -7.796 -11.438 -18.199 51 1HG GLU 7 1HG GLU 7 -9.013 -10.994 -16.301 52 2HG GLU 7 2HG GLU 7 -7.690 -10.091 -15.549 53 H TYR 8 H TYR 8 -6.629 -13.976 -18.095 54 HA TYR 8 HA TYR 8 -7.800 -15.587 -18.188 55 1HB TYR 8 1HB TYR 8 -7.412 -17.437 -16.562 56 2HB TYR 8 2HB TYR 8 -5.992 -16.592 -17.129 57 HD1 TYR 8 HD1 TYR 8 -8.219 -17.071 -14.218 58 HD2 TYR 8 HD2 TYR 8 -4.494 -15.572 -15.598 59 HE1 TYR 8 HE1 TYR 8 -7.449 -16.857 -11.900 60 HE2 TYR 8 HE2 TYR 8 -3.717 -15.346 -13.287 61 HH TYR 8 HH TYR 8 -4.730 -15.061 -11.070 62 H GLN 9 H GLN 9 -9.383 -13.375 -16.781 63 HA GLN 9 HA GLN 9 -11.704 -14.861 -16.279 64 1HB GLN 9 1HB GLN 9 -10.346 -13.468 -13.966 65 2HB GLN 9 2HB GLN 9 -12.079 -13.761 -14.001 66 1HG GLN 9 1HG GLN 9 -11.665 -16.096 -14.277 67 2HG GLN 9 2HG GLN 9 -9.935 -15.824 -14.173 68 1HE2 GLN 9 1HE2 GLN 9 -12.891 -15.918 -12.411 69 2HE2 GLN 9 2HE2 GLN 9 -12.248 -15.879 -10.820 70 H CYS 10 H CYS 10 -12.230 -13.745 -17.934 71 HA CYS 10 HA CYS 10 -12.530 -10.849 -17.595 72 1HB CYS 10 1HB CYS 10 -12.834 -12.610 -20.035 73 2HB CYS 10 2HB CYS 10 -13.065 -10.837 -20.037 74 H ASP 11 H ASP 11 -14.806 -10.113 -18.570 75 HA ASP 11 HA ASP 11 -16.784 -11.166 -16.905 76 1HB ASP 11 1HB ASP 11 -17.183 -9.616 -19.468 77 2HB ASP 11 2HB ASP 11 -18.381 -9.835 -18.199 78 H GLU 12 H GLU 12 -16.172 -11.731 -20.292 79 HA GLU 12 HA GLU 12 -18.516 -13.430 -20.509 80 1HB GLU 12 1HB GLU 12 -16.500 -12.745 -22.607 81 2HB GLU 12 2HB GLU 12 -18.118 -13.395 -22.845 82 1HG GLU 12 1HG GLU 12 -19.063 -11.338 -21.971 83 2HG GLU 12 2HG GLU 12 -17.419 -10.749 -21.696 84 H LYS 13 H LYS 13 -15.027 -13.763 -20.466 85 HA LYS 13 HA LYS 13 -15.278 -16.643 -20.946 86 1HB LYS 13 1HB LYS 13 -13.483 -14.823 -22.552 87 2HB LYS 13 2HB LYS 13 -13.596 -16.560 -22.707 88 1HG LYS 13 1HG LYS 13 -15.888 -14.724 -23.257 89 2HG LYS 13 2HG LYS 13 -14.723 -15.135 -24.503 90 1HD LYS 13 1HD LYS 13 -15.276 -17.499 -24.250 91 2HD LYS 13 2HD LYS 13 -16.499 -17.102 -23.020 92 1HE LYS 13 1HE LYS 13 -16.433 -16.258 -25.921 93 2HE LYS 13 2HE LYS 13 -17.478 -17.489 -25.226 94 1HZ LYS 13 1HZ LYS 13 -18.682 -15.466 -25.507 95 2HZ LYS 13 2HZ LYS 13 -17.532 -14.572 -24.697 96 3HZ LYS 13 3HZ LYS 13 -18.478 -15.708 -23.848 97 HA PRO 14 HA PRO 14 -11.668 -16.085 -18.479 98 1HB PRO 14 1HB PRO 14 -10.605 -18.634 -18.517 99 2HB PRO 14 2HB PRO 14 -11.971 -18.155 -17.508 100 1HG PRO 14 1HG PRO 14 -11.941 -19.823 -19.920 101 2HG PRO 14 2HG PRO 14 -13.195 -19.670 -18.683 102 1HD PRO 14 1HD PRO 14 -13.098 -18.452 -21.298 103 2HD PRO 14 2HD PRO 14 -14.381 -18.341 -20.077 104 H LEU 15 H LEU 15 -9.631 -15.256 -19.116 105 HA LEU 15 HA LEU 15 -8.780 -15.961 -21.807 106 1HB LEU 15 1HB LEU 15 -9.320 -13.599 -21.518 107 2HB LEU 15 2HB LEU 15 -8.219 -13.515 -20.154 108 HG LEU 15 HG LEU 15 -6.325 -13.937 -21.648 109 1HD1 LEU 15 1HD1 LEU 15 -6.540 -13.938 -24.007 110 2HD1 LEU 15 2HD1 LEU 15 -8.268 -13.681 -23.919 111 3HD1 LEU 15 3HD1 LEU 15 -7.573 -15.221 -23.372 112 1HD2 LEU 15 1HD2 LEU 15 -8.090 -11.661 -22.486 113 2HD2 LEU 15 2HD2 LEU 15 -6.353 -11.783 -22.777 114 3HD2 LEU 15 3HD2 LEU 15 -6.965 -11.664 -21.127 115 H THR 16 H THR 16 -7.962 -17.840 -20.707 116 HA THR 16 HA THR 16 -5.689 -17.231 -19.102 117 HB THR 16 HB THR 16 -6.615 -20.044 -19.686 118 HG1 THR 16 HG1 THR 16 -8.371 -19.656 -18.634 119 1HG2 THR 16 1HG2 THR 16 -4.538 -19.701 -18.454 120 2HG2 THR 16 2HG2 THR 16 -5.778 -20.370 -17.372 121 3HG2 THR 16 3HG2 THR 16 -5.384 -18.643 -17.334 122 H VAL 17 H VAL 17 -4.163 -16.643 -20.469 123 HA VAL 17 HA VAL 17 -3.608 -18.160 -22.910 124 HB VAL 17 HB VAL 17 -2.727 -15.450 -21.963 125 1HG1 VAL 17 1HG1 VAL 17 -1.702 -15.160 -24.199 126 2HG1 VAL 17 2HG1 VAL 17 -2.195 -16.800 -24.586 127 3HG1 VAL 17 3HG1 VAL 17 -0.952 -16.536 -23.373 128 1HG2 VAL 17 1HG2 VAL 17 -4.558 -16.258 -24.200 129 2HG2 VAL 17 2HG2 VAL 17 -4.067 -14.604 -23.827 130 3HG2 VAL 17 3HG2 VAL 17 -5.037 -15.524 -22.672 131 H LYS 18 H LYS 18 -1.678 -19.211 -23.130 132 HA LYS 18 HA LYS 18 0.062 -19.086 -20.809 133 1HB LYS 18 1HB LYS 18 -0.250 -21.012 -23.067 134 2HB LYS 18 2HB LYS 18 1.257 -20.961 -22.187 135 1HG LYS 18 1HG LYS 18 -0.263 -22.774 -21.444 136 2HG LYS 18 2HG LYS 18 0.169 -21.650 -20.157 137 1HD LYS 18 1HD LYS 18 -1.944 -20.588 -20.305 138 2HD LYS 18 2HD LYS 18 -2.384 -21.528 -21.742 139 1HE LYS 18 1HE LYS 18 -2.450 -23.552 -20.465 140 2HE LYS 18 2HE LYS 18 -1.745 -22.761 -19.058 141 1HZ LYS 18 1HZ LYS 18 -4.439 -22.123 -20.176 142 2HZ LYS 18 2HZ LYS 18 -3.731 -21.509 -18.759 143 3HZ LYS 18 3HZ LYS 18 -4.132 -23.130 -18.871 144 H LEU 19 H LEU 19 0.879 -17.114 -21.273 145 HA LEU 19 HA LEU 19 2.112 -16.539 -23.768 146 1HB LEU 19 1HB LEU 19 2.095 -15.335 -21.083 147 2HB LEU 19 2HB LEU 19 3.375 -14.868 -22.191 148 HG LEU 19 HG LEU 19 0.396 -14.444 -22.610 149 1HD1 LEU 19 1HD1 LEU 19 0.990 -12.067 -22.259 150 2HD1 LEU 19 2HD1 LEU 19 2.647 -12.546 -21.902 151 3HD1 LEU 19 3HD1 LEU 19 1.338 -13.039 -20.831 152 1HD2 LEU 19 1HD2 LEU 19 1.023 -13.162 -24.542 153 2HD2 LEU 19 2HD2 LEU 19 1.807 -14.744 -24.704 154 3HD2 LEU 19 3HD2 LEU 19 2.726 -13.351 -24.169 155 H ASN 20 H ASN 20 3.643 -17.593 -24.320 156 HA ASN 20 HA ASN 20 5.451 -19.005 -22.598 157 1HB ASN 20 1HB ASN 20 4.922 -19.487 -25.083 158 2HB ASN 20 2HB ASN 20 5.911 -18.069 -25.426 159 1HD2 ASN 20 1HD2 ASN 20 5.924 -21.363 -24.343 160 2HD2 ASN 20 2HD2 ASN 20 7.603 -21.649 -24.533 161 H ASN 21 H ASN 21 7.463 -18.207 -21.816 162 HA ASN 21 HA ASN 21 7.448 -15.528 -21.227 163 1HB ASN 21 1HB ASN 21 8.620 -17.077 -19.794 164 2HB ASN 21 2HB ASN 21 9.830 -17.357 -21.044 165 1HD2 ASN 21 1HD2 ASN 21 8.542 -14.960 -18.817 166 2HD2 ASN 21 2HD2 ASN 21 9.956 -13.983 -18.767 167 HA PRO 22 HA PRO 22 10.705 -14.422 -24.790 168 1HB PRO 22 1HB PRO 22 9.861 -16.637 -26.601 169 2HB PRO 22 2HB PRO 22 11.436 -15.855 -26.447 170 1HG PRO 22 1HG PRO 22 11.082 -18.256 -25.431 171 2HG PRO 22 2HG PRO 22 11.971 -17.029 -24.510 172 1HD PRO 22 1HD PRO 22 9.165 -17.993 -24.148 173 2HD PRO 22 2HD PRO 22 10.400 -17.599 -22.933 174 H ARG 23 H ARG 23 7.468 -15.512 -24.777 175 HA ARG 23 HA ARG 23 5.540 -14.861 -25.673 176 1HB ARG 23 1HB ARG 23 7.123 -12.342 -25.873 177 2HB ARG 23 2HB ARG 23 5.431 -12.410 -26.385 178 1HG ARG 23 1HG ARG 23 4.675 -12.953 -24.311 179 2HG ARG 23 2HG ARG 23 6.244 -13.503 -23.772 180 1HD ARG 23 1HD ARG 23 7.104 -11.221 -23.681 181 2HD ARG 23 2HD ARG 23 5.643 -10.597 -24.427 182 HE ARG 23 HE ARG 23 4.900 -10.277 -22.339 183 1HH1 ARG 23 1HH1 ARG 23 6.852 -13.304 -22.080 184 2HH1 ARG 23 2HH1 ARG 23 6.514 -13.497 -20.415 185 1HH2 ARG 23 1HH2 ARG 23 4.648 -10.547 -19.984 186 2HH2 ARG 23 2HH2 ARG 23 5.281 -11.929 -19.233 187 H GLN 24 H GLN 24 7.329 -16.156 -27.275 188 HA GLN 24 HA GLN 24 6.933 -15.307 -29.925 189 1HB GLN 24 1HB GLN 24 8.039 -17.460 -30.463 190 2HB GLN 24 2HB GLN 24 8.939 -16.496 -29.298 191 1HG GLN 24 1HG GLN 24 7.964 -17.874 -27.470 192 2HG GLN 24 2HG GLN 24 7.191 -18.873 -28.690 193 1HE2 GLN 24 1HE2 GLN 24 9.107 -19.568 -26.639 194 2HE2 GLN 24 2HE2 GLN 24 10.454 -20.261 -27.450 195 H GLU 25 H GLU 25 5.061 -16.896 -27.566 196 HA GLU 25 HA GLU 25 3.251 -18.097 -29.466 197 1HB GLU 25 1HB GLU 25 5.021 -19.792 -29.370 198 2HB GLU 25 2HB GLU 25 4.900 -19.840 -27.622 199 1HG GLU 25 1HG GLU 25 2.594 -20.697 -27.846 200 2HG GLU 25 2HG GLU 25 2.795 -20.710 -29.595 201 H VAL 26 H VAL 26 1.326 -18.626 -28.574 202 HA VAL 26 HA VAL 26 0.873 -18.448 -25.638 203 HB VAL 26 HB VAL 26 -1.242 -17.414 -26.029 204 1HG1 VAL 26 1HG1 VAL 26 -0.538 -15.128 -26.683 205 2HG1 VAL 26 2HG1 VAL 26 0.996 -15.808 -27.243 206 3HG1 VAL 26 3HG1 VAL 26 0.538 -15.924 -25.538 207 1HG2 VAL 26 1HG2 VAL 26 -1.850 -16.371 -28.199 208 2HG2 VAL 26 2HG2 VAL 26 -1.803 -18.136 -28.225 209 3HG2 VAL 26 3HG2 VAL 26 -0.471 -17.212 -28.921 210 H SER 27 H SER 27 -0.060 -20.098 -24.870 211 HA SER 27 HA SER 27 -1.538 -21.730 -26.759 212 1HB SER 27 1HB SER 27 -0.825 -22.551 -23.917 213 2HB SER 27 2HB SER 27 -1.318 -23.531 -25.290 214 HG SER 27 HG SER 27 0.671 -22.220 -26.177 215 H PHE 28 H PHE 28 -3.548 -21.449 -26.773 216 HA PHE 28 HA PHE 28 -4.719 -19.892 -24.633 217 1HB PHE 28 1HB PHE 28 -4.348 -18.302 -26.156 218 2HB PHE 28 2HB PHE 28 -4.631 -19.335 -27.558 219 HD1 PHE 28 HD1 PHE 28 -6.253 -17.386 -24.849 220 HD2 PHE 28 HD2 PHE 28 -6.777 -19.418 -28.554 221 HE1 PHE 28 HE1 PHE 28 -8.512 -16.435 -25.059 222 HE2 PHE 28 HE2 PHE 28 -9.028 -18.474 -28.764 223 HZ PHE 28 HZ PHE 28 -9.899 -16.995 -27.022 224 H VAL 29 H VAL 29 -6.822 -19.957 -24.416 225 HA VAL 29 HA VAL 29 -7.832 -22.609 -24.572 226 HB VAL 29 HB VAL 29 -7.600 -21.638 -22.398 227 1HG1 VAL 29 1HG1 VAL 29 -7.663 -19.268 -22.942 228 2HG1 VAL 29 2HG1 VAL 29 -8.822 -19.624 -21.664 229 3HG1 VAL 29 3HG1 VAL 29 -9.377 -19.380 -23.317 230 1HG2 VAL 29 1HG2 VAL 29 -10.500 -21.763 -23.197 231 2HG2 VAL 29 2HG2 VAL 29 -9.897 -21.824 -21.542 232 3HG2 VAL 29 3HG2 VAL 29 -9.486 -23.112 -22.683 233 H TYR 30 H TYR 30 -9.033 -23.045 -26.015 234 HA TYR 30 HA TYR 30 -10.714 -21.429 -27.792 235 1HB TYR 30 1HB TYR 30 -9.692 -23.730 -28.244 236 2HB TYR 30 2HB TYR 30 -10.883 -24.373 -27.140 237 HD1 TYR 30 HD1 TYR 30 -13.310 -24.381 -27.818 238 HD2 TYR 30 HD2 TYR 30 -10.209 -23.209 -30.465 239 HE1 TYR 30 HE1 TYR 30 -14.821 -24.715 -29.743 240 HE2 TYR 30 HE2 TYR 30 -11.700 -23.521 -32.370 241 HH TYR 30 HH TYR 30 -15.020 -23.880 -32.063 242 H ASP 31 H ASP 31 -11.199 -23.339 -24.941 243 HA ASP 31 HA ASP 31 -13.461 -22.008 -23.992 244 1HB ASP 31 1HB ASP 31 -14.595 -23.197 -25.847 245 2HB ASP 31 2HB ASP 31 -14.007 -24.726 -25.240 246 H ASN 32 H ASN 32 -12.309 -25.377 -24.200 247 HA ASN 32 HA ASN 32 -11.157 -25.086 -21.547 248 1HB ASN 32 1HB ASN 32 -12.080 -27.206 -20.721 249 2HB ASN 32 2HB ASN 32 -13.354 -26.052 -21.069 250 1HD2 ASN 32 1HD2 ASN 32 -14.845 -27.704 -21.160 251 2HD2 ASN 32 2HD2 ASN 32 -14.972 -28.789 -22.508 252 H GLN 33 H GLN 33 -10.283 -25.462 -24.443 253 HA GLN 33 HA GLN 33 -8.430 -27.618 -23.952 254 1HB GLN 33 1HB GLN 33 -8.735 -28.538 -26.153 255 2HB GLN 33 2HB GLN 33 -10.339 -28.420 -25.461 256 1HG GLN 33 1HG GLN 33 -10.722 -26.372 -26.684 257 2HG GLN 33 2HG GLN 33 -9.110 -26.497 -27.379 258 1HE2 GLN 33 1HE2 GLN 33 -12.318 -27.804 -27.383 259 2HE2 GLN 33 2HE2 GLN 33 -12.183 -28.751 -28.805 260 H LEU 34 H LEU 34 -6.553 -27.280 -25.267 261 HA LEU 34 HA LEU 34 -6.318 -24.427 -25.412 262 1HB LEU 34 1HB LEU 34 -4.343 -26.506 -24.603 263 2HB LEU 34 2HB LEU 34 -3.853 -24.840 -24.885 264 HG LEU 34 HG LEU 34 -5.813 -25.792 -22.782 265 1HD1 LEU 34 1HD1 LEU 34 -2.945 -24.887 -22.541 266 2HD1 LEU 34 2HD1 LEU 34 -3.538 -26.534 -22.320 267 3HD1 LEU 34 3HD1 LEU 34 -4.026 -25.262 -21.199 268 1HD2 LEU 34 1HD2 LEU 34 -5.563 -23.519 -21.887 269 2HD2 LEU 34 2HD2 LEU 34 -6.286 -23.519 -23.490 270 3HD2 LEU 34 3HD2 LEU 34 -4.588 -23.079 -23.288 271 H LEU 35 H LEU 35 -5.513 -23.587 -27.284 272 HA LEU 35 HA LEU 35 -4.223 -25.380 -29.257 273 1HB LEU 35 1HB LEU 35 -5.654 -22.757 -29.716 274 2HB LEU 35 2HB LEU 35 -4.715 -23.583 -30.932 275 HG LEU 35 HG LEU 35 -6.893 -23.946 -31.429 276 1HD1 LEU 35 1HD1 LEU 35 -5.638 -25.931 -31.744 277 2HD1 LEU 35 2HD1 LEU 35 -7.254 -26.381 -31.206 278 3HD1 LEU 35 3HD1 LEU 35 -5.904 -26.429 -30.073 279 1HD2 LEU 35 1HD2 LEU 35 -8.595 -24.890 -29.910 280 2HD2 LEU 35 2HD2 LEU 35 -7.985 -23.311 -29.403 281 3HD2 LEU 35 3HD2 LEU 35 -7.425 -24.777 -28.593 282 H HIS 36 H HIS 36 -2.718 -23.970 -30.683 283 HA HIS 36 HA HIS 36 -1.330 -22.125 -28.922 284 1HB HIS 36 1HB HIS 36 0.921 -22.996 -29.550 285 2HB HIS 36 2HB HIS 36 -0.049 -24.121 -28.619 286 HD2 HIS 36 HD2 HIS 36 -1.068 -26.322 -30.165 287 HE1 HIS 36 HE1 HIS 36 1.871 -25.853 -33.166 288 HE2 HIS 36 HE2 HIS 36 0.051 -27.357 -32.252 289 H LEU 37 H LEU 37 -0.997 -20.317 -29.669 290 HA LEU 37 HA LEU 37 -1.054 -19.886 -32.581 291 1HB LEU 37 1HB LEU 37 -1.891 -18.005 -30.382 292 2HB LEU 37 2HB LEU 37 -1.885 -17.607 -32.056 293 HG LEU 37 HG LEU 37 -3.673 -19.438 -32.386 294 1HD1 LEU 37 1HD1 LEU 37 -3.353 -20.710 -30.356 295 2HD1 LEU 37 2HD1 LEU 37 -5.004 -20.078 -30.394 296 3HD1 LEU 37 3HD1 LEU 37 -3.775 -19.310 -29.381 297 1HD2 LEU 37 1HD2 LEU 37 -4.390 -17.150 -30.587 298 2HD2 LEU 37 2HD2 LEU 37 -5.522 -18.066 -31.584 299 3HD2 LEU 37 3HD2 LEU 37 -4.273 -17.078 -32.344 300 H LYS 38 H LYS 38 0.403 -18.276 -33.316 301 HA LYS 38 HA LYS 38 2.332 -17.564 -31.285 302 1HB LYS 38 1HB LYS 38 4.149 -18.121 -32.719 303 2HB LYS 38 2HB LYS 38 3.092 -19.492 -32.299 304 1HG LYS 38 1HG LYS 38 2.176 -19.550 -34.489 305 2HG LYS 38 2HG LYS 38 2.988 -18.042 -34.929 306 1HD LYS 38 1HD LYS 38 5.132 -19.080 -34.643 307 2HD LYS 38 2HD LYS 38 4.376 -20.592 -34.151 308 1HE LYS 38 1HE LYS 38 3.380 -20.836 -36.353 309 2HE LYS 38 2HE LYS 38 4.035 -19.274 -36.846 310 1HZ LYS 38 1HZ LYS 38 5.355 -21.186 -37.612 311 2HZ LYS 38 2HZ LYS 38 5.700 -21.586 -36.014 312 3HZ LYS 38 3HZ LYS 38 6.234 -20.115 -36.665 313 H GLN 39 H GLN 39 3.767 -15.942 -31.870 314 HA GLN 39 HA GLN 39 2.331 -13.840 -33.183 315 1HB GLN 39 1HB GLN 39 3.273 -13.445 -31.004 316 2HB GLN 39 2HB GLN 39 4.901 -13.805 -31.582 317 1HG GLN 39 1HG GLN 39 3.467 -11.656 -33.000 318 2HG GLN 39 2HG GLN 39 3.824 -11.324 -31.312 319 1HE2 GLN 39 1HE2 GLN 39 5.268 -9.730 -31.781 320 2HE2 GLN 39 2HE2 GLN 39 6.818 -10.024 -32.469 321 H GLY 40 H GLY 40 2.584 -13.322 -35.002 322 1HA GLY 40 1HA GLY 40 5.000 -14.098 -36.506 323 2HA GLY 40 2HA GLY 40 3.415 -13.936 -37.255 324 H ILE 41 H ILE 41 3.434 -12.241 -38.551 325 HA ILE 41 HA ILE 41 5.155 -9.997 -37.913 326 HB ILE 41 HB ILE 41 3.361 -10.429 -40.336 327 1HG1 ILE 41 1HG1 ILE 41 5.588 -10.473 -41.590 328 2HG1 ILE 41 2HG1 ILE 41 6.376 -10.585 -40.027 329 1HG2 ILE 41 1HG2 ILE 41 4.422 -8.429 -41.301 330 2HG2 ILE 41 2HG2 ILE 41 5.273 -8.177 -39.769 331 3HG2 ILE 41 3HG2 ILE 41 3.522 -8.074 -39.822 332 1HD1 ILE 41 1HD1 ILE 41 6.225 -12.755 -41.103 333 2HD1 ILE 41 2HD1 ILE 41 4.471 -12.602 -41.208 334 3HD1 ILE 41 3HD1 ILE 41 5.252 -12.730 -39.632 335 H SER 42 H SER 42 4.384 -8.657 -36.464 336 HA SER 42 HA SER 42 1.523 -8.259 -36.295 337 1HB SER 42 1HB SER 42 3.766 -7.396 -34.510 338 2HB SER 42 2HB SER 42 2.039 -7.298 -34.134 339 HG SER 42 HG SER 42 3.728 -9.514 -34.355 340 H ALA 43 H ALA 43 0.554 -6.273 -36.554 341 HA ALA 43 HA ALA 43 2.214 -4.073 -37.110 342 1HB ALA 43 1HB ALA 43 -0.071 -4.889 -38.894 343 2HB ALA 43 2HB ALA 43 1.644 -4.979 -39.293 344 3HB ALA 43 3HB ALA 43 0.872 -3.410 -39.076 345 H SER 44 H SER 44 -1.077 -5.258 -36.523 346 HA SER 44 HA SER 44 -2.022 -2.699 -35.632 347 1HB SER 44 1HB SER 44 -3.340 -5.409 -35.433 348 2HB SER 44 2HB SER 44 -4.130 -3.833 -35.366 349 HG SER 44 HG SER 44 -3.520 -3.492 -37.525 350 H GLY 45 H GLY 45 -0.181 -5.086 -34.219 351 1HA GLY 45 1HA GLY 45 -0.171 -4.127 -31.620 352 2HA GLY 45 2HA GLY 45 -1.374 -5.407 -31.671 353 H ALA 46 H ALA 46 -0.702 -7.311 -31.171 354 HA ALA 46 HA ALA 46 1.827 -8.276 -32.135 355 1HB ALA 46 1HB ALA 46 0.706 -8.364 -29.334 356 2HB ALA 46 2HB ALA 46 2.277 -7.712 -29.812 357 3HB ALA 46 3HB ALA 46 1.966 -9.456 -29.903 358 H ARG 47 H ARG 47 1.187 -10.015 -33.284 359 HA ARG 47 HA ARG 47 -1.461 -10.755 -32.578 360 1HB ARG 47 1HB ARG 47 -1.868 -11.471 -34.924 361 2HB ARG 47 2HB ARG 47 -1.486 -9.765 -34.749 362 1HG ARG 47 1HG ARG 47 0.713 -10.090 -35.590 363 2HG ARG 47 2HG ARG 47 0.530 -11.842 -35.552 364 1HD ARG 47 1HD ARG 47 -1.069 -9.942 -37.241 365 2HD ARG 47 2HD ARG 47 0.273 -10.933 -37.812 366 HE ARG 47 HE ARG 47 -1.485 -12.687 -36.676 367 1HH1 ARG 47 1HH1 ARG 47 -1.548 -10.371 -39.342 368 2HH1 ARG 47 2HH1 ARG 47 -2.793 -11.154 -40.187 369 1HH2 ARG 47 1HH2 ARG 47 -3.197 -13.760 -37.812 370 2HH2 ARG 47 2HH2 ARG 47 -3.746 -13.160 -39.317 371 H TYR 48 H TYR 48 -1.683 -12.758 -31.887 372 HA TYR 48 HA TYR 48 0.275 -14.886 -32.503 373 1HB TYR 48 1HB TYR 48 -1.712 -14.646 -30.226 374 2HB TYR 48 2HB TYR 48 -0.470 -15.875 -30.453 375 HD1 TYR 48 HD1 TYR 48 -1.083 -12.363 -29.505 376 HD2 TYR 48 HD2 TYR 48 1.821 -15.459 -29.802 377 HE1 TYR 48 HE1 TYR 48 0.458 -11.031 -28.153 378 HE2 TYR 48 HE2 TYR 48 3.379 -14.121 -28.446 379 HH TYR 48 HH TYR 48 2.370 -11.343 -26.737 380 H THR 49 H THR 49 -0.450 -15.998 -34.103 381 HA THR 49 HA THR 49 -3.320 -16.576 -34.051 382 HB THR 49 HB THR 49 -1.818 -15.677 -36.475 383 HG1 THR 49 HG1 THR 49 -2.807 -14.229 -34.640 384 1HG2 THR 49 1HG2 THR 49 -3.501 -17.276 -37.133 385 2HG2 THR 49 2HG2 THR 49 -4.044 -15.668 -37.616 386 3HG2 THR 49 3HG2 THR 49 -4.732 -16.447 -36.191 387 H ASP 50 H ASP 50 -3.871 -18.510 -34.768 388 HA ASP 50 HA ASP 50 -1.694 -20.224 -35.663 389 1HB ASP 50 1HB ASP 50 -2.415 -21.115 -33.586 390 2HB ASP 50 2HB ASP 50 -4.115 -20.889 -33.997 391 H GLY 51 H GLY 51 -5.135 -19.570 -35.931 392 1HA GLY 51 1HA GLY 51 -5.687 -19.464 -38.465 393 2HA GLY 51 2HA GLY 51 -5.332 -21.189 -38.341 394 H ILE 52 H ILE 52 -6.226 -21.564 -35.742 395 HA ILE 52 HA ILE 52 -8.958 -22.105 -36.056 396 HB ILE 52 HB ILE 52 -7.373 -21.747 -33.486 397 1HG1 ILE 52 1HG1 ILE 52 -6.368 -23.470 -34.906 398 2HG1 ILE 52 2HG1 ILE 52 -7.102 -24.196 -33.488 399 1HG2 ILE 52 1HG2 ILE 52 -9.755 -21.666 -33.056 400 2HG2 ILE 52 2HG2 ILE 52 -9.083 -23.177 -32.441 401 3HG2 ILE 52 3HG2 ILE 52 -9.989 -23.165 -33.955 402 1HD1 ILE 52 1HD1 ILE 52 -8.273 -24.153 -36.261 403 2HD1 ILE 52 2HD1 ILE 52 -9.020 -24.881 -34.838 404 3HD1 ILE 52 3HD1 ILE 52 -7.506 -25.527 -35.470 405 H TYR 53 H TYR 53 -7.289 -19.673 -34.141 406 HA TYR 53 HA TYR 53 -9.325 -17.767 -34.893 407 1HB TYR 53 1HB TYR 53 -8.292 -18.046 -32.057 408 2HB TYR 53 2HB TYR 53 -9.289 -16.746 -32.716 409 HD1 TYR 53 HD1 TYR 53 -11.568 -17.471 -33.738 410 HD2 TYR 53 HD2 TYR 53 -9.364 -19.868 -31.019 411 HE1 TYR 53 HE1 TYR 53 -13.603 -18.742 -33.230 412 HE2 TYR 53 HE2 TYR 53 -11.399 -21.146 -30.498 413 HH TYR 53 HH TYR 53 -13.866 -20.820 -30.593 414 H VAL 54 H VAL 54 -8.513 -15.597 -34.402 415 HA VAL 54 HA VAL 54 -5.624 -15.292 -34.898 416 HB VAL 54 HB VAL 54 -8.091 -13.733 -35.499 417 1HG1 VAL 54 1HG1 VAL 54 -5.171 -13.077 -36.198 418 2HG1 VAL 54 2HG1 VAL 54 -6.179 -12.175 -35.065 419 3HG1 VAL 54 3HG1 VAL 54 -6.545 -12.143 -36.791 420 1HG2 VAL 54 1HG2 VAL 54 -7.868 -15.567 -37.016 421 2HG2 VAL 54 2HG2 VAL 54 -6.200 -15.136 -37.390 422 3HG2 VAL 54 3HG2 VAL 54 -7.517 -14.086 -37.907 423 H PHE 55 H PHE 55 -4.724 -14.698 -32.921 424 HA PHE 55 HA PHE 55 -6.452 -13.267 -31.043 425 1HB PHE 55 1HB PHE 55 -5.344 -15.353 -30.255 426 2HB PHE 55 2HB PHE 55 -3.777 -14.626 -30.572 427 HD1 PHE 55 HD1 PHE 55 -6.546 -14.953 -28.303 428 HD2 PHE 55 HD2 PHE 55 -3.021 -12.730 -29.118 429 HE1 PHE 55 HE1 PHE 55 -6.552 -14.125 -26.008 430 HE2 PHE 55 HE2 PHE 55 -3.011 -11.893 -26.797 431 HZ PHE 55 HZ PHE 55 -4.777 -12.591 -25.242 432 H TRP 56 H TRP 56 -6.093 -11.217 -30.598 433 HA TRP 56 HA TRP 56 -3.689 -10.039 -31.649 434 1HB TRP 56 1HB TRP 56 -5.371 -9.435 -33.161 435 2HB TRP 56 2HB TRP 56 -6.527 -9.074 -31.870 436 HD1 TRP 56 HD1 TRP 56 -2.937 -7.647 -31.963 437 HE1 TRP 56 HE1 TRP 56 -3.098 -5.087 -32.181 438 HE3 TRP 56 HE3 TRP 56 -7.971 -7.187 -32.727 439 HZ2 TRP 56 HZ2 TRP 56 -5.065 -3.144 -32.656 440 HZ3 TRP 56 HZ3 TRP 56 -8.908 -4.938 -33.074 441 HH2 TRP 56 HH2 TRP 56 -7.486 -2.961 -33.037 442 H SER 57 H SER 57 -2.636 -9.214 -30.289 443 HA SER 57 HA SER 57 -3.716 -8.460 -27.671 444 1HB SER 57 1HB SER 57 -2.005 -10.282 -27.658 445 2HB SER 57 2HB SER 57 -0.885 -9.196 -28.471 446 HG SER 57 HG SER 57 -0.509 -9.220 -26.244 447 H LYS 58 H LYS 58 -3.858 -6.331 -27.482 448 HA LYS 58 HA LYS 58 -2.306 -4.670 -29.263 449 1HB LYS 58 1HB LYS 58 -4.722 -4.213 -28.699 450 2HB LYS 58 2HB LYS 58 -4.200 -3.818 -27.070 451 1HG LYS 58 1HG LYS 58 -4.499 -1.776 -28.319 452 2HG LYS 58 2HG LYS 58 -2.773 -2.050 -28.001 453 1HD LYS 58 1HD LYS 58 -2.507 -2.967 -30.232 454 2HD LYS 58 2HD LYS 58 -4.211 -2.650 -30.559 455 1HE LYS 58 1HE LYS 58 -3.849 -0.277 -30.219 456 2HE LYS 58 2HE LYS 58 -2.156 -0.579 -29.823 457 1HZ LYS 58 1HZ LYS 58 -1.879 -1.482 -32.075 458 2HZ LYS 58 2HZ LYS 58 -2.328 0.125 -32.080 459 3HZ LYS 58 3HZ LYS 58 -3.470 -1.063 -32.428 460 H GLY 59 H GLY 59 -1.970 -6.079 -26.276 461 1HA GLY 59 1HA GLY 59 0.295 -5.821 -25.277 462 2HA GLY 59 2HA GLY 59 -0.026 -4.085 -25.306 463 H ASP 60 H ASP 60 -2.476 -3.829 -24.516 464 HA ASP 60 HA ASP 60 -2.648 -5.163 -21.906 465 1HB ASP 60 1HB ASP 60 -3.453 -2.329 -22.614 466 2HB ASP 60 2HB ASP 60 -3.827 -3.114 -21.086 467 H GLU 61 H GLU 61 -4.105 -4.741 -24.882 468 HA GLU 61 HA GLU 61 -6.677 -5.595 -23.766 469 1HB GLU 61 1HB GLU 61 -6.180 -4.268 -26.435 470 2HB GLU 61 2HB GLU 61 -7.734 -4.733 -25.766 471 1HG GLU 61 1HG GLU 61 -7.291 -3.113 -23.895 472 2HG GLU 61 2HG GLU 61 -5.887 -2.600 -24.821 473 H ALA 62 H ALA 62 -7.457 -7.446 -24.504 474 HA ALA 62 HA ALA 62 -5.831 -8.730 -26.494 475 1HB ALA 62 1HB ALA 62 -6.880 -9.943 -23.957 476 2HB ALA 62 2HB ALA 62 -5.188 -9.615 -24.342 477 3HB ALA 62 3HB ALA 62 -6.088 -10.838 -25.253 478 H THR 63 H THR 63 -7.052 -9.353 -28.053 479 HA THR 63 HA THR 63 -9.792 -10.206 -27.554 480 HB THR 63 HB THR 63 -9.827 -7.828 -28.385 481 HG1 THR 63 HG1 THR 63 -11.309 -8.111 -29.953 482 1HG2 THR 63 1HG2 THR 63 -8.573 -9.035 -30.788 483 2HG2 THR 63 2HG2 THR 63 -7.795 -7.906 -29.654 484 3HG2 THR 63 3HG2 THR 63 -9.145 -7.360 -30.675 485 H VAL 64 H VAL 64 -10.558 -11.536 -29.492 486 HA VAL 64 HA VAL 64 -8.530 -12.640 -31.131 487 HB VAL 64 HB VAL 64 -7.922 -13.843 -29.193 488 1HG1 VAL 64 1HG1 VAL 64 -10.808 -14.493 -28.817 489 2HG1 VAL 64 2HG1 VAL 64 -9.749 -13.488 -27.816 490 3HG1 VAL 64 3HG1 VAL 64 -9.482 -15.230 -27.902 491 1HG2 VAL 64 1HG2 VAL 64 -8.363 -16.191 -29.781 492 2HG2 VAL 64 2HG2 VAL 64 -7.949 -15.214 -31.191 493 3HG2 VAL 64 3HG2 VAL 64 -9.630 -15.653 -30.883 494 H TYR 65 H TYR 65 -9.362 -12.968 -32.933 495 HA TYR 65 HA TYR 65 -12.237 -13.494 -33.247 496 1HB TYR 65 1HB TYR 65 -12.505 -11.280 -33.440 497 2HB TYR 65 2HB TYR 65 -10.786 -11.004 -33.512 498 HD1 TYR 65 HD1 TYR 65 -9.686 -10.587 -35.613 499 HD2 TYR 65 HD2 TYR 65 -13.835 -11.549 -35.564 500 HE1 TYR 65 HE1 TYR 65 -9.887 -9.821 -37.931 501 HE2 TYR 65 HE2 TYR 65 -14.033 -10.794 -37.883 502 HH TYR 65 HH TYR 65 -12.846 -9.241 -39.388 503 H LYS 66 H LYS 66 -12.275 -15.300 -34.519 504 HA LYS 66 HA LYS 66 -10.646 -15.400 -36.877 505 1HB LYS 66 1HB LYS 66 -11.446 -17.555 -35.717 506 2HB LYS 66 2HB LYS 66 -13.097 -16.983 -36.039 507 1HG LYS 66 1HG LYS 66 -12.299 -16.886 -38.491 508 2HG LYS 66 2HG LYS 66 -11.041 -17.999 -37.949 509 1HD LYS 66 1HD LYS 66 -13.979 -18.456 -37.520 510 2HD LYS 66 2HD LYS 66 -13.129 -19.012 -38.954 511 1HE LYS 66 1HE LYS 66 -12.405 -19.802 -36.123 512 2HE LYS 66 2HE LYS 66 -13.437 -20.764 -37.175 513 1HZ LYS 66 1HZ LYS 66 -11.196 -21.594 -37.261 514 2HZ LYS 66 2HZ LYS 66 -10.576 -20.098 -37.656 515 3HZ LYS 66 3HZ LYS 66 -11.550 -20.914 -38.753 516 H ARG 67 H ARG 67 -11.800 -15.081 -38.761 517 HA ARG 67 HA ARG 67 -13.928 -13.157 -38.441 518 1HB ARG 67 1HB ARG 67 -12.079 -12.574 -39.852 519 2HB ARG 67 2HB ARG 67 -12.434 -13.957 -40.900 520 1HG ARG 67 1HG ARG 67 -14.535 -11.864 -40.525 521 2HG ARG 67 2HG ARG 67 -13.162 -11.474 -41.560 522 1HD ARG 67 1HD ARG 67 -14.863 -13.902 -41.801 523 2HD ARG 67 2HD ARG 67 -15.116 -12.442 -42.794 524 HE ARG 67 HE ARG 67 -12.518 -13.090 -43.199 525 1HH1 ARG 67 1HH1 ARG 67 -15.472 -14.982 -43.487 526 2HH1 ARG 67 2HH1 ARG 67 -14.838 -16.064 -44.636 527 1HH2 ARG 67 1HH2 ARG 67 -11.656 -14.522 -44.769 528 2HH2 ARG 67 2HH2 ARG 67 -12.610 -15.792 -45.409 529 H ASP 68 H ASP 68 -15.005 -14.586 -37.657 530 HA ASP 68 HA ASP 68 -17.391 -15.283 -38.789 531 1HB ASP 68 1HB ASP 68 -16.216 -17.065 -40.104 532 2HB ASP 68 2HB ASP 68 -15.696 -17.798 -38.592 533 H ARG 69 H ARG 69 -14.989 -15.947 -36.438 534 HA ARG 69 HA ARG 69 -17.022 -16.099 -34.423 535 1HB ARG 69 1HB ARG 69 -16.842 -18.428 -35.129 536 2HB ARG 69 2HB ARG 69 -15.117 -18.404 -34.806 537 1HG ARG 69 1HG ARG 69 -16.323 -19.524 -33.000 538 2HG ARG 69 2HG ARG 69 -15.563 -18.032 -32.435 539 1HD ARG 69 1HD ARG 69 -17.855 -18.340 -31.565 540 2HD ARG 69 2HD ARG 69 -17.661 -16.866 -32.504 541 HE ARG 69 HE ARG 69 -18.594 -18.995 -34.134 542 1HH1 ARG 69 1HH1 ARG 69 -19.750 -16.726 -31.651 543 2HH1 ARG 69 2HH1 ARG 69 -21.351 -16.718 -32.221 544 1HH2 ARG 69 1HH2 ARG 69 -20.756 -18.962 -34.896 545 2HH2 ARG 69 2HH2 ARG 69 -21.958 -18.041 -34.115 546 H ILE 70 H ILE 70 -16.317 -14.497 -33.360 547 HA ILE 70 HA ILE 70 -13.639 -14.252 -32.198 548 HB ILE 70 HB ILE 70 -16.151 -12.716 -31.616 549 1HG1 ILE 70 1HG1 ILE 70 -14.936 -10.837 -33.006 550 2HG1 ILE 70 2HG1 ILE 70 -14.134 -12.233 -33.722 551 1HG2 ILE 70 1HG2 ILE 70 -13.278 -12.044 -31.092 552 2HG2 ILE 70 2HG2 ILE 70 -14.526 -12.448 -29.908 553 3HG2 ILE 70 3HG2 ILE 70 -14.634 -10.952 -30.843 554 1HD1 ILE 70 1HD1 ILE 70 -16.021 -11.441 -35.092 555 2HD1 ILE 70 2HD1 ILE 70 -17.106 -11.767 -33.746 556 3HD1 ILE 70 3HD1 ILE 70 -16.247 -13.096 -34.529 557 H VAL 71 H VAL 71 -13.231 -14.787 -30.348 558 HA VAL 71 HA VAL 71 -15.395 -15.996 -28.738 559 HB VAL 71 HB VAL 71 -13.619 -17.406 -27.544 560 1HG1 VAL 71 1HG1 VAL 71 -14.183 -17.906 -30.451 561 2HG1 VAL 71 2HG1 VAL 71 -15.222 -18.347 -29.092 562 3HG1 VAL 71 3HG1 VAL 71 -13.640 -19.117 -29.290 563 1HG2 VAL 71 1HG2 VAL 71 -11.602 -16.277 -28.365 564 2HG2 VAL 71 2HG2 VAL 71 -12.020 -16.730 -30.024 565 3HG2 VAL 71 3HG2 VAL 71 -11.620 -17.976 -28.839 566 H LEU 72 H LEU 72 -12.974 -13.667 -28.743 567 HA LEU 72 HA LEU 72 -14.066 -12.660 -26.268 568 1HB LEU 72 1HB LEU 72 -11.076 -13.189 -26.476 569 2HB LEU 72 2HB LEU 72 -11.789 -12.125 -25.300 570 HG LEU 72 HG LEU 72 -13.050 -14.229 -24.501 571 1HD1 LEU 72 1HD1 LEU 72 -12.459 -15.721 -26.318 572 2HD1 LEU 72 2HD1 LEU 72 -11.829 -16.326 -24.785 573 3HD1 LEU 72 3HD1 LEU 72 -10.748 -15.526 -25.928 574 1HD2 LEU 72 1HD2 LEU 72 -11.417 -13.089 -23.180 575 2HD2 LEU 72 2HD2 LEU 72 -10.124 -13.870 -24.084 576 3HD2 LEU 72 3HD2 LEU 72 -11.173 -14.836 -23.046 577 H ASN 73 H ASN 73 -14.074 -10.479 -26.290 578 HA ASN 73 HA ASN 73 -12.434 -9.169 -28.328 579 1HB ASN 73 1HB ASN 73 -14.300 -7.923 -29.274 580 2HB ASN 73 2HB ASN 73 -14.631 -9.645 -29.390 581 1HD2 ASN 73 1HD2 ASN 73 -15.586 -6.648 -28.002 582 2HD2 ASN 73 2HD2 ASN 73 -17.033 -7.198 -27.243 583 H ASN 74 H ASN 74 -12.908 -9.307 -25.362 584 HA ASN 74 HA ASN 74 -12.307 -6.618 -24.820 585 1HB ASN 74 1HB ASN 74 -14.664 -6.214 -25.055 586 2HB ASN 74 2HB ASN 74 -15.052 -7.562 -23.995 587 1HD2 ASN 74 1HD2 ASN 74 -15.022 -7.238 -21.814 588 2HD2 ASN 74 2HD2 ASN 74 -14.800 -5.726 -21.033 589 H CYS 75 H CYS 75 -10.612 -7.601 -24.031 590 HA CYS 75 HA CYS 75 -10.923 -8.189 -21.228 591 1HB CYS 75 1HB CYS 75 -9.252 -9.787 -23.186 592 2HB CYS 75 2HB CYS 75 -8.946 -9.780 -21.454 593 H GLN 76 H GLN 76 -9.523 -6.994 -20.126 594 HA GLN 76 HA GLN 76 -7.473 -5.678 -21.657 595 1HB GLN 76 1HB GLN 76 -9.503 -4.285 -19.910 596 2HB GLN 76 2HB GLN 76 -8.002 -3.538 -20.452 597 1HG GLN 76 1HG GLN 76 -8.658 -3.852 -22.740 598 2HG GLN 76 2HG GLN 76 -10.165 -4.596 -22.260 599 1HE2 GLN 76 1HE2 GLN 76 -9.701 -2.070 -23.809 600 2HE2 GLN 76 2HE2 GLN 76 -10.497 -0.858 -22.891 601 H LEU 77 H LEU 77 -5.935 -6.288 -20.871 602 HA LEU 77 HA LEU 77 -5.950 -8.080 -18.859 603 1HB LEU 77 1HB LEU 77 -4.504 -8.289 -20.695 604 2HB LEU 77 2HB LEU 77 -3.714 -6.774 -20.346 605 HG LEU 77 HG LEU 77 -2.587 -7.813 -18.398 606 1HD1 LEU 77 1HD1 LEU 77 -2.774 -10.158 -18.004 607 2HD1 LEU 77 2HD1 LEU 77 -4.015 -10.292 -19.252 608 3HD1 LEU 77 3HD1 LEU 77 -4.329 -9.362 -17.787 609 1HD2 LEU 77 1HD2 LEU 77 -1.454 -7.886 -20.516 610 2HD2 LEU 77 2HD2 LEU 77 -2.417 -9.267 -21.012 611 3HD2 LEU 77 3HD2 LEU 77 -1.249 -9.452 -19.713 612 H GLN 78 H GLN 78 -5.469 -7.984 -16.697 613 HA GLN 78 HA GLN 78 -5.036 -5.493 -15.422 614 1HB GLN 78 1HB GLN 78 -4.381 -8.235 -14.314 615 2HB GLN 78 2HB GLN 78 -4.663 -6.770 -13.390 616 1HG GLN 78 1HG GLN 78 -6.713 -8.291 -14.997 617 2HG GLN 78 2HG GLN 78 -6.553 -8.274 -13.244 618 1HE2 GLN 78 1HE2 GLN 78 -7.764 -6.670 -16.015 619 2HE2 GLN 78 2HE2 GLN 78 -8.602 -5.400 -15.200 620 H ASN 79 H ASN 79 -2.831 -8.338 -15.927 621 HA ASN 79 HA ASN 79 -0.780 -7.097 -17.159 622 1HB ASN 79 1HB ASN 79 -0.496 -5.942 -14.839 623 2HB ASN 79 2HB ASN 79 -0.196 -7.549 -14.193 624 1HD2 ASN 79 1HD2 ASN 79 1.789 -8.603 -14.713 625 2HD2 ASN 79 2HD2 ASN 79 3.073 -7.723 -15.464 626 HA PRO 80 HA PRO 80 -0.506 -11.439 -16.876 627 1HB PRO 80 1HB PRO 80 1.816 -12.023 -18.229 628 2HB PRO 80 2HB PRO 80 0.316 -11.557 -19.034 629 1HG PRO 80 1HG PRO 80 2.718 -9.918 -18.408 630 2HG PRO 80 2HG PRO 80 1.676 -9.887 -19.840 631 1HD PRO 80 1HD PRO 80 1.528 -8.094 -17.747 632 2HD PRO 80 2HD PRO 80 0.204 -8.478 -18.888 633 H GLN 81 H GLN 81 2.208 -12.813 -16.701 634 HA GLN 81 HA GLN 81 2.657 -12.688 -13.999 635 1HB GLN 81 1HB GLN 81 3.165 -14.629 -15.348 636 2HB GLN 81 2HB GLN 81 4.268 -13.695 -16.333 637 1HG GLN 81 1HG GLN 81 5.459 -15.141 -14.931 638 2HG GLN 81 2HG GLN 81 5.718 -13.463 -14.432 639 1HE2 GLN 81 1HE2 GLN 81 4.166 -16.466 -13.629 640 2HE2 GLN 81 2HE2 GLN 81 3.890 -16.133 -11.970 641 H ARG 82 H ARG 82 3.936 -11.218 -16.712 642 HA ARG 82 HA ARG 82 5.318 -9.168 -15.187 643 1HB ARG 82 1HB ARG 82 6.732 -10.797 -17.307 644 2HB ARG 82 2HB ARG 82 7.347 -9.273 -16.679 645 1HG ARG 82 1HG ARG 82 6.771 -11.712 -15.056 646 2HG ARG 82 2HG ARG 82 8.394 -11.248 -15.610 647 1HD ARG 82 1HD ARG 82 8.285 -9.209 -14.301 648 2HD ARG 82 2HD ARG 82 6.612 -9.527 -13.856 649 HE ARG 82 HE ARG 82 8.704 -11.386 -13.054 650 1HH1 ARG 82 1HH1 ARG 82 6.201 -9.040 -12.161 651 2HH1 ARG 82 2HH1 ARG 82 6.290 -9.332 -10.497 652 1HH2 ARG 82 1HH2 ARG 82 8.857 -11.774 -10.737 653 2HH2 ARG 82 2HH2 ARG 82 7.808 -10.960 -9.671 Start of MODEL 2 1 H MET 1 H MET 1 11.296 -23.208 -15.053 2 HA MET 1 HA MET 1 8.943 -23.807 -14.939 3 1HB MET 1 1HB MET 1 9.627 -21.540 -13.043 4 2HB MET 1 2HB MET 1 8.317 -22.672 -12.827 5 1HG MET 1 1HG MET 1 9.950 -24.481 -12.627 6 2HG MET 1 2HG MET 1 11.251 -23.293 -12.788 7 1HE MET 1 1HE MET 1 11.014 -25.337 -10.347 8 2HE MET 1 2HE MET 1 11.385 -24.291 -8.982 9 3HE MET 1 3HE MET 1 12.313 -24.151 -10.477 10 H GLN 2 H GLN 2 9.313 -20.284 -14.676 11 HA GLN 2 HA GLN 2 6.615 -19.657 -14.738 12 1HB GLN 2 1HB GLN 2 8.991 -17.938 -15.418 13 2HB GLN 2 2HB GLN 2 7.384 -17.362 -15.005 14 1HG GLN 2 1HG GLN 2 9.182 -18.948 -13.180 15 2HG GLN 2 2HG GLN 2 8.966 -17.201 -13.124 16 1HE2 GLN 2 1HE2 GLN 2 7.072 -16.397 -12.336 17 2HE2 GLN 2 2HE2 GLN 2 5.945 -17.336 -11.438 18 H THR 3 H THR 3 5.350 -18.595 -16.271 19 HA THR 3 HA THR 3 6.210 -18.351 -19.039 20 HB THR 3 HB THR 3 3.531 -19.610 -18.417 21 HG1 THR 3 HG1 THR 3 6.002 -20.800 -18.146 22 1HG2 THR 3 1HG2 THR 3 4.037 -18.712 -20.644 23 2HG2 THR 3 2HG2 THR 3 3.813 -20.463 -20.688 24 3HG2 THR 3 3HG2 THR 3 5.436 -19.781 -20.757 25 H ASP 4 H ASP 4 5.367 -16.594 -19.851 26 HA ASP 4 HA ASP 4 4.067 -14.757 -18.116 27 1HB ASP 4 1HB ASP 4 4.866 -14.812 -20.985 28 2HB ASP 4 2HB ASP 4 3.845 -13.471 -20.425 29 H THR 5 H THR 5 1.922 -14.245 -18.048 30 HA THR 5 HA THR 5 0.144 -15.457 -19.961 31 HB THR 5 HB THR 5 0.212 -17.196 -18.265 32 HG1 THR 5 HG1 THR 5 -2.137 -15.994 -17.496 33 1HG2 THR 5 1HG2 THR 5 -0.447 -16.762 -15.924 34 2HG2 THR 5 2HG2 THR 5 -0.538 -15.036 -16.276 35 3HG2 THR 5 3HG2 THR 5 1.013 -15.870 -16.353 36 H LEU 6 H LEU 6 -1.946 -14.496 -19.962 37 HA LEU 6 HA LEU 6 -1.785 -11.841 -19.173 38 1HB LEU 6 1HB LEU 6 -3.654 -13.427 -20.844 39 2HB LEU 6 2HB LEU 6 -4.175 -11.846 -20.286 40 HG LEU 6 HG LEU 6 -2.021 -10.981 -21.143 41 1HD1 LEU 6 1HD1 LEU 6 -0.636 -12.724 -21.422 42 2HD1 LEU 6 2HD1 LEU 6 -0.903 -12.029 -23.008 43 3HD1 LEU 6 3HD1 LEU 6 -1.701 -13.550 -22.565 44 1HD2 LEU 6 1HD2 LEU 6 -2.792 -10.736 -23.475 45 2HD2 LEU 6 2HD2 LEU 6 -4.036 -10.422 -22.266 46 3HD2 LEU 6 3HD2 LEU 6 -4.028 -11.954 -23.147 47 H GLU 7 H GLU 7 -4.712 -11.413 -18.628 48 HA GLU 7 HA GLU 7 -4.172 -11.229 -15.866 49 1HB GLU 7 1HB GLU 7 -5.233 -9.432 -17.204 50 2HB GLU 7 2HB GLU 7 -6.644 -10.454 -17.432 51 1HG GLU 7 1HG GLU 7 -7.003 -10.532 -15.076 52 2HG GLU 7 2HG GLU 7 -5.586 -9.528 -14.797 53 H TYR 8 H TYR 8 -5.324 -13.542 -17.786 54 HA TYR 8 HA TYR 8 -6.515 -15.183 -17.867 55 1HB TYR 8 1HB TYR 8 -6.321 -16.874 -16.007 56 2HB TYR 8 2HB TYR 8 -4.855 -16.184 -16.674 57 HD1 TYR 8 HD1 TYR 8 -7.148 -16.007 -13.746 58 HD2 TYR 8 HD2 TYR 8 -3.264 -15.126 -15.236 59 HE1 TYR 8 HE1 TYR 8 -6.416 -15.423 -11.476 60 HE2 TYR 8 HE2 TYR 8 -2.522 -14.536 -12.969 61 HH TYR 8 HH TYR 8 -3.477 -13.812 -10.874 62 H GLN 9 H GLN 9 -8.239 -12.931 -17.086 63 HA GLN 9 HA GLN 9 -10.500 -14.378 -16.505 64 1HB GLN 9 1HB GLN 9 -9.847 -13.843 -14.230 65 2HB GLN 9 2HB GLN 9 -9.436 -12.194 -14.702 66 1HG GLN 9 1HG GLN 9 -11.629 -11.746 -15.278 67 2HG GLN 9 2HG GLN 9 -12.154 -13.390 -14.920 68 1HE2 GLN 9 1HE2 GLN 9 -11.238 -10.322 -13.563 69 2HE2 GLN 9 2HE2 GLN 9 -11.727 -10.646 -11.949 70 H CYS 10 H CYS 10 -11.643 -13.641 -18.070 71 HA CYS 10 HA CYS 10 -11.437 -10.850 -18.752 72 1HB CYS 10 1HB CYS 10 -11.531 -13.274 -20.506 73 2HB CYS 10 2HB CYS 10 -11.870 -11.630 -21.137 74 H ASP 11 H ASP 11 -13.577 -10.431 -20.158 75 HA ASP 11 HA ASP 11 -15.636 -10.636 -18.330 76 1HB ASP 11 1HB ASP 11 -15.602 -8.907 -20.030 77 2HB ASP 11 2HB ASP 11 -15.906 -10.107 -21.282 78 H GLU 12 H GLU 12 -15.179 -12.733 -21.159 79 HA GLU 12 HA GLU 12 -17.524 -14.305 -20.196 80 1HB GLU 12 1HB GLU 12 -16.393 -14.371 -22.947 81 2HB GLU 12 2HB GLU 12 -17.989 -14.886 -22.413 82 1HG GLU 12 1HG GLU 12 -18.531 -12.547 -21.937 83 2HG GLU 12 2HG GLU 12 -16.920 -12.129 -22.529 84 H LYS 13 H LYS 13 -14.207 -14.389 -20.409 85 HA LYS 13 HA LYS 13 -14.080 -17.303 -20.633 86 1HB LYS 13 1HB LYS 13 -12.592 -15.353 -22.392 87 2HB LYS 13 2HB LYS 13 -12.263 -17.077 -22.316 88 1HG LYS 13 1HG LYS 13 -15.019 -16.199 -22.955 89 2HG LYS 13 2HG LYS 13 -13.782 -16.022 -24.199 90 1HD LYS 13 1HD LYS 13 -13.545 -18.253 -24.472 91 2HD LYS 13 2HD LYS 13 -13.913 -18.627 -22.781 92 1HE LYS 13 1HE LYS 13 -15.997 -17.627 -24.688 93 2HE LYS 13 2HE LYS 13 -15.569 -19.339 -24.590 94 1HZ LYS 13 1HZ LYS 13 -16.455 -17.730 -22.243 95 2HZ LYS 13 2HZ LYS 13 -16.184 -19.394 -22.338 96 3HZ LYS 13 3HZ LYS 13 -17.477 -18.695 -23.180 97 HA PRO 14 HA PRO 14 -10.667 -16.056 -18.100 98 1HB PRO 14 1HB PRO 14 -9.637 -18.579 -17.510 99 2HB PRO 14 2HB PRO 14 -10.983 -17.831 -16.654 100 1HG PRO 14 1HG PRO 14 -11.029 -20.084 -18.492 101 2HG PRO 14 2HG PRO 14 -12.334 -19.468 -17.472 102 1HD PRO 14 1HD PRO 14 -11.872 -19.046 -20.329 103 2HD PRO 14 2HD PRO 14 -13.309 -18.676 -19.357 104 H LEU 15 H LEU 15 -8.496 -15.422 -18.910 105 HA LEU 15 HA LEU 15 -7.762 -16.852 -21.329 106 1HB LEU 15 1HB LEU 15 -8.447 -14.504 -21.691 107 2HB LEU 15 2HB LEU 15 -7.194 -14.046 -20.539 108 HG LEU 15 HG LEU 15 -5.444 -14.801 -22.021 109 1HD1 LEU 15 1HD1 LEU 15 -6.566 -16.677 -23.067 110 2HD1 LEU 15 2HD1 LEU 15 -5.885 -15.601 -24.278 111 3HD1 LEU 15 3HD1 LEU 15 -7.618 -15.580 -23.963 112 1HD2 LEU 15 1HD2 LEU 15 -7.423 -13.048 -23.466 113 2HD2 LEU 15 2HD2 LEU 15 -5.708 -13.192 -23.845 114 3HD2 LEU 15 3HD2 LEU 15 -6.216 -12.520 -22.296 115 H THR 16 H THR 16 -6.507 -18.295 -20.269 116 HA THR 16 HA THR 16 -4.361 -17.020 -18.903 117 HB THR 16 HB THR 16 -4.769 -20.031 -18.912 118 HG1 THR 16 HG1 THR 16 -6.540 -18.338 -18.189 119 1HG2 THR 16 1HG2 THR 16 -3.668 -19.804 -16.706 120 2HG2 THR 16 2HG2 THR 16 -3.609 -18.049 -16.962 121 3HG2 THR 16 3HG2 THR 16 -2.665 -19.116 -17.996 122 H VAL 17 H VAL 17 -2.257 -17.224 -19.859 123 HA VAL 17 HA VAL 17 -2.263 -18.486 -22.502 124 HB VAL 17 HB VAL 17 -1.135 -15.758 -21.780 125 1HG1 VAL 17 1HG1 VAL 17 0.366 -16.865 -23.402 126 2HG1 VAL 17 2HG1 VAL 17 -0.530 -15.563 -24.173 127 3HG1 VAL 17 3HG1 VAL 17 -1.036 -17.236 -24.391 128 1HG2 VAL 17 1HG2 VAL 17 -2.756 -14.951 -23.478 129 2HG2 VAL 17 2HG2 VAL 17 -3.514 -15.695 -22.072 130 3HG2 VAL 17 3HG2 VAL 17 -3.395 -16.591 -23.584 131 H LYS 18 H LYS 18 -0.342 -19.387 -23.165 132 HA LYS 18 HA LYS 18 1.767 -19.389 -21.186 133 1HB LYS 18 1HB LYS 18 1.046 -21.438 -23.284 134 2HB LYS 18 2HB LYS 18 2.624 -21.413 -22.524 135 1HG LYS 18 1HG LYS 18 1.249 -23.075 -21.445 136 2HG LYS 18 2HG LYS 18 1.546 -21.737 -20.339 137 1HD LYS 18 1HD LYS 18 -0.614 -20.845 -20.751 138 2HD LYS 18 2HD LYS 18 -0.969 -22.093 -21.957 139 1HE LYS 18 1HE LYS 18 -0.469 -22.499 -19.002 140 2HE LYS 18 2HE LYS 18 -2.033 -22.607 -19.807 141 1HZ LYS 18 1HZ LYS 18 -1.106 -24.798 -19.430 142 2HZ LYS 18 2HZ LYS 18 0.284 -24.416 -20.281 143 3HZ LYS 18 3HZ LYS 18 -1.177 -24.510 -21.076 144 H LEU 19 H LEU 19 2.212 -17.298 -21.930 145 HA LEU 19 HA LEU 19 3.121 -16.907 -24.561 146 1HB LEU 19 1HB LEU 19 1.915 -15.430 -22.741 147 2HB LEU 19 2HB LEU 19 3.552 -15.229 -22.190 148 HG LEU 19 HG LEU 19 2.507 -14.588 -24.861 149 1HD1 LEU 19 1HD1 LEU 19 2.695 -12.183 -24.164 150 2HD1 LEU 19 2HD1 LEU 19 3.137 -12.748 -22.547 151 3HD1 LEU 19 3HD1 LEU 19 1.543 -13.117 -23.205 152 1HD2 LEU 19 1HD2 LEU 19 4.877 -15.019 -24.999 153 2HD2 LEU 19 2HD2 LEU 19 5.199 -13.906 -23.669 154 3HD2 LEU 19 3HD2 LEU 19 4.617 -13.287 -25.218 155 H ASN 20 H ASN 20 4.791 -18.071 -24.822 156 HA ASN 20 HA ASN 20 6.920 -18.260 -22.850 157 1HB ASN 20 1HB ASN 20 6.300 -20.175 -24.449 158 2HB ASN 20 2HB ASN 20 6.962 -19.169 -25.735 159 1HD2 ASN 20 1HD2 ASN 20 7.724 -21.828 -24.668 160 2HD2 ASN 20 2HD2 ASN 20 9.404 -21.721 -24.336 161 H ASN 21 H ASN 21 8.300 -16.585 -22.628 162 HA ASN 21 HA ASN 21 8.296 -14.463 -24.497 163 1HB ASN 21 1HB ASN 21 8.622 -14.086 -22.061 164 2HB ASN 21 2HB ASN 21 10.165 -14.910 -22.156 165 1HD2 ASN 21 1HD2 ASN 21 9.472 -12.195 -21.290 166 2HD2 ASN 21 2HD2 ASN 21 10.440 -11.116 -22.222 167 HA PRO 22 HA PRO 22 12.769 -15.840 -25.793 168 1HB PRO 22 1HB PRO 22 13.324 -18.481 -25.339 169 2HB PRO 22 2HB PRO 22 13.980 -17.132 -24.391 170 1HG PRO 22 1HG PRO 22 11.714 -18.958 -23.853 171 2HG PRO 22 2HG PRO 22 12.901 -18.259 -22.717 172 1HD PRO 22 1HD PRO 22 10.368 -17.352 -22.900 173 2HD PRO 22 2HD PRO 22 11.739 -16.275 -22.565 174 H ARG 23 H ARG 23 9.889 -17.620 -26.011 175 HA ARG 23 HA ARG 23 10.389 -18.241 -28.774 176 1HB ARG 23 1HB ARG 23 10.924 -20.370 -27.738 177 2HB ARG 23 2HB ARG 23 9.447 -20.298 -26.772 178 1HG ARG 23 1HG ARG 23 8.128 -20.409 -28.875 179 2HG ARG 23 2HG ARG 23 9.631 -20.621 -29.762 180 1HD ARG 23 1HD ARG 23 10.019 -22.735 -28.774 181 2HD ARG 23 2HD ARG 23 8.773 -22.458 -27.546 182 HE ARG 23 HE ARG 23 7.554 -22.244 -30.014 183 1HH1 ARG 23 1HH1 ARG 23 9.282 -24.854 -28.393 184 2HH1 ARG 23 2HH1 ARG 23 8.202 -26.066 -28.905 185 1HH2 ARG 23 1HH2 ARG 23 6.055 -23.820 -30.631 186 2HH2 ARG 23 2HH2 ARG 23 6.299 -25.470 -30.249 187 H GLN 24 H GLN 24 9.272 -16.476 -28.582 188 HA GLN 24 HA GLN 24 6.863 -15.565 -27.890 189 1HB GLN 24 1HB GLN 24 6.822 -14.186 -29.991 190 2HB GLN 24 2HB GLN 24 8.298 -14.114 -29.040 191 1HG GLN 24 1HG GLN 24 9.291 -15.794 -30.609 192 2HG GLN 24 2HG GLN 24 7.836 -15.640 -31.583 193 1HE2 GLN 24 1HE2 GLN 24 10.563 -15.084 -32.255 194 2HE2 GLN 24 2HE2 GLN 24 10.648 -13.456 -32.788 195 H GLU 25 H GLU 25 6.245 -17.753 -28.031 196 HA GLU 25 HA GLU 25 3.884 -17.953 -29.827 197 1HB GLU 25 1HB GLU 25 5.702 -20.086 -28.834 198 2HB GLU 25 2HB GLU 25 3.993 -20.474 -28.976 199 1HG GLU 25 1HG GLU 25 3.966 -20.078 -31.236 200 2HG GLU 25 2HG GLU 25 5.553 -19.285 -31.242 201 H VAL 26 H VAL 26 1.985 -18.544 -28.962 202 HA VAL 26 HA VAL 26 1.747 -18.569 -26.000 203 HB VAL 26 HB VAL 26 -0.317 -17.298 -26.168 204 1HG1 VAL 26 1HG1 VAL 26 0.631 -15.076 -26.651 205 2HG1 VAL 26 2HG1 VAL 26 2.056 -15.870 -27.339 206 3HG1 VAL 26 3HG1 VAL 26 1.644 -16.096 -25.634 207 1HG2 VAL 26 1HG2 VAL 26 0.387 -16.894 -29.060 208 2HG2 VAL 26 2HG2 VAL 26 -0.896 -16.039 -28.202 209 3HG2 VAL 26 3HG2 VAL 26 -0.998 -17.786 -28.430 210 H SER 27 H SER 27 0.770 -20.193 -25.268 211 HA SER 27 HA SER 27 -1.238 -21.450 -26.972 212 1HB SER 27 1HB SER 27 0.131 -22.653 -24.536 213 2HB SER 27 2HB SER 27 -1.022 -23.431 -25.621 214 HG SER 27 HG SER 27 1.129 -22.335 -26.903 215 H PHE 28 H PHE 28 -3.219 -20.981 -26.401 216 HA PHE 28 HA PHE 28 -3.562 -19.873 -23.717 217 1HB PHE 28 1HB PHE 28 -4.802 -18.058 -24.466 218 2HB PHE 28 2HB PHE 28 -3.533 -18.183 -25.673 219 HD1 PHE 28 HD1 PHE 28 -4.256 -19.733 -27.785 220 HD2 PHE 28 HD2 PHE 28 -6.947 -17.706 -25.191 221 HE1 PHE 28 HE1 PHE 28 -6.010 -19.814 -29.523 222 HE2 PHE 28 HE2 PHE 28 -8.689 -17.788 -26.917 223 HZ PHE 28 HZ PHE 28 -8.220 -18.845 -29.087 224 H VAL 29 H VAL 29 -5.627 -20.019 -22.953 225 HA VAL 29 HA VAL 29 -6.921 -22.397 -23.881 226 HB VAL 29 HB VAL 29 -6.279 -22.320 -21.489 227 1HG1 VAL 29 1HG1 VAL 29 -8.263 -20.104 -21.197 228 2HG1 VAL 29 2HG1 VAL 29 -6.513 -20.025 -20.971 229 3HG1 VAL 29 3HG1 VAL 29 -7.502 -20.988 -19.872 230 1HG2 VAL 29 1HG2 VAL 29 -9.245 -22.497 -21.973 231 2HG2 VAL 29 2HG2 VAL 29 -8.396 -23.116 -20.549 232 3HG2 VAL 29 3HG2 VAL 29 -8.047 -23.785 -22.141 233 H TYR 30 H TYR 30 -8.354 -22.245 -25.075 234 HA TYR 30 HA TYR 30 -9.783 -20.113 -26.221 235 1HB TYR 30 1HB TYR 30 -9.631 -22.435 -27.120 236 2HB TYR 30 2HB TYR 30 -10.653 -22.988 -25.817 237 HD1 TYR 30 HD1 TYR 30 -10.568 -22.147 -29.186 238 HD2 TYR 30 HD2 TYR 30 -13.068 -21.736 -25.778 239 HE1 TYR 30 HE1 TYR 30 -12.521 -21.902 -30.641 240 HE2 TYR 30 HE2 TYR 30 -15.026 -21.480 -27.232 241 HH TYR 30 HH TYR 30 -14.869 -22.169 -30.575 242 H ASP 31 H ASP 31 -10.683 -22.434 -23.848 243 HA ASP 31 HA ASP 31 -12.119 -20.794 -22.121 244 1HB ASP 31 1HB ASP 31 -13.834 -20.766 -23.890 245 2HB ASP 31 2HB ASP 31 -13.773 -22.518 -23.995 246 H ASN 32 H ASN 32 -12.097 -24.024 -23.593 247 HA ASN 32 HA ASN 32 -11.371 -25.140 -20.984 248 1HB ASN 32 1HB ASN 32 -13.845 -25.344 -21.383 249 2HB ASN 32 2HB ASN 32 -13.503 -26.279 -22.824 250 1HD2 ASN 32 1HD2 ASN 32 -13.492 -26.268 -19.335 251 2HD2 ASN 32 2HD2 ASN 32 -13.356 -27.970 -19.136 252 H GLN 33 H GLN 33 -9.981 -24.599 -23.809 253 HA GLN 33 HA GLN 33 -8.582 -27.065 -23.899 254 1HB GLN 33 1HB GLN 33 -8.905 -27.439 -26.270 255 2HB GLN 33 2HB GLN 33 -10.471 -27.478 -25.474 256 1HG GLN 33 1HG GLN 33 -10.866 -25.175 -26.190 257 2HG GLN 33 2HG GLN 33 -9.294 -25.209 -26.988 258 1HE2 GLN 33 1HE2 GLN 33 -10.293 -24.780 -29.024 259 2HE2 GLN 33 2HE2 GLN 33 -11.152 -26.011 -29.863 260 H LEU 34 H LEU 34 -6.719 -26.772 -25.195 261 HA LEU 34 HA LEU 34 -5.975 -23.999 -24.981 262 1HB LEU 34 1HB LEU 34 -4.426 -26.546 -24.692 263 2HB LEU 34 2HB LEU 34 -3.580 -25.039 -24.990 264 HG LEU 34 HG LEU 34 -3.465 -25.677 -22.648 265 1HD1 LEU 34 1HD1 LEU 34 -5.189 -23.285 -23.047 266 2HD1 LEU 34 2HD1 LEU 34 -3.429 -23.364 -23.082 267 3HD1 LEU 34 3HD1 LEU 34 -4.297 -23.677 -21.578 268 1HD2 LEU 34 1HD2 LEU 34 -5.443 -25.752 -21.197 269 2HD2 LEU 34 2HD2 LEU 34 -5.490 -27.008 -22.434 270 3HD2 LEU 34 3HD2 LEU 34 -6.478 -25.560 -22.613 271 H LEU 35 H LEU 35 -5.226 -23.000 -26.811 272 HA LEU 35 HA LEU 35 -4.529 -24.640 -29.160 273 1HB LEU 35 1HB LEU 35 -5.767 -21.891 -29.113 274 2HB LEU 35 2HB LEU 35 -5.139 -22.666 -30.542 275 HG LEU 35 HG LEU 35 -7.375 -22.792 -30.680 276 1HD1 LEU 35 1HD1 LEU 35 -6.490 -25.480 -29.663 277 2HD1 LEU 35 2HD1 LEU 35 -6.388 -24.880 -31.316 278 3HD1 LEU 35 3HD1 LEU 35 -7.963 -25.197 -30.590 279 1HD2 LEU 35 1HD2 LEU 35 -8.053 -22.216 -28.473 280 2HD2 LEU 35 2HD2 LEU 35 -7.543 -23.788 -27.854 281 3HD2 LEU 35 3HD2 LEU 35 -8.915 -23.674 -28.962 282 H HIS 36 H HIS 36 -3.163 -23.155 -30.649 283 HA HIS 36 HA HIS 36 -1.362 -21.582 -29.030 284 1HB HIS 36 1HB HIS 36 0.677 -22.773 -29.799 285 2HB HIS 36 2HB HIS 36 -0.373 -23.707 -28.749 286 HD2 HIS 36 HD2 HIS 36 -2.203 -24.479 -31.694 287 HE1 HIS 36 HE1 HIS 36 1.218 -26.916 -32.079 288 HE2 HIS 36 HE2 HIS 36 -1.252 -26.721 -32.515 289 H LEU 37 H LEU 37 -0.344 -20.026 -29.912 290 HA LEU 37 HA LEU 37 -0.531 -19.543 -32.849 291 1HB LEU 37 1HB LEU 37 -1.052 -17.517 -30.700 292 2HB LEU 37 2HB LEU 37 -1.042 -17.231 -32.412 293 HG LEU 37 HG LEU 37 -3.214 -17.137 -31.825 294 1HD1 LEU 37 1HD1 LEU 37 -4.377 -19.046 -32.820 295 2HD1 LEU 37 2HD1 LEU 37 -2.867 -19.953 -32.777 296 3HD1 LEU 37 3HD1 LEU 37 -2.993 -18.503 -33.774 297 1HD2 LEU 37 1HD2 LEU 37 -2.867 -19.579 -30.104 298 2HD2 LEU 37 2HD2 LEU 37 -4.407 -18.764 -30.384 299 3HD2 LEU 37 3HD2 LEU 37 -3.092 -17.925 -29.560 300 H LYS 38 H LYS 38 0.842 -17.726 -33.421 301 HA LYS 38 HA LYS 38 3.171 -17.467 -31.696 302 1HB LYS 38 1HB LYS 38 4.623 -17.893 -33.603 303 2HB LYS 38 2HB LYS 38 3.609 -19.287 -33.206 304 1HG LYS 38 1HG LYS 38 2.210 -18.918 -35.059 305 2HG LYS 38 2HG LYS 38 2.927 -17.335 -35.371 306 1HD LYS 38 1HD LYS 38 5.006 -18.350 -35.761 307 2HD LYS 38 2HD LYS 38 4.339 -19.976 -35.538 308 1HE LYS 38 1HE LYS 38 2.745 -19.532 -37.415 309 2HE LYS 38 2HE LYS 38 3.522 -17.973 -37.670 310 1HZ LYS 38 1HZ LYS 38 4.329 -19.577 -39.230 311 2HZ LYS 38 2HZ LYS 38 4.768 -20.645 -38.033 312 3HZ LYS 38 3HZ LYS 38 5.598 -19.185 -38.204 313 H GLN 39 H GLN 39 4.355 -15.663 -32.193 314 HA GLN 39 HA GLN 39 2.782 -13.503 -33.466 315 1HB GLN 39 1HB GLN 39 3.790 -13.104 -31.296 316 2HB GLN 39 2HB GLN 39 5.396 -13.360 -32.017 317 1HG GLN 39 1HG GLN 39 4.991 -11.416 -33.477 318 2HG GLN 39 2HG GLN 39 3.438 -11.168 -32.687 319 1HE2 GLN 39 1HE2 GLN 39 4.094 -9.101 -32.045 320 2HE2 GLN 39 2HE2 GLN 39 5.169 -8.869 -30.723 321 H GLY 40 H GLY 40 2.911 -13.734 -35.445 322 1HA GLY 40 1HA GLY 40 5.567 -13.950 -36.740 323 2HA GLY 40 2HA GLY 40 4.100 -14.616 -37.449 324 H ILE 41 H ILE 41 2.316 -12.752 -37.459 325 HA ILE 41 HA ILE 41 3.567 -10.484 -38.842 326 HB ILE 41 HB ILE 41 0.909 -11.805 -39.443 327 1HG1 ILE 41 1HG1 ILE 41 3.419 -11.811 -41.130 328 2HG1 ILE 41 2HG1 ILE 41 2.973 -13.134 -40.063 329 1HG2 ILE 41 1HG2 ILE 41 0.965 -9.393 -39.866 330 2HG2 ILE 41 2HG2 ILE 41 0.858 -10.293 -41.384 331 3HG2 ILE 41 3HG2 ILE 41 2.397 -9.591 -40.871 332 1HD1 ILE 41 1HD1 ILE 41 1.375 -12.140 -42.407 333 2HD1 ILE 41 2HD1 ILE 41 0.937 -13.467 -41.321 334 3HD1 ILE 41 3HD1 ILE 41 2.364 -13.605 -42.347 335 H SER 42 H SER 42 3.199 -8.694 -37.716 336 HA SER 42 HA SER 42 0.742 -8.538 -36.154 337 1HB SER 42 1HB SER 42 3.460 -7.410 -35.633 338 2HB SER 42 2HB SER 42 2.031 -7.050 -34.649 339 HG SER 42 HG SER 42 3.509 -9.413 -34.924 340 H ALA 43 H ALA 43 -0.586 -7.380 -37.441 341 HA ALA 43 HA ALA 43 0.339 -5.301 -38.972 342 1HB ALA 43 1HB ALA 43 -2.011 -4.958 -39.612 343 2HB ALA 43 2HB ALA 43 -2.487 -6.117 -38.367 344 3HB ALA 43 3HB ALA 43 -1.497 -6.639 -39.728 345 H SER 44 H SER 44 -2.391 -5.135 -36.660 346 HA SER 44 HA SER 44 -1.718 -2.406 -36.053 347 1HB SER 44 1HB SER 44 -4.076 -2.618 -35.066 348 2HB SER 44 2HB SER 44 -3.895 -2.693 -36.827 349 HG SER 44 HG SER 44 -5.201 -4.378 -35.646 350 H GLY 45 H GLY 45 -0.237 -4.718 -34.784 351 1HA GLY 45 1HA GLY 45 -0.070 -3.865 -32.155 352 2HA GLY 45 2HA GLY 45 -1.292 -5.136 -32.177 353 H ALA 46 H ALA 46 -0.576 -6.985 -31.606 354 HA ALA 46 HA ALA 46 1.942 -7.934 -32.587 355 1HB ALA 46 1HB ALA 46 2.181 -8.922 -30.277 356 2HB ALA 46 2HB ALA 46 0.890 -7.799 -29.776 357 3HB ALA 46 3HB ALA 46 2.426 -7.172 -30.363 358 H ARG 47 H ARG 47 1.309 -9.741 -33.609 359 HA ARG 47 HA ARG 47 -1.232 -10.580 -32.692 360 1HB ARG 47 1HB ARG 47 -0.219 -10.544 -35.496 361 2HB ARG 47 2HB ARG 47 -1.566 -11.556 -35.032 362 1HG ARG 47 1HG ARG 47 -2.807 -9.578 -34.319 363 2HG ARG 47 2HG ARG 47 -1.439 -8.563 -34.791 364 1HD ARG 47 1HD ARG 47 -3.225 -8.697 -36.501 365 2HD ARG 47 2HD ARG 47 -1.650 -9.240 -37.087 366 HE ARG 47 HE ARG 47 -3.219 -11.378 -36.058 367 1HH1 ARG 47 1HH1 ARG 47 -2.841 -9.378 -38.995 368 2HH1 ARG 47 2HH1 ARG 47 -3.404 -10.555 -40.043 369 1HH2 ARG 47 1HH2 ARG 47 -3.974 -13.005 -37.528 370 2HH2 ARG 47 2HH2 ARG 47 -4.098 -12.684 -39.190 371 H TYR 48 H TYR 48 -1.187 -12.516 -31.877 372 HA TYR 48 HA TYR 48 0.845 -14.405 -32.704 373 1HB TYR 48 1HB TYR 48 -1.044 -14.381 -30.318 374 2HB TYR 48 2HB TYR 48 0.123 -15.646 -30.701 375 HD1 TYR 48 HD1 TYR 48 -0.211 -12.116 -29.586 376 HD2 TYR 48 HD2 TYR 48 2.418 -15.430 -30.090 377 HE1 TYR 48 HE1 TYR 48 1.489 -10.965 -28.233 378 HE2 TYR 48 HE2 TYR 48 4.125 -14.284 -28.740 379 HH TYR 48 HH TYR 48 3.490 -11.500 -26.858 380 H THR 49 H THR 49 0.164 -15.523 -34.335 381 HA THR 49 HA THR 49 -2.499 -16.496 -34.423 382 HB THR 49 HB THR 49 -1.558 -14.482 -36.510 383 HG1 THR 49 HG1 THR 49 -2.764 -14.112 -34.256 384 1HG2 THR 49 1HG2 THR 49 -4.205 -15.965 -36.393 385 2HG2 THR 49 2HG2 THR 49 -2.885 -16.407 -37.439 386 3HG2 THR 49 3HG2 THR 49 -3.681 -14.843 -37.661 387 H ASP 50 H ASP 50 -2.596 -18.117 -36.070 388 HA ASP 50 HA ASP 50 -0.311 -18.512 -37.800 389 1HB ASP 50 1HB ASP 50 0.150 -19.973 -35.858 390 2HB ASP 50 2HB ASP 50 -1.454 -20.682 -35.993 391 H GLY 51 H GLY 51 -3.034 -20.481 -36.935 392 1HA GLY 51 1HA GLY 51 -4.575 -19.526 -39.240 393 2HA GLY 51 2HA GLY 51 -4.109 -21.217 -39.269 394 H ILE 52 H ILE 52 -4.562 -20.588 -36.081 395 HA ILE 52 HA ILE 52 -7.066 -21.998 -36.148 396 HB ILE 52 HB ILE 52 -5.509 -21.061 -33.707 397 1HG1 ILE 52 1HG1 ILE 52 -5.277 -23.698 -35.189 398 2HG1 ILE 52 2HG1 ILE 52 -4.063 -22.429 -35.188 399 1HG2 ILE 52 1HG2 ILE 52 -7.811 -21.763 -33.278 400 2HG2 ILE 52 2HG2 ILE 52 -6.668 -22.939 -32.619 401 3HG2 ILE 52 3HG2 ILE 52 -7.516 -23.282 -34.122 402 1HD1 ILE 52 1HD1 ILE 52 -3.459 -24.229 -33.677 403 2HD1 ILE 52 2HD1 ILE 52 -4.970 -24.016 -32.794 404 3HD1 ILE 52 3HD1 ILE 52 -3.753 -22.738 -32.782 405 H TYR 53 H TYR 53 -5.902 -19.140 -34.368 406 HA TYR 53 HA TYR 53 -8.313 -17.601 -35.036 407 1HB TYR 53 1HB TYR 53 -7.297 -18.034 -32.209 408 2HB TYR 53 2HB TYR 53 -8.486 -16.846 -32.772 409 HD1 TYR 53 HD1 TYR 53 -10.600 -17.667 -33.803 410 HD2 TYR 53 HD2 TYR 53 -8.016 -20.257 -31.671 411 HE1 TYR 53 HE1 TYR 53 -12.384 -19.328 -33.686 412 HE2 TYR 53 HE2 TYR 53 -9.809 -21.937 -31.540 413 HH TYR 53 HH TYR 53 -12.628 -21.666 -33.464 414 H VAL 54 H VAL 54 -7.903 -15.408 -34.169 415 HA VAL 54 HA VAL 54 -5.130 -14.714 -34.736 416 HB VAL 54 HB VAL 54 -7.743 -13.379 -35.176 417 1HG1 VAL 54 1HG1 VAL 54 -4.941 -12.243 -35.702 418 2HG1 VAL 54 2HG1 VAL 54 -6.074 -11.641 -34.491 419 3HG1 VAL 54 3HG1 VAL 54 -6.435 -11.453 -36.208 420 1HG2 VAL 54 1HG2 VAL 54 -7.216 -14.992 -36.863 421 2HG2 VAL 54 2HG2 VAL 54 -5.621 -14.281 -37.116 422 3HG2 VAL 54 3HG2 VAL 54 -7.064 -13.386 -37.575 423 H PHE 55 H PHE 55 -4.273 -14.551 -32.715 424 HA PHE 55 HA PHE 55 -5.803 -13.218 -30.641 425 1HB PHE 55 1HB PHE 55 -4.541 -15.299 -30.090 426 2HB PHE 55 2HB PHE 55 -3.052 -14.511 -30.571 427 HD1 PHE 55 HD1 PHE 55 -2.112 -12.702 -29.155 428 HD2 PHE 55 HD2 PHE 55 -5.515 -14.948 -27.962 429 HE1 PHE 55 HE1 PHE 55 -1.779 -11.954 -26.831 430 HE2 PHE 55 HE2 PHE 55 -5.203 -14.197 -25.646 431 HZ PHE 55 HZ PHE 55 -3.331 -12.700 -25.075 432 H TRP 56 H TRP 56 -5.795 -11.085 -30.870 433 HA TRP 56 HA TRP 56 -3.385 -9.836 -31.787 434 1HB TRP 56 1HB TRP 56 -5.121 -9.406 -33.293 435 2HB TRP 56 2HB TRP 56 -6.277 -9.074 -32.002 436 HD1 TRP 56 HD1 TRP 56 -2.815 -7.491 -32.881 437 HE1 TRP 56 HE1 TRP 56 -3.136 -4.924 -32.884 438 HE3 TRP 56 HE3 TRP 56 -7.794 -7.273 -31.845 439 HZ2 TRP 56 HZ2 TRP 56 -5.213 -3.083 -32.569 440 HZ3 TRP 56 HZ3 TRP 56 -8.889 -5.075 -31.725 441 HH2 TRP 56 HH2 TRP 56 -7.624 -3.020 -32.081 442 H SER 57 H SER 57 -2.394 -8.879 -30.512 443 HA SER 57 HA SER 57 -3.463 -7.990 -27.930 444 1HB SER 57 1HB SER 57 -1.640 -9.692 -27.843 445 2HB SER 57 2HB SER 57 -0.604 -8.611 -28.758 446 HG SER 57 HG SER 57 -0.370 -8.602 -26.382 447 H LYS 58 H LYS 58 -3.942 -5.878 -28.079 448 HA LYS 58 HA LYS 58 -2.542 -4.231 -29.989 449 1HB LYS 58 1HB LYS 58 -4.950 -4.155 -29.833 450 2HB LYS 58 2HB LYS 58 -4.846 -3.742 -28.135 451 1HG LYS 58 1HG LYS 58 -3.965 -1.587 -28.655 452 2HG LYS 58 2HG LYS 58 -3.844 -2.005 -30.373 453 1HD LYS 58 1HD LYS 58 -6.178 -2.294 -30.535 454 2HD LYS 58 2HD LYS 58 -6.385 -2.074 -28.800 455 1HE LYS 58 1HE LYS 58 -5.387 0.030 -30.733 456 2HE LYS 58 2HE LYS 58 -7.018 -0.040 -30.081 457 1HZ LYS 58 1HZ LYS 58 -6.046 0.180 -27.846 458 2HZ LYS 58 2HZ LYS 58 -5.741 1.521 -28.831 459 3HZ LYS 58 3HZ LYS 58 -4.516 0.408 -28.544 460 H GLY 59 H GLY 59 -2.673 -4.792 -26.581 461 1HA GLY 59 1HA GLY 59 -0.300 -3.713 -25.868 462 2HA GLY 59 2HA GLY 59 -1.397 -2.331 -25.820 463 H ASP 60 H ASP 60 -3.192 -2.397 -24.424 464 HA ASP 60 HA ASP 60 -2.738 -4.045 -22.030 465 1HB ASP 60 1HB ASP 60 -4.687 -1.774 -22.505 466 2HB ASP 60 2HB ASP 60 -4.557 -2.676 -21.010 467 H GLU 61 H GLU 61 -4.407 -4.173 -24.860 468 HA GLU 61 HA GLU 61 -6.575 -5.636 -23.638 469 1HB GLU 61 1HB GLU 61 -8.091 -4.703 -25.294 470 2HB GLU 61 2HB GLU 61 -7.387 -3.438 -24.290 471 1HG GLU 61 1HG GLU 61 -5.700 -3.183 -26.178 472 2HG GLU 61 2HG GLU 61 -6.834 -4.125 -27.133 473 H ALA 62 H ALA 62 -7.365 -7.314 -24.885 474 HA ALA 62 HA ALA 62 -5.706 -8.049 -27.080 475 1HB ALA 62 1HB ALA 62 -4.766 -9.174 -25.152 476 2HB ALA 62 2HB ALA 62 -5.603 -10.365 -26.160 477 3HB ALA 62 3HB ALA 62 -6.370 -9.747 -24.692 478 H THR 63 H THR 63 -6.904 -9.091 -28.555 479 HA THR 63 HA THR 63 -9.552 -10.136 -27.922 480 HB THR 63 HB THR 63 -9.076 -8.091 -30.118 481 HG1 THR 63 HG1 THR 63 -9.707 -7.896 -27.539 482 1HG2 THR 63 1HG2 THR 63 -10.723 -9.704 -30.844 483 2HG2 THR 63 2HG2 THR 63 -11.563 -8.216 -30.393 484 3HG2 THR 63 3HG2 THR 63 -11.567 -9.606 -29.310 485 H VAL 64 H VAL 64 -10.225 -11.807 -29.280 486 HA VAL 64 HA VAL 64 -8.164 -12.838 -31.145 487 HB VAL 64 HB VAL 64 -10.066 -14.465 -29.476 488 1HG1 VAL 64 1HG1 VAL 64 -8.570 -16.308 -30.008 489 2HG1 VAL 64 2HG1 VAL 64 -7.670 -15.237 -31.106 490 3HG1 VAL 64 3HG1 VAL 64 -9.386 -15.595 -31.385 491 1HG2 VAL 64 1HG2 VAL 64 -8.190 -15.059 -28.025 492 2HG2 VAL 64 2HG2 VAL 64 -8.589 -13.343 -27.936 493 3HG2 VAL 64 3HG2 VAL 64 -7.174 -13.873 -28.855 494 H TYR 65 H TYR 65 -8.902 -12.722 -33.140 495 HA TYR 65 HA TYR 65 -11.846 -13.047 -33.670 496 1HB TYR 65 1HB TYR 65 -9.784 -11.516 -35.190 497 2HB TYR 65 2HB TYR 65 -11.456 -11.684 -35.677 498 HD1 TYR 65 HD1 TYR 65 -13.173 -10.400 -34.239 499 HD2 TYR 65 HD2 TYR 65 -8.976 -9.808 -33.945 500 HE1 TYR 65 HE1 TYR 65 -13.559 -8.156 -33.306 501 HE2 TYR 65 HE2 TYR 65 -9.352 -7.573 -33.003 502 HH TYR 65 HH TYR 65 -12.419 -6.565 -31.954 503 H LYS 66 H LYS 66 -11.631 -15.513 -34.469 504 HA LYS 66 HA LYS 66 -10.382 -15.483 -37.014 505 1HB LYS 66 1HB LYS 66 -10.503 -17.673 -35.793 506 2HB LYS 66 2HB LYS 66 -12.244 -17.425 -35.595 507 1HG LYS 66 1HG LYS 66 -11.699 -19.111 -37.303 508 2HG LYS 66 2HG LYS 66 -12.624 -17.741 -37.911 509 1HD LYS 66 1HD LYS 66 -10.991 -18.241 -39.557 510 2HD LYS 66 2HD LYS 66 -10.442 -16.780 -38.756 511 1HE LYS 66 1HE LYS 66 -8.547 -18.199 -39.099 512 2HE LYS 66 2HE LYS 66 -8.916 -18.206 -37.378 513 1HZ LYS 66 1HZ LYS 66 -8.394 -20.411 -38.322 514 2HZ LYS 66 2HZ LYS 66 -9.789 -20.342 -39.259 515 3HZ LYS 66 3HZ LYS 66 -9.891 -20.363 -37.574 516 H ARG 67 H ARG 67 -11.723 -15.436 -38.731 517 HA ARG 67 HA ARG 67 -13.444 -13.359 -39.017 518 1HB ARG 67 1HB ARG 67 -12.338 -14.547 -40.878 519 2HB ARG 67 2HB ARG 67 -13.437 -15.889 -40.685 520 1HG ARG 67 1HG ARG 67 -14.385 -13.126 -41.407 521 2HG ARG 67 2HG ARG 67 -13.856 -14.294 -42.622 522 1HD ARG 67 1HD ARG 67 -15.576 -15.829 -41.910 523 2HD ARG 67 2HD ARG 67 -16.030 -14.738 -40.607 524 HE ARG 67 HE ARG 67 -16.264 -13.932 -43.434 525 1HH1 ARG 67 1HH1 ARG 67 -17.768 -14.293 -40.226 526 2HH1 ARG 67 2HH1 ARG 67 -19.243 -13.597 -40.692 527 1HH2 ARG 67 1HH2 ARG 67 -18.252 -12.987 -44.041 528 2HH2 ARG 67 2HH2 ARG 67 -19.556 -12.850 -42.935 529 H ASP 68 H ASP 68 -14.437 -16.652 -38.188 530 HA ASP 68 HA ASP 68 -17.190 -15.633 -37.953 531 1HB ASP 68 1HB ASP 68 -16.823 -17.425 -39.651 532 2HB ASP 68 2HB ASP 68 -16.281 -18.488 -38.366 533 H ARG 69 H ARG 69 -14.533 -16.189 -36.071 534 HA ARG 69 HA ARG 69 -16.213 -16.895 -33.906 535 1HB ARG 69 1HB ARG 69 -15.684 -19.077 -34.770 536 2HB ARG 69 2HB ARG 69 -13.969 -18.734 -34.665 537 1HG ARG 69 1HG ARG 69 -14.531 -20.142 -32.800 538 2HG ARG 69 2HG ARG 69 -14.250 -18.499 -32.206 539 1HD ARG 69 1HD ARG 69 -17.032 -19.456 -32.830 540 2HD ARG 69 2HD ARG 69 -16.284 -19.808 -31.278 541 HE ARG 69 HE ARG 69 -16.012 -17.280 -31.153 542 1HH1 ARG 69 1HH1 ARG 69 -18.783 -18.754 -32.870 543 2HH1 ARG 69 2HH1 ARG 69 -19.823 -17.474 -32.447 544 1HH2 ARG 69 1HH2 ARG 69 -17.490 -15.572 -30.629 545 2HH2 ARG 69 2HH2 ARG 69 -19.096 -15.673 -31.179 546 H ILE 70 H ILE 70 -15.608 -14.859 -33.235 547 HA ILE 70 HA ILE 70 -13.036 -14.383 -32.004 548 HB ILE 70 HB ILE 70 -15.744 -13.321 -31.337 549 1HG1 ILE 70 1HG1 ILE 70 -13.679 -12.040 -33.030 550 2HG1 ILE 70 2HG1 ILE 70 -15.092 -12.877 -33.698 551 1HG2 ILE 70 1HG2 ILE 70 -14.180 -12.912 -29.545 552 2HG2 ILE 70 2HG2 ILE 70 -14.542 -11.383 -30.351 553 3HG2 ILE 70 3HG2 ILE 70 -13.020 -12.209 -30.677 554 1HD1 ILE 70 1HD1 ILE 70 -15.075 -10.361 -32.012 555 2HD1 ILE 70 2HD1 ILE 70 -16.532 -11.192 -32.551 556 3HD1 ILE 70 3HD1 ILE 70 -15.447 -10.460 -33.732 557 H VAL 71 H VAL 71 -12.475 -15.086 -30.305 558 HA VAL 71 HA VAL 71 -14.365 -16.671 -28.745 559 HB VAL 71 HB VAL 71 -12.493 -17.986 -27.752 560 1HG1 VAL 71 1HG1 VAL 71 -13.758 -18.814 -29.648 561 2HG1 VAL 71 2HG1 VAL 71 -12.064 -19.290 -29.787 562 3HG1 VAL 71 3HG1 VAL 71 -12.690 -17.951 -30.751 563 1HG2 VAL 71 1HG2 VAL 71 -10.850 -16.619 -29.862 564 2HG2 VAL 71 2HG2 VAL 71 -10.311 -17.922 -28.796 565 3HG2 VAL 71 3HG2 VAL 71 -10.693 -16.331 -28.135 566 H LEU 72 H LEU 72 -12.264 -14.051 -28.556 567 HA LEU 72 HA LEU 72 -13.322 -13.391 -25.954 568 1HB LEU 72 1HB LEU 72 -10.304 -13.616 -26.303 569 2HB LEU 72 2HB LEU 72 -11.085 -12.755 -25.000 570 HG LEU 72 HG LEU 72 -12.106 -15.067 -24.423 571 1HD1 LEU 72 1HD1 LEU 72 -10.600 -16.942 -24.877 572 2HD1 LEU 72 2HD1 LEU 72 -9.735 -15.930 -26.041 573 3HD1 LEU 72 3HD1 LEU 72 -11.440 -16.331 -26.295 574 1HD2 LEU 72 1HD2 LEU 72 -9.243 -14.371 -23.935 575 2HD2 LEU 72 2HD2 LEU 72 -10.147 -15.593 -23.043 576 3HD2 LEU 72 3HD2 LEU 72 -10.638 -13.900 -22.965 577 H ASN 73 H ASN 73 -13.495 -11.189 -25.709 578 HA ASN 73 HA ASN 73 -12.027 -9.455 -27.540 579 1HB ASN 73 1HB ASN 73 -13.967 -8.431 -28.533 580 2HB ASN 73 2HB ASN 73 -14.099 -10.168 -28.757 581 1HD2 ASN 73 1HD2 ASN 73 -16.220 -8.343 -28.927 582 2HD2 ASN 73 2HD2 ASN 73 -17.348 -8.714 -27.685 583 H ASN 74 H ASN 74 -12.359 -9.922 -24.652 584 HA ASN 74 HA ASN 74 -12.287 -7.188 -23.895 585 1HB ASN 74 1HB ASN 74 -14.725 -7.577 -23.652 586 2HB ASN 74 2HB ASN 74 -14.396 -8.973 -22.629 587 1HD2 ASN 74 1HD2 ASN 74 -14.411 -5.496 -22.807 588 2HD2 ASN 74 2HD2 ASN 74 -14.247 -5.227 -21.111 589 H CYS 75 H CYS 75 -10.221 -7.844 -23.628 590 HA CYS 75 HA CYS 75 -9.733 -9.118 -21.074 591 1HB CYS 75 1HB CYS 75 -8.341 -9.719 -23.680 592 2HB CYS 75 2HB CYS 75 -7.669 -10.132 -22.106 593 H GLN 76 H GLN 76 -8.229 -8.042 -19.921 594 HA GLN 76 HA GLN 76 -6.802 -5.970 -21.245 595 1HB GLN 76 1HB GLN 76 -8.719 -5.601 -18.944 596 2HB GLN 76 2HB GLN 76 -7.454 -4.435 -19.330 597 1HG GLN 76 1HG GLN 76 -8.362 -4.092 -21.520 598 2HG GLN 76 2HG GLN 76 -9.587 -5.323 -21.272 599 1HE2 GLN 76 1HE2 GLN 76 -11.199 -3.809 -21.683 600 2HE2 GLN 76 2HE2 GLN 76 -11.660 -2.615 -20.521 601 H LEU 77 H LEU 77 -4.932 -6.056 -20.672 602 HA LEU 77 HA LEU 77 -4.383 -8.190 -18.950 603 1HB LEU 77 1HB LEU 77 -3.425 -8.395 -21.007 604 2HB LEU 77 2HB LEU 77 -2.764 -6.778 -21.007 605 HG LEU 77 HG LEU 77 -1.022 -7.487 -19.422 606 1HD1 LEU 77 1HD1 LEU 77 -2.120 -9.063 -18.097 607 2HD1 LEU 77 2HD1 LEU 77 -0.834 -9.950 -18.923 608 3HD1 LEU 77 3HD1 LEU 77 -2.520 -10.066 -19.468 609 1HD2 LEU 77 1HD2 LEU 77 0.097 -9.169 -20.928 610 2HD2 LEU 77 2HD2 LEU 77 -0.471 -7.701 -21.712 611 3HD2 LEU 77 3HD2 LEU 77 -1.389 -9.189 -21.879 612 H GLN 78 H GLN 78 -3.446 -7.994 -16.915 613 HA GLN 78 HA GLN 78 -2.747 -5.494 -15.745 614 1HB GLN 78 1HB GLN 78 -2.206 -8.333 -14.861 615 2HB GLN 78 2HB GLN 78 -1.847 -6.916 -13.887 616 1HG GLN 78 1HG GLN 78 -4.584 -7.611 -14.897 617 2HG GLN 78 2HG GLN 78 -3.960 -8.071 -13.311 618 1HE2 GLN 78 1HE2 GLN 78 -6.146 -6.332 -14.192 619 2HE2 GLN 78 2HE2 GLN 78 -5.908 -4.829 -13.354 620 H ASN 79 H ASN 79 -0.659 -8.391 -16.321 621 HA ASN 79 HA ASN 79 1.469 -7.029 -17.490 622 1HB ASN 79 1HB ASN 79 1.799 -6.273 -15.096 623 2HB ASN 79 2HB ASN 79 1.721 -7.947 -14.578 624 1HD2 ASN 79 1HD2 ASN 79 3.838 -6.080 -14.129 625 2HD2 ASN 79 2HD2 ASN 79 5.264 -6.726 -14.844 626 HA PRO 80 HA PRO 80 1.011 -11.284 -18.462 627 1HB PRO 80 1HB PRO 80 3.397 -11.656 -19.875 628 2HB PRO 80 2HB PRO 80 1.865 -11.104 -20.568 629 1HG PRO 80 1HG PRO 80 4.206 -9.509 -19.591 630 2HG PRO 80 2HG PRO 80 3.212 -9.249 -21.036 631 1HD PRO 80 1HD PRO 80 2.841 -7.751 -18.868 632 2HD PRO 80 2HD PRO 80 1.463 -8.370 -19.828 633 H GLN 81 H GLN 81 3.922 -10.040 -16.974 634 HA GLN 81 HA GLN 81 4.395 -12.641 -15.870 635 1HB GLN 81 1HB GLN 81 6.696 -11.824 -15.363 636 2HB GLN 81 2HB GLN 81 6.316 -12.086 -17.070 637 1HG GLN 81 1HG GLN 81 5.955 -9.670 -17.320 638 2HG GLN 81 2HG GLN 81 6.393 -9.444 -15.631 639 1HE2 GLN 81 1HE2 GLN 81 8.512 -9.734 -15.018 640 2HE2 GLN 81 2HE2 GLN 81 9.823 -9.662 -16.123 641 H ARG 82 H ARG 82 2.568 -11.602 -14.854 642 HA ARG 82 HA ARG 82 2.863 -9.761 -12.756 643 1HB ARG 82 1HB ARG 82 0.610 -10.683 -11.882 644 2HB ARG 82 2HB ARG 82 0.641 -9.874 -13.431 645 1HG ARG 82 1HG ARG 82 -0.822 -11.767 -13.583 646 2HG ARG 82 2HG ARG 82 0.612 -12.117 -14.533 647 1HD ARG 82 1HD ARG 82 -0.104 -14.068 -13.275 648 2HD ARG 82 2HD ARG 82 1.465 -13.510 -12.703 649 HE ARG 82 HE ARG 82 -0.785 -12.491 -11.217 650 1HH1 ARG 82 1HH1 ARG 82 1.491 -15.142 -11.498 651 2HH1 ARG 82 2HH1 ARG 82 1.392 -15.639 -9.870 652 1HH2 ARG 82 1HH2 ARG 82 -0.958 -13.124 -9.002 653 2HH2 ARG 82 2HH2 ARG 82 -0.049 -14.437 -8.387 Start of MODEL 3 1 H MET 1 H MET 1 1.596 -25.758 -14.677 2 HA MET 1 HA MET 1 2.740 -24.387 -16.253 3 1HB MET 1 1HB MET 1 0.371 -23.903 -15.502 4 2HB MET 1 2HB MET 1 1.019 -22.761 -14.347 5 1HG MET 1 1HG MET 1 1.422 -22.522 -17.324 6 2HG MET 1 2HG MET 1 0.071 -21.793 -16.472 7 1HE MET 1 1HE MET 1 1.824 -19.096 -14.261 8 2HE MET 1 2HE MET 1 1.370 -20.726 -13.780 9 3HE MET 1 3HE MET 1 0.287 -19.773 -14.797 10 H GLN 2 H GLN 2 4.710 -23.642 -16.415 11 HA GLN 2 HA GLN 2 5.606 -21.547 -14.577 12 1HB GLN 2 1HB GLN 2 7.330 -23.789 -15.690 13 2HB GLN 2 2HB GLN 2 7.916 -22.434 -14.741 14 1HG GLN 2 1HG GLN 2 6.614 -23.214 -12.831 15 2HG GLN 2 2HG GLN 2 6.024 -24.570 -13.788 16 1HE2 GLN 2 1HE2 GLN 2 7.452 -26.237 -14.319 17 2HE2 GLN 2 2HE2 GLN 2 8.950 -26.447 -13.499 18 H THR 3 H THR 3 4.632 -20.339 -16.267 19 HA THR 3 HA THR 3 6.341 -19.558 -18.538 20 HB THR 3 HB THR 3 3.463 -20.339 -19.039 21 HG1 THR 3 HG1 THR 3 5.660 -22.041 -18.748 22 1HG2 THR 3 1HG2 THR 3 5.961 -20.389 -20.720 23 2HG2 THR 3 2HG2 THR 3 4.786 -19.075 -20.677 24 3HG2 THR 3 3HG2 THR 3 4.317 -20.658 -21.293 25 H ASP 4 H ASP 4 5.327 -17.628 -19.502 26 HA ASP 4 HA ASP 4 4.223 -16.048 -17.350 27 1HB ASP 4 1HB ASP 4 5.186 -15.463 -20.107 28 2HB ASP 4 2HB ASP 4 3.898 -14.441 -19.471 29 H THR 5 H THR 5 2.144 -14.996 -17.491 30 HA THR 5 HA THR 5 0.324 -16.228 -19.341 31 HB THR 5 HB THR 5 0.182 -17.780 -17.458 32 HG1 THR 5 HG1 THR 5 -2.096 -16.420 -16.846 33 1HG2 THR 5 1HG2 THR 5 -0.496 -17.036 -15.204 34 2HG2 THR 5 2HG2 THR 5 -0.437 -15.357 -15.742 35 3HG2 THR 5 3HG2 THR 5 1.043 -16.312 -15.678 36 H LEU 6 H LEU 6 -1.749 -15.149 -19.305 37 HA LEU 6 HA LEU 6 -1.175 -12.316 -18.996 38 1HB LEU 6 1HB LEU 6 -3.520 -13.671 -20.330 39 2HB LEU 6 2HB LEU 6 -3.175 -11.950 -20.364 40 HG LEU 6 HG LEU 6 -1.501 -14.111 -21.609 41 1HD1 LEU 6 1HD1 LEU 6 -2.118 -13.112 -23.672 42 2HD1 LEU 6 2HD1 LEU 6 -3.066 -11.875 -22.842 43 3HD1 LEU 6 3HD1 LEU 6 -3.584 -13.561 -22.793 44 1HD2 LEU 6 1HD2 LEU 6 -0.047 -12.344 -20.760 45 2HD2 LEU 6 2HD2 LEU 6 -1.057 -11.126 -21.529 46 3HD2 LEU 6 3HD2 LEU 6 -0.147 -12.261 -22.518 47 H GLU 7 H GLU 7 -4.188 -11.864 -18.850 48 HA GLU 7 HA GLU 7 -4.177 -10.985 -16.190 49 1HB GLU 7 1HB GLU 7 -5.352 -9.929 -18.093 50 2HB GLU 7 2HB GLU 7 -6.399 -11.327 -18.212 51 1HG GLU 7 1HG GLU 7 -7.276 -10.847 -16.004 52 2HG GLU 7 2HG GLU 7 -6.217 -9.436 -15.908 53 H TYR 8 H TYR 8 -5.000 -13.831 -17.825 54 HA TYR 8 HA TYR 8 -5.901 -15.546 -17.614 55 1HB TYR 8 1HB TYR 8 -5.454 -17.031 -15.737 56 2HB TYR 8 2HB TYR 8 -4.069 -16.122 -16.321 57 HD1 TYR 8 HD1 TYR 8 -2.932 -14.523 -14.842 58 HD2 TYR 8 HD2 TYR 8 -6.409 -16.591 -13.527 59 HE1 TYR 8 HE1 TYR 8 -2.485 -13.798 -12.534 60 HE2 TYR 8 HE2 TYR 8 -5.980 -15.867 -11.226 61 HH TYR 8 HH TYR 8 -3.788 -13.423 -10.469 62 H GLN 9 H GLN 9 -7.530 -13.248 -16.214 63 HA GLN 9 HA GLN 9 -9.896 -14.775 -16.016 64 1HB GLN 9 1HB GLN 9 -8.847 -13.156 -13.688 65 2HB GLN 9 2HB GLN 9 -10.536 -13.618 -13.863 66 1HG GLN 9 1HG GLN 9 -9.904 -15.919 -13.914 67 2HG GLN 9 2HG GLN 9 -8.213 -15.482 -13.714 68 1HE2 GLN 9 1HE2 GLN 9 -11.266 -15.772 -12.183 69 2HE2 GLN 9 2HE2 GLN 9 -10.730 -15.525 -10.564 70 H CYS 10 H CYS 10 -10.356 -13.821 -17.710 71 HA CYS 10 HA CYS 10 -10.153 -10.922 -17.912 72 1HB CYS 10 1HB CYS 10 -10.542 -13.129 -19.850 73 2HB CYS 10 2HB CYS 10 -10.832 -11.447 -20.335 74 H ASP 11 H ASP 11 -12.029 -10.226 -19.545 75 HA ASP 11 HA ASP 11 -14.326 -9.971 -18.044 76 1HB ASP 11 1HB ASP 11 -13.716 -8.337 -19.652 77 2HB ASP 11 2HB ASP 11 -13.728 -9.559 -20.919 78 H GLU 12 H GLU 12 -13.838 -11.984 -20.885 79 HA GLU 12 HA GLU 12 -16.473 -13.090 -20.291 80 1HB GLU 12 1HB GLU 12 -16.064 -12.119 -22.500 81 2HB GLU 12 2HB GLU 12 -14.843 -13.355 -22.791 82 1HG GLU 12 1HG GLU 12 -16.860 -14.028 -23.843 83 2HG GLU 12 2HG GLU 12 -16.517 -15.031 -22.416 84 H LYS 13 H LYS 13 -13.131 -14.005 -20.414 85 HA LYS 13 HA LYS 13 -13.879 -16.813 -19.976 86 1HB LYS 13 1HB LYS 13 -11.559 -16.044 -21.742 87 2HB LYS 13 2HB LYS 13 -12.257 -17.622 -21.511 88 1HG LYS 13 1HG LYS 13 -13.517 -15.335 -23.022 89 2HG LYS 13 2HG LYS 13 -12.689 -16.667 -23.732 90 1HD LYS 13 1HD LYS 13 -14.288 -18.273 -22.822 91 2HD LYS 13 2HD LYS 13 -15.148 -16.944 -22.013 92 1HE LYS 13 1HE LYS 13 -15.637 -16.016 -24.243 93 2HE LYS 13 2HE LYS 13 -14.860 -17.428 -24.963 94 1HZ LYS 13 1HZ LYS 13 -17.137 -17.582 -23.093 95 2HZ LYS 13 2HZ LYS 13 -16.494 -18.855 -23.975 96 3HZ LYS 13 3HZ LYS 13 -17.326 -17.600 -24.760 97 HA PRO 14 HA PRO 14 -10.390 -16.030 -17.411 98 1HB PRO 14 1HB PRO 14 -9.992 -18.824 -16.736 99 2HB PRO 14 2HB PRO 14 -10.727 -17.578 -15.730 100 1HG PRO 14 1HG PRO 14 -12.108 -19.713 -16.870 101 2HG PRO 14 2HG PRO 14 -12.846 -18.215 -16.286 102 1HD PRO 14 1HD PRO 14 -12.155 -19.027 -19.078 103 2HD PRO 14 2HD PRO 14 -13.531 -18.072 -18.479 104 H LEU 15 H LEU 15 -8.322 -15.740 -18.394 105 HA LEU 15 HA LEU 15 -7.818 -17.468 -20.686 106 1HB LEU 15 1HB LEU 15 -8.438 -15.079 -21.120 107 2HB LEU 15 2HB LEU 15 -7.013 -14.655 -20.179 108 HG LEU 15 HG LEU 15 -5.581 -15.753 -21.815 109 1HD1 LEU 15 1HD1 LEU 15 -7.126 -17.402 -22.681 110 2HD1 LEU 15 2HD1 LEU 15 -6.497 -16.413 -23.997 111 3HD1 LEU 15 3HD1 LEU 15 -8.123 -16.128 -23.379 112 1HD2 LEU 15 1HD2 LEU 15 -7.415 -13.672 -22.991 113 2HD2 LEU 15 2HD2 LEU 15 -5.827 -14.110 -23.622 114 3HD2 LEU 15 3HD2 LEU 15 -5.970 -13.374 -22.025 115 H THR 16 H THR 16 -6.646 -18.830 -19.162 116 HA THR 16 HA THR 16 -4.314 -17.536 -18.158 117 HB THR 16 HB THR 16 -4.727 -20.519 -17.894 118 HG1 THR 16 HG1 THR 16 -6.321 -18.416 -16.913 119 1HG2 THR 16 1HG2 THR 16 -3.707 -18.299 -16.146 120 2HG2 THR 16 2HG2 THR 16 -2.700 -19.463 -17.006 121 3HG2 THR 16 3HG2 THR 16 -3.735 -20.000 -15.665 122 H VAL 17 H VAL 17 -2.327 -17.767 -19.146 123 HA VAL 17 HA VAL 17 -2.417 -19.121 -21.756 124 HB VAL 17 HB VAL 17 -1.095 -16.485 -21.083 125 1HG1 VAL 17 1HG1 VAL 17 0.075 -17.593 -22.893 126 2HG1 VAL 17 2HG1 VAL 17 -0.837 -16.223 -23.527 127 3HG1 VAL 17 3HG1 VAL 17 -1.451 -17.864 -23.724 128 1HG2 VAL 17 1HG2 VAL 17 -2.839 -15.466 -22.502 129 2HG2 VAL 17 2HG2 VAL 17 -3.456 -16.174 -21.011 130 3HG2 VAL 17 3HG2 VAL 17 -3.682 -17.014 -22.539 131 H LYS 18 H LYS 18 -0.475 -19.985 -22.494 132 HA LYS 18 HA LYS 18 1.727 -19.890 -20.627 133 1HB LYS 18 1HB LYS 18 1.063 -21.982 -22.723 134 2HB LYS 18 2HB LYS 18 2.635 -21.881 -21.954 135 1HG LYS 18 1HG LYS 18 1.399 -23.605 -20.864 136 2HG LYS 18 2HG LYS 18 1.512 -22.240 -19.757 137 1HD LYS 18 1HD LYS 18 -0.716 -21.531 -20.473 138 2HD LYS 18 2HD LYS 18 -0.862 -22.994 -21.452 139 1HE LYS 18 1HE LYS 18 -0.457 -24.318 -19.372 140 2HE LYS 18 2HE LYS 18 -0.543 -22.818 -18.457 141 1HZ LYS 18 1HZ LYS 18 -2.842 -22.538 -19.399 142 2HZ LYS 18 2HZ LYS 18 -2.643 -23.790 -18.344 143 3HZ LYS 18 3HZ LYS 18 -2.719 -24.127 -19.987 144 H LEU 19 H LEU 19 2.433 -17.977 -21.215 145 HA LEU 19 HA LEU 19 2.840 -17.296 -23.932 146 1HB LEU 19 1HB LEU 19 1.988 -15.778 -22.144 147 2HB LEU 19 2HB LEU 19 3.499 -16.163 -21.315 148 HG LEU 19 HG LEU 19 4.768 -15.078 -22.762 149 1HD1 LEU 19 1HD1 LEU 19 3.689 -15.565 -24.931 150 2HD1 LEU 19 2HD1 LEU 19 3.894 -13.817 -24.813 151 3HD1 LEU 19 3HD1 LEU 19 2.318 -14.543 -24.492 152 1HD2 LEU 19 1HD2 LEU 19 2.378 -13.391 -22.096 153 2HD2 LEU 19 2HD2 LEU 19 3.864 -12.695 -22.736 154 3HD2 LEU 19 3HD2 LEU 19 3.891 -13.551 -21.198 155 H ASN 20 H ASN 20 4.313 -18.866 -24.434 156 HA ASN 20 HA ASN 20 6.563 -19.272 -22.753 157 1HB ASN 20 1HB ASN 20 6.041 -20.298 -25.550 158 2HB ASN 20 2HB ASN 20 7.474 -20.738 -24.629 159 1HD2 ASN 20 1HD2 ASN 20 7.183 -22.042 -22.783 160 2HD2 ASN 20 2HD2 ASN 20 5.787 -23.029 -22.584 161 H ASN 21 H ASN 21 7.990 -17.794 -22.550 162 HA ASN 21 HA ASN 21 8.458 -15.573 -24.081 163 1HB ASN 21 1HB ASN 21 9.183 -15.738 -21.772 164 2HB ASN 21 2HB ASN 21 10.372 -16.955 -22.219 165 1HD2 ASN 21 1HD2 ASN 21 12.072 -15.778 -21.424 166 2HD2 ASN 21 2HD2 ASN 21 12.690 -14.364 -22.194 167 HA PRO 22 HA PRO 22 12.343 -17.347 -26.263 168 1HB PRO 22 1HB PRO 22 12.405 -20.235 -26.088 169 2HB PRO 22 2HB PRO 22 13.599 -19.079 -25.502 170 1HG PRO 22 1HG PRO 22 12.069 -20.603 -23.842 171 2HG PRO 22 2HG PRO 22 12.672 -18.997 -23.393 172 1HD PRO 22 1HD PRO 22 9.980 -19.803 -24.415 173 2HD PRO 22 2HD PRO 22 10.376 -18.706 -23.080 174 H ARG 23 H ARG 23 9.304 -18.611 -26.490 175 HA ARG 23 HA ARG 23 9.746 -19.694 -29.211 176 1HB ARG 23 1HB ARG 23 7.438 -20.126 -27.332 177 2HB ARG 23 2HB ARG 23 7.584 -20.813 -28.938 178 1HG ARG 23 1HG ARG 23 9.432 -21.362 -26.633 179 2HG ARG 23 2HG ARG 23 8.109 -22.402 -27.163 180 1HD ARG 23 1HD ARG 23 9.217 -22.554 -29.399 181 2HD ARG 23 2HD ARG 23 10.576 -21.654 -28.723 182 HE ARG 23 HE ARG 23 10.950 -23.450 -27.204 183 1HH1 ARG 23 1HH1 ARG 23 8.825 -24.188 -29.963 184 2HH1 ARG 23 2HH1 ARG 23 9.001 -25.865 -29.840 185 1HH2 ARG 23 1HH2 ARG 23 11.255 -25.771 -27.093 186 2HH2 ARG 23 2HH2 ARG 23 10.446 -26.789 -28.199 187 H GLN 24 H GLN 24 7.766 -17.546 -27.253 188 HA GLN 24 HA GLN 24 6.135 -16.246 -27.601 189 1HB GLN 24 1HB GLN 24 7.779 -15.696 -29.991 190 2HB GLN 24 2HB GLN 24 6.193 -14.899 -29.870 191 1HG GLN 24 1HG GLN 24 6.840 -13.957 -27.728 192 2HG GLN 24 2HG GLN 24 8.376 -14.808 -27.793 193 1HE2 GLN 24 1HE2 GLN 24 6.470 -12.256 -29.145 194 2HE2 GLN 24 2HE2 GLN 24 7.769 -11.389 -29.852 195 H GLU 25 H GLU 25 5.312 -18.309 -27.499 196 HA GLU 25 HA GLU 25 3.222 -18.627 -29.485 197 1HB GLU 25 1HB GLU 25 4.954 -20.399 -29.770 198 2HB GLU 25 2HB GLU 25 4.776 -20.794 -28.068 199 1HG GLU 25 1HG GLU 25 2.495 -21.516 -28.450 200 2HG GLU 25 2HG GLU 25 2.626 -21.069 -30.150 201 H VAL 26 H VAL 26 1.342 -19.013 -28.494 202 HA VAL 26 HA VAL 26 1.280 -18.974 -25.509 203 HB VAL 26 HB VAL 26 -0.791 -17.664 -25.620 204 1HG1 VAL 26 1HG1 VAL 26 1.555 -16.307 -26.935 205 2HG1 VAL 26 2HG1 VAL 26 1.280 -16.485 -25.201 206 3HG1 VAL 26 3HG1 VAL 26 0.203 -15.479 -26.165 207 1HG2 VAL 26 1HG2 VAL 26 -1.543 -18.192 -27.861 208 2HG2 VAL 26 2HG2 VAL 26 -0.163 -17.336 -28.547 209 3HG2 VAL 26 3HG2 VAL 26 -1.407 -16.441 -27.672 210 H SER 27 H SER 27 0.304 -20.475 -24.632 211 HA SER 27 HA SER 27 -1.748 -21.873 -26.187 212 1HB SER 27 1HB SER 27 -0.250 -22.999 -23.819 213 2HB SER 27 2HB SER 27 -1.306 -23.819 -24.979 214 HG SER 27 HG SER 27 0.621 -22.479 -26.236 215 H PHE 28 H PHE 28 -3.667 -21.390 -25.544 216 HA PHE 28 HA PHE 28 -4.120 -20.844 -22.756 217 1HB PHE 28 1HB PHE 28 -5.314 -18.749 -23.143 218 2HB PHE 28 2HB PHE 28 -3.625 -18.670 -23.626 219 HD1 PHE 28 HD1 PHE 28 -7.054 -19.126 -25.042 220 HD2 PHE 28 HD2 PHE 28 -3.065 -17.791 -25.689 221 HE1 PHE 28 HE1 PHE 28 -7.741 -18.138 -27.184 222 HE2 PHE 28 HE2 PHE 28 -3.748 -16.816 -27.838 223 HZ PHE 28 HZ PHE 28 -6.084 -16.985 -28.585 224 H VAL 29 H VAL 29 -6.226 -20.747 -22.188 225 HA VAL 29 HA VAL 29 -7.859 -22.583 -23.675 226 HB VAL 29 HB VAL 29 -7.513 -23.187 -21.354 227 1HG1 VAL 29 1HG1 VAL 29 -8.495 -20.457 -20.582 228 2HG1 VAL 29 2HG1 VAL 29 -6.868 -21.129 -20.386 229 3HG1 VAL 29 3HG1 VAL 29 -8.212 -21.802 -19.471 230 1HG2 VAL 29 1HG2 VAL 29 -10.294 -22.087 -21.710 231 2HG2 VAL 29 2HG2 VAL 29 -9.805 -23.267 -20.488 232 3HG2 VAL 29 3HG2 VAL 29 -9.709 -23.678 -22.202 233 H TYR 30 H TYR 30 -9.071 -21.790 -24.974 234 HA TYR 30 HA TYR 30 -9.737 -18.948 -24.964 235 1HB TYR 30 1HB TYR 30 -10.735 -19.261 -27.152 236 2HB TYR 30 2HB TYR 30 -9.141 -19.998 -27.111 237 HD1 TYR 30 HD1 TYR 30 -12.752 -20.583 -27.330 238 HD2 TYR 30 HD2 TYR 30 -8.922 -22.411 -27.342 239 HE1 TYR 30 HE1 TYR 30 -13.741 -22.628 -28.238 240 HE2 TYR 30 HE2 TYR 30 -9.924 -24.473 -28.249 241 HH TYR 30 HH TYR 30 -13.062 -24.585 -29.499 242 H ASP 31 H ASP 31 -11.197 -21.772 -23.988 243 HA ASP 31 HA ASP 31 -13.371 -20.391 -22.874 244 1HB ASP 31 1HB ASP 31 -14.179 -20.477 -25.190 245 2HB ASP 31 2HB ASP 31 -14.030 -22.223 -25.195 246 H ASN 32 H ASN 32 -12.943 -23.703 -24.230 247 HA ASN 32 HA ASN 32 -12.966 -24.630 -21.457 248 1HB ASN 32 1HB ASN 32 -15.205 -24.887 -22.565 249 2HB ASN 32 2HB ASN 32 -14.445 -25.946 -23.735 250 1HD2 ASN 32 1HD2 ASN 32 -15.728 -27.645 -23.207 251 2HD2 ASN 32 2HD2 ASN 32 -15.622 -28.543 -21.743 252 H GLN 33 H GLN 33 -10.868 -24.432 -23.944 253 HA GLN 33 HA GLN 33 -9.487 -26.724 -23.134 254 1HB GLN 33 1HB GLN 33 -9.288 -27.836 -25.260 255 2HB GLN 33 2HB GLN 33 -10.987 -27.789 -24.824 256 1HG GLN 33 1HG GLN 33 -11.391 -26.034 -26.356 257 2HG GLN 33 2HG GLN 33 -9.658 -25.859 -26.649 258 1HE2 GLN 33 1HE2 GLN 33 -11.832 -26.456 -28.522 259 2HE2 GLN 33 2HE2 GLN 33 -11.396 -27.947 -29.275 260 H LEU 34 H LEU 34 -7.505 -26.843 -24.329 261 HA LEU 34 HA LEU 34 -6.662 -24.135 -24.323 262 1HB LEU 34 1HB LEU 34 -5.267 -26.729 -23.877 263 2HB LEU 34 2HB LEU 34 -4.329 -25.276 -24.200 264 HG LEU 34 HG LEU 34 -4.405 -25.858 -21.790 265 1HD1 LEU 34 1HD1 LEU 34 -4.024 -23.624 -22.339 266 2HD1 LEU 34 2HD1 LEU 34 -5.068 -23.702 -20.918 267 3HD1 LEU 34 3HD1 LEU 34 -5.746 -23.313 -22.497 268 1HD2 LEU 34 1HD2 LEU 34 -6.466 -25.588 -20.490 269 2HD2 LEU 34 2HD2 LEU 34 -6.609 -26.902 -21.660 270 3HD2 LEU 34 3HD2 LEU 34 -7.370 -25.348 -21.988 271 H LEU 35 H LEU 35 -5.817 -23.205 -26.167 272 HA LEU 35 HA LEU 35 -5.273 -24.850 -28.531 273 1HB LEU 35 1HB LEU 35 -7.050 -22.790 -28.083 274 2HB LEU 35 2HB LEU 35 -5.663 -21.975 -28.754 275 HG LEU 35 HG LEU 35 -7.239 -22.395 -30.374 276 1HD1 LEU 35 1HD1 LEU 35 -4.940 -22.536 -31.145 277 2HD1 LEU 35 2HD1 LEU 35 -5.943 -23.645 -32.081 278 3HD1 LEU 35 3HD1 LEU 35 -4.907 -24.266 -30.795 279 1HD2 LEU 35 1HD2 LEU 35 -7.953 -24.659 -31.083 280 2HD2 LEU 35 2HD2 LEU 35 -8.426 -24.210 -29.438 281 3HD2 LEU 35 3HD2 LEU 35 -7.080 -25.312 -29.690 282 H HIS 36 H HIS 36 -3.406 -23.997 -29.738 283 HA HIS 36 HA HIS 36 -1.742 -22.180 -28.213 284 1HB HIS 36 1HB HIS 36 0.315 -23.437 -28.898 285 2HB HIS 36 2HB HIS 36 -0.697 -24.276 -27.739 286 HD2 HIS 36 HD2 HIS 36 0.496 -24.597 -31.432 287 HE1 HIS 36 HE1 HIS 36 -1.424 -28.184 -30.294 288 HE2 HIS 36 HE2 HIS 36 0.164 -27.121 -31.927 289 H LEU 37 H LEU 37 -1.170 -20.519 -29.197 290 HA LEU 37 HA LEU 37 -1.390 -20.425 -32.131 291 1HB LEU 37 1HB LEU 37 -1.890 -18.200 -30.180 292 2HB LEU 37 2HB LEU 37 -1.996 -18.077 -31.899 293 HG LEU 37 HG LEU 37 -3.909 -19.823 -31.771 294 1HD1 LEU 37 1HD1 LEU 37 -5.140 -19.991 -29.659 295 2HD1 LEU 37 2HD1 LEU 37 -3.835 -19.114 -28.847 296 3HD1 LEU 37 3HD1 LEU 37 -3.520 -20.683 -29.552 297 1HD2 LEU 37 1HD2 LEU 37 -4.314 -17.116 -30.528 298 2HD2 LEU 37 2HD2 LEU 37 -5.605 -18.173 -31.096 299 3HD2 LEU 37 3HD2 LEU 37 -4.425 -17.544 -32.241 300 H LYS 38 H LYS 38 0.070 -19.043 -33.160 301 HA LYS 38 HA LYS 38 2.434 -18.549 -31.509 302 1HB LYS 38 1HB LYS 38 3.803 -19.262 -33.304 303 2HB LYS 38 2HB LYS 38 2.574 -20.485 -32.902 304 1HG LYS 38 1HG LYS 38 1.312 -19.985 -34.834 305 2HG LYS 38 2HG LYS 38 2.297 -18.567 -35.192 306 1HD LYS 38 1HD LYS 38 2.993 -20.323 -36.660 307 2HD LYS 38 2HD LYS 38 4.214 -20.012 -35.403 308 1HE LYS 38 1HE LYS 38 3.573 -21.953 -34.171 309 2HE LYS 38 2HE LYS 38 2.170 -22.222 -35.203 310 1HZ LYS 38 1HZ LYS 38 4.999 -22.420 -36.068 311 2HZ LYS 38 2HZ LYS 38 3.654 -22.778 -37.022 312 3HZ LYS 38 3HZ LYS 38 4.020 -23.724 -35.683 313 H GLN 39 H GLN 39 3.752 -16.913 -32.248 314 HA GLN 39 HA GLN 39 2.182 -14.705 -33.256 315 1HB GLN 39 1HB GLN 39 3.590 -14.299 -31.355 316 2HB GLN 39 2HB GLN 39 5.029 -14.720 -32.295 317 1HG GLN 39 1HG GLN 39 4.695 -12.806 -33.716 318 2HG GLN 39 2HG GLN 39 3.173 -12.429 -32.919 319 1HE2 GLN 39 1HE2 GLN 39 5.569 -10.826 -33.248 320 2HE2 GLN 39 2HE2 GLN 39 6.072 -10.387 -31.654 321 H GLY 40 H GLY 40 1.886 -14.513 -35.129 322 1HA GLY 40 1HA GLY 40 3.962 -15.141 -37.147 323 2HA GLY 40 2HA GLY 40 2.230 -15.180 -37.470 324 H ILE 41 H ILE 41 1.413 -13.487 -38.481 325 HA ILE 41 HA ILE 41 3.091 -11.239 -39.019 326 HB ILE 41 HB ILE 41 0.174 -11.659 -39.761 327 1HG1 ILE 41 1HG1 ILE 41 1.163 -11.902 -42.128 328 2HG1 ILE 41 2HG1 ILE 41 2.719 -12.091 -41.341 329 1HG2 ILE 41 1HG2 ILE 41 0.765 -9.310 -39.628 330 2HG2 ILE 41 2HG2 ILE 41 0.445 -9.780 -41.297 331 3HG2 ILE 41 3HG2 ILE 41 2.109 -9.570 -40.733 332 1HD1 ILE 41 1HD1 ILE 41 0.337 -13.898 -40.977 333 2HD1 ILE 41 2HD1 ILE 41 1.927 -14.106 -40.237 334 3HD1 ILE 41 3HD1 ILE 41 1.744 -14.224 -41.985 335 H SER 42 H SER 42 3.346 -9.728 -37.590 336 HA SER 42 HA SER 42 1.073 -8.966 -35.919 337 1HB SER 42 1HB SER 42 4.020 -8.688 -35.442 338 2HB SER 42 2HB SER 42 2.735 -8.219 -34.311 339 HG SER 42 HG SER 42 3.689 -10.726 -35.048 340 H ALA 43 H ALA 43 0.598 -6.748 -35.791 341 HA ALA 43 HA ALA 43 2.182 -5.150 -37.474 342 1HB ALA 43 1HB ALA 43 0.187 -3.775 -38.037 343 2HB ALA 43 2HB ALA 43 -0.795 -4.861 -37.055 344 3HB ALA 43 3HB ALA 43 0.004 -5.463 -38.506 345 H SER 44 H SER 44 -0.440 -4.009 -35.400 346 HA SER 44 HA SER 44 1.518 -2.538 -33.841 347 1HB SER 44 1HB SER 44 -1.510 -2.368 -33.790 348 2HB SER 44 2HB SER 44 -0.376 -1.222 -33.071 349 HG SER 44 HG SER 44 0.404 -0.810 -35.174 350 H GLY 45 H GLY 45 2.245 -4.561 -32.838 351 1HA GLY 45 1HA GLY 45 1.789 -5.050 -30.326 352 2HA GLY 45 2HA GLY 45 0.332 -5.773 -30.979 353 H ALA 46 H ALA 46 0.457 -7.919 -31.123 354 HA ALA 46 HA ALA 46 2.654 -9.176 -32.378 355 1HB ALA 46 1HB ALA 46 2.906 -10.661 -30.370 356 2HB ALA 46 2HB ALA 46 1.920 -9.478 -29.482 357 3HB ALA 46 3HB ALA 46 3.490 -9.008 -30.122 358 H ARG 47 H ARG 47 1.615 -10.782 -33.486 359 HA ARG 47 HA ARG 47 -1.005 -11.191 -32.470 360 1HB ARG 47 1HB ARG 47 -0.124 -11.112 -35.311 361 2HB ARG 47 2HB ARG 47 -1.605 -11.949 -34.874 362 1HG ARG 47 1HG ARG 47 -2.458 -9.852 -33.903 363 2HG ARG 47 2HG ARG 47 -0.977 -9.042 -34.425 364 1HD ARG 47 1HD ARG 47 -2.905 -8.761 -35.996 365 2HD ARG 47 2HD ARG 47 -1.464 -9.468 -36.729 366 HE ARG 47 HE ARG 47 -3.092 -11.532 -35.808 367 1HH1 ARG 47 1HH1 ARG 47 -3.269 -9.013 -38.295 368 2HH1 ARG 47 2HH1 ARG 47 -4.105 -9.967 -39.420 369 1HH2 ARG 47 1HH2 ARG 47 -4.220 -12.886 -37.374 370 2HH2 ARG 47 2HH2 ARG 47 -4.682 -12.199 -38.865 371 H TYR 48 H TYR 48 -1.318 -13.206 -31.730 372 HA TYR 48 HA TYR 48 0.247 -15.510 -32.706 373 1HB TYR 48 1HB TYR 48 -1.427 -15.184 -30.194 374 2HB TYR 48 2HB TYR 48 -0.410 -16.540 -30.638 375 HD1 TYR 48 HD1 TYR 48 1.827 -16.645 -29.935 376 HD2 TYR 48 HD2 TYR 48 -0.207 -12.910 -29.720 377 HE1 TYR 48 HE1 TYR 48 3.696 -15.691 -28.657 378 HE2 TYR 48 HE2 TYR 48 1.654 -11.961 -28.453 379 HH TYR 48 HH TYR 48 3.460 -12.742 -27.007 380 H THR 49 H THR 49 -0.769 -16.718 -34.079 381 HA THR 49 HA THR 49 -3.657 -16.892 -33.826 382 HB THR 49 HB THR 49 -2.267 -15.993 -36.350 383 HG1 THR 49 HG1 THR 49 -3.104 -14.630 -34.353 384 1HG2 THR 49 1HG2 THR 49 -4.515 -15.820 -37.368 385 2HG2 THR 49 2HG2 THR 49 -5.217 -16.539 -35.913 386 3HG2 THR 49 3HG2 THR 49 -4.133 -17.482 -36.927 387 H ASP 50 H ASP 50 -4.474 -18.892 -34.441 388 HA ASP 50 HA ASP 50 -2.672 -20.538 -35.970 389 1HB ASP 50 1HB ASP 50 -2.444 -21.076 -33.512 390 2HB ASP 50 2HB ASP 50 -4.080 -21.724 -33.572 391 H GLY 51 H GLY 51 -4.663 -19.295 -37.063 392 1HA GLY 51 1HA GLY 51 -6.150 -19.723 -38.738 393 2HA GLY 51 2HA GLY 51 -6.090 -21.417 -38.307 394 H ILE 52 H ILE 52 -6.991 -21.265 -35.771 395 HA ILE 52 HA ILE 52 -9.834 -21.224 -36.285 396 HB ILE 52 HB ILE 52 -8.381 -21.835 -33.695 397 1HG1 ILE 52 1HG1 ILE 52 -7.619 -23.350 -35.445 398 2HG1 ILE 52 2HG1 ILE 52 -8.628 -24.217 -34.298 399 1HG2 ILE 52 1HG2 ILE 52 -10.424 -23.066 -33.076 400 2HG2 ILE 52 2HG2 ILE 52 -11.185 -22.544 -34.582 401 3HG2 ILE 52 3HG2 ILE 52 -10.748 -21.353 -33.358 402 1HD1 ILE 52 1HD1 ILE 52 -9.467 -23.250 -37.032 403 2HD1 ILE 52 2HD1 ILE 52 -10.510 -24.078 -35.879 404 3HD1 ILE 52 3HD1 ILE 52 -9.117 -24.916 -36.563 405 H TYR 53 H TYR 53 -7.556 -19.497 -34.247 406 HA TYR 53 HA TYR 53 -9.480 -17.315 -34.095 407 1HB TYR 53 1HB TYR 53 -7.867 -18.201 -31.719 408 2HB TYR 53 2HB TYR 53 -8.928 -16.796 -31.918 409 HD1 TYR 53 HD1 TYR 53 -8.809 -20.235 -30.895 410 HD2 TYR 53 HD2 TYR 53 -11.367 -17.246 -32.477 411 HE1 TYR 53 HE1 TYR 53 -10.772 -21.574 -30.255 412 HE2 TYR 53 HE2 TYR 53 -13.309 -18.562 -31.844 413 HH TYR 53 HH TYR 53 -13.205 -21.150 -29.755 414 H VAL 54 H VAL 54 -8.548 -15.379 -33.591 415 HA VAL 54 HA VAL 54 -5.768 -15.066 -34.465 416 HB VAL 54 HB VAL 54 -8.211 -13.426 -34.608 417 1HG1 VAL 54 1HG1 VAL 54 -5.393 -12.800 -35.650 418 2HG1 VAL 54 2HG1 VAL 54 -6.217 -11.956 -34.340 419 3HG1 VAL 54 3HG1 VAL 54 -6.792 -11.783 -35.997 420 1HG2 VAL 54 1HG2 VAL 54 -8.294 -15.128 -36.281 421 2HG2 VAL 54 2HG2 VAL 54 -6.668 -14.742 -36.840 422 3HG2 VAL 54 3HG2 VAL 54 -7.984 -13.601 -37.109 423 H PHE 55 H PHE 55 -4.660 -14.664 -32.564 424 HA PHE 55 HA PHE 55 -5.999 -13.055 -30.538 425 1HB PHE 55 1HB PHE 55 -5.205 -15.185 -29.675 426 2HB PHE 55 2HB PHE 55 -3.615 -14.925 -30.370 427 HD1 PHE 55 HD1 PHE 55 -2.016 -13.539 -29.274 428 HD2 PHE 55 HD2 PHE 55 -5.896 -14.000 -27.599 429 HE1 PHE 55 HE1 PHE 55 -1.232 -12.578 -27.167 430 HE2 PHE 55 HE2 PHE 55 -5.125 -13.029 -25.529 431 HZ PHE 55 HZ PHE 55 -2.791 -12.301 -25.301 432 H TRP 56 H TRP 56 -5.275 -11.113 -30.091 433 HA TRP 56 HA TRP 56 -2.857 -10.198 -31.407 434 1HB TRP 56 1HB TRP 56 -5.125 -9.397 -32.350 435 2HB TRP 56 2HB TRP 56 -5.281 -8.540 -30.813 436 HD1 TRP 56 HD1 TRP 56 -2.458 -7.294 -30.472 437 HE1 TRP 56 HE1 TRP 56 -1.596 -5.497 -32.052 438 HE3 TRP 56 HE3 TRP 56 -5.534 -8.210 -34.444 439 HZ2 TRP 56 HZ2 TRP 56 -2.159 -4.547 -34.651 440 HZ3 TRP 56 HZ3 TRP 56 -5.313 -6.788 -36.443 441 HH2 TRP 56 HH2 TRP 56 -3.658 -4.994 -36.535 442 H SER 57 H SER 57 -1.577 -9.455 -30.050 443 HA SER 57 HA SER 57 -2.379 -8.810 -27.303 444 1HB SER 57 1HB SER 57 -0.819 -10.754 -27.587 445 2HB SER 57 2HB SER 57 0.319 -9.677 -28.376 446 HG SER 57 HG SER 57 0.871 -9.899 -26.230 447 H LYS 58 H LYS 58 -2.495 -6.620 -27.171 448 HA LYS 58 HA LYS 58 -0.822 -4.986 -28.874 449 1HB LYS 58 1HB LYS 58 -3.164 -4.329 -28.279 450 2HB LYS 58 2HB LYS 58 -2.635 -4.183 -26.603 451 1HG LYS 58 1HG LYS 58 -2.694 -1.992 -27.528 452 2HG LYS 58 2HG LYS 58 -1.005 -2.489 -27.326 453 1HD LYS 58 1HD LYS 58 -0.954 -3.151 -29.683 454 2HD LYS 58 2HD LYS 58 -2.577 -2.506 -29.878 455 1HE LYS 58 1HE LYS 58 -0.109 -0.944 -29.080 456 2HE LYS 58 2HE LYS 58 -0.935 -0.863 -30.630 457 1HZ LYS 58 1HZ LYS 58 -1.528 0.999 -29.293 458 2HZ LYS 58 2HZ LYS 58 -2.007 0.045 -28.003 459 3HZ LYS 58 3HZ LYS 58 -2.900 0.035 -29.430 460 H GLY 59 H GLY 59 -0.779 -6.380 -25.797 461 1HA GLY 59 1HA GLY 59 1.447 -6.378 -24.695 462 2HA GLY 59 2HA GLY 59 1.404 -4.622 -24.883 463 H ASP 60 H ASP 60 -0.888 -3.769 -24.172 464 HA ASP 60 HA ASP 60 -1.296 -4.700 -21.416 465 1HB ASP 60 1HB ASP 60 -2.204 -2.162 -22.801 466 2HB ASP 60 2HB ASP 60 -2.623 -2.587 -21.153 467 H GLU 61 H GLU 61 -2.537 -5.089 -24.453 468 HA GLU 61 HA GLU 61 -5.199 -5.691 -23.422 469 1HB GLU 61 1HB GLU 61 -4.484 -4.630 -26.161 470 2HB GLU 61 2HB GLU 61 -6.057 -5.215 -25.681 471 1HG GLU 61 1HG GLU 61 -6.318 -3.446 -24.117 472 2HG GLU 61 2HG GLU 61 -4.641 -2.951 -24.411 473 H ALA 62 H ALA 62 -5.948 -7.590 -24.032 474 HA ALA 62 HA ALA 62 -4.445 -9.016 -26.008 475 1HB ALA 62 1HB ALA 62 -5.483 -10.130 -23.389 476 2HB ALA 62 2HB ALA 62 -3.798 -9.977 -23.890 477 3HB ALA 62 3HB ALA 62 -4.871 -11.104 -24.724 478 H THR 63 H THR 63 -5.771 -9.585 -27.537 479 HA THR 63 HA THR 63 -8.641 -9.933 -26.992 480 HB THR 63 HB THR 63 -7.381 -8.224 -29.152 481 HG1 THR 63 HG1 THR 63 -8.242 -7.800 -26.685 482 1HG2 THR 63 1HG2 THR 63 -9.384 -9.374 -30.038 483 2HG2 THR 63 2HG2 THR 63 -9.697 -7.654 -29.834 484 3HG2 THR 63 3HG2 THR 63 -10.333 -8.810 -28.668 485 H VAL 64 H VAL 64 -9.608 -11.612 -28.196 486 HA VAL 64 HA VAL 64 -8.131 -12.598 -30.387 487 HB VAL 64 HB VAL 64 -7.164 -14.047 -28.883 488 1HG1 VAL 64 1HG1 VAL 64 -8.430 -15.388 -27.196 489 2HG1 VAL 64 2HG1 VAL 64 -9.826 -14.349 -27.586 490 3HG1 VAL 64 3HG1 VAL 64 -8.347 -13.650 -26.921 491 1HG2 VAL 64 1HG2 VAL 64 -7.950 -15.278 -30.754 492 2HG2 VAL 64 2HG2 VAL 64 -9.527 -15.509 -30.006 493 3HG2 VAL 64 3HG2 VAL 64 -8.105 -16.300 -29.323 494 H TYR 65 H TYR 65 -9.252 -12.501 -31.866 495 HA TYR 65 HA TYR 65 -12.221 -12.734 -31.788 496 1HB TYR 65 1HB TYR 65 -11.193 -10.442 -31.368 497 2HB TYR 65 2HB TYR 65 -10.485 -10.636 -32.964 498 HD1 TYR 65 HD1 TYR 65 -12.561 -11.322 -34.771 499 HD2 TYR 65 HD2 TYR 65 -12.842 -8.898 -31.286 500 HE1 TYR 65 HE1 TYR 65 -14.504 -10.168 -35.731 501 HE2 TYR 65 HE2 TYR 65 -14.792 -7.754 -32.230 502 HH TYR 65 HH TYR 65 -16.425 -8.922 -34.967 503 H LYS 66 H LYS 66 -12.127 -14.617 -33.219 504 HA LYS 66 HA LYS 66 -10.821 -14.122 -35.714 505 1HB LYS 66 1HB LYS 66 -11.124 -16.481 -34.596 506 2HB LYS 66 2HB LYS 66 -12.793 -16.327 -35.123 507 1HG LYS 66 1HG LYS 66 -11.626 -15.688 -37.409 508 2HG LYS 66 2HG LYS 66 -10.343 -16.689 -36.737 509 1HD LYS 66 1HD LYS 66 -11.948 -18.534 -36.491 510 2HD LYS 66 2HD LYS 66 -13.217 -17.504 -37.167 511 1HE LYS 66 1HE LYS 66 -11.762 -17.230 -39.202 512 2HE LYS 66 2HE LYS 66 -10.732 -18.504 -38.549 513 1HZ LYS 66 1HZ LYS 66 -13.590 -18.712 -39.289 514 2HZ LYS 66 2HZ LYS 66 -12.717 -19.957 -38.562 515 3HZ LYS 66 3HZ LYS 66 -12.302 -19.432 -40.102 516 H ARG 67 H ARG 67 -12.102 -13.969 -37.424 517 HA ARG 67 HA ARG 67 -14.219 -12.174 -37.511 518 1HB ARG 67 1HB ARG 67 -12.827 -12.751 -39.434 519 2HB ARG 67 2HB ARG 67 -13.573 -14.335 -39.518 520 1HG ARG 67 1HG ARG 67 -14.450 -12.866 -41.232 521 2HG ARG 67 2HG ARG 67 -15.703 -13.295 -40.063 522 1HD ARG 67 1HD ARG 67 -15.457 -11.227 -38.947 523 2HD ARG 67 2HD ARG 67 -14.109 -10.748 -39.981 524 HE ARG 67 HE ARG 67 -16.465 -11.386 -41.456 525 1HH1 ARG 67 1HH1 ARG 67 -14.869 -8.722 -39.737 526 2HH1 ARG 67 2HH1 ARG 67 -15.740 -7.495 -40.533 527 1HH2 ARG 67 1HH2 ARG 67 -17.694 -9.699 -42.504 528 2HH2 ARG 67 2HH2 ARG 67 -17.433 -8.067 -42.094 529 H ASP 68 H ASP 68 -14.342 -15.558 -36.984 530 HA ASP 68 HA ASP 68 -17.268 -15.716 -37.284 531 1HB ASP 68 1HB ASP 68 -15.249 -17.931 -36.899 532 2HB ASP 68 2HB ASP 68 -16.978 -18.164 -36.986 533 H ARG 69 H ARG 69 -14.792 -15.588 -34.953 534 HA ARG 69 HA ARG 69 -16.653 -16.082 -32.918 535 1HB ARG 69 1HB ARG 69 -16.300 -18.355 -33.592 536 2HB ARG 69 2HB ARG 69 -14.568 -18.186 -33.416 537 1HG ARG 69 1HG ARG 69 -15.411 -19.449 -31.552 538 2HG ARG 69 2HG ARG 69 -14.911 -17.855 -30.984 539 1HD ARG 69 1HD ARG 69 -17.138 -17.114 -30.813 540 2HD ARG 69 2HD ARG 69 -17.762 -18.544 -31.639 541 HE ARG 69 HE ARG 69 -16.739 -19.788 -29.689 542 1HH1 ARG 69 1HH1 ARG 69 -18.112 -16.538 -29.333 543 2HH1 ARG 69 2HH1 ARG 69 -18.556 -16.757 -27.710 544 1HH2 ARG 69 1HH2 ARG 69 -17.381 -20.099 -27.448 545 2HH2 ARG 69 2HH2 ARG 69 -18.188 -18.843 -26.643 546 H ILE 70 H ILE 70 -16.081 -14.456 -31.743 547 HA ILE 70 HA ILE 70 -13.383 -13.903 -30.815 548 HB ILE 70 HB ILE 70 -15.994 -12.735 -29.905 549 1HG1 ILE 70 1HG1 ILE 70 -15.312 -10.708 -31.306 550 2HG1 ILE 70 2HG1 ILE 70 -14.249 -11.829 -32.131 551 1HG2 ILE 70 1HG2 ILE 70 -14.633 -10.809 -29.181 552 2HG2 ILE 70 2HG2 ILE 70 -13.186 -11.661 -29.722 553 3HG2 ILE 70 3HG2 ILE 70 -14.154 -12.321 -28.405 554 1HD1 ILE 70 1HD1 ILE 70 -17.265 -12.074 -32.029 555 2HD1 ILE 70 2HD1 ILE 70 -16.164 -13.100 -32.954 556 3HD1 ILE 70 3HD1 ILE 70 -16.349 -11.401 -33.374 557 H VAL 71 H VAL 71 -12.777 -14.421 -28.966 558 HA VAL 71 HA VAL 71 -14.694 -15.715 -27.115 559 HB VAL 71 HB VAL 71 -12.771 -17.154 -26.281 560 1HG1 VAL 71 1HG1 VAL 71 -13.616 -17.490 -29.156 561 2HG1 VAL 71 2HG1 VAL 71 -14.482 -18.102 -27.742 562 3HG1 VAL 71 3HG1 VAL 71 -12.894 -18.751 -28.168 563 1HG2 VAL 71 1HG2 VAL 71 -10.904 -17.512 -27.913 564 2HG2 VAL 71 2HG2 VAL 71 -10.906 -15.953 -27.120 565 3HG2 VAL 71 3HG2 VAL 71 -11.484 -16.094 -28.791 566 H LEU 72 H LEU 72 -12.128 -13.486 -27.556 567 HA LEU 72 HA LEU 72 -12.667 -12.523 -24.872 568 1HB LEU 72 1HB LEU 72 -10.036 -13.422 -25.803 569 2HB LEU 72 2HB LEU 72 -10.066 -11.951 -24.818 570 HG LEU 72 HG LEU 72 -9.579 -13.553 -23.366 571 1HD1 LEU 72 1HD1 LEU 72 -12.543 -13.553 -23.202 572 2HD1 LEU 72 2HD1 LEU 72 -11.425 -12.371 -22.542 573 3HD1 LEU 72 3HD1 LEU 72 -11.412 -14.017 -21.928 574 1HD2 LEU 72 1HD2 LEU 72 -10.437 -15.867 -23.379 575 2HD2 LEU 72 2HD2 LEU 72 -9.640 -15.428 -24.887 576 3HD2 LEU 72 3HD2 LEU 72 -11.399 -15.463 -24.805 577 H ASN 73 H ASN 73 -12.934 -10.312 -25.033 578 HA ASN 73 HA ASN 73 -11.274 -8.959 -27.009 579 1HB ASN 73 1HB ASN 73 -13.060 -7.631 -27.886 580 2HB ASN 73 2HB ASN 73 -13.558 -9.315 -27.948 581 1HD2 ASN 73 1HD2 ASN 73 -15.258 -10.020 -26.563 582 2HD2 ASN 73 2HD2 ASN 73 -16.262 -8.894 -25.736 583 H ASN 74 H ASN 74 -11.637 -9.343 -24.074 584 HA ASN 74 HA ASN 74 -11.007 -6.649 -23.372 585 1HB ASN 74 1HB ASN 74 -13.491 -6.718 -23.138 586 2HB ASN 74 2HB ASN 74 -13.324 -8.006 -21.961 587 1HD2 ASN 74 1HD2 ASN 74 -14.603 -5.547 -21.464 588 2HD2 ASN 74 2HD2 ASN 74 -13.705 -4.708 -20.275 589 H CYS 75 H CYS 75 -9.119 -7.686 -23.164 590 HA CYS 75 HA CYS 75 -8.765 -8.786 -20.506 591 1HB CYS 75 1HB CYS 75 -7.358 -9.627 -23.038 592 2HB CYS 75 2HB CYS 75 -6.728 -9.999 -21.433 593 H GLN 76 H GLN 76 -7.432 -7.643 -19.416 594 HA GLN 76 HA GLN 76 -5.854 -5.663 -20.787 595 1HB GLN 76 1HB GLN 76 -7.888 -5.160 -18.617 596 2HB GLN 76 2HB GLN 76 -6.597 -4.016 -18.993 597 1HG GLN 76 1HG GLN 76 -7.365 -3.764 -21.216 598 2HG GLN 76 2HG GLN 76 -8.557 -5.037 -21.025 599 1HE2 GLN 76 1HE2 GLN 76 -10.476 -4.586 -19.950 600 2HE2 GLN 76 2HE2 GLN 76 -10.940 -2.995 -19.503 601 H LEU 77 H LEU 77 -4.091 -6.143 -20.315 602 HA LEU 77 HA LEU 77 -3.678 -8.201 -18.517 603 1HB LEU 77 1HB LEU 77 -2.530 -8.174 -20.596 604 2HB LEU 77 2HB LEU 77 -1.711 -6.682 -20.191 605 HG LEU 77 HG LEU 77 -0.388 -7.841 -18.499 606 1HD1 LEU 77 1HD1 LEU 77 -0.501 -10.283 -18.311 607 2HD1 LEU 77 2HD1 LEU 77 -1.911 -10.300 -19.372 608 3HD1 LEU 77 3HD1 LEU 77 -2.002 -9.521 -17.804 609 1HD2 LEU 77 1HD2 LEU 77 0.884 -9.301 -20.043 610 2HD2 LEU 77 2HD2 LEU 77 0.485 -7.730 -20.734 611 3HD2 LEU 77 3HD2 LEU 77 -0.435 -9.157 -21.206 612 H GLN 78 H GLN 78 -2.974 -8.202 -16.514 613 HA GLN 78 HA GLN 78 -2.431 -5.798 -15.070 614 1HB GLN 78 1HB GLN 78 -2.040 -8.685 -14.235 615 2HB GLN 78 2HB GLN 78 -2.075 -7.292 -13.165 616 1HG GLN 78 1HG GLN 78 -4.391 -8.274 -14.821 617 2HG GLN 78 2HG GLN 78 -4.151 -8.578 -13.101 618 1HE2 GLN 78 1HE2 GLN 78 -4.421 -6.909 -11.656 619 2HE2 GLN 78 2HE2 GLN 78 -5.248 -5.458 -12.050 620 H ASN 79 H ASN 79 -0.517 -8.775 -15.672 621 HA ASN 79 HA ASN 79 1.792 -7.587 -16.612 622 1HB ASN 79 1HB ASN 79 2.009 -6.834 -14.199 623 2HB ASN 79 2HB ASN 79 1.854 -8.513 -13.706 624 1HD2 ASN 79 1HD2 ASN 79 3.834 -8.521 -12.716 625 2HD2 ASN 79 2HD2 ASN 79 5.333 -8.460 -13.589 626 HA PRO 80 HA PRO 80 1.166 -11.817 -17.492 627 1HB PRO 80 1HB PRO 80 3.252 -12.359 -19.161 628 2HB PRO 80 2HB PRO 80 1.796 -11.508 -19.651 629 1HG PRO 80 1HG PRO 80 4.467 -10.395 -18.928 630 2HG PRO 80 2HG PRO 80 3.330 -9.845 -20.169 631 1HD PRO 80 1HD PRO 80 3.639 -8.635 -17.706 632 2HD PRO 80 2HD PRO 80 2.156 -8.551 -18.677 633 H GLN 81 H GLN 81 4.131 -10.682 -16.134 634 HA GLN 81 HA GLN 81 5.127 -13.224 -15.428 635 1HB GLN 81 1HB GLN 81 6.542 -11.259 -15.925 636 2HB GLN 81 2HB GLN 81 5.846 -10.437 -14.538 637 1HG GLN 81 1HG GLN 81 6.631 -12.279 -13.162 638 2HG GLN 81 2HG GLN 81 7.545 -12.879 -14.557 639 1HE2 GLN 81 1HE2 GLN 81 9.307 -11.649 -15.293 640 2HE2 GLN 81 2HE2 GLN 81 10.017 -10.401 -14.339 641 H ARG 82 H ARG 82 2.716 -11.253 -14.482 642 HA ARG 82 HA ARG 82 1.292 -10.962 -12.837 643 1HB ARG 82 1HB ARG 82 2.710 -13.296 -11.652 644 2HB ARG 82 2HB ARG 82 1.229 -12.608 -10.957 645 1HG ARG 82 1HG ARG 82 0.039 -13.194 -13.022 646 2HG ARG 82 2HG ARG 82 1.535 -13.846 -13.698 647 1HD ARG 82 1HD ARG 82 0.110 -14.831 -11.242 648 2HD ARG 82 2HD ARG 82 0.138 -15.634 -12.812 649 HE ARG 82 HE ARG 82 2.633 -15.702 -12.460 650 1HH1 ARG 82 1HH1 ARG 82 0.343 -15.804 -9.738 651 2HH1 ARG 82 2HH1 ARG 82 1.359 -16.704 -8.723 652 1HH2 ARG 82 1HH2 ARG 82 4.059 -16.931 -11.020 653 2HH2 ARG 82 2HH2 ARG 82 3.506 -17.372 -9.479 Start of MODEL 4 1 H MET 1 H MET 1 12.552 -21.894 -15.486 2 HA MET 1 HA MET 1 11.035 -23.700 -15.192 3 1HB MET 1 1HB MET 1 10.897 -23.702 -12.781 4 2HB MET 1 2HB MET 1 12.387 -22.905 -13.235 5 1HG MET 1 1HG MET 1 9.855 -21.571 -12.285 6 2HG MET 1 2HG MET 1 11.336 -21.786 -11.365 7 1HE MET 1 1HE MET 1 11.187 -17.900 -11.955 8 2HE MET 1 2HE MET 1 11.332 -19.176 -10.750 9 3HE MET 1 3HE MET 1 9.834 -18.992 -11.659 10 H GLN 2 H GLN 2 9.476 -20.646 -15.446 11 HA GLN 2 HA GLN 2 6.913 -21.968 -15.091 12 1HB GLN 2 1HB GLN 2 7.732 -19.246 -14.097 13 2HB GLN 2 2HB GLN 2 6.054 -19.709 -14.320 14 1HG GLN 2 1HG GLN 2 6.246 -21.418 -12.667 15 2HG GLN 2 2HG GLN 2 7.982 -21.154 -12.524 16 1HE2 GLN 2 1HE2 GLN 2 4.830 -19.922 -11.787 17 2HE2 GLN 2 2HE2 GLN 2 5.358 -18.744 -10.646 18 H THR 3 H THR 3 5.205 -20.667 -16.165 19 HA THR 3 HA THR 3 6.200 -19.638 -18.737 20 HB THR 3 HB THR 3 3.425 -20.662 -18.256 21 HG1 THR 3 HG1 THR 3 4.722 -22.305 -17.459 22 1HG2 THR 3 1HG2 THR 3 3.652 -21.355 -20.587 23 2HG2 THR 3 2HG2 THR 3 5.337 -20.844 -20.581 24 3HG2 THR 3 3HG2 THR 3 4.050 -19.648 -20.404 25 H ASP 4 H ASP 4 4.985 -17.796 -19.549 26 HA ASP 4 HA ASP 4 3.831 -16.236 -17.354 27 1HB ASP 4 1HB ASP 4 4.564 -15.453 -20.162 28 2HB ASP 4 2HB ASP 4 3.766 -14.355 -19.034 29 H THR 5 H THR 5 1.851 -14.832 -18.090 30 HA THR 5 HA THR 5 0.143 -16.128 -19.909 31 HB THR 5 HB THR 5 -0.116 -17.736 -18.144 32 HG1 THR 5 HG1 THR 5 -2.411 -16.473 -17.480 33 1HG2 THR 5 1HG2 THR 5 -0.881 -17.141 -15.871 34 2HG2 THR 5 2HG2 THR 5 -0.768 -15.437 -16.306 35 3HG2 THR 5 3HG2 THR 5 0.689 -16.430 -16.250 36 H LEU 6 H LEU 6 -2.072 -15.094 -19.772 37 HA LEU 6 HA LEU 6 -1.604 -12.244 -19.499 38 1HB LEU 6 1HB LEU 6 -3.899 -13.824 -20.651 39 2HB LEU 6 2HB LEU 6 -3.946 -12.070 -20.549 40 HG LEU 6 HG LEU 6 -1.960 -13.687 -22.091 41 1HD1 LEU 6 1HD1 LEU 6 -3.134 -12.797 -24.075 42 2HD1 LEU 6 2HD1 LEU 6 -4.283 -11.982 -23.016 43 3HD1 LEU 6 3HD1 LEU 6 -4.220 -13.746 -23.059 44 1HD2 LEU 6 1HD2 LEU 6 -1.050 -11.508 -21.297 45 2HD2 LEU 6 2HD2 LEU 6 -2.406 -10.715 -22.119 46 3HD2 LEU 6 3HD2 LEU 6 -1.215 -11.601 -23.047 47 H GLU 7 H GLU 7 -4.521 -11.713 -18.896 48 HA GLU 7 HA GLU 7 -3.917 -11.157 -16.243 49 1HB GLU 7 1HB GLU 7 -5.111 -9.784 -17.912 50 2HB GLU 7 2HB GLU 7 -6.505 -10.837 -17.726 51 1HG GLU 7 1HG GLU 7 -6.669 -8.797 -16.422 52 2HG GLU 7 2HG GLU 7 -6.690 -10.273 -15.440 53 H TYR 8 H TYR 8 -5.629 -13.573 -18.046 54 HA TYR 8 HA TYR 8 -6.983 -15.020 -17.840 55 1HB TYR 8 1HB TYR 8 -6.466 -16.924 -16.299 56 2HB TYR 8 2HB TYR 8 -5.140 -16.268 -17.231 57 HD1 TYR 8 HD1 TYR 8 -6.557 -16.604 -13.840 58 HD2 TYR 8 HD2 TYR 8 -3.231 -15.341 -16.161 59 HE1 TYR 8 HE1 TYR 8 -5.162 -16.543 -11.811 60 HE2 TYR 8 HE2 TYR 8 -1.842 -15.265 -14.149 61 HH TYR 8 HH TYR 8 -2.795 -16.688 -11.243 62 H GLN 9 H GLN 9 -8.042 -12.743 -16.309 63 HA GLN 9 HA GLN 9 -10.001 -14.217 -14.741 64 1HB GLN 9 1HB GLN 9 -9.982 -12.462 -13.048 65 2HB GLN 9 2HB GLN 9 -8.505 -13.436 -13.091 66 1HG GLN 9 1HG GLN 9 -7.342 -11.644 -14.200 67 2HG GLN 9 2HG GLN 9 -8.814 -10.666 -14.264 68 1HE2 GLN 9 1HE2 GLN 9 -9.580 -9.772 -12.323 69 2HE2 GLN 9 2HE2 GLN 9 -8.549 -9.576 -10.949 70 H CYS 10 H CYS 10 -10.275 -13.374 -17.258 71 HA CYS 10 HA CYS 10 -11.482 -10.782 -17.372 72 1HB CYS 10 1HB CYS 10 -11.702 -13.047 -19.344 73 2HB CYS 10 2HB CYS 10 -11.831 -11.311 -19.692 74 H ASP 11 H ASP 11 -13.584 -10.492 -16.942 75 HA ASP 11 HA ASP 11 -15.009 -12.209 -15.359 76 1HB ASP 11 1HB ASP 11 -15.482 -9.857 -15.409 77 2HB ASP 11 2HB ASP 11 -16.048 -9.969 -17.073 78 H GLU 12 H GLU 12 -15.167 -12.011 -18.830 79 HA GLU 12 HA GLU 12 -17.363 -13.873 -18.854 80 1HB GLU 12 1HB GLU 12 -17.436 -12.064 -20.444 81 2HB GLU 12 2HB GLU 12 -15.872 -12.522 -21.089 82 1HG GLU 12 1HG GLU 12 -17.661 -13.186 -22.590 83 2HG GLU 12 2HG GLU 12 -16.804 -14.579 -21.941 84 H LYS 13 H LYS 13 -13.855 -14.015 -19.369 85 HA LYS 13 HA LYS 13 -14.179 -16.865 -19.903 86 1HB LYS 13 1HB LYS 13 -12.357 -15.191 -21.634 87 2HB LYS 13 2HB LYS 13 -12.814 -16.860 -21.860 88 1HG LYS 13 1HG LYS 13 -14.619 -14.463 -22.296 89 2HG LYS 13 2HG LYS 13 -13.788 -15.345 -23.547 90 1HD LYS 13 1HD LYS 13 -15.883 -16.512 -21.734 91 2HD LYS 13 2HD LYS 13 -16.161 -15.922 -23.370 92 1HE LYS 13 1HE LYS 13 -14.524 -17.607 -24.169 93 2HE LYS 13 2HE LYS 13 -14.466 -18.253 -22.523 94 1HZ LYS 13 1HZ LYS 13 -16.091 -19.519 -23.662 95 2HZ LYS 13 2HZ LYS 13 -16.753 -18.161 -24.368 96 3HZ LYS 13 3HZ LYS 13 -16.979 -18.414 -22.731 97 HA PRO 14 HA PRO 14 -10.580 -16.237 -17.278 98 1HB PRO 14 1HB PRO 14 -10.347 -19.185 -17.275 99 2HB PRO 14 2HB PRO 14 -10.564 -18.105 -15.898 100 1HG PRO 14 1HG PRO 14 -12.536 -19.742 -16.787 101 2HG PRO 14 2HG PRO 14 -12.858 -18.173 -16.033 102 1HD PRO 14 1HD PRO 14 -12.899 -18.925 -18.930 103 2HD PRO 14 2HD PRO 14 -13.965 -17.825 -18.030 104 H LEU 15 H LEU 15 -8.831 -15.646 -18.505 105 HA LEU 15 HA LEU 15 -8.448 -17.004 -21.045 106 1HB LEU 15 1HB LEU 15 -9.187 -14.606 -20.926 107 2HB LEU 15 2HB LEU 15 -7.656 -14.247 -20.161 108 HG LEU 15 HG LEU 15 -6.529 -15.097 -22.178 109 1HD1 LEU 15 1HD1 LEU 15 -7.875 -15.271 -24.253 110 2HD1 LEU 15 2HD1 LEU 15 -9.337 -14.969 -23.320 111 3HD1 LEU 15 3HD1 LEU 15 -8.425 -16.445 -23.055 112 1HD2 LEU 15 1HD2 LEU 15 -6.994 -13.060 -23.516 113 2HD2 LEU 15 2HD2 LEU 15 -6.751 -12.736 -21.803 114 3HD2 LEU 15 3HD2 LEU 15 -8.380 -12.733 -22.472 115 H THR 16 H THR 16 -7.071 -18.560 -20.081 116 HA THR 16 HA THR 16 -4.782 -17.369 -18.846 117 HB THR 16 HB THR 16 -5.221 -20.337 -18.688 118 HG1 THR 16 HG1 THR 16 -6.891 -18.316 -17.926 119 1HG2 THR 16 1HG2 THR 16 -4.296 -18.160 -16.828 120 2HG2 THR 16 2HG2 THR 16 -3.234 -19.251 -17.710 121 3HG2 THR 16 3HG2 THR 16 -4.292 -19.882 -16.429 122 H VAL 17 H VAL 17 -2.662 -17.946 -19.566 123 HA VAL 17 HA VAL 17 -2.586 -19.084 -22.290 124 HB VAL 17 HB VAL 17 -1.053 -16.689 -21.326 125 1HG1 VAL 17 1HG1 VAL 17 -0.040 -17.821 -23.202 126 2HG1 VAL 17 2HG1 VAL 17 -0.713 -16.269 -23.709 127 3HG1 VAL 17 3HG1 VAL 17 -1.575 -17.761 -24.067 128 1HG2 VAL 17 1HG2 VAL 17 -3.647 -16.755 -22.786 129 2HG2 VAL 17 2HG2 VAL 17 -2.592 -15.363 -22.739 130 3HG2 VAL 17 3HG2 VAL 17 -3.297 -15.989 -21.234 131 H LYS 18 H LYS 18 -0.788 -20.294 -22.673 132 HA LYS 18 HA LYS 18 1.231 -20.185 -20.598 133 1HB LYS 18 1HB LYS 18 0.542 -22.261 -22.635 134 2HB LYS 18 2HB LYS 18 2.172 -22.194 -22.000 135 1HG LYS 18 1HG LYS 18 0.935 -23.843 -20.789 136 2HG LYS 18 2HG LYS 18 1.266 -22.470 -19.732 137 1HD LYS 18 1HD LYS 18 -1.020 -21.694 -20.026 138 2HD LYS 18 2HD LYS 18 -1.360 -23.052 -21.109 139 1HE LYS 18 1HE LYS 18 -0.736 -24.598 -19.238 140 2HE LYS 18 2HE LYS 18 -0.586 -23.185 -18.202 141 1HZ LYS 18 1HZ LYS 18 -2.696 -24.327 -17.966 142 2HZ LYS 18 2HZ LYS 18 -3.100 -24.043 -19.551 143 3HZ LYS 18 3HZ LYS 18 -2.920 -22.749 -18.453 144 H LEU 19 H LEU 19 1.966 -18.213 -21.214 145 HA LEU 19 HA LEU 19 2.963 -17.721 -23.856 146 1HB LEU 19 1HB LEU 19 3.054 -16.265 -21.258 147 2HB LEU 19 2HB LEU 19 4.155 -15.798 -22.536 148 HG LEU 19 HG LEU 19 1.160 -15.835 -22.909 149 1HD1 LEU 19 1HD1 LEU 19 1.254 -13.416 -22.508 150 2HD1 LEU 19 2HD1 LEU 19 2.970 -13.543 -22.113 151 3HD1 LEU 19 3HD1 LEU 19 1.766 -14.301 -21.070 152 1HD2 LEU 19 1HD2 LEU 19 1.690 -14.375 -24.777 153 2HD2 LEU 19 2HD2 LEU 19 2.617 -15.875 -24.928 154 3HD2 LEU 19 3HD2 LEU 19 3.396 -14.416 -24.352 155 H ASN 20 H ASN 20 4.199 -19.491 -24.109 156 HA ASN 20 HA ASN 20 6.461 -19.874 -22.404 157 1HB ASN 20 1HB ASN 20 5.372 -21.811 -23.516 158 2HB ASN 20 2HB ASN 20 5.818 -21.160 -25.082 159 1HD2 ASN 20 1HD2 ASN 20 7.935 -21.246 -22.199 160 2HD2 ASN 20 2HD2 ASN 20 9.029 -22.371 -22.899 161 H ASN 21 H ASN 21 7.591 -18.095 -22.483 162 HA ASN 21 HA ASN 21 7.895 -16.242 -24.437 163 1HB ASN 21 1HB ASN 21 8.573 -16.009 -22.036 164 2HB ASN 21 2HB ASN 21 10.047 -16.870 -22.459 165 1HD2 ASN 21 1HD2 ASN 21 11.279 -15.117 -21.850 166 2HD2 ASN 21 2HD2 ASN 21 11.437 -13.700 -22.816 167 HA PRO 22 HA PRO 22 12.147 -18.027 -26.001 168 1HB PRO 22 1HB PRO 22 11.881 -20.919 -25.524 169 2HB PRO 22 2HB PRO 22 13.277 -19.867 -25.271 170 1HG PRO 22 1HG PRO 22 11.898 -20.850 -23.209 171 2HG PRO 22 2HG PRO 22 12.550 -19.203 -23.178 172 1HD PRO 22 1HD PRO 22 9.765 -20.133 -23.711 173 2HD PRO 22 2HD PRO 22 10.321 -18.772 -22.717 174 H ARG 23 H ARG 23 9.067 -19.366 -26.372 175 HA ARG 23 HA ARG 23 9.736 -20.301 -29.109 176 1HB ARG 23 1HB ARG 23 7.472 -21.180 -27.328 177 2HB ARG 23 2HB ARG 23 7.659 -21.664 -29.003 178 1HG ARG 23 1HG ARG 23 9.645 -22.220 -26.825 179 2HG ARG 23 2HG ARG 23 8.415 -23.358 -27.375 180 1HD ARG 23 1HD ARG 23 9.404 -23.283 -29.632 181 2HD ARG 23 2HD ARG 23 10.655 -22.198 -29.031 182 HE ARG 23 HE ARG 23 11.064 -24.114 -27.392 183 1HH1 ARG 23 1HH1 ARG 23 10.215 -24.499 -30.829 184 2HH1 ARG 23 2HH1 ARG 23 10.983 -25.997 -30.996 185 1HH2 ARG 23 1HH2 ARG 23 12.134 -26.215 -27.649 186 2HH2 ARG 23 2HH2 ARG 23 12.108 -26.973 -29.172 187 H GLN 24 H GLN 24 7.747 -18.158 -27.232 188 HA GLN 24 HA GLN 24 6.203 -16.655 -27.650 189 1HB GLN 24 1HB GLN 24 7.356 -16.942 -30.366 190 2HB GLN 24 2HB GLN 24 6.032 -15.790 -30.092 191 1HG GLN 24 1HG GLN 24 8.834 -15.771 -28.936 192 2HG GLN 24 2HG GLN 24 8.167 -14.628 -30.096 193 1HE2 GLN 24 1HE2 GLN 24 8.440 -15.496 -26.781 194 2HE2 GLN 24 2HE2 GLN 24 7.609 -14.124 -26.138 195 H GLU 25 H GLU 25 5.763 -19.517 -27.834 196 HA GLU 25 HA GLU 25 3.271 -19.622 -29.336 197 1HB GLU 25 1HB GLU 25 5.114 -21.752 -28.317 198 2HB GLU 25 2HB GLU 25 3.414 -22.113 -28.557 199 1HG GLU 25 1HG GLU 25 3.550 -21.543 -30.813 200 2HG GLU 25 2HG GLU 25 5.268 -21.081 -30.705 201 H VAL 26 H VAL 26 1.481 -20.125 -28.348 202 HA VAL 26 HA VAL 26 1.505 -20.056 -25.405 203 HB VAL 26 HB VAL 26 -0.570 -18.783 -25.485 204 1HG1 VAL 26 1HG1 VAL 26 1.676 -17.491 -27.017 205 2HG1 VAL 26 2HG1 VAL 26 1.502 -17.582 -25.261 206 3HG1 VAL 26 3HG1 VAL 26 0.361 -16.630 -26.213 207 1HG2 VAL 26 1HG2 VAL 26 -1.270 -17.668 -27.592 208 2HG2 VAL 26 2HG2 VAL 26 -1.465 -19.421 -27.630 209 3HG2 VAL 26 3HG2 VAL 26 -0.105 -18.668 -28.461 210 H SER 27 H SER 27 0.496 -21.614 -24.469 211 HA SER 27 HA SER 27 -1.406 -23.142 -26.073 212 1HB SER 27 1HB SER 27 -0.389 -23.837 -23.280 213 2HB SER 27 2HB SER 27 -1.317 -24.836 -24.399 214 HG SER 27 HG SER 27 1.107 -23.803 -25.286 215 H PHE 28 H PHE 28 -3.363 -22.538 -25.849 216 HA PHE 28 HA PHE 28 -3.969 -20.634 -23.690 217 1HB PHE 28 1HB PHE 28 -3.179 -20.023 -26.071 218 2HB PHE 28 2HB PHE 28 -4.916 -20.351 -26.415 219 HD1 PHE 28 HD1 PHE 28 -2.984 -17.834 -26.589 220 HD2 PHE 28 HD2 PHE 28 -6.034 -19.101 -23.945 221 HE1 PHE 28 HE1 PHE 28 -3.435 -15.494 -26.022 222 HE2 PHE 28 HE2 PHE 28 -6.493 -16.797 -23.374 223 HZ PHE 28 HZ PHE 28 -5.214 -14.968 -24.411 224 H VAL 29 H VAL 29 -6.072 -20.608 -23.218 225 HA VAL 29 HA VAL 29 -7.680 -22.812 -24.131 226 HB VAL 29 HB VAL 29 -7.201 -22.820 -21.757 227 1HG1 VAL 29 1HG1 VAL 29 -6.641 -20.518 -21.522 228 2HG1 VAL 29 2HG1 VAL 29 -7.770 -21.005 -20.253 229 3HG1 VAL 29 3HG1 VAL 29 -8.323 -20.035 -21.637 230 1HG2 VAL 29 1HG2 VAL 29 -10.031 -21.931 -22.281 231 2HG2 VAL 29 2HG2 VAL 29 -9.467 -22.799 -20.839 232 3HG2 VAL 29 3HG2 VAL 29 -9.390 -23.571 -22.423 233 H TYR 30 H TYR 30 -9.026 -22.281 -25.524 234 HA TYR 30 HA TYR 30 -9.834 -19.496 -25.994 235 1HB TYR 30 1HB TYR 30 -10.473 -20.130 -28.099 236 2HB TYR 30 2HB TYR 30 -9.622 -21.620 -27.736 237 HD1 TYR 30 HD1 TYR 30 -10.944 -23.670 -27.172 238 HD2 TYR 30 HD2 TYR 30 -12.813 -20.044 -28.287 239 HE1 TYR 30 HE1 TYR 30 -13.061 -24.889 -27.601 240 HE2 TYR 30 HE2 TYR 30 -14.932 -21.234 -28.702 241 HH TYR 30 HH TYR 30 -15.570 -24.281 -27.619 242 H ASP 31 H ASP 31 -11.071 -22.207 -24.390 243 HA ASP 31 HA ASP 31 -13.123 -20.798 -23.101 244 1HB ASP 31 1HB ASP 31 -14.277 -20.873 -25.224 245 2HB ASP 31 2HB ASP 31 -14.016 -22.603 -25.355 246 H ASN 32 H ASN 32 -12.937 -24.115 -24.425 247 HA ASN 32 HA ASN 32 -12.642 -25.077 -21.674 248 1HB ASN 32 1HB ASN 32 -15.008 -25.226 -22.365 249 2HB ASN 32 2HB ASN 32 -14.559 -26.189 -23.755 250 1HD2 ASN 32 1HD2 ASN 32 -13.399 -26.445 -20.395 251 2HD2 ASN 32 2HD2 ASN 32 -14.021 -28.034 -20.153 252 H GLN 33 H GLN 33 -10.858 -24.838 -24.333 253 HA GLN 33 HA GLN 33 -9.693 -27.365 -23.887 254 1HB GLN 33 1HB GLN 33 -9.638 -28.089 -26.171 255 2HB GLN 33 2HB GLN 33 -11.321 -27.835 -25.754 256 1HG GLN 33 1HG GLN 33 -11.223 -25.659 -26.848 257 2HG GLN 33 2HG GLN 33 -9.549 -26.006 -27.297 258 1HE2 GLN 33 1HE2 GLN 33 -12.870 -26.825 -27.850 259 2HE2 GLN 33 2HE2 GLN 33 -12.648 -27.664 -29.339 260 H LEU 34 H LEU 34 -7.659 -27.378 -24.699 261 HA LEU 34 HA LEU 34 -6.698 -24.694 -24.781 262 1HB LEU 34 1HB LEU 34 -5.455 -27.279 -23.898 263 2HB LEU 34 2HB LEU 34 -4.452 -25.902 -24.309 264 HG LEU 34 HG LEU 34 -4.813 -26.228 -21.848 265 1HD1 LEU 34 1HD1 LEU 34 -5.777 -23.656 -22.993 266 2HD1 LEU 34 2HD1 LEU 34 -4.115 -24.124 -22.640 267 3HD1 LEU 34 3HD1 LEU 34 -5.269 -23.912 -21.324 268 1HD2 LEU 34 1HD2 LEU 34 -6.938 -25.551 -20.844 269 2HD2 LEU 34 2HD2 LEU 34 -7.136 -26.979 -21.857 270 3HD2 LEU 34 3HD2 LEU 34 -7.650 -25.401 -22.449 271 H LEU 35 H LEU 35 -5.757 -24.039 -26.596 272 HA LEU 35 HA LEU 35 -4.688 -26.034 -28.431 273 1HB LEU 35 1HB LEU 35 -5.515 -24.920 -30.420 274 2HB LEU 35 2HB LEU 35 -6.862 -25.259 -29.379 275 HG LEU 35 HG LEU 35 -5.637 -22.528 -29.914 276 1HD1 LEU 35 1HD1 LEU 35 -6.853 -23.384 -31.764 277 2HD1 LEU 35 2HD1 LEU 35 -7.727 -22.055 -31.000 278 3HD1 LEU 35 3HD1 LEU 35 -8.242 -23.721 -30.732 279 1HD2 LEU 35 1HD2 LEU 35 -7.507 -21.608 -28.634 280 2HD2 LEU 35 2HD2 LEU 35 -6.510 -22.633 -27.603 281 3HD2 LEU 35 3HD2 LEU 35 -8.047 -23.239 -28.225 282 H HIS 36 H HIS 36 -2.917 -25.215 -29.804 283 HA HIS 36 HA HIS 36 -1.542 -23.183 -28.283 284 1HB HIS 36 1HB HIS 36 0.555 -24.133 -29.140 285 2HB HIS 36 2HB HIS 36 -0.400 -25.352 -28.315 286 HD2 HIS 36 HD2 HIS 36 1.131 -24.595 -31.762 287 HE1 HIS 36 HE1 HIS 36 -0.897 -28.280 -32.029 288 HE2 HIS 36 HE2 HIS 36 0.978 -26.906 -32.911 289 H LEU 37 H LEU 37 -0.709 -21.504 -29.223 290 HA LEU 37 HA LEU 37 -1.203 -21.041 -32.063 291 1HB LEU 37 1HB LEU 37 -1.979 -18.971 -29.992 292 2HB LEU 37 2HB LEU 37 -2.246 -18.855 -31.674 293 HG LEU 37 HG LEU 37 -3.618 -21.104 -31.174 294 1HD1 LEU 37 1HD1 LEU 37 -3.270 -21.113 -28.815 295 2HD1 LEU 37 2HD1 LEU 37 -4.972 -20.745 -29.121 296 3HD1 LEU 37 3HD1 LEU 37 -3.856 -19.462 -28.671 297 1HD2 LEU 37 1HD2 LEU 37 -4.522 -19.328 -32.418 298 2HD2 LEU 37 2HD2 LEU 37 -4.555 -18.276 -31.007 299 3HD2 LEU 37 3HD2 LEU 37 -5.654 -19.661 -31.105 300 H LYS 38 H LYS 38 -0.101 -18.975 -32.631 301 HA LYS 38 HA LYS 38 2.036 -18.372 -30.817 302 1HB LYS 38 1HB LYS 38 3.807 -19.055 -32.147 303 2HB LYS 38 2HB LYS 38 2.626 -20.375 -32.082 304 1HG LYS 38 1HG LYS 38 2.888 -18.477 -34.348 305 2HG LYS 38 2HG LYS 38 3.707 -20.062 -34.308 306 1HD LYS 38 1HD LYS 38 1.342 -20.985 -33.946 307 2HD LYS 38 2HD LYS 38 0.815 -19.360 -34.398 308 1HE LYS 38 1HE LYS 38 0.735 -20.786 -36.367 309 2HE LYS 38 2HE LYS 38 2.019 -19.594 -36.545 310 1HZ LYS 38 1HZ LYS 38 3.642 -21.259 -35.910 311 2HZ LYS 38 2HZ LYS 38 2.756 -21.856 -37.202 312 3HZ LYS 38 3HZ LYS 38 2.445 -22.399 -35.653 313 H GLN 39 H GLN 39 3.279 -16.831 -31.516 314 HA GLN 39 HA GLN 39 1.871 -14.699 -32.804 315 1HB GLN 39 1HB GLN 39 3.005 -14.178 -30.905 316 2HB GLN 39 2HB GLN 39 4.525 -14.915 -31.457 317 1HG GLN 39 1HG GLN 39 4.790 -13.104 -33.044 318 2HG GLN 39 2HG GLN 39 3.233 -12.433 -32.569 319 1HE2 GLN 39 1HE2 GLN 39 6.544 -12.870 -31.680 320 2HE2 GLN 39 2HE2 GLN 39 6.522 -11.802 -30.334 321 H GLY 40 H GLY 40 1.704 -14.821 -34.797 322 1HA GLY 40 1HA GLY 40 3.953 -15.667 -36.526 323 2HA GLY 40 2HA GLY 40 2.271 -15.652 -37.019 324 H ILE 41 H ILE 41 1.654 -14.027 -38.308 325 HA ILE 41 HA ILE 41 3.569 -11.915 -38.881 326 HB ILE 41 HB ILE 41 0.931 -12.587 -40.251 327 1HG1 ILE 41 1HG1 ILE 41 2.492 -13.224 -42.210 328 2HG1 ILE 41 2HG1 ILE 41 3.785 -13.204 -41.024 329 1HG2 ILE 41 1HG2 ILE 41 3.052 -10.625 -41.101 330 2HG2 ILE 41 2HG2 ILE 41 1.460 -10.227 -40.461 331 3HG2 ILE 41 3HG2 ILE 41 1.603 -11.039 -42.020 332 1HD1 ILE 41 1HD1 ILE 41 2.700 -15.009 -39.800 333 2HD1 ILE 41 2HD1 ILE 41 3.006 -15.459 -41.477 334 3HD1 ILE 41 3HD1 ILE 41 1.378 -15.012 -40.968 335 H SER 42 H SER 42 3.381 -9.879 -38.027 336 HA SER 42 HA SER 42 1.379 -9.318 -36.171 337 1HB SER 42 1HB SER 42 2.887 -7.038 -37.224 338 2HB SER 42 2HB SER 42 2.757 -7.711 -35.582 339 HG SER 42 HG SER 42 4.855 -7.862 -36.789 340 H ALA 43 H ALA 43 -0.574 -9.540 -37.310 341 HA ALA 43 HA ALA 43 -1.357 -8.094 -39.440 342 1HB ALA 43 1HB ALA 43 -3.662 -8.551 -38.718 343 2HB ALA 43 2HB ALA 43 -3.060 -9.023 -37.131 344 3HB ALA 43 3HB ALA 43 -2.624 -9.968 -38.556 345 H SER 44 H SER 44 -2.220 -7.387 -36.043 346 HA SER 44 HA SER 44 -1.818 -4.537 -36.467 347 1HB SER 44 1HB SER 44 -4.494 -5.692 -35.622 348 2HB SER 44 2HB SER 44 -4.099 -3.978 -35.706 349 HG SER 44 HG SER 44 -3.482 -4.730 -38.032 350 H GLY 45 H GLY 45 -0.560 -6.638 -34.770 351 1HA GLY 45 1HA GLY 45 -0.234 -5.441 -32.341 352 2HA GLY 45 2HA GLY 45 -1.668 -6.442 -32.129 353 H ALA 46 H ALA 46 -0.937 -8.006 -30.805 354 HA ALA 46 HA ALA 46 1.447 -9.388 -31.573 355 1HB ALA 46 1HB ALA 46 1.180 -10.229 -29.143 356 2HB ALA 46 2HB ALA 46 0.001 -8.908 -28.964 357 3HB ALA 46 3HB ALA 46 1.679 -8.547 -29.333 358 H ARG 47 H ARG 47 0.940 -11.460 -32.045 359 HA ARG 47 HA ARG 47 -1.827 -11.633 -32.112 360 1HB ARG 47 1HB ARG 47 -1.351 -12.510 -34.698 361 2HB ARG 47 2HB ARG 47 -1.875 -10.908 -34.212 362 1HG ARG 47 1HG ARG 47 0.048 -10.858 -35.792 363 2HG ARG 47 2HG ARG 47 0.421 -10.082 -34.252 364 1HD ARG 47 1HD ARG 47 1.499 -12.253 -33.557 365 2HD ARG 47 2HD ARG 47 1.241 -12.828 -35.178 366 HE ARG 47 HE ARG 47 3.121 -11.816 -35.802 367 1HH1 ARG 47 1HH1 ARG 47 1.998 -9.588 -33.267 368 2HH1 ARG 47 2HH1 ARG 47 3.548 -9.019 -32.923 369 1HH2 ARG 47 1HH2 ARG 47 5.271 -11.013 -35.250 370 2HH2 ARG 47 2HH2 ARG 47 5.436 -9.827 -34.057 371 H TYR 48 H TYR 48 -2.049 -13.783 -30.992 372 HA TYR 48 HA TYR 48 -0.274 -15.941 -31.847 373 1HB TYR 48 1HB TYR 48 -2.121 -15.765 -29.441 374 2HB TYR 48 2HB TYR 48 -0.861 -16.960 -29.770 375 HD1 TYR 48 HD1 TYR 48 1.539 -16.300 -29.659 376 HD2 TYR 48 HD2 TYR 48 -1.569 -13.688 -28.394 377 HE1 TYR 48 HE1 TYR 48 3.188 -14.932 -28.444 378 HE2 TYR 48 HE2 TYR 48 0.069 -12.317 -27.179 379 HH TYR 48 HH TYR 48 2.266 -12.556 -26.204 380 H THR 49 H THR 49 -1.097 -17.009 -33.399 381 HA THR 49 HA THR 49 -3.916 -17.657 -33.277 382 HB THR 49 HB THR 49 -2.699 -16.267 -35.644 383 HG1 THR 49 HG1 THR 49 -3.752 -15.299 -33.436 384 1HG2 THR 49 1HG2 THR 49 -4.394 -17.869 -36.354 385 2HG2 THR 49 2HG2 THR 49 -4.997 -16.227 -36.576 386 3HG2 THR 49 3HG2 THR 49 -5.545 -17.192 -35.205 387 H ASP 50 H ASP 50 -4.259 -19.685 -34.163 388 HA ASP 50 HA ASP 50 -1.994 -20.856 -35.525 389 1HB ASP 50 1HB ASP 50 -2.780 -23.030 -34.753 390 2HB ASP 50 2HB ASP 50 -2.692 -21.945 -33.377 391 H GLY 51 H GLY 51 -5.373 -20.215 -35.571 392 1HA GLY 51 1HA GLY 51 -5.971 -19.704 -38.032 393 2HA GLY 51 2HA GLY 51 -5.653 -21.426 -38.207 394 H ILE 52 H ILE 52 -6.803 -21.479 -35.216 395 HA ILE 52 HA ILE 52 -9.470 -22.084 -36.176 396 HB ILE 52 HB ILE 52 -8.311 -22.383 -33.366 397 1HG1 ILE 52 1HG1 ILE 52 -7.075 -23.769 -34.959 398 2HG1 ILE 52 2HG1 ILE 52 -8.073 -24.763 -33.909 399 1HG2 ILE 52 1HG2 ILE 52 -10.191 -23.925 -32.990 400 2HG2 ILE 52 2HG2 ILE 52 -10.788 -23.594 -34.614 401 3HG2 ILE 52 3HG2 ILE 52 -10.771 -22.309 -33.406 402 1HD1 ILE 52 1HD1 ILE 52 -8.691 -24.024 -36.765 403 2HD1 ILE 52 2HD1 ILE 52 -9.708 -25.007 -35.715 404 3HD1 ILE 52 3HD1 ILE 52 -8.112 -25.589 -36.186 405 H TYR 53 H TYR 53 -7.944 -19.997 -33.790 406 HA TYR 53 HA TYR 53 -10.040 -17.961 -34.166 407 1HB TYR 53 1HB TYR 53 -8.929 -18.828 -31.493 408 2HB TYR 53 2HB TYR 53 -9.851 -17.356 -31.869 409 HD1 TYR 53 HD1 TYR 53 -12.206 -17.437 -32.229 410 HD2 TYR 53 HD2 TYR 53 -10.065 -21.032 -31.560 411 HE1 TYR 53 HE1 TYR 53 -14.314 -18.639 -31.998 412 HE2 TYR 53 HE2 TYR 53 -12.182 -22.257 -31.325 413 HH TYR 53 HH TYR 53 -14.527 -21.828 -30.819 414 H VAL 54 H VAL 54 -9.260 -15.946 -33.460 415 HA VAL 54 HA VAL 54 -6.396 -15.619 -33.997 416 HB VAL 54 HB VAL 54 -8.829 -13.987 -34.377 417 1HG1 VAL 54 1HG1 VAL 54 -7.285 -12.288 -35.546 418 2HG1 VAL 54 2HG1 VAL 54 -5.912 -13.286 -35.067 419 3HG1 VAL 54 3HG1 VAL 54 -6.890 -12.488 -33.837 420 1HG2 VAL 54 1HG2 VAL 54 -8.661 -15.663 -36.061 421 2HG2 VAL 54 2HG2 VAL 54 -6.991 -15.222 -36.423 422 3HG2 VAL 54 3HG2 VAL 54 -8.303 -14.111 -36.816 423 H PHE 55 H PHE 55 -5.468 -15.313 -32.011 424 HA PHE 55 HA PHE 55 -6.948 -13.760 -30.040 425 1HB PHE 55 1HB PHE 55 -4.469 -15.485 -29.769 426 2HB PHE 55 2HB PHE 55 -5.075 -14.471 -28.472 427 HD1 PHE 55 HD1 PHE 55 -6.249 -17.190 -30.757 428 HD2 PHE 55 HD2 PHE 55 -6.463 -15.435 -26.906 429 HE1 PHE 55 HE1 PHE 55 -7.649 -19.062 -29.980 430 HE2 PHE 55 HE2 PHE 55 -7.873 -17.290 -26.131 431 HZ PHE 55 HZ PHE 55 -8.465 -19.109 -27.671 432 H TRP 56 H TRP 56 -6.724 -11.676 -30.479 433 HA TRP 56 HA TRP 56 -4.150 -10.727 -31.300 434 1HB TRP 56 1HB TRP 56 -5.738 -10.169 -32.927 435 2HB TRP 56 2HB TRP 56 -6.948 -9.711 -31.721 436 HD1 TRP 56 HD1 TRP 56 -3.306 -8.424 -32.305 437 HE1 TRP 56 HE1 TRP 56 -3.411 -5.835 -32.415 438 HE3 TRP 56 HE3 TRP 56 -8.355 -7.744 -31.894 439 HZ2 TRP 56 HZ2 TRP 56 -5.326 -3.825 -32.370 440 HZ3 TRP 56 HZ3 TRP 56 -9.240 -5.450 -31.941 441 HH2 TRP 56 HH2 TRP 56 -7.756 -3.533 -32.179 442 H SER 57 H SER 57 -3.139 -9.805 -30.007 443 HA SER 57 HA SER 57 -4.299 -8.618 -27.588 444 1HB SER 57 1HB SER 57 -2.801 -10.592 -27.197 445 2HB SER 57 2HB SER 57 -1.506 -9.745 -28.010 446 HG SER 57 HG SER 57 -2.842 -8.582 -25.809 447 H LYS 58 H LYS 58 -4.330 -6.461 -27.848 448 HA LYS 58 HA LYS 58 -2.511 -5.313 -29.747 449 1HB LYS 58 1HB LYS 58 -4.769 -4.630 -29.913 450 2HB LYS 58 2HB LYS 58 -4.873 -4.323 -28.193 451 1HG LYS 58 1HG LYS 58 -3.464 -2.387 -28.429 452 2HG LYS 58 2HG LYS 58 -3.268 -2.714 -30.159 453 1HD LYS 58 1HD LYS 58 -5.450 -2.207 -30.643 454 2HD LYS 58 2HD LYS 58 -5.985 -2.559 -28.998 455 1HE LYS 58 1HE LYS 58 -4.275 -0.191 -29.754 456 2HE LYS 58 2HE LYS 58 -6.029 -0.121 -29.574 457 1HZ LYS 58 1HZ LYS 58 -4.972 0.579 -27.515 458 2HZ LYS 58 2HZ LYS 58 -4.065 -0.824 -27.453 459 3HZ LYS 58 3HZ LYS 58 -5.725 -0.909 -27.249 460 H GLY 59 H GLY 59 -3.496 -4.173 -26.509 461 1HA GLY 59 1HA GLY 59 -0.734 -4.360 -25.653 462 2HA GLY 59 2HA GLY 59 -1.378 -2.729 -25.793 463 H ASP 60 H ASP 60 -3.742 -2.725 -24.842 464 HA ASP 60 HA ASP 60 -3.402 -3.484 -22.025 465 1HB ASP 60 1HB ASP 60 -5.344 -1.633 -23.408 466 2HB ASP 60 2HB ASP 60 -5.456 -2.059 -21.710 467 H GLU 61 H GLU 61 -5.013 -4.381 -24.871 468 HA GLU 61 HA GLU 61 -7.046 -5.794 -23.378 469 1HB GLU 61 1HB GLU 61 -8.580 -5.330 -25.183 470 2HB GLU 61 2HB GLU 61 -8.048 -3.844 -24.393 471 1HG GLU 61 1HG GLU 61 -6.858 -4.941 -26.857 472 2HG GLU 61 2HG GLU 61 -8.245 -3.837 -26.929 473 H ALA 62 H ALA 62 -7.945 -7.535 -24.535 474 HA ALA 62 HA ALA 62 -6.242 -8.557 -26.561 475 1HB ALA 62 1HB ALA 62 -7.309 -10.106 -24.186 476 2HB ALA 62 2HB ALA 62 -5.618 -9.742 -24.528 477 3HB ALA 62 3HB ALA 62 -6.512 -10.847 -25.574 478 H THR 63 H THR 63 -7.486 -9.326 -28.183 479 HA THR 63 HA THR 63 -10.377 -9.613 -27.798 480 HB THR 63 HB THR 63 -9.004 -8.346 -30.183 481 HG1 THR 63 HG1 THR 63 -9.520 -7.401 -27.748 482 1HG2 THR 63 1HG2 THR 63 -11.292 -9.368 -30.529 483 2HG2 THR 63 2HG2 THR 63 -11.207 -7.634 -30.825 484 3HG2 THR 63 3HG2 THR 63 -11.896 -8.224 -29.319 485 H VAL 64 H VAL 64 -11.072 -11.562 -28.583 486 HA VAL 64 HA VAL 64 -9.220 -13.096 -30.254 487 HB VAL 64 HB VAL 64 -11.120 -14.145 -28.166 488 1HG1 VAL 64 1HG1 VAL 64 -10.790 -15.668 -29.952 489 2HG1 VAL 64 2HG1 VAL 64 -9.967 -16.264 -28.519 490 3HG1 VAL 64 3HG1 VAL 64 -9.029 -15.529 -29.837 491 1HG2 VAL 64 1HG2 VAL 64 -9.138 -14.690 -26.833 492 2HG2 VAL 64 2HG2 VAL 64 -9.307 -12.949 -27.077 493 3HG2 VAL 64 3HG2 VAL 64 -8.121 -13.862 -28.012 494 H TYR 65 H TYR 65 -10.113 -13.166 -32.190 495 HA TYR 65 HA TYR 65 -12.940 -13.814 -32.394 496 1HB TYR 65 1HB TYR 65 -13.473 -11.939 -33.802 497 2HB TYR 65 2HB TYR 65 -12.886 -11.368 -32.236 498 HD1 TYR 65 HD1 TYR 65 -12.611 -11.143 -35.767 499 HD2 TYR 65 HD2 TYR 65 -10.403 -10.564 -32.178 500 HE1 TYR 65 HE1 TYR 65 -11.048 -9.709 -36.971 501 HE2 TYR 65 HE2 TYR 65 -8.824 -9.109 -33.387 502 HH TYR 65 HH TYR 65 -8.071 -8.794 -35.784 503 H LYS 66 H LYS 66 -13.013 -15.494 -33.695 504 HA LYS 66 HA LYS 66 -11.491 -15.406 -36.106 505 1HB LYS 66 1HB LYS 66 -11.806 -17.602 -34.927 506 2HB LYS 66 2HB LYS 66 -13.543 -17.363 -34.992 507 1HG LYS 66 1HG LYS 66 -13.020 -18.882 -36.731 508 2HG LYS 66 2HG LYS 66 -13.341 -17.332 -37.498 509 1HD LYS 66 1HD LYS 66 -10.787 -16.990 -37.374 510 2HD LYS 66 2HD LYS 66 -10.727 -18.729 -37.103 511 1HE LYS 66 1HE LYS 66 -11.832 -17.283 -39.509 512 2HE LYS 66 2HE LYS 66 -10.435 -18.349 -39.441 513 1HZ LYS 66 1HZ LYS 66 -12.173 -19.538 -40.405 514 2HZ LYS 66 2HZ LYS 66 -13.312 -19.063 -39.296 515 3HZ LYS 66 3HZ LYS 66 -12.114 -20.167 -38.846 516 H ARG 67 H ARG 67 -12.643 -15.176 -37.895 517 HA ARG 67 HA ARG 67 -14.750 -13.441 -38.375 518 1HB ARG 67 1HB ARG 67 -13.382 -14.209 -40.144 519 2HB ARG 67 2HB ARG 67 -13.866 -15.874 -39.883 520 1HG ARG 67 1HG ARG 67 -16.146 -15.271 -40.605 521 2HG ARG 67 2HG ARG 67 -15.552 -13.649 -40.995 522 1HD ARG 67 1HD ARG 67 -13.980 -14.534 -42.507 523 2HD ARG 67 2HD ARG 67 -14.396 -16.185 -42.051 524 HE ARG 67 HE ARG 67 -16.729 -15.099 -42.963 525 1HH1 ARG 67 1HH1 ARG 67 -13.479 -15.441 -44.320 526 2HH1 ARG 67 2HH1 ARG 67 -14.016 -15.650 -45.921 527 1HH2 ARG 67 1HH2 ARG 67 -17.454 -15.393 -45.204 528 2HH2 ARG 67 2HH2 ARG 67 -16.283 -15.650 -46.422 529 H ASP 68 H ASP 68 -14.909 -16.720 -37.338 530 HA ASP 68 HA ASP 68 -17.719 -17.045 -37.992 531 1HB ASP 68 1HB ASP 68 -15.648 -19.037 -37.094 532 2HB ASP 68 2HB ASP 68 -17.307 -19.407 -37.546 533 H ARG 69 H ARG 69 -15.636 -16.317 -35.429 534 HA ARG 69 HA ARG 69 -17.666 -16.484 -33.541 535 1HB ARG 69 1HB ARG 69 -17.394 -18.870 -33.740 536 2HB ARG 69 2HB ARG 69 -15.680 -18.752 -33.428 537 1HG ARG 69 1HG ARG 69 -16.545 -19.543 -31.417 538 2HG ARG 69 2HG ARG 69 -16.388 -17.818 -31.126 539 1HD ARG 69 1HD ARG 69 -18.936 -19.234 -31.912 540 2HD ARG 69 2HD ARG 69 -18.509 -18.767 -30.275 541 HE ARG 69 HE ARG 69 -19.021 -16.864 -32.472 542 1HH1 ARG 69 1HH1 ARG 69 -19.298 -17.758 -29.045 543 2HH1 ARG 69 2HH1 ARG 69 -20.173 -16.350 -28.648 544 1HH2 ARG 69 1HH2 ARG 69 -20.244 -14.966 -31.865 545 2HH2 ARG 69 2HH2 ARG 69 -20.759 -14.812 -30.231 546 H ILE 70 H ILE 70 -17.040 -14.638 -32.569 547 HA ILE 70 HA ILE 70 -14.422 -14.114 -31.427 548 HB ILE 70 HB ILE 70 -17.071 -12.901 -30.761 549 1HG1 ILE 70 1HG1 ILE 70 -15.064 -11.864 -32.688 550 2HG1 ILE 70 2HG1 ILE 70 -16.551 -12.676 -33.207 551 1HG2 ILE 70 1HG2 ILE 70 -15.345 -12.421 -29.134 552 2HG2 ILE 70 2HG2 ILE 70 -15.760 -10.952 -30.015 553 3HG2 ILE 70 3HG2 ILE 70 -14.276 -11.825 -30.405 554 1HD1 ILE 70 1HD1 ILE 70 -16.774 -10.256 -33.421 555 2HD1 ILE 70 2HD1 ILE 70 -16.303 -10.039 -31.738 556 3HD1 ILE 70 3HD1 ILE 70 -17.832 -10.827 -32.130 557 H VAL 71 H VAL 71 -13.844 -14.616 -29.584 558 HA VAL 71 HA VAL 71 -15.844 -15.710 -27.809 559 HB VAL 71 HB VAL 71 -14.226 -17.290 -26.694 560 1HG1 VAL 71 1HG1 VAL 71 -14.435 -19.001 -28.401 561 2HG1 VAL 71 2HG1 VAL 71 -14.666 -17.769 -29.629 562 3HG1 VAL 71 3HG1 VAL 71 -15.888 -17.998 -28.378 563 1HG2 VAL 71 1HG2 VAL 71 -12.528 -16.761 -29.132 564 2HG2 VAL 71 2HG2 VAL 71 -12.196 -17.935 -27.857 565 3HG2 VAL 71 3HG2 VAL 71 -12.145 -16.212 -27.506 566 H LEU 72 H LEU 72 -13.455 -13.463 -28.130 567 HA LEU 72 HA LEU 72 -14.197 -12.412 -25.551 568 1HB LEU 72 1HB LEU 72 -11.304 -12.907 -26.236 569 2HB LEU 72 2HB LEU 72 -11.784 -11.651 -25.129 570 HG LEU 72 HG LEU 72 -12.949 -13.655 -23.909 571 1HD1 LEU 72 1HD1 LEU 72 -11.577 -15.695 -24.023 572 2HD1 LEU 72 2HD1 LEU 72 -10.681 -15.007 -25.377 573 3HD1 LEU 72 3HD1 LEU 72 -12.405 -15.356 -25.541 574 1HD2 LEU 72 1HD2 LEU 72 -11.334 -12.177 -22.944 575 2HD2 LEU 72 2HD2 LEU 72 -10.027 -12.997 -23.789 576 3HD2 LEU 72 3HD2 LEU 72 -10.928 -13.841 -22.527 577 H ASN 73 H ASN 73 -14.366 -10.206 -25.743 578 HA ASN 73 HA ASN 73 -12.793 -8.995 -27.845 579 1HB ASN 73 1HB ASN 73 -14.680 -7.695 -28.748 580 2HB ASN 73 2HB ASN 73 -14.935 -9.423 -28.933 581 1HD2 ASN 73 1HD2 ASN 73 -16.548 -10.448 -27.664 582 2HD2 ASN 73 2HD2 ASN 73 -17.742 -9.487 -26.878 583 H ASN 74 H ASN 74 -13.136 -9.056 -24.882 584 HA ASN 74 HA ASN 74 -12.294 -6.465 -24.391 585 1HB ASN 74 1HB ASN 74 -14.740 -5.955 -24.650 586 2HB ASN 74 2HB ASN 74 -15.058 -7.008 -23.274 587 1HD2 ASN 74 1HD2 ASN 74 -14.425 -6.330 -21.214 588 2HD2 ASN 74 2HD2 ASN 74 -13.985 -4.706 -20.877 589 H CYS 75 H CYS 75 -10.747 -7.493 -23.475 590 HA CYS 75 HA CYS 75 -11.135 -7.976 -20.693 591 1HB CYS 75 1HB CYS 75 -11.025 -10.335 -21.514 592 2HB CYS 75 2HB CYS 75 -9.551 -9.949 -22.408 593 H GLN 76 H GLN 76 -8.912 -7.595 -19.604 594 HA GLN 76 HA GLN 76 -7.329 -6.067 -21.347 595 1HB GLN 76 1HB GLN 76 -8.840 -4.895 -19.018 596 2HB GLN 76 2HB GLN 76 -7.437 -4.122 -19.755 597 1HG GLN 76 1HG GLN 76 -8.587 -4.071 -21.904 598 2HG GLN 76 2HG GLN 76 -10.003 -4.813 -21.204 599 1HE2 GLN 76 1HE2 GLN 76 -8.071 -1.970 -21.427 600 2HE2 GLN 76 2HE2 GLN 76 -9.196 -0.873 -20.723 601 H LEU 77 H LEU 77 -5.454 -6.327 -20.909 602 HA LEU 77 HA LEU 77 -5.012 -8.168 -18.891 603 1HB LEU 77 1HB LEU 77 -4.190 -8.953 -20.908 604 2HB LEU 77 2HB LEU 77 -3.581 -7.399 -21.385 605 HG LEU 77 HG LEU 77 -1.857 -9.217 -21.088 606 1HD1 LEU 77 1HD1 LEU 77 -1.187 -6.932 -21.165 607 2HD1 LEU 77 2HD1 LEU 77 -0.206 -7.874 -20.047 608 3HD1 LEU 77 3HD1 LEU 77 -1.442 -6.780 -19.421 609 1HD2 LEU 77 1HD2 LEU 77 -1.110 -9.758 -18.838 610 2HD2 LEU 77 2HD2 LEU 77 -2.776 -10.282 -19.098 611 3HD2 LEU 77 3HD2 LEU 77 -2.442 -8.824 -18.164 612 H GLN 78 H GLN 78 -3.511 -7.698 -17.054 613 HA GLN 78 HA GLN 78 -2.797 -4.867 -16.965 614 1HB GLN 78 1HB GLN 78 -2.790 -6.927 -14.765 615 2HB GLN 78 2HB GLN 78 -2.296 -5.252 -14.551 616 1HG GLN 78 1HG GLN 78 -5.020 -6.148 -15.469 617 2HG GLN 78 2HG GLN 78 -4.607 -5.648 -13.831 618 1HE2 GLN 78 1HE2 GLN 78 -5.089 -4.590 -17.106 619 2HE2 GLN 78 2HE2 GLN 78 -5.198 -2.908 -16.789 620 H ASN 79 H ASN 79 -1.127 -8.013 -16.675 621 HA ASN 79 HA ASN 79 1.257 -7.002 -17.752 622 1HB ASN 79 1HB ASN 79 1.564 -6.081 -15.475 623 2HB ASN 79 2HB ASN 79 1.117 -7.627 -14.777 624 1HD2 ASN 79 1HD2 ASN 79 3.039 -7.640 -13.631 625 2HD2 ASN 79 2HD2 ASN 79 4.551 -8.047 -14.358 626 HA PRO 80 HA PRO 80 0.624 -11.295 -18.091 627 1HB PRO 80 1HB PRO 80 2.214 -11.917 -20.175 628 2HB PRO 80 2HB PRO 80 0.699 -11.043 -20.361 629 1HG PRO 80 1HG PRO 80 3.476 -9.998 -20.455 630 2HG PRO 80 2HG PRO 80 2.029 -9.412 -21.284 631 1HD PRO 80 1HD PRO 80 3.172 -8.362 -18.910 632 2HD PRO 80 2HD PRO 80 1.605 -7.931 -19.626 633 H GLN 81 H GLN 81 3.608 -9.827 -17.249 634 HA GLN 81 HA GLN 81 4.983 -12.241 -16.871 635 1HB GLN 81 1HB GLN 81 5.921 -9.949 -17.421 636 2HB GLN 81 2HB GLN 81 5.526 -9.546 -15.743 637 1HG GLN 81 1HG GLN 81 7.206 -11.871 -16.409 638 2HG GLN 81 2HG GLN 81 7.914 -10.251 -16.381 639 1HE2 GLN 81 1HE2 GLN 81 8.403 -12.627 -14.667 640 2HE2 GLN 81 2HE2 GLN 81 8.130 -12.095 -13.048 641 H ARG 82 H ARG 82 3.684 -13.296 -15.663 642 HA ARG 82 HA ARG 82 2.967 -12.326 -12.969 643 1HB ARG 82 1HB ARG 82 2.142 -15.016 -14.058 644 2HB ARG 82 2HB ARG 82 1.357 -14.061 -12.814 645 1HG ARG 82 1HG ARG 82 1.374 -13.489 -15.769 646 2HG ARG 82 2HG ARG 82 0.035 -14.135 -14.833 647 1HD ARG 82 1HD ARG 82 1.280 -11.460 -14.277 648 2HD ARG 82 2HD ARG 82 -0.022 -11.680 -15.433 649 HE ARG 82 HE ARG 82 -0.386 -12.518 -12.651 650 1HH1 ARG 82 1HH1 ARG 82 -1.179 -10.358 -15.329 651 2HH1 ARG 82 2HH1 ARG 82 -2.597 -9.708 -14.667 652 1HH2 ARG 82 1HH2 ARG 82 -2.332 -11.571 -11.613 653 2HH2 ARG 82 2HH2 ARG 82 -3.217 -10.380 -12.446 Start of MODEL 5 1 H MET 1 H MET 1 3.392 -22.317 -14.356 2 HA MET 1 HA MET 1 3.563 -20.813 -12.577 3 1HB MET 1 1HB MET 1 5.436 -20.954 -10.930 4 2HB MET 1 2HB MET 1 4.229 -22.204 -10.735 5 1HG MET 1 1HG MET 1 6.907 -22.576 -12.068 6 2HG MET 1 2HG MET 1 6.554 -22.981 -10.389 7 1HE MET 1 1HE MET 1 7.347 -25.461 -10.634 8 2HE MET 1 2HE MET 1 7.837 -25.142 -12.299 9 3HE MET 1 3HE MET 1 6.839 -26.545 -11.927 10 H GLN 2 H GLN 2 6.420 -22.285 -14.230 11 HA GLN 2 HA GLN 2 7.341 -19.589 -14.624 12 1HB GLN 2 1HB GLN 2 9.048 -21.223 -14.047 13 2HB GLN 2 2HB GLN 2 8.605 -22.222 -15.424 14 1HG GLN 2 1HG GLN 2 9.355 -20.455 -16.939 15 2HG GLN 2 2HG GLN 2 9.791 -19.454 -15.557 16 1HE2 GLN 2 1HE2 GLN 2 10.545 -22.340 -17.343 17 2HE2 GLN 2 2HE2 GLN 2 12.149 -22.516 -16.755 18 H THR 3 H THR 3 5.446 -19.096 -15.758 19 HA THR 3 HA THR 3 5.911 -18.881 -18.588 20 HB THR 3 HB THR 3 3.215 -19.943 -17.745 21 HG1 THR 3 HG1 THR 3 5.553 -21.355 -18.090 22 1HG2 THR 3 1HG2 THR 3 3.040 -20.455 -20.117 23 2HG2 THR 3 2HG2 THR 3 4.683 -19.861 -20.364 24 3HG2 THR 3 3HG2 THR 3 3.413 -18.754 -19.841 25 H ASP 4 H ASP 4 5.191 -16.983 -19.131 26 HA ASP 4 HA ASP 4 4.031 -15.377 -17.063 27 1HB ASP 4 1HB ASP 4 4.728 -14.897 -19.927 28 2HB ASP 4 2HB ASP 4 4.060 -13.628 -18.879 29 H THR 5 H THR 5 1.945 -14.250 -17.428 30 HA THR 5 HA THR 5 0.175 -15.584 -19.272 31 HB THR 5 HB THR 5 -0.099 -15.884 -16.263 32 HG1 THR 5 HG1 THR 5 0.801 -17.438 -18.209 33 1HG2 THR 5 1HG2 THR 5 -2.079 -16.768 -18.368 34 2HG2 THR 5 2HG2 THR 5 -2.327 -15.434 -17.246 35 3HG2 THR 5 3HG2 THR 5 -2.191 -17.085 -16.635 36 H LEU 6 H LEU 6 -1.966 -14.518 -19.376 37 HA LEU 6 HA LEU 6 -1.475 -11.678 -18.979 38 1HB LEU 6 1HB LEU 6 -3.706 -13.054 -20.496 39 2HB LEU 6 2HB LEU 6 -3.466 -11.321 -20.419 40 HG LEU 6 HG LEU 6 -1.791 -13.350 -21.838 41 1HD1 LEU 6 1HD1 LEU 6 -2.227 -11.959 -23.756 42 2HD1 LEU 6 2HD1 LEU 6 -3.148 -10.842 -22.752 43 3HD1 LEU 6 3HD1 LEU 6 -3.738 -12.484 -23.006 44 1HD2 LEU 6 1HD2 LEU 6 -1.066 -10.471 -21.266 45 2HD2 LEU 6 2HD2 LEU 6 -0.239 -11.517 -22.417 46 3HD2 LEU 6 3HD2 LEU 6 -0.202 -11.900 -20.700 47 H GLU 7 H GLU 7 -4.517 -11.259 -18.953 48 HA GLU 7 HA GLU 7 -4.553 -10.511 -16.240 49 1HB GLU 7 1HB GLU 7 -5.667 -9.275 -18.076 50 2HB GLU 7 2HB GLU 7 -6.720 -10.648 -18.358 51 1HG GLU 7 1HG GLU 7 -7.672 -10.378 -16.154 52 2HG GLU 7 2HG GLU 7 -6.617 -8.994 -15.863 53 H TYR 8 H TYR 8 -5.488 -13.173 -18.110 54 HA TYR 8 HA TYR 8 -6.636 -14.803 -18.047 55 1HB TYR 8 1HB TYR 8 -6.095 -16.561 -16.463 56 2HB TYR 8 2HB TYR 8 -4.718 -15.658 -17.061 57 HD1 TYR 8 HD1 TYR 8 -6.757 -16.472 -14.141 58 HD2 TYR 8 HD2 TYR 8 -3.329 -14.393 -15.535 59 HE1 TYR 8 HE1 TYR 8 -5.925 -16.320 -11.847 60 HE2 TYR 8 HE2 TYR 8 -2.489 -14.223 -13.234 61 HH TYR 8 HH TYR 8 -3.430 -14.287 -10.928 62 H GLN 9 H GLN 9 -7.950 -12.624 -16.171 63 HA GLN 9 HA GLN 9 -10.354 -14.134 -15.786 64 1HB GLN 9 1HB GLN 9 -9.008 -12.565 -13.582 65 2HB GLN 9 2HB GLN 9 -10.693 -13.069 -13.537 66 1HG GLN 9 1HG GLN 9 -9.977 -15.348 -13.783 67 2HG GLN 9 2HG GLN 9 -8.301 -14.825 -13.706 68 1HE2 GLN 9 1HE2 GLN 9 -11.223 -15.238 -11.901 69 2HE2 GLN 9 2HE2 GLN 9 -10.544 -15.044 -10.323 70 H CYS 10 H CYS 10 -10.322 -12.981 -17.598 71 HA CYS 10 HA CYS 10 -10.456 -10.103 -17.573 72 1HB CYS 10 1HB CYS 10 -11.149 -12.123 -19.659 73 2HB CYS 10 2HB CYS 10 -11.115 -10.379 -19.963 74 H ASP 11 H ASP 11 -12.411 -9.078 -18.518 75 HA ASP 11 HA ASP 11 -14.749 -9.949 -17.104 76 1HB ASP 11 1HB ASP 11 -14.135 -7.570 -17.238 77 2HB ASP 11 2HB ASP 11 -14.290 -7.634 -18.987 78 H GLU 12 H GLU 12 -13.386 -10.592 -20.081 79 HA GLU 12 HA GLU 12 -15.792 -11.005 -21.551 80 1HB GLU 12 1HB GLU 12 -13.609 -10.079 -22.403 81 2HB GLU 12 2HB GLU 12 -12.925 -11.667 -22.129 82 1HG GLU 12 1HG GLU 12 -13.418 -11.402 -24.387 83 2HG GLU 12 2HG GLU 12 -14.571 -12.582 -23.760 84 H LYS 13 H LYS 13 -12.986 -12.848 -20.422 85 HA LYS 13 HA LYS 13 -14.458 -15.335 -20.055 86 1HB LYS 13 1HB LYS 13 -12.092 -15.186 -21.935 87 2HB LYS 13 2HB LYS 13 -13.112 -16.570 -21.634 88 1HG LYS 13 1HG LYS 13 -13.980 -14.065 -22.885 89 2HG LYS 13 2HG LYS 13 -13.370 -15.415 -23.868 90 1HD LYS 13 1HD LYS 13 -15.892 -15.298 -22.180 91 2HD LYS 13 2HD LYS 13 -15.768 -15.446 -23.938 92 1HE LYS 13 1HE LYS 13 -14.713 -17.657 -23.662 93 2HE LYS 13 2HE LYS 13 -14.906 -17.515 -21.915 94 1HZ LYS 13 1HZ LYS 13 -17.099 -17.524 -23.892 95 2HZ LYS 13 2HZ LYS 13 -17.312 -17.429 -22.228 96 3HZ LYS 13 3HZ LYS 13 -16.660 -18.825 -22.925 97 HA PRO 14 HA PRO 14 -10.637 -15.515 -17.698 98 1HB PRO 14 1HB PRO 14 -10.284 -18.271 -17.441 99 2HB PRO 14 2HB PRO 14 -11.276 -17.296 -16.361 100 1HG PRO 14 1HG PRO 14 -12.111 -19.209 -18.400 101 2HG PRO 14 2HG PRO 14 -13.053 -18.478 -17.096 102 1HD PRO 14 1HD PRO 14 -13.075 -17.814 -19.881 103 2HD PRO 14 2HD PRO 14 -14.013 -17.071 -18.574 104 H LEU 15 H LEU 15 -8.743 -15.068 -18.818 105 HA LEU 15 HA LEU 15 -8.241 -16.692 -21.187 106 1HB LEU 15 1HB LEU 15 -8.853 -14.365 -21.712 107 2HB LEU 15 2HB LEU 15 -7.521 -13.821 -20.702 108 HG LEU 15 HG LEU 15 -5.972 -15.006 -22.165 109 1HD1 LEU 15 1HD1 LEU 15 -6.714 -15.669 -24.424 110 2HD1 LEU 15 2HD1 LEU 15 -8.383 -15.376 -23.929 111 3HD1 LEU 15 3HD1 LEU 15 -7.438 -16.636 -23.142 112 1HD2 LEU 15 1HD2 LEU 15 -7.636 -12.887 -23.514 113 2HD2 LEU 15 2HD2 LEU 15 -6.012 -13.383 -24.001 114 3HD2 LEU 15 3HD2 LEU 15 -6.269 -12.627 -22.431 115 H THR 16 H THR 16 -7.095 -18.075 -19.814 116 HA THR 16 HA THR 16 -4.772 -16.930 -18.595 117 HB THR 16 HB THR 16 -5.231 -19.895 -18.611 118 HG1 THR 16 HG1 THR 16 -6.753 -18.086 -16.951 119 1HG2 THR 16 1HG2 THR 16 -3.357 -18.952 -17.399 120 2HG2 THR 16 2HG2 THR 16 -4.554 -19.521 -16.210 121 3HG2 THR 16 3HG2 THR 16 -4.434 -17.801 -16.628 122 H VAL 17 H VAL 17 -3.429 -16.392 -20.044 123 HA VAL 17 HA VAL 17 -2.756 -17.976 -22.369 124 HB VAL 17 HB VAL 17 -1.942 -15.264 -21.367 125 1HG1 VAL 17 1HG1 VAL 17 -1.028 -16.672 -23.855 126 2HG1 VAL 17 2HG1 VAL 17 -0.008 -16.185 -22.515 127 3HG1 VAL 17 3HG1 VAL 17 -0.765 -14.960 -23.539 128 1HG2 VAL 17 1HG2 VAL 17 -4.152 -15.443 -22.276 129 2HG2 VAL 17 2HG2 VAL 17 -3.512 -16.120 -23.784 130 3HG2 VAL 17 3HG2 VAL 17 -3.131 -14.464 -23.325 131 H LYS 18 H LYS 18 -1.048 -19.265 -22.498 132 HA LYS 18 HA LYS 18 0.943 -19.079 -20.413 133 1HB LYS 18 1HB LYS 18 0.419 -21.117 -22.591 134 2HB LYS 18 2HB LYS 18 1.967 -21.076 -21.797 135 1HG LYS 18 1HG LYS 18 0.531 -22.819 -20.891 136 2HG LYS 18 2HG LYS 18 0.916 -21.611 -19.671 137 1HD LYS 18 1HD LYS 18 -1.191 -20.648 -19.828 138 2HD LYS 18 2HD LYS 18 -1.635 -21.585 -21.266 139 1HE LYS 18 1HE LYS 18 -2.717 -22.527 -19.313 140 2HE LYS 18 2HE LYS 18 -1.491 -23.640 -19.898 141 1HZ LYS 18 1HZ LYS 18 0.008 -22.871 -18.164 142 2HZ LYS 18 2HZ LYS 18 -1.452 -23.416 -17.495 143 3HZ LYS 18 3HZ LYS 18 -1.163 -21.769 -17.628 144 H LEU 19 H LEU 19 2.024 -17.242 -20.957 145 HA LEU 19 HA LEU 19 2.580 -16.670 -23.651 146 1HB LEU 19 1HB LEU 19 1.703 -15.020 -22.052 147 2HB LEU 19 2HB LEU 19 3.085 -15.420 -21.033 148 HG LEU 19 HG LEU 19 4.560 -14.544 -22.491 149 1HD1 LEU 19 1HD1 LEU 19 2.201 -13.853 -24.292 150 2HD1 LEU 19 2HD1 LEU 19 3.499 -14.983 -24.675 151 3HD1 LEU 19 3HD1 LEU 19 3.835 -13.255 -24.578 152 1HD2 LEU 19 1HD2 LEU 19 2.297 -12.637 -21.971 153 2HD2 LEU 19 2HD2 LEU 19 3.918 -12.113 -22.432 154 3HD2 LEU 19 3HD2 LEU 19 3.667 -12.991 -20.922 155 H ASN 20 H ASN 20 4.075 -18.141 -24.163 156 HA ASN 20 HA ASN 20 6.452 -18.223 -22.520 157 1HB ASN 20 1HB ASN 20 5.633 -19.866 -24.938 158 2HB ASN 20 2HB ASN 20 7.264 -19.925 -24.286 159 1HD2 ASN 20 1HD2 ASN 20 6.702 -19.920 -21.542 160 2HD2 ASN 20 2HD2 ASN 20 5.867 -21.381 -21.174 161 H ASN 21 H ASN 21 7.454 -16.327 -22.886 162 HA ASN 21 HA ASN 21 7.275 -14.894 -25.268 163 1HB ASN 21 1HB ASN 21 7.639 -13.773 -23.140 164 2HB ASN 21 2HB ASN 21 9.225 -14.518 -23.009 165 1HD2 ASN 21 1HD2 ASN 21 10.943 -13.576 -24.047 166 2HD2 ASN 21 2HD2 ASN 21 10.820 -12.133 -24.990 167 HA PRO 22 HA PRO 22 11.777 -16.276 -26.432 168 1HB PRO 22 1HB PRO 22 12.092 -18.867 -25.057 169 2HB PRO 22 2HB PRO 22 13.240 -17.530 -25.185 170 1HG PRO 22 1HG PRO 22 12.036 -18.085 -22.870 171 2HG PRO 22 2HG PRO 22 12.330 -16.409 -23.367 172 1HD PRO 22 1HD PRO 22 9.805 -18.013 -23.535 173 2HD PRO 22 2HD PRO 22 10.035 -16.347 -22.965 174 H ARG 23 H ARG 23 9.017 -18.078 -26.109 175 HA ARG 23 HA ARG 23 9.652 -19.884 -28.331 176 1HB ARG 23 1HB ARG 23 8.768 -20.980 -26.363 177 2HB ARG 23 2HB ARG 23 7.416 -19.866 -26.311 178 1HG ARG 23 1HG ARG 23 6.579 -20.835 -28.408 179 2HG ARG 23 2HG ARG 23 7.918 -21.977 -28.386 180 1HD ARG 23 1HD ARG 23 7.137 -23.034 -26.428 181 2HD ARG 23 2HD ARG 23 6.004 -21.727 -26.078 182 HE ARG 23 HE ARG 23 5.458 -22.878 -28.581 183 1HH1 ARG 23 1HH1 ARG 23 5.137 -23.683 -25.132 184 2HH1 ARG 23 2HH1 ARG 23 3.642 -24.486 -25.328 185 1HH2 ARG 23 1HH2 ARG 23 3.375 -23.929 -28.823 186 2HH2 ARG 23 2HH2 ARG 23 2.649 -24.661 -27.454 187 H GLN 24 H GLN 24 7.951 -17.003 -27.563 188 HA GLN 24 HA GLN 24 6.450 -15.701 -28.522 189 1HB GLN 24 1HB GLN 24 7.817 -16.899 -30.880 190 2HB GLN 24 2HB GLN 24 6.613 -15.617 -31.091 191 1HG GLN 24 1HG GLN 24 7.994 -14.154 -29.668 192 2HG GLN 24 2HG GLN 24 9.179 -15.448 -29.505 193 1HE2 GLN 24 1HE2 GLN 24 10.768 -14.143 -30.379 194 2HE2 GLN 24 2HE2 GLN 24 10.861 -13.782 -32.056 195 H GLU 25 H GLU 25 5.374 -18.012 -27.591 196 HA GLU 25 HA GLU 25 3.041 -18.275 -29.312 197 1HB GLU 25 1HB GLU 25 4.578 -20.540 -28.091 198 2HB GLU 25 2HB GLU 25 2.856 -20.674 -28.376 199 1HG GLU 25 1HG GLU 25 3.136 -20.329 -30.691 200 2HG GLU 25 2HG GLU 25 4.880 -20.052 -30.515 201 H VAL 26 H VAL 26 1.192 -18.632 -28.329 202 HA VAL 26 HA VAL 26 1.028 -18.433 -25.360 203 HB VAL 26 HB VAL 26 -1.026 -17.139 -25.637 204 1HG1 VAL 26 1HG1 VAL 26 -0.005 -14.962 -26.255 205 2HG1 VAL 26 2HG1 VAL 26 1.367 -15.826 -26.947 206 3HG1 VAL 26 3HG1 VAL 26 1.053 -15.913 -25.214 207 1HG2 VAL 26 1HG2 VAL 26 -1.558 -16.020 -27.768 208 2HG2 VAL 26 2HG2 VAL 26 -1.681 -17.780 -27.865 209 3HG2 VAL 26 3HG2 VAL 26 -0.276 -16.954 -28.543 210 H SER 27 H SER 27 -0.058 -19.910 -24.477 211 HA SER 27 HA SER 27 -2.001 -21.368 -26.129 212 1HB SER 27 1HB SER 27 -0.769 -22.375 -23.563 213 2HB SER 27 2HB SER 27 -1.676 -23.249 -24.798 214 HG SER 27 HG SER 27 0.434 -22.000 -25.866 215 H PHE 28 H PHE 28 -3.967 -20.825 -25.622 216 HA PHE 28 HA PHE 28 -4.492 -20.196 -22.864 217 1HB PHE 28 1HB PHE 28 -5.807 -18.191 -23.384 218 2HB PHE 28 2HB PHE 28 -4.109 -18.026 -23.770 219 HD1 PHE 28 HD1 PHE 28 -3.403 -17.475 -25.935 220 HD2 PHE 28 HD2 PHE 28 -7.472 -18.480 -25.228 221 HE1 PHE 28 HE1 PHE 28 -3.999 -16.611 -28.148 222 HE2 PHE 28 HE2 PHE 28 -8.075 -17.625 -27.448 223 HZ PHE 28 HZ PHE 28 -6.340 -16.688 -28.911 224 H VAL 29 H VAL 29 -6.695 -19.955 -22.427 225 HA VAL 29 HA VAL 29 -8.089 -22.115 -23.680 226 HB VAL 29 HB VAL 29 -7.868 -22.327 -21.284 227 1HG1 VAL 29 1HG1 VAL 29 -7.513 -20.079 -20.621 228 2HG1 VAL 29 2HG1 VAL 29 -8.846 -20.763 -19.687 229 3HG1 VAL 29 3HG1 VAL 29 -9.174 -19.645 -21.017 230 1HG2 VAL 29 1HG2 VAL 29 -10.703 -21.605 -22.006 231 2HG2 VAL 29 2HG2 VAL 29 -10.209 -22.532 -20.583 232 3HG2 VAL 29 3HG2 VAL 29 -9.923 -23.178 -22.198 233 H TYR 30 H TYR 30 -9.187 -21.642 -25.201 234 HA TYR 30 HA TYR 30 -10.271 -19.122 -25.946 235 1HB TYR 30 1HB TYR 30 -10.661 -21.915 -26.880 236 2HB TYR 30 2HB TYR 30 -11.781 -20.668 -27.426 237 HD1 TYR 30 HD1 TYR 30 -8.193 -21.619 -27.345 238 HD2 TYR 30 HD2 TYR 30 -11.195 -19.152 -28.982 239 HE1 TYR 30 HE1 TYR 30 -6.599 -20.810 -29.059 240 HE2 TYR 30 HE2 TYR 30 -9.665 -18.344 -30.656 241 HH TYR 30 HH TYR 30 -7.212 -18.104 -30.906 242 H ASP 31 H ASP 31 -11.587 -21.829 -24.322 243 HA ASP 31 HA ASP 31 -13.473 -20.385 -22.913 244 1HB ASP 31 1HB ASP 31 -14.740 -20.170 -24.983 245 2HB ASP 31 2HB ASP 31 -14.630 -21.904 -25.267 246 H ASN 32 H ASN 32 -13.082 -23.491 -24.551 247 HA ASN 32 HA ASN 32 -13.376 -24.766 -21.927 248 1HB ASN 32 1HB ASN 32 -14.751 -26.488 -22.854 249 2HB ASN 32 2HB ASN 32 -15.452 -24.929 -23.288 250 1HD2 ASN 32 1HD2 ASN 32 -14.021 -27.843 -24.416 251 2HD2 ASN 32 2HD2 ASN 32 -14.258 -27.578 -26.099 252 H GLN 33 H GLN 33 -11.008 -24.190 -24.070 253 HA GLN 33 HA GLN 33 -9.727 -26.628 -23.508 254 1HB GLN 33 1HB GLN 33 -9.328 -27.277 -25.787 255 2HB GLN 33 2HB GLN 33 -11.072 -27.171 -25.576 256 1HG GLN 33 1HG GLN 33 -11.003 -24.917 -26.557 257 2HG GLN 33 2HG GLN 33 -9.274 -25.159 -26.812 258 1HE2 GLN 33 1HE2 GLN 33 -8.586 -26.560 -28.436 259 2HE2 GLN 33 2HE2 GLN 33 -9.662 -27.155 -29.637 260 H LEU 34 H LEU 34 -7.629 -26.412 -23.937 261 HA LEU 34 HA LEU 34 -6.815 -23.673 -24.077 262 1HB LEU 34 1HB LEU 34 -5.492 -26.191 -23.152 263 2HB LEU 34 2HB LEU 34 -4.497 -24.792 -23.528 264 HG LEU 34 HG LEU 34 -4.854 -25.090 -21.101 265 1HD1 LEU 34 1HD1 LEU 34 -5.597 -22.854 -20.538 266 2HD1 LEU 34 2HD1 LEU 34 -6.082 -22.624 -22.226 267 3HD1 LEU 34 3HD1 LEU 34 -4.396 -22.920 -21.823 268 1HD2 LEU 34 1HD2 LEU 34 -7.054 -26.128 -21.095 269 2HD2 LEU 34 2HD2 LEU 34 -7.776 -24.638 -21.695 270 3HD2 LEU 34 3HD2 LEU 34 -7.053 -24.680 -20.086 271 H LEU 35 H LEU 35 -5.672 -22.980 -25.905 272 HA LEU 35 HA LEU 35 -4.778 -24.980 -27.817 273 1HB LEU 35 1HB LEU 35 -7.110 -24.265 -28.190 274 2HB LEU 35 2HB LEU 35 -6.522 -22.619 -28.293 275 HG LEU 35 HG LEU 35 -5.469 -23.056 -30.360 276 1HD1 LEU 35 1HD1 LEU 35 -6.437 -25.907 -29.955 277 2HD1 LEU 35 2HD1 LEU 35 -4.745 -25.400 -29.939 278 3HD1 LEU 35 3HD1 LEU 35 -5.684 -25.308 -31.433 279 1HD2 LEU 35 1HD2 LEU 35 -8.234 -24.214 -30.213 280 2HD2 LEU 35 2HD2 LEU 35 -7.479 -23.585 -31.688 281 3HD2 LEU 35 3HD2 LEU 35 -7.822 -22.515 -30.316 282 H HIS 36 H HIS 36 -3.145 -24.072 -29.222 283 HA HIS 36 HA HIS 36 -1.911 -21.703 -28.067 284 1HB HIS 36 1HB HIS 36 0.344 -22.641 -28.532 285 2HB HIS 36 2HB HIS 36 -0.572 -23.550 -27.350 286 HD2 HIS 36 HD2 HIS 36 0.972 -23.942 -30.881 287 HE1 HIS 36 HE1 HIS 36 -0.377 -27.721 -29.543 288 HE2 HIS 36 HE2 HIS 36 1.186 -26.528 -31.108 289 H LEU 37 H LEU 37 -1.054 -20.260 -29.133 290 HA LEU 37 HA LEU 37 -1.289 -20.155 -32.110 291 1HB LEU 37 1HB LEU 37 -1.862 -17.959 -30.131 292 2HB LEU 37 2HB LEU 37 -1.830 -17.748 -31.841 293 HG LEU 37 HG LEU 37 -3.833 -19.340 -31.986 294 1HD1 LEU 37 1HD1 LEU 37 -3.584 -20.490 -29.881 295 2HD1 LEU 37 2HD1 LEU 37 -5.155 -19.677 -29.944 296 3HD1 LEU 37 3HD1 LEU 37 -3.832 -18.994 -28.991 297 1HD2 LEU 37 1HD2 LEU 37 -5.445 -17.697 -31.326 298 2HD2 LEU 37 2HD2 LEU 37 -4.045 -16.875 -32.034 299 3HD2 LEU 37 3HD2 LEU 37 -4.260 -16.914 -30.293 300 H LYS 38 H LYS 38 0.217 -18.662 -33.100 301 HA LYS 38 HA LYS 38 2.442 -18.058 -31.306 302 1HB LYS 38 1HB LYS 38 4.000 -18.765 -32.899 303 2HB LYS 38 2HB LYS 38 2.788 -20.039 -32.682 304 1HG LYS 38 1HG LYS 38 1.813 -19.626 -34.778 305 2HG LYS 38 2HG LYS 38 2.677 -18.096 -34.963 306 1HD LYS 38 1HD LYS 38 4.771 -19.272 -35.028 307 2HD LYS 38 2HD LYS 38 3.945 -20.823 -34.870 308 1HE LYS 38 1HE LYS 38 2.774 -20.393 -36.996 309 2HE LYS 38 2HE LYS 38 3.621 -18.854 -37.144 310 1HZ LYS 38 1HZ LYS 38 4.903 -21.530 -37.091 311 2HZ LYS 38 2HZ LYS 38 5.709 -20.057 -37.232 312 3HZ LYS 38 3HZ LYS 38 4.696 -20.569 -38.464 313 H GLN 39 H GLN 39 3.701 -16.362 -31.897 314 HA GLN 39 HA GLN 39 2.421 -14.317 -33.543 315 1HB GLN 39 1HB GLN 39 3.419 -13.672 -31.399 316 2HB GLN 39 2HB GLN 39 4.988 -14.264 -31.966 317 1HG GLN 39 1HG GLN 39 5.035 -12.559 -33.683 318 2HG GLN 39 2HG GLN 39 3.429 -12.009 -33.217 319 1HE2 GLN 39 1HE2 GLN 39 6.003 -10.600 -33.289 320 2HE2 GLN 39 2HE2 GLN 39 6.215 -9.965 -31.700 321 H GLY 40 H GLY 40 2.752 -14.411 -35.501 322 1HA GLY 40 1HA GLY 40 5.393 -14.765 -36.661 323 2HA GLY 40 2HA GLY 40 4.260 -16.062 -37.039 324 H ILE 41 H ILE 41 1.913 -14.675 -37.254 325 HA ILE 41 HA ILE 41 2.432 -12.992 -39.521 326 HB ILE 41 HB ILE 41 1.058 -14.855 -40.127 327 1HG1 ILE 41 1HG1 ILE 41 -1.098 -13.791 -40.736 328 2HG1 ILE 41 2HG1 ILE 41 -0.679 -12.480 -39.629 329 1HG2 ILE 41 1HG2 ILE 41 0.370 -15.661 -37.962 330 2HG2 ILE 41 2HG2 ILE 41 -1.048 -15.464 -38.999 331 3HG2 ILE 41 3HG2 ILE 41 -0.694 -14.271 -37.753 332 1HD1 ILE 41 1HD1 ILE 41 0.885 -13.246 -42.084 333 2HD1 ILE 41 2HD1 ILE 41 1.258 -11.941 -40.958 334 3HD1 ILE 41 3HD1 ILE 41 -0.205 -11.854 -41.948 335 H SER 42 H SER 42 2.293 -10.867 -39.093 336 HA SER 42 HA SER 42 0.205 -9.818 -37.465 337 1HB SER 42 1HB SER 42 1.924 -10.562 -35.773 338 2HB SER 42 2HB SER 42 3.083 -9.493 -36.555 339 HG SER 42 HG SER 42 2.299 -7.963 -35.354 340 H ALA 43 H ALA 43 0.587 -7.372 -37.341 341 HA ALA 43 HA ALA 43 2.335 -6.177 -39.087 342 1HB ALA 43 1HB ALA 43 0.696 -5.140 -40.629 343 2HB ALA 43 2HB ALA 43 -0.588 -6.096 -39.895 344 3HB ALA 43 3HB ALA 43 0.701 -6.896 -40.798 345 H SER 44 H SER 44 -0.789 -5.942 -37.501 346 HA SER 44 HA SER 44 0.098 -3.447 -36.264 347 1HB SER 44 1HB SER 44 -2.675 -4.657 -36.419 348 2HB SER 44 2HB SER 44 -2.260 -3.034 -35.855 349 HG SER 44 HG SER 44 -1.276 -2.831 -38.040 350 H GLY 45 H GLY 45 0.408 -3.445 -34.053 351 1HA GLY 45 1HA GLY 45 0.503 -4.202 -31.874 352 2HA GLY 45 2HA GLY 45 -0.798 -5.316 -32.265 353 H ALA 46 H ALA 46 -0.247 -7.305 -31.772 354 HA ALA 46 HA ALA 46 2.099 -8.463 -32.872 355 1HB ALA 46 1HB ALA 46 2.516 -9.568 -30.662 356 2HB ALA 46 2HB ALA 46 1.373 -8.441 -29.933 357 3HB ALA 46 3HB ALA 46 2.879 -7.837 -30.632 358 H ARG 47 H ARG 47 1.342 -10.443 -33.583 359 HA ARG 47 HA ARG 47 -1.263 -10.890 -32.585 360 1HB ARG 47 1HB ARG 47 -0.325 -11.067 -35.395 361 2HB ARG 47 2HB ARG 47 -1.701 -12.012 -34.870 362 1HG ARG 47 1HG ARG 47 -2.836 -9.951 -34.204 363 2HG ARG 47 2HG ARG 47 -1.450 -9.017 -34.795 364 1HD ARG 47 1HD ARG 47 -3.346 -9.239 -36.418 365 2HD ARG 47 2HD ARG 47 -1.786 -9.804 -37.023 366 HE ARG 47 HE ARG 47 -3.356 -11.849 -35.787 367 1HH1 ARG 47 1HH1 ARG 47 -2.781 -10.160 -38.846 368 2HH1 ARG 47 2HH1 ARG 47 -3.300 -11.441 -39.817 369 1HH2 ARG 47 1HH2 ARG 47 -4.013 -13.649 -37.126 370 2HH2 ARG 47 2HH2 ARG 47 -4.042 -13.471 -38.829 371 H TYR 48 H TYR 48 -1.526 -12.870 -31.775 372 HA TYR 48 HA TYR 48 0.267 -15.058 -32.545 373 1HB TYR 48 1HB TYR 48 -1.519 -14.688 -30.125 374 2HB TYR 48 2HB TYR 48 -0.548 -16.104 -30.497 375 HD1 TYR 48 HD1 TYR 48 -0.395 -12.576 -29.394 376 HD2 TYR 48 HD2 TYR 48 1.799 -16.166 -30.021 377 HE1 TYR 48 HE1 TYR 48 1.460 -11.659 -28.083 378 HE2 TYR 48 HE2 TYR 48 3.669 -15.250 -28.707 379 HH TYR 48 HH TYR 48 3.332 -12.480 -26.775 380 H THR 49 H THR 49 -0.555 -16.337 -33.900 381 HA THR 49 HA THR 49 -3.358 -16.940 -33.743 382 HB THR 49 HB THR 49 -2.114 -15.927 -36.282 383 HG1 THR 49 HG1 THR 49 -3.156 -14.566 -34.327 384 1HG2 THR 49 1HG2 THR 49 -3.767 -17.647 -36.737 385 2HG2 THR 49 2HG2 THR 49 -4.401 -16.081 -37.245 386 3HG2 THR 49 3HG2 THR 49 -4.952 -16.807 -35.736 387 H ASP 50 H ASP 50 -3.503 -19.083 -34.062 388 HA ASP 50 HA ASP 50 -1.187 -20.343 -35.132 389 1HB ASP 50 1HB ASP 50 -2.272 -21.516 -33.273 390 2HB ASP 50 2HB ASP 50 -3.786 -21.586 -34.163 391 H GLY 51 H GLY 51 -4.583 -20.813 -35.717 392 1HA GLY 51 1HA GLY 51 -4.851 -19.744 -38.226 393 2HA GLY 51 2HA GLY 51 -4.379 -21.431 -38.455 394 H ILE 52 H ILE 52 -6.223 -20.038 -35.831 395 HA ILE 52 HA ILE 52 -8.531 -21.674 -36.614 396 HB ILE 52 HB ILE 52 -7.639 -21.320 -33.700 397 1HG1 ILE 52 1HG1 ILE 52 -5.930 -22.677 -34.893 398 2HG1 ILE 52 2HG1 ILE 52 -6.811 -23.629 -33.713 399 1HG2 ILE 52 1HG2 ILE 52 -9.593 -23.247 -34.954 400 2HG2 ILE 52 2HG2 ILE 52 -10.032 -21.774 -34.110 401 3HG2 ILE 52 3HG2 ILE 52 -9.241 -23.088 -33.232 402 1HD1 ILE 52 1HD1 ILE 52 -7.212 -23.652 -36.697 403 2HD1 ILE 52 2HD1 ILE 52 -8.160 -24.583 -35.542 404 3HD1 ILE 52 3HD1 ILE 52 -6.435 -24.906 -35.729 405 H TYR 53 H TYR 53 -7.535 -19.324 -34.130 406 HA TYR 53 HA TYR 53 -9.497 -17.279 -35.081 407 1HB TYR 53 1HB TYR 53 -8.694 -17.980 -32.278 408 2HB TYR 53 2HB TYR 53 -9.564 -16.539 -32.826 409 HD1 TYR 53 HD1 TYR 53 -9.867 -20.274 -32.787 410 HD2 TYR 53 HD2 TYR 53 -11.896 -16.558 -32.882 411 HE1 TYR 53 HE1 TYR 53 -12.015 -21.455 -32.556 412 HE2 TYR 53 HE2 TYR 53 -14.035 -17.712 -32.653 413 HH TYR 53 HH TYR 53 -14.259 -21.029 -31.848 414 H VAL 54 H VAL 54 -8.739 -15.226 -34.524 415 HA VAL 54 HA VAL 54 -5.832 -14.999 -34.751 416 HB VAL 54 HB VAL 54 -8.186 -13.286 -35.278 417 1HG1 VAL 54 1HG1 VAL 54 -6.304 -11.839 -34.549 418 2HG1 VAL 54 2HG1 VAL 54 -6.554 -11.607 -36.280 419 3HG1 VAL 54 3HG1 VAL 54 -5.230 -12.623 -35.708 420 1HG2 VAL 54 1HG2 VAL 54 -6.203 -14.533 -37.175 421 2HG2 VAL 54 2HG2 VAL 54 -7.468 -13.405 -37.665 422 3HG2 VAL 54 3HG2 VAL 54 -7.899 -14.960 -36.956 423 H PHE 55 H PHE 55 -4.877 -14.542 -32.789 424 HA PHE 55 HA PHE 55 -6.375 -12.994 -30.819 425 1HB PHE 55 1HB PHE 55 -5.295 -14.967 -29.894 426 2HB PHE 55 2HB PHE 55 -3.772 -14.553 -30.657 427 HD1 PHE 55 HD1 PHE 55 -5.979 -13.949 -27.804 428 HD2 PHE 55 HD2 PHE 55 -2.368 -12.800 -29.714 429 HE1 PHE 55 HE1 PHE 55 -5.254 -12.839 -25.757 430 HE2 PHE 55 HE2 PHE 55 -1.628 -11.692 -27.648 431 HZ PHE 55 HZ PHE 55 -3.073 -11.707 -25.669 432 H TRP 56 H TRP 56 -5.892 -10.912 -30.486 433 HA TRP 56 HA TRP 56 -3.563 -9.900 -31.849 434 1HB TRP 56 1HB TRP 56 -5.584 -9.366 -33.134 435 2HB TRP 56 2HB TRP 56 -6.267 -8.591 -31.699 436 HD1 TRP 56 HD1 TRP 56 -2.695 -8.157 -33.063 437 HE1 TRP 56 HE1 TRP 56 -2.298 -5.736 -33.607 438 HE3 TRP 56 HE3 TRP 56 -7.397 -6.386 -32.122 439 HZ2 TRP 56 HZ2 TRP 56 -3.794 -3.300 -33.656 440 HZ3 TRP 56 HZ3 TRP 56 -7.830 -3.986 -32.452 441 HH2 TRP 56 HH2 TRP 56 -6.065 -2.476 -33.204 442 H SER 57 H SER 57 -2.383 -8.910 -30.661 443 HA SER 57 HA SER 57 -3.257 -7.954 -28.037 444 1HB SER 57 1HB SER 57 -1.427 -9.719 -28.125 445 2HB SER 57 2HB SER 57 -0.438 -8.554 -28.987 446 HG SER 57 HG SER 57 -1.370 -8.445 -26.321 447 H LYS 58 H LYS 58 -3.771 -5.891 -28.311 448 HA LYS 58 HA LYS 58 -2.501 -4.353 -30.372 449 1HB LYS 58 1HB LYS 58 -4.855 -4.263 -30.173 450 2HB LYS 58 2HB LYS 58 -4.768 -3.887 -28.465 451 1HG LYS 58 1HG LYS 58 -3.881 -1.693 -28.998 452 2HG LYS 58 2HG LYS 58 -3.957 -2.079 -30.728 453 1HD LYS 58 1HD LYS 58 -6.311 -2.286 -30.658 454 2HD LYS 58 2HD LYS 58 -6.313 -2.265 -28.896 455 1HE LYS 58 1HE LYS 58 -5.533 0.043 -30.679 456 2HE LYS 58 2HE LYS 58 -7.075 -0.120 -29.834 457 1HZ LYS 58 1HZ LYS 58 -5.730 -0.233 -27.727 458 2HZ LYS 58 2HZ LYS 58 -5.764 1.248 -28.485 459 3HZ LYS 58 3HZ LYS 58 -4.385 0.285 -28.611 460 H GLY 59 H GLY 59 -2.248 -4.815 -26.975 461 1HA GLY 59 1HA GLY 59 0.195 -3.813 -26.589 462 2HA GLY 59 2HA GLY 59 -0.776 -2.347 -26.574 463 H ASP 60 H ASP 60 -2.779 -2.614 -25.142 464 HA ASP 60 HA ASP 60 -1.849 -3.673 -22.526 465 1HB ASP 60 1HB ASP 60 -3.688 -1.314 -23.053 466 2HB ASP 60 2HB ASP 60 -3.203 -1.900 -21.472 467 H GLU 61 H GLU 61 -3.842 -4.117 -25.005 468 HA GLU 61 HA GLU 61 -5.885 -5.442 -23.454 469 1HB GLU 61 1HB GLU 61 -7.549 -4.710 -25.060 470 2HB GLU 61 2HB GLU 61 -6.830 -3.320 -24.253 471 1HG GLU 61 1HG GLU 61 -5.858 -4.322 -26.832 472 2HG GLU 61 2HG GLU 61 -7.274 -3.262 -26.798 473 H ALA 62 H ALA 62 -6.852 -7.154 -24.597 474 HA ALA 62 HA ALA 62 -5.367 -8.089 -26.840 475 1HB ALA 62 1HB ALA 62 -4.307 -9.138 -24.922 476 2HB ALA 62 2HB ALA 62 -5.228 -10.345 -25.817 477 3HB ALA 62 3HB ALA 62 -5.874 -9.671 -24.315 478 H THR 63 H THR 63 -6.694 -9.142 -28.174 479 HA THR 63 HA THR 63 -9.428 -9.811 -27.395 480 HB THR 63 HB THR 63 -9.434 -7.494 -28.303 481 HG1 THR 63 HG1 THR 63 -10.931 -7.852 -30.005 482 1HG2 THR 63 1HG2 THR 63 -8.866 -7.110 -30.641 483 2HG2 THR 63 2HG2 THR 63 -8.367 -8.815 -30.736 484 3HG2 THR 63 3HG2 THR 63 -7.489 -7.689 -29.676 485 H VAL 64 H VAL 64 -10.465 -11.095 -29.215 486 HA VAL 64 HA VAL 64 -8.595 -12.648 -30.839 487 HB VAL 64 HB VAL 64 -10.551 -13.993 -28.963 488 1HG1 VAL 64 1HG1 VAL 64 -8.533 -15.145 -30.893 489 2HG1 VAL 64 2HG1 VAL 64 -10.312 -15.201 -30.979 490 3HG1 VAL 64 3HG1 VAL 64 -9.477 -16.068 -29.709 491 1HG2 VAL 64 1HG2 VAL 64 -8.618 -14.920 -27.788 492 2HG2 VAL 64 2HG2 VAL 64 -8.630 -13.151 -27.704 493 3HG2 VAL 64 3HG2 VAL 64 -7.558 -13.983 -28.845 494 H TYR 65 H TYR 65 -9.465 -12.457 -32.758 495 HA TYR 65 HA TYR 65 -12.357 -12.836 -33.172 496 1HB TYR 65 1HB TYR 65 -12.279 -10.534 -33.097 497 2HB TYR 65 2HB TYR 65 -10.702 -10.451 -33.878 498 HD1 TYR 65 HD1 TYR 65 -14.185 -11.641 -34.721 499 HD2 TYR 65 HD2 TYR 65 -10.711 -9.573 -36.037 500 HE1 TYR 65 HE1 TYR 65 -15.304 -11.113 -36.824 501 HE2 TYR 65 HE2 TYR 65 -11.831 -9.050 -38.159 502 HH TYR 65 HH TYR 65 -15.164 -9.440 -38.560 503 H LYS 66 H LYS 66 -12.355 -14.649 -34.369 504 HA LYS 66 HA LYS 66 -10.683 -14.747 -36.703 505 1HB LYS 66 1HB LYS 66 -11.347 -16.815 -35.246 506 2HB LYS 66 2HB LYS 66 -12.953 -16.556 -35.885 507 1HG LYS 66 1HG LYS 66 -11.800 -16.579 -38.188 508 2HG LYS 66 2HG LYS 66 -10.504 -17.424 -37.334 509 1HD LYS 66 1HD LYS 66 -12.236 -19.050 -36.542 510 2HD LYS 66 2HD LYS 66 -13.377 -18.197 -37.597 511 1HE LYS 66 1HE LYS 66 -11.871 -18.675 -39.522 512 2HE LYS 66 2HE LYS 66 -10.881 -19.661 -38.447 513 1HZ LYS 66 1HZ LYS 66 -12.894 -21.016 -38.022 514 2HZ LYS 66 2HZ LYS 66 -12.386 -21.095 -39.604 515 3HZ LYS 66 3HZ LYS 66 -13.701 -20.106 -39.189 516 H ARG 67 H ARG 67 -11.827 -14.797 -38.562 517 HA ARG 67 HA ARG 67 -13.795 -12.861 -39.069 518 1HB ARG 67 1HB ARG 67 -12.319 -13.629 -40.844 519 2HB ARG 67 2HB ARG 67 -12.968 -15.249 -40.747 520 1HG ARG 67 1HG ARG 67 -14.744 -12.974 -41.508 521 2HG ARG 67 2HG ARG 67 -13.653 -13.676 -42.712 522 1HD ARG 67 1HD ARG 67 -14.706 -15.859 -42.377 523 2HD ARG 67 2HD ARG 67 -15.730 -15.191 -41.109 524 HE ARG 67 HE ARG 67 -15.932 -13.961 -43.717 525 1HH1 ARG 67 1HH1 ARG 67 -17.253 -16.475 -41.551 526 2HH1 ARG 67 2HH1 ARG 67 -18.806 -16.405 -42.244 527 1HH2 ARG 67 1HH2 ARG 67 -18.083 -13.988 -44.688 528 2HH2 ARG 67 2HH2 ARG 67 -19.280 -15.020 -44.053 529 H ASP 68 H ASP 68 -14.174 -16.120 -38.076 530 HA ASP 68 HA ASP 68 -16.996 -16.121 -38.793 531 1HB ASP 68 1HB ASP 68 -15.318 -18.438 -37.829 532 2HB ASP 68 2HB ASP 68 -17.012 -18.507 -38.265 533 H ARG 69 H ARG 69 -14.991 -15.487 -36.152 534 HA ARG 69 HA ARG 69 -17.081 -15.195 -34.481 535 1HB ARG 69 1HB ARG 69 -17.280 -17.623 -34.459 536 2HB ARG 69 2HB ARG 69 -15.624 -17.776 -33.894 537 1HG ARG 69 1HG ARG 69 -16.306 -16.446 -31.878 538 2HG ARG 69 2HG ARG 69 -17.967 -16.590 -32.435 539 1HD ARG 69 1HD ARG 69 -16.117 -18.859 -31.809 540 2HD ARG 69 2HD ARG 69 -17.374 -18.229 -30.745 541 HE ARG 69 HE ARG 69 -18.460 -18.992 -33.251 542 1HH1 ARG 69 1HH1 ARG 69 -17.220 -20.388 -30.255 543 2HH1 ARG 69 2HH1 ARG 69 -18.197 -21.770 -30.278 544 1HH2 ARG 69 1HH2 ARG 69 -19.816 -20.942 -33.340 545 2HH2 ARG 69 2HH2 ARG 69 -19.708 -22.110 -32.101 546 H ILE 70 H ILE 70 -16.421 -13.850 -33.147 547 HA ILE 70 HA ILE 70 -13.752 -13.402 -32.015 548 HB ILE 70 HB ILE 70 -16.405 -12.299 -31.155 549 1HG1 ILE 70 1HG1 ILE 70 -14.445 -10.955 -32.938 550 2HG1 ILE 70 2HG1 ILE 70 -15.928 -11.727 -33.545 551 1HG2 ILE 70 1HG2 ILE 70 -14.689 -12.013 -29.491 552 2HG2 ILE 70 2HG2 ILE 70 -15.101 -10.441 -30.177 553 3HG2 ILE 70 3HG2 ILE 70 -13.618 -11.258 -30.672 554 1HD1 ILE 70 1HD1 ILE 70 -16.190 -9.309 -33.410 555 2HD1 ILE 70 2HD1 ILE 70 -15.703 -9.331 -31.715 556 3HD1 ILE 70 3HD1 ILE 70 -17.219 -10.085 -32.207 557 H VAL 71 H VAL 71 -13.223 -14.161 -30.201 558 HA VAL 71 HA VAL 71 -15.308 -15.410 -28.561 559 HB VAL 71 HB VAL 71 -13.600 -16.947 -27.495 560 1HG1 VAL 71 1HG1 VAL 71 -13.657 -18.571 -29.334 561 2HG1 VAL 71 2HG1 VAL 71 -14.096 -17.278 -30.446 562 3HG1 VAL 71 3HG1 VAL 71 -15.210 -17.745 -29.158 563 1HG2 VAL 71 1HG2 VAL 71 -11.967 -16.336 -29.941 564 2HG2 VAL 71 2HG2 VAL 71 -11.526 -17.349 -28.547 565 3HG2 VAL 71 3HG2 VAL 71 -11.665 -15.615 -28.373 566 H LEU 72 H LEU 72 -12.863 -13.130 -28.642 567 HA LEU 72 HA LEU 72 -13.637 -12.322 -25.997 568 1HB LEU 72 1HB LEU 72 -10.747 -12.867 -26.698 569 2HB LEU 72 2HB LEU 72 -11.206 -11.797 -25.404 570 HG LEU 72 HG LEU 72 -12.435 -13.879 -24.487 571 1HD1 LEU 72 1HD1 LEU 72 -11.251 -15.988 -24.942 572 2HD1 LEU 72 2HD1 LEU 72 -10.371 -15.189 -26.249 573 3HD1 LEU 72 3HD1 LEU 72 -12.124 -15.372 -26.342 574 1HD2 LEU 72 1HD2 LEU 72 -10.660 -12.771 -23.361 575 2HD2 LEU 72 2HD2 LEU 72 -9.470 -13.542 -24.407 576 3HD2 LEU 72 3HD2 LEU 72 -10.411 -14.516 -23.273 577 H ASN 73 H ASN 73 -13.733 -10.007 -25.979 578 HA ASN 73 HA ASN 73 -11.768 -8.714 -27.671 579 1HB ASN 73 1HB ASN 73 -13.211 -7.227 -28.809 580 2HB ASN 73 2HB ASN 73 -14.056 -8.753 -28.890 581 1HD2 ASN 73 1HD2 ASN 73 -15.248 -8.556 -26.129 582 2HD2 ASN 73 2HD2 ASN 73 -16.378 -7.276 -26.292 583 H ASN 74 H ASN 74 -12.213 -9.227 -24.822 584 HA ASN 74 HA ASN 74 -11.556 -6.595 -23.959 585 1HB ASN 74 1HB ASN 74 -13.980 -6.484 -23.654 586 2HB ASN 74 2HB ASN 74 -13.938 -7.949 -22.682 587 1HD2 ASN 74 1HD2 ASN 74 -14.789 -6.899 -20.893 588 2HD2 ASN 74 2HD2 ASN 74 -13.871 -5.791 -19.936 589 H CYS 75 H CYS 75 -9.653 -7.707 -23.772 590 HA CYS 75 HA CYS 75 -9.424 -8.543 -20.996 591 1HB CYS 75 1HB CYS 75 -7.980 -9.709 -23.372 592 2HB CYS 75 2HB CYS 75 -7.245 -9.726 -21.773 593 H GLN 76 H GLN 76 -8.003 -7.335 -19.882 594 HA GLN 76 HA GLN 76 -6.474 -5.494 -21.431 595 1HB GLN 76 1HB GLN 76 -8.614 -4.712 -19.458 596 2HB GLN 76 2HB GLN 76 -7.308 -3.616 -19.907 597 1HG GLN 76 1HG GLN 76 -7.959 -3.772 -22.237 598 2HG GLN 76 2HG GLN 76 -9.264 -4.872 -21.831 599 1HE2 GLN 76 1HE2 GLN 76 -11.130 -4.034 -20.926 600 2HE2 GLN 76 2HE2 GLN 76 -11.451 -2.347 -20.833 601 H LEU 77 H LEU 77 -4.714 -5.810 -20.868 602 HA LEU 77 HA LEU 77 -4.233 -7.639 -18.885 603 1HB LEU 77 1HB LEU 77 -3.019 -7.644 -20.931 604 2HB LEU 77 2HB LEU 77 -2.312 -6.090 -20.579 605 HG LEU 77 HG LEU 77 -1.005 -7.123 -18.710 606 1HD1 LEU 77 1HD1 LEU 77 -2.315 -9.675 -19.579 607 2HD1 LEU 77 2HD1 LEU 77 -2.549 -8.819 -18.060 608 3HD1 LEU 77 3HD1 LEU 77 -0.977 -9.506 -18.442 609 1HD2 LEU 77 1HD2 LEU 77 0.440 -8.489 -20.152 610 2HD2 LEU 77 2HD2 LEU 77 -0.014 -6.963 -20.903 611 3HD2 LEU 77 3HD2 LEU 77 -0.804 -8.455 -21.406 612 H GLN 78 H GLN 78 -3.641 -7.402 -16.846 613 HA GLN 78 HA GLN 78 -3.282 -4.781 -15.738 614 1HB GLN 78 1HB GLN 78 -3.196 -7.493 -14.402 615 2HB GLN 78 2HB GLN 78 -3.318 -5.942 -13.584 616 1HG GLN 78 1HG GLN 78 -5.385 -7.111 -15.440 617 2HG GLN 78 2HG GLN 78 -5.468 -7.105 -13.679 618 1HE2 GLN 78 1HE2 GLN 78 -5.684 -5.170 -16.570 619 2HE2 GLN 78 2HE2 GLN 78 -6.377 -3.789 -15.832 620 H ASN 79 H ASN 79 -1.429 -7.866 -15.728 621 HA ASN 79 HA ASN 79 1.024 -6.711 -16.323 622 1HB ASN 79 1HB ASN 79 0.876 -5.874 -14.005 623 2HB ASN 79 2HB ASN 79 0.545 -7.508 -13.434 624 1HD2 ASN 79 1HD2 ASN 79 2.925 -5.374 -14.755 625 2HD2 ASN 79 2HD2 ASN 79 4.294 -6.307 -14.298 626 HA PRO 80 HA PRO 80 0.585 -10.961 -17.053 627 1HB PRO 80 1HB PRO 80 2.351 -11.374 -19.006 628 2HB PRO 80 2HB PRO 80 0.870 -10.461 -19.246 629 1HG PRO 80 1HG PRO 80 3.644 -9.410 -18.746 630 2HG PRO 80 2HG PRO 80 2.441 -8.819 -19.901 631 1HD PRO 80 1HD PRO 80 2.904 -7.697 -17.415 632 2HD PRO 80 2HD PRO 80 1.371 -7.577 -18.315 633 H GLN 81 H GLN 81 3.454 -9.540 -15.810 634 HA GLN 81 HA GLN 81 5.040 -11.912 -15.983 635 1HB GLN 81 1HB GLN 81 6.904 -10.575 -15.168 636 2HB GLN 81 2HB GLN 81 6.125 -9.862 -16.578 637 1HG GLN 81 1HG GLN 81 5.022 -8.242 -15.177 638 2HG GLN 81 2HG GLN 81 5.688 -9.000 -13.733 639 1HE2 GLN 81 1HE2 GLN 81 7.848 -8.744 -13.276 640 2HE2 GLN 81 2HE2 GLN 81 8.822 -7.533 -14.017 641 H ARG 82 H ARG 82 2.973 -10.633 -13.844 642 HA ARG 82 HA ARG 82 2.551 -10.574 -11.661 643 1HB ARG 82 1HB ARG 82 2.547 -12.769 -10.475 644 2HB ARG 82 2HB ARG 82 1.851 -12.860 -12.081 645 1HG ARG 82 1HG ARG 82 3.944 -13.743 -12.902 646 2HG ARG 82 2HG ARG 82 4.595 -13.748 -11.265 647 1HD ARG 82 1HD ARG 82 3.822 -15.984 -11.712 648 2HD ARG 82 2HD ARG 82 2.662 -15.232 -10.622 649 HE ARG 82 HE ARG 82 1.141 -15.020 -12.374 650 1HH1 ARG 82 1HH1 ARG 82 4.054 -16.835 -13.323 651 2HH1 ARG 82 2HH1 ARG 82 3.364 -17.487 -14.726 652 1HH2 ARG 82 1HH2 ARG 82 0.203 -15.921 -14.289 653 2HH2 ARG 82 2HH2 ARG 82 1.101 -16.993 -15.285 Start of MODEL 6 1 H MET 1 H MET 1 2.186 -20.051 -13.332 2 HA MET 1 HA MET 1 3.208 -21.846 -12.188 3 1HB MET 1 1HB MET 1 2.745 -23.563 -13.933 4 2HB MET 1 2HB MET 1 3.941 -22.813 -14.975 5 1HG MET 1 1HG MET 1 5.669 -23.333 -13.273 6 2HG MET 1 2HG MET 1 4.437 -24.186 -12.341 7 1HE MET 1 1HE MET 1 2.718 -25.539 -14.766 8 2HE MET 1 2HE MET 1 3.132 -26.347 -13.259 9 3HE MET 1 3HE MET 1 3.486 -27.125 -14.801 10 H GLN 2 H GLN 2 5.203 -21.467 -15.122 11 HA GLN 2 HA GLN 2 6.532 -19.169 -13.850 12 1HB GLN 2 1HB GLN 2 7.738 -21.376 -15.529 13 2HB GLN 2 2HB GLN 2 8.568 -19.887 -15.136 14 1HG GLN 2 1HG GLN 2 8.412 -20.469 -12.757 15 2HG GLN 2 2HG GLN 2 7.659 -22.000 -13.214 16 1HE2 GLN 2 1HE2 GLN 2 8.895 -23.560 -14.220 17 2HE2 GLN 2 2HE2 GLN 2 10.615 -23.518 -14.232 18 H THR 3 H THR 3 4.493 -20.125 -16.075 19 HA THR 3 HA THR 3 5.418 -19.051 -18.482 20 HB THR 3 HB THR 3 2.568 -19.345 -18.142 21 HG1 THR 3 HG1 THR 3 2.687 -21.596 -17.503 22 1HG2 THR 3 1HG2 THR 3 2.933 -21.032 -19.888 23 2HG2 THR 3 2HG2 THR 3 4.672 -20.975 -19.593 24 3HG2 THR 3 3HG2 THR 3 3.836 -19.564 -20.249 25 H ASP 4 H ASP 4 4.687 -17.202 -19.456 26 HA ASP 4 HA ASP 4 3.898 -15.050 -17.707 27 1HB ASP 4 1HB ASP 4 5.742 -14.872 -19.400 28 2HB ASP 4 2HB ASP 4 4.578 -15.151 -20.675 29 H THR 5 H THR 5 1.890 -13.816 -18.370 30 HA THR 5 HA THR 5 0.032 -15.160 -20.057 31 HB THR 5 HB THR 5 -0.048 -16.759 -18.265 32 HG1 THR 5 HG1 THR 5 -2.374 -15.266 -17.796 33 1HG2 THR 5 1HG2 THR 5 0.712 -15.393 -16.395 34 2HG2 THR 5 2HG2 THR 5 -0.818 -16.169 -15.987 35 3HG2 THR 5 3HG2 THR 5 -0.785 -14.464 -16.436 36 H LEU 6 H LEU 6 -2.089 -14.148 -20.080 37 HA LEU 6 HA LEU 6 -1.765 -11.407 -19.435 38 1HB LEU 6 1HB LEU 6 -3.791 -12.892 -21.069 39 2HB LEU 6 2HB LEU 6 -4.070 -11.218 -20.617 40 HG LEU 6 HG LEU 6 -1.753 -10.796 -21.544 41 1HD1 LEU 6 1HD1 LEU 6 -2.175 -13.364 -22.965 42 2HD1 LEU 6 2HD1 LEU 6 -0.900 -12.940 -21.814 43 3HD1 LEU 6 3HD1 LEU 6 -0.973 -12.138 -23.381 44 1HD2 LEU 6 1HD2 LEU 6 -3.706 -9.883 -22.583 45 2HD2 LEU 6 2HD2 LEU 6 -4.011 -11.400 -23.435 46 3HD2 LEU 6 3HD2 LEU 6 -2.582 -10.434 -23.822 47 H GLU 7 H GLU 7 -4.626 -10.752 -18.964 48 HA GLU 7 HA GLU 7 -4.140 -10.579 -16.196 49 1HB GLU 7 1HB GLU 7 -5.029 -8.747 -17.586 50 2HB GLU 7 2HB GLU 7 -6.512 -9.666 -17.815 51 1HG GLU 7 1HG GLU 7 -6.951 -9.614 -15.480 52 2HG GLU 7 2HG GLU 7 -5.431 -8.775 -15.179 53 H TYR 8 H TYR 8 -5.601 -12.772 -18.195 54 HA TYR 8 HA TYR 8 -7.013 -14.207 -18.262 55 1HB TYR 8 1HB TYR 8 -7.221 -15.879 -16.358 56 2HB TYR 8 2HB TYR 8 -5.612 -15.519 -16.932 57 HD1 TYR 8 HD1 TYR 8 -3.961 -14.612 -15.436 58 HD2 TYR 8 HD2 TYR 8 -7.988 -15.055 -14.129 59 HE1 TYR 8 HE1 TYR 8 -3.244 -14.238 -13.117 60 HE2 TYR 8 HE2 TYR 8 -7.277 -14.676 -11.804 61 HH TYR 8 HH TYR 8 -4.253 -13.440 -11.005 62 H GLN 9 H GLN 9 -8.167 -11.764 -17.747 63 HA GLN 9 HA GLN 9 -10.709 -12.494 -16.686 64 1HB GLN 9 1HB GLN 9 -9.052 -10.163 -15.721 65 2HB GLN 9 2HB GLN 9 -10.784 -10.311 -15.461 66 1HG GLN 9 1HG GLN 9 -10.518 -12.249 -14.181 67 2HG GLN 9 2HG GLN 9 -8.806 -12.365 -14.575 68 1HE2 GLN 9 1HE2 GLN 9 -7.371 -10.956 -13.611 69 2HE2 GLN 9 2HE2 GLN 9 -7.786 -10.002 -12.223 70 H CYS 10 H CYS 10 -11.733 -12.230 -18.341 71 HA CYS 10 HA CYS 10 -11.606 -9.713 -19.822 72 1HB CYS 10 1HB CYS 10 -11.548 -12.511 -20.883 73 2HB CYS 10 2HB CYS 10 -11.919 -11.123 -21.936 74 H ASP 11 H ASP 11 -13.676 -9.213 -20.775 75 HA ASP 11 HA ASP 11 -15.852 -10.153 -19.170 76 1HB ASP 11 1HB ASP 11 -15.743 -7.826 -19.963 77 2HB ASP 11 2HB ASP 11 -15.846 -8.385 -21.626 78 H GLU 12 H GLU 12 -14.406 -11.313 -21.908 79 HA GLU 12 HA GLU 12 -16.675 -12.508 -23.183 80 1HB GLU 12 1HB GLU 12 -13.731 -12.942 -23.582 81 2HB GLU 12 2HB GLU 12 -15.033 -13.312 -24.702 82 1HG GLU 12 1HG GLU 12 -14.428 -10.535 -23.792 83 2HG GLU 12 2HG GLU 12 -13.640 -11.268 -25.184 84 H LYS 13 H LYS 13 -13.672 -13.558 -21.657 85 HA LYS 13 HA LYS 13 -14.697 -16.155 -20.826 86 1HB LYS 13 1HB LYS 13 -12.274 -15.912 -22.610 87 2HB LYS 13 2HB LYS 13 -13.125 -17.370 -22.169 88 1HG LYS 13 1HG LYS 13 -14.197 -15.227 -23.986 89 2HG LYS 13 2HG LYS 13 -13.358 -16.659 -24.575 90 1HD LYS 13 1HD LYS 13 -15.966 -16.569 -23.049 91 2HD LYS 13 2HD LYS 13 -15.750 -16.927 -24.761 92 1HE LYS 13 1HE LYS 13 -14.505 -18.954 -24.204 93 2HE LYS 13 2HE LYS 13 -14.688 -18.604 -22.485 94 1HZ LYS 13 1HZ LYS 13 -16.333 -20.208 -23.242 95 2HZ LYS 13 2HZ LYS 13 -16.883 -19.119 -24.389 96 3HZ LYS 13 3HZ LYS 13 -17.086 -18.772 -22.754 97 HA PRO 14 HA PRO 14 -11.028 -15.064 -18.364 98 1HB PRO 14 1HB PRO 14 -10.307 -17.832 -17.810 99 2HB PRO 14 2HB PRO 14 -11.038 -16.670 -16.703 100 1HG PRO 14 1HG PRO 14 -12.346 -18.885 -17.672 101 2HG PRO 14 2HG PRO 14 -13.163 -17.412 -17.130 102 1HD PRO 14 1HD PRO 14 -12.525 -18.306 -19.913 103 2HD PRO 14 2HD PRO 14 -13.979 -17.491 -19.293 104 H LEU 15 H LEU 15 -8.837 -14.681 -19.164 105 HA LEU 15 HA LEU 15 -8.120 -16.423 -21.377 106 1HB LEU 15 1HB LEU 15 -8.723 -14.190 -22.173 107 2HB LEU 15 2HB LEU 15 -7.564 -13.495 -21.052 108 HG LEU 15 HG LEU 15 -5.739 -14.616 -22.259 109 1HD1 LEU 15 1HD1 LEU 15 -6.933 -16.483 -23.238 110 2HD1 LEU 15 2HD1 LEU 15 -6.144 -15.542 -24.506 111 3HD1 LEU 15 3HD1 LEU 15 -7.877 -15.383 -24.244 112 1HD2 LEU 15 1HD2 LEU 15 -5.753 -13.156 -24.228 113 2HD2 LEU 15 2HD2 LEU 15 -6.272 -12.310 -22.773 114 3HD2 LEU 15 3HD2 LEU 15 -7.464 -12.827 -23.967 115 H THR 16 H THR 16 -7.033 -17.704 -19.920 116 HA THR 16 HA THR 16 -4.755 -16.378 -18.793 117 HB THR 16 HB THR 16 -5.286 -19.335 -18.401 118 HG1 THR 16 HG1 THR 16 -6.913 -17.278 -17.776 119 1HG2 THR 16 1HG2 THR 16 -4.162 -17.136 -16.665 120 2HG2 THR 16 2HG2 THR 16 -3.214 -18.358 -17.515 121 3HG2 THR 16 3HG2 THR 16 -4.286 -18.831 -16.190 122 H VAL 17 H VAL 17 -2.688 -16.935 -19.621 123 HA VAL 17 HA VAL 17 -2.825 -18.471 -22.082 124 HB VAL 17 HB VAL 17 -1.319 -15.888 -21.585 125 1HG1 VAL 17 1HG1 VAL 17 -1.375 -17.606 -24.040 126 2HG1 VAL 17 2HG1 VAL 17 0.037 -17.403 -23.010 127 3HG1 VAL 17 3HG1 VAL 17 -0.592 -16.037 -23.929 128 1HG2 VAL 17 1HG2 VAL 17 -3.638 -15.491 -22.008 129 2HG2 VAL 17 2HG2 VAL 17 -3.634 -16.633 -23.344 130 3HG2 VAL 17 3HG2 VAL 17 -2.760 -15.118 -23.502 131 H LYS 18 H LYS 18 -0.998 -19.818 -22.561 132 HA LYS 18 HA LYS 18 0.981 -19.927 -20.468 133 1HB LYS 18 1HB LYS 18 0.092 -21.924 -22.535 134 2HB LYS 18 2HB LYS 18 1.683 -22.049 -21.813 135 1HG LYS 18 1HG LYS 18 0.192 -23.559 -20.701 136 2HG LYS 18 2HG LYS 18 0.612 -22.251 -19.599 137 1HD LYS 18 1HD LYS 18 -1.522 -21.208 -19.969 138 2HD LYS 18 2HD LYS 18 -1.957 -22.422 -21.177 139 1HE LYS 18 1HE LYS 18 -1.757 -24.180 -19.433 140 2HE LYS 18 2HE LYS 18 -1.406 -22.925 -18.249 141 1HZ LYS 18 1HZ LYS 18 -3.618 -22.011 -18.616 142 2HZ LYS 18 2HZ LYS 18 -3.738 -23.613 -18.181 143 3HZ LYS 18 3HZ LYS 18 -3.952 -23.174 -19.766 144 H LEU 19 H LEU 19 1.597 -17.844 -21.390 145 HA LEU 19 HA LEU 19 2.810 -17.829 -23.942 146 1HB LEU 19 1HB LEU 19 1.676 -15.987 -22.336 147 2HB LEU 19 2HB LEU 19 3.348 -15.837 -21.861 148 HG LEU 19 HG LEU 19 2.239 -15.546 -24.571 149 1HD1 LEU 19 1HD1 LEU 19 1.567 -13.712 -23.192 150 2HD1 LEU 19 2HD1 LEU 19 2.800 -13.130 -24.316 151 3HD1 LEU 19 3HD1 LEU 19 3.222 -13.462 -22.633 152 1HD2 LEU 19 1HD2 LEU 19 4.461 -14.631 -25.237 153 2HD2 LEU 19 2HD2 LEU 19 4.519 -16.324 -24.741 154 3HD2 LEU 19 3HD2 LEU 19 5.074 -15.063 -23.639 155 H ASN 20 H ASN 20 4.394 -19.088 -24.009 156 HA ASN 20 HA ASN 20 6.247 -19.391 -21.804 157 1HB ASN 20 1HB ASN 20 5.647 -21.247 -23.475 158 2HB ASN 20 2HB ASN 20 6.682 -20.356 -24.602 159 1HD2 ASN 20 1HD2 ASN 20 8.043 -22.045 -24.763 160 2HD2 ASN 20 2HD2 ASN 20 9.214 -22.462 -23.565 161 H ASN 21 H ASN 21 7.912 -18.071 -21.462 162 HA ASN 21 HA ASN 21 8.408 -15.930 -23.247 163 1HB ASN 21 1HB ASN 21 8.582 -15.713 -20.787 164 2HB ASN 21 2HB ASN 21 10.020 -16.733 -20.855 165 1HD2 ASN 21 1HD2 ASN 21 8.710 -13.607 -21.665 166 2HD2 ASN 21 2HD2 ASN 21 10.231 -12.823 -21.877 167 HA PRO 22 HA PRO 22 12.684 -18.080 -24.211 168 1HB PRO 22 1HB PRO 22 12.134 -20.927 -23.727 169 2HB PRO 22 2HB PRO 22 13.549 -19.975 -23.266 170 1HG PRO 22 1HG PRO 22 11.790 -20.806 -21.444 171 2HG PRO 22 2HG PRO 22 12.548 -19.202 -21.323 172 1HD PRO 22 1HD PRO 22 9.825 -19.949 -22.311 173 2HD PRO 22 2HD PRO 22 10.301 -18.635 -21.220 174 H ARG 23 H ARG 23 9.544 -18.951 -25.073 175 HA ARG 23 HA ARG 23 10.152 -19.510 -27.748 176 1HB ARG 23 1HB ARG 23 10.693 -21.708 -26.682 177 2HB ARG 23 2HB ARG 23 9.043 -21.766 -26.083 178 1HG ARG 23 1HG ARG 23 8.250 -21.742 -28.413 179 2HG ARG 23 2HG ARG 23 9.934 -21.839 -28.945 180 1HD ARG 23 1HD ARG 23 10.193 -23.894 -27.605 181 2HD ARG 23 2HD ARG 23 8.478 -23.827 -27.216 182 HE ARG 23 HE ARG 23 9.649 -24.315 -29.849 183 1HH1 ARG 23 1HH1 ARG 23 6.772 -24.368 -27.749 184 2HH1 ARG 23 2HH1 ARG 23 5.934 -25.457 -28.748 185 1HH2 ARG 23 1HH2 ARG 23 8.517 -25.804 -31.136 186 2HH2 ARG 23 2HH2 ARG 23 6.940 -26.307 -30.717 187 H GLN 24 H GLN 24 8.936 -17.951 -27.783 188 HA GLN 24 HA GLN 24 6.662 -16.957 -26.680 189 1HB GLN 24 1HB GLN 24 7.500 -16.507 -29.532 190 2HB GLN 24 2HB GLN 24 6.271 -15.577 -28.708 191 1HG GLN 24 1HG GLN 24 8.144 -14.221 -28.606 192 2HG GLN 24 2HG GLN 24 8.139 -14.995 -27.026 193 1HE2 GLN 24 1HE2 GLN 24 9.826 -16.391 -26.493 194 2HE2 GLN 24 2HE2 GLN 24 11.212 -16.560 -27.509 195 H GLU 25 H GLU 25 6.194 -19.618 -27.455 196 HA GLU 25 HA GLU 25 3.716 -19.380 -29.022 197 1HB GLU 25 1HB GLU 25 5.314 -21.717 -28.176 198 2HB GLU 25 2HB GLU 25 3.574 -21.947 -28.204 199 1HG GLU 25 1HG GLU 25 4.384 -22.677 -30.257 200 2HG GLU 25 2HG GLU 25 3.589 -21.143 -30.541 201 H VAL 26 H VAL 26 1.754 -19.628 -28.244 202 HA VAL 26 HA VAL 26 1.407 -19.643 -25.290 203 HB VAL 26 HB VAL 26 -0.509 -18.285 -25.585 204 1HG1 VAL 26 1HG1 VAL 26 0.500 -16.171 -26.299 205 2HG1 VAL 26 2HG1 VAL 26 1.845 -17.081 -26.998 206 3HG1 VAL 26 3HG1 VAL 26 1.535 -17.149 -25.260 207 1HG2 VAL 26 1HG2 VAL 26 -1.300 -18.991 -27.761 208 2HG2 VAL 26 2HG2 VAL 26 0.091 -18.236 -28.535 209 3HG2 VAL 26 3HG2 VAL 26 -1.123 -17.234 -27.739 210 H SER 27 H SER 27 -0.101 -20.785 -24.514 211 HA SER 27 HA SER 27 -1.881 -22.168 -26.335 212 1HB SER 27 1HB SER 27 -0.650 -23.391 -23.842 213 2HB SER 27 2HB SER 27 -1.737 -24.153 -25.016 214 HG SER 27 HG SER 27 0.258 -23.159 -26.376 215 H PHE 28 H PHE 28 -3.828 -21.596 -25.836 216 HA PHE 28 HA PHE 28 -4.318 -20.876 -23.079 217 1HB PHE 28 1HB PHE 28 -5.586 -18.846 -23.594 218 2HB PHE 28 2HB PHE 28 -3.934 -18.719 -24.147 219 HD1 PHE 28 HD1 PHE 28 -3.466 -18.204 -26.381 220 HD2 PHE 28 HD2 PHE 28 -7.424 -19.261 -25.256 221 HE1 PHE 28 HE1 PHE 28 -4.291 -17.429 -28.554 222 HE2 PHE 28 HE2 PHE 28 -8.255 -18.500 -27.438 223 HZ PHE 28 HZ PHE 28 -6.686 -17.579 -29.091 224 H VAL 29 H VAL 29 -6.768 -20.215 -23.018 225 HA VAL 29 HA VAL 29 -7.958 -22.775 -23.540 226 HB VAL 29 HB VAL 29 -7.712 -22.271 -21.205 227 1HG1 VAL 29 1HG1 VAL 29 -7.535 -19.864 -21.212 228 2HG1 VAL 29 2HG1 VAL 29 -8.801 -20.345 -20.096 229 3HG1 VAL 29 3HG1 VAL 29 -9.224 -19.699 -21.674 230 1HG2 VAL 29 1HG2 VAL 29 -10.591 -21.980 -22.058 231 2HG2 VAL 29 2HG2 VAL 29 -10.066 -22.404 -20.433 232 3HG2 VAL 29 3HG2 VAL 29 -9.722 -23.490 -21.779 233 H TYR 30 H TYR 30 -9.209 -22.858 -25.010 234 HA TYR 30 HA TYR 30 -10.629 -20.693 -26.278 235 1HB TYR 30 1HB TYR 30 -10.025 -22.686 -27.577 236 2HB TYR 30 2HB TYR 30 -11.027 -23.691 -26.542 237 HD1 TYR 30 HD1 TYR 30 -11.166 -20.892 -28.979 238 HD2 TYR 30 HD2 TYR 30 -13.303 -24.035 -27.072 239 HE1 TYR 30 HE1 TYR 30 -13.057 -20.527 -30.505 240 HE2 TYR 30 HE2 TYR 30 -15.198 -23.676 -28.595 241 HH TYR 30 HH TYR 30 -16.116 -21.956 -30.004 242 H ASP 31 H ASP 31 -11.488 -23.232 -24.041 243 HA ASP 31 HA ASP 31 -13.471 -21.783 -22.695 244 1HB ASP 31 1HB ASP 31 -14.762 -22.185 -24.817 245 2HB ASP 31 2HB ASP 31 -14.623 -23.913 -24.534 246 H ASN 32 H ASN 32 -12.891 -25.104 -23.826 247 HA ASN 32 HA ASN 32 -12.298 -25.907 -21.080 248 1HB ASN 32 1HB ASN 32 -14.749 -26.340 -21.566 249 2HB ASN 32 2HB ASN 32 -14.245 -27.393 -22.875 250 1HD2 ASN 32 1HD2 ASN 32 -15.263 -29.175 -21.926 251 2HD2 ASN 32 2HD2 ASN 32 -14.605 -29.943 -20.524 252 H GLN 33 H GLN 33 -10.702 -25.398 -23.542 253 HA GLN 33 HA GLN 33 -9.179 -27.754 -23.603 254 1HB GLN 33 1HB GLN 33 -9.344 -28.208 -25.949 255 2HB GLN 33 2HB GLN 33 -10.985 -28.274 -25.321 256 1HG GLN 33 1HG GLN 33 -11.323 -25.973 -26.113 257 2HG GLN 33 2HG GLN 33 -9.687 -26.035 -26.773 258 1HE2 GLN 33 1HE2 GLN 33 -9.284 -27.241 -28.631 259 2HE2 GLN 33 2HE2 GLN 33 -10.540 -27.898 -29.605 260 H LEU 34 H LEU 34 -7.272 -27.321 -24.545 261 HA LEU 34 HA LEU 34 -6.774 -24.480 -24.583 262 1HB LEU 34 1HB LEU 34 -5.003 -26.834 -24.099 263 2HB LEU 34 2HB LEU 34 -4.358 -25.198 -24.227 264 HG LEU 34 HG LEU 34 -6.217 -26.277 -22.093 265 1HD1 LEU 34 1HD1 LEU 34 -3.306 -25.511 -21.980 266 2HD1 LEU 34 2HD1 LEU 34 -3.951 -27.149 -21.929 267 3HD1 LEU 34 3HD1 LEU 34 -4.290 -26.030 -20.612 268 1HD2 LEU 34 1HD2 LEU 34 -4.903 -23.576 -22.343 269 2HD2 LEU 34 2HD2 LEU 34 -5.812 -24.153 -20.947 270 3HD2 LEU 34 3HD2 LEU 34 -6.626 -23.917 -22.490 271 H LEU 35 H LEU 35 -5.729 -23.636 -26.364 272 HA LEU 35 HA LEU 35 -4.727 -25.519 -28.360 273 1HB LEU 35 1HB LEU 35 -5.691 -24.423 -30.255 274 2HB LEU 35 2HB LEU 35 -6.980 -24.722 -29.126 275 HG LEU 35 HG LEU 35 -5.723 -22.050 -29.792 276 1HD1 LEU 35 1HD1 LEU 35 -7.896 -21.552 -30.677 277 2HD1 LEU 35 2HD1 LEU 35 -8.411 -23.203 -30.331 278 3HD1 LEU 35 3HD1 LEU 35 -7.116 -22.904 -31.491 279 1HD2 LEU 35 1HD2 LEU 35 -7.452 -21.058 -28.355 280 2HD2 LEU 35 2HD2 LEU 35 -6.365 -22.075 -27.414 281 3HD2 LEU 35 3HD2 LEU 35 -7.963 -22.672 -27.853 282 H HIS 36 H HIS 36 -3.025 -24.702 -29.752 283 HA HIS 36 HA HIS 36 -1.705 -22.555 -28.342 284 1HB HIS 36 1HB HIS 36 0.457 -23.601 -28.722 285 2HB HIS 36 2HB HIS 36 -0.634 -24.598 -27.783 286 HD2 HIS 36 HD2 HIS 36 0.976 -24.544 -31.373 287 HE1 HIS 36 HE1 HIS 36 -0.236 -28.482 -30.452 288 HE2 HIS 36 HE2 HIS 36 0.697 -26.973 -32.228 289 H LEU 37 H LEU 37 -0.798 -21.041 -29.262 290 HA LEU 37 HA LEU 37 -0.763 -20.836 -32.215 291 1HB LEU 37 1HB LEU 37 -1.560 -18.601 -30.374 292 2HB LEU 37 2HB LEU 37 -1.477 -18.555 -32.093 293 HG LEU 37 HG LEU 37 -3.302 -20.441 -32.014 294 1HD1 LEU 37 1HD1 LEU 37 -3.300 -20.986 -29.735 295 2HD1 LEU 37 2HD1 LEU 37 -4.864 -20.236 -30.099 296 3HD1 LEU 37 3HD1 LEU 37 -3.609 -19.326 -29.263 297 1HD2 LEU 37 1HD2 LEU 37 -3.869 -18.428 -32.988 298 2HD2 LEU 37 2HD2 LEU 37 -3.856 -17.554 -31.453 299 3HD2 LEU 37 3HD2 LEU 37 -5.141 -18.723 -31.801 300 H LYS 38 H LYS 38 0.751 -19.526 -32.995 301 HA LYS 38 HA LYS 38 2.942 -19.226 -31.113 302 1HB LYS 38 1HB LYS 38 4.374 -19.629 -32.974 303 2HB LYS 38 2HB LYS 38 3.167 -20.909 -32.752 304 1HG LYS 38 1HG LYS 38 1.903 -20.176 -34.594 305 2HG LYS 38 2HG LYS 38 2.892 -18.719 -34.769 306 1HD LYS 38 1HD LYS 38 4.796 -20.044 -35.171 307 2HD LYS 38 2HD LYS 38 3.849 -21.534 -35.033 308 1HE LYS 38 1HE LYS 38 2.438 -20.764 -36.920 309 2HE LYS 38 2HE LYS 38 3.476 -19.353 -37.086 310 1HZ LYS 38 1HZ LYS 38 4.272 -22.181 -37.436 311 2HZ LYS 38 2HZ LYS 38 5.335 -20.870 -37.509 312 3HZ LYS 38 3HZ LYS 38 4.116 -21.028 -38.661 313 H GLN 39 H GLN 39 4.276 -17.537 -31.471 314 HA GLN 39 HA GLN 39 2.850 -15.150 -32.291 315 1HB GLN 39 1HB GLN 39 3.944 -15.044 -30.247 316 2HB GLN 39 2HB GLN 39 5.526 -15.485 -30.935 317 1HG GLN 39 1HG GLN 39 5.175 -13.329 -32.328 318 2HG GLN 39 2HG GLN 39 3.925 -12.947 -31.147 319 1HE2 GLN 39 1HE2 GLN 39 4.552 -12.580 -28.956 320 2HE2 GLN 39 2HE2 GLN 39 6.186 -12.182 -28.593 321 H GLY 40 H GLY 40 2.916 -14.556 -34.118 322 1HA GLY 40 1HA GLY 40 5.394 -14.628 -35.664 323 2HA GLY 40 2HA GLY 40 3.776 -14.666 -36.402 324 H ILE 41 H ILE 41 6.176 -12.530 -35.886 325 HA ILE 41 HA ILE 41 4.837 -10.635 -34.422 326 HB ILE 41 HB ILE 41 7.266 -10.650 -34.551 327 1HG1 ILE 41 1HG1 ILE 41 7.593 -8.231 -35.020 328 2HG1 ILE 41 2HG1 ILE 41 5.937 -8.253 -35.667 329 1HG2 ILE 41 1HG2 ILE 41 6.942 -9.819 -37.432 330 2HG2 ILE 41 2HG2 ILE 41 7.592 -11.354 -36.862 331 3HG2 ILE 41 3HG2 ILE 41 8.466 -9.855 -36.543 332 1HD1 ILE 41 1HD1 ILE 41 5.043 -8.848 -33.512 333 2HD1 ILE 41 2HD1 ILE 41 6.023 -7.387 -33.337 334 3HD1 ILE 41 3HD1 ILE 41 6.660 -8.954 -32.826 335 H SER 42 H SER 42 3.305 -9.338 -34.894 336 HA SER 42 HA SER 42 2.211 -9.148 -37.493 337 1HB SER 42 1HB SER 42 0.681 -7.596 -36.069 338 2HB SER 42 2HB SER 42 0.738 -9.329 -35.670 339 HG SER 42 HG SER 42 1.194 -7.401 -33.993 340 H ALA 43 H ALA 43 3.030 -6.825 -35.091 341 HA ALA 43 HA ALA 43 5.023 -5.368 -36.107 342 1HB ALA 43 1HB ALA 43 3.911 -3.299 -37.006 343 2HB ALA 43 2HB ALA 43 2.364 -4.153 -36.952 344 3HB ALA 43 3HB ALA 43 3.635 -4.707 -38.034 345 H SER 44 H SER 44 1.895 -4.089 -35.136 346 HA SER 44 HA SER 44 2.988 -3.244 -32.613 347 1HB SER 44 1HB SER 44 1.392 -1.803 -33.933 348 2HB SER 44 2HB SER 44 0.154 -3.037 -33.704 349 HG SER 44 HG SER 44 0.289 -1.133 -32.225 350 H GLY 45 H GLY 45 2.603 -4.331 -30.739 351 1HA GLY 45 1HA GLY 45 1.706 -5.890 -29.280 352 2HA GLY 45 2HA GLY 45 0.514 -6.313 -30.492 353 H ALA 46 H ALA 46 0.708 -8.482 -30.274 354 HA ALA 46 HA ALA 46 2.940 -9.625 -31.565 355 1HB ALA 46 1HB ALA 46 3.234 -11.259 -29.726 356 2HB ALA 46 2HB ALA 46 2.120 -10.303 -28.742 357 3HB ALA 46 3HB ALA 46 3.673 -9.620 -29.232 358 H ARG 47 H ARG 47 2.141 -11.260 -32.728 359 HA ARG 47 HA ARG 47 -0.596 -11.539 -32.169 360 1HB ARG 47 1HB ARG 47 -0.317 -10.247 -34.120 361 2HB ARG 47 2HB ARG 47 0.805 -11.369 -34.814 362 1HG ARG 47 1HG ARG 47 -0.942 -12.988 -35.208 363 2HG ARG 47 2HG ARG 47 -2.111 -11.978 -34.351 364 1HD ARG 47 1HD ARG 47 -1.925 -10.258 -35.985 365 2HD ARG 47 2HD ARG 47 -0.583 -11.084 -36.771 366 HE ARG 47 HE ARG 47 -2.314 -12.898 -37.180 367 1HH1 ARG 47 1HH1 ARG 47 -3.204 -9.463 -37.036 368 2HH1 ARG 47 2HH1 ARG 47 -4.373 -9.553 -38.258 369 1HH2 ARG 47 1HH2 ARG 47 -3.853 -13.030 -38.889 370 2HH2 ARG 47 2HH2 ARG 47 -4.750 -11.654 -39.382 371 H TYR 48 H TYR 48 -0.875 -13.593 -31.360 372 HA TYR 48 HA TYR 48 0.802 -15.825 -32.155 373 1HB TYR 48 1HB TYR 48 -1.301 -15.659 -29.997 374 2HB TYR 48 2HB TYR 48 0.031 -16.806 -30.191 375 HD1 TYR 48 HD1 TYR 48 -0.843 -13.407 -29.086 376 HD2 TYR 48 HD2 TYR 48 2.258 -16.291 -29.456 377 HE1 TYR 48 HE1 TYR 48 0.579 -12.054 -27.616 378 HE2 TYR 48 HE2 TYR 48 3.691 -14.933 -27.982 379 HH TYR 48 HH TYR 48 2.460 -12.223 -26.239 380 H THR 49 H THR 49 0.086 -16.855 -33.730 381 HA THR 49 HA THR 49 -2.674 -17.370 -33.926 382 HB THR 49 HB THR 49 -1.251 -15.834 -36.096 383 HG1 THR 49 HG1 THR 49 -2.518 -14.998 -34.028 384 1HG2 THR 49 1HG2 THR 49 -2.730 -17.522 -37.086 385 2HG2 THR 49 2HG2 THR 49 -3.381 -15.907 -37.349 386 3HG2 THR 49 3HG2 THR 49 -4.069 -16.943 -36.095 387 H ASP 50 H ASP 50 -2.787 -19.404 -34.766 388 HA ASP 50 HA ASP 50 -0.355 -20.361 -35.964 389 1HB ASP 50 1HB ASP 50 -1.152 -21.756 -34.121 390 2HB ASP 50 2HB ASP 50 -2.706 -21.955 -34.910 391 H GLY 51 H GLY 51 -3.657 -21.366 -36.325 392 1HA GLY 51 1HA GLY 51 -4.250 -20.152 -38.755 393 2HA GLY 51 2HA GLY 51 -3.696 -21.808 -39.044 394 H ILE 52 H ILE 52 -5.387 -20.415 -36.352 395 HA ILE 52 HA ILE 52 -7.687 -22.155 -36.881 396 HB ILE 52 HB ILE 52 -6.650 -21.559 -34.047 397 1HG1 ILE 52 1HG1 ILE 52 -6.271 -24.139 -35.588 398 2HG1 ILE 52 2HG1 ILE 52 -5.013 -22.918 -35.455 399 1HG2 ILE 52 1HG2 ILE 52 -8.124 -23.402 -33.448 400 2HG2 ILE 52 2HG2 ILE 52 -8.590 -23.593 -35.137 401 3HG2 ILE 52 3HG2 ILE 52 -9.015 -22.118 -34.263 402 1HD1 ILE 52 1HD1 ILE 52 -4.690 -24.710 -33.848 403 2HD1 ILE 52 2HD1 ILE 52 -6.286 -24.388 -33.156 404 3HD1 ILE 52 3HD1 ILE 52 -5.011 -23.168 -33.056 405 H TYR 53 H TYR 53 -6.669 -19.690 -34.528 406 HA TYR 53 HA TYR 53 -8.635 -17.715 -35.540 407 1HB TYR 53 1HB TYR 53 -7.986 -18.058 -32.624 408 2HB TYR 53 2HB TYR 53 -9.262 -17.119 -33.389 409 HD1 TYR 53 HD1 TYR 53 -8.787 -19.857 -31.411 410 HD2 TYR 53 HD2 TYR 53 -10.800 -18.823 -34.997 411 HE1 TYR 53 HE1 TYR 53 -10.260 -21.813 -31.153 412 HE2 TYR 53 HE2 TYR 53 -12.271 -20.750 -34.742 413 HH TYR 53 HH TYR 53 -12.124 -22.966 -33.658 414 H VAL 54 H VAL 54 -7.961 -15.656 -34.348 415 HA VAL 54 HA VAL 54 -5.048 -15.410 -34.646 416 HB VAL 54 HB VAL 54 -7.366 -13.674 -35.297 417 1HG1 VAL 54 1HG1 VAL 54 -4.386 -12.981 -35.454 418 2HG1 VAL 54 2HG1 VAL 54 -5.550 -12.243 -34.357 419 3HG1 VAL 54 3HG1 VAL 54 -5.668 -11.952 -36.093 420 1HG2 VAL 54 1HG2 VAL 54 -6.926 -15.274 -37.010 421 2HG2 VAL 54 2HG2 VAL 54 -5.214 -14.865 -37.032 422 3HG2 VAL 54 3HG2 VAL 54 -6.397 -13.702 -37.617 423 H PHE 55 H PHE 55 -4.237 -15.142 -32.597 424 HA PHE 55 HA PHE 55 -5.800 -13.546 -30.723 425 1HB PHE 55 1HB PHE 55 -5.176 -15.705 -29.798 426 2HB PHE 55 2HB PHE 55 -3.499 -15.466 -30.263 427 HD1 PHE 55 HD1 PHE 55 -5.833 -13.127 -28.493 428 HD2 PHE 55 HD2 PHE 55 -2.321 -15.523 -28.263 429 HE1 PHE 55 HE1 PHE 55 -5.373 -12.240 -26.259 430 HE2 PHE 55 HE2 PHE 55 -1.852 -14.621 -26.028 431 HZ PHE 55 HZ PHE 55 -3.379 -12.975 -25.023 432 H TRP 56 H TRP 56 -5.350 -11.515 -30.958 433 HA TRP 56 HA TRP 56 -2.605 -10.792 -31.491 434 1HB TRP 56 1HB TRP 56 -4.263 -10.195 -33.257 435 2HB TRP 56 2HB TRP 56 -5.083 -9.191 -32.048 436 HD1 TRP 56 HD1 TRP 56 -1.406 -8.865 -31.667 437 HE1 TRP 56 HE1 TRP 56 -0.578 -6.673 -32.706 438 HE3 TRP 56 HE3 TRP 56 -5.586 -7.600 -34.331 439 HZ2 TRP 56 HZ2 TRP 56 -1.541 -4.686 -34.447 440 HZ3 TRP 56 HZ3 TRP 56 -5.539 -5.535 -35.667 441 HH2 TRP 56 HH2 TRP 56 -3.560 -4.110 -35.723 442 H SER 57 H SER 57 -1.722 -10.003 -29.996 443 HA SER 57 HA SER 57 -3.103 -8.991 -27.620 444 1HB SER 57 1HB SER 57 -1.415 -10.891 -27.439 445 2HB SER 57 2HB SER 57 -0.192 -9.755 -28.009 446 HG SER 57 HG SER 57 -0.249 -9.904 -25.729 447 H LYS 58 H LYS 58 -3.310 -6.785 -27.827 448 HA LYS 58 HA LYS 58 -1.337 -5.459 -29.490 449 1HB LYS 58 1HB LYS 58 -3.961 -4.501 -28.346 450 2HB LYS 58 2HB LYS 58 -2.910 -3.530 -29.377 451 1HG LYS 58 1HG LYS 58 -3.201 -5.026 -31.223 452 2HG LYS 58 2HG LYS 58 -4.031 -6.199 -30.216 453 1HD LYS 58 1HD LYS 58 -5.605 -5.016 -31.619 454 2HD LYS 58 2HD LYS 58 -5.891 -4.620 -29.928 455 1HE LYS 58 1HE LYS 58 -4.654 -2.505 -30.258 456 2HE LYS 58 2HE LYS 58 -4.452 -2.918 -31.964 457 1HZ LYS 58 1HZ LYS 58 -7.039 -2.599 -30.566 458 2HZ LYS 58 2HZ LYS 58 -6.849 -2.908 -32.213 459 3HZ LYS 58 3HZ LYS 58 -6.351 -1.430 -31.569 460 H GLY 59 H GLY 59 -2.217 -5.852 -26.223 461 1HA GLY 59 1HA GLY 59 -0.165 -5.319 -24.808 462 2HA GLY 59 2HA GLY 59 -0.405 -3.684 -25.419 463 H ASP 60 H ASP 60 -2.593 -2.783 -25.086 464 HA ASP 60 HA ASP 60 -3.306 -3.141 -22.302 465 1HB ASP 60 1HB ASP 60 -4.341 -1.244 -24.417 466 2HB ASP 60 2HB ASP 60 -4.914 -1.282 -22.759 467 H GLU 61 H GLU 61 -4.353 -4.015 -25.437 468 HA GLU 61 HA GLU 61 -6.666 -5.243 -24.305 469 1HB GLU 61 1HB GLU 61 -7.793 -4.805 -26.501 470 2HB GLU 61 2HB GLU 61 -7.616 -3.395 -25.440 471 1HG GLU 61 1HG GLU 61 -5.682 -2.721 -26.784 472 2HG GLU 61 2HG GLU 61 -5.948 -4.119 -27.826 473 H ALA 62 H ALA 62 -7.360 -7.077 -25.592 474 HA ALA 62 HA ALA 62 -5.449 -8.081 -27.401 475 1HB ALA 62 1HB ALA 62 -6.203 -9.496 -24.844 476 2HB ALA 62 2HB ALA 62 -4.604 -8.864 -25.253 477 3HB ALA 62 3HB ALA 62 -5.277 -10.222 -26.161 478 H THR 63 H THR 63 -6.478 -9.717 -28.610 479 HA THR 63 HA THR 63 -9.250 -10.372 -28.045 480 HB THR 63 HB THR 63 -9.224 -8.189 -29.280 481 HG1 THR 63 HG1 THR 63 -10.242 -10.022 -31.149 482 1HG2 THR 63 1HG2 THR 63 -8.070 -9.897 -31.382 483 2HG2 THR 63 2HG2 THR 63 -7.255 -8.551 -30.533 484 3HG2 THR 63 3HG2 THR 63 -8.607 -8.220 -31.654 485 H VAL 64 H VAL 64 -10.015 -12.074 -29.450 486 HA VAL 64 HA VAL 64 -8.024 -13.548 -30.992 487 HB VAL 64 HB VAL 64 -10.103 -14.863 -29.204 488 1HG1 VAL 64 1HG1 VAL 64 -9.494 -16.163 -31.160 489 2HG1 VAL 64 2HG1 VAL 64 -8.872 -16.934 -29.700 490 3HG1 VAL 64 3HG1 VAL 64 -7.786 -16.018 -30.745 491 1HG2 VAL 64 1HG2 VAL 64 -8.271 -15.595 -27.748 492 2HG2 VAL 64 2HG2 VAL 64 -8.393 -13.833 -27.785 493 3HG2 VAL 64 3HG2 VAL 64 -7.139 -14.657 -28.714 494 H TYR 65 H TYR 65 -8.807 -13.184 -32.910 495 HA TYR 65 HA TYR 65 -11.718 -13.417 -33.483 496 1HB TYR 65 1HB TYR 65 -11.200 -11.098 -33.037 497 2HB TYR 65 2HB TYR 65 -9.834 -11.174 -34.150 498 HD1 TYR 65 HD1 TYR 65 -13.251 -10.264 -33.765 499 HD2 TYR 65 HD2 TYR 65 -10.466 -11.593 -36.670 500 HE1 TYR 65 HE1 TYR 65 -14.699 -9.395 -35.550 501 HE2 TYR 65 HE2 TYR 65 -11.901 -10.741 -38.463 502 HH TYR 65 HH TYR 65 -14.246 -10.219 -38.802 503 H LYS 66 H LYS 66 -11.570 -15.187 -34.821 504 HA LYS 66 HA LYS 66 -9.973 -14.878 -37.170 505 1HB LYS 66 1HB LYS 66 -10.326 -17.116 -35.929 506 2HB LYS 66 2HB LYS 66 -12.005 -16.961 -36.394 507 1HG LYS 66 1HG LYS 66 -10.875 -18.465 -37.894 508 2HG LYS 66 2HG LYS 66 -11.423 -17.007 -38.727 509 1HD LYS 66 1HD LYS 66 -9.097 -16.117 -38.596 510 2HD LYS 66 2HD LYS 66 -8.591 -17.640 -37.859 511 1HE LYS 66 1HE LYS 66 -9.346 -18.853 -39.839 512 2HE LYS 66 2HE LYS 66 -9.862 -17.342 -40.573 513 1HZ LYS 66 1HZ LYS 66 -7.784 -18.011 -41.449 514 2HZ LYS 66 2HZ LYS 66 -7.064 -18.162 -39.962 515 3HZ LYS 66 3HZ LYS 66 -7.476 -16.626 -40.542 516 H ARG 67 H ARG 67 -11.368 -15.103 -39.037 517 HA ARG 67 HA ARG 67 -12.927 -13.028 -39.701 518 1HB ARG 67 1HB ARG 67 -12.137 -14.685 -41.268 519 2HB ARG 67 2HB ARG 67 -13.337 -15.825 -40.680 520 1HG ARG 67 1HG ARG 67 -15.111 -14.288 -41.427 521 2HG ARG 67 2HG ARG 67 -13.862 -13.243 -42.112 522 1HD ARG 67 1HD ARG 67 -13.086 -15.054 -43.479 523 2HD ARG 67 2HD ARG 67 -14.329 -16.112 -42.807 524 HE ARG 67 HE ARG 67 -15.238 -13.658 -44.015 525 1HH1 ARG 67 1HH1 ARG 67 -14.734 -17.140 -44.504 526 2HH1 ARG 67 2HH1 ARG 67 -15.775 -17.260 -45.828 527 1HH2 ARG 67 1HH2 ARG 67 -16.685 -13.819 -45.839 528 2HH2 ARG 67 2HH2 ARG 67 -16.908 -15.329 -46.610 529 H ASP 68 H ASP 68 -14.382 -16.113 -38.717 530 HA ASP 68 HA ASP 68 -16.855 -14.662 -38.062 531 1HB ASP 68 1HB ASP 68 -17.128 -16.043 -40.082 532 2HB ASP 68 2HB ASP 68 -16.520 -17.448 -39.227 533 H ARG 69 H ARG 69 -14.281 -15.900 -36.645 534 HA ARG 69 HA ARG 69 -15.907 -16.873 -34.484 535 1HB ARG 69 1HB ARG 69 -15.071 -18.916 -35.515 536 2HB ARG 69 2HB ARG 69 -13.416 -18.351 -35.334 537 1HG ARG 69 1HG ARG 69 -13.890 -19.923 -33.569 538 2HG ARG 69 2HG ARG 69 -13.733 -18.306 -32.879 539 1HD ARG 69 1HD ARG 69 -15.595 -19.421 -31.848 540 2HD ARG 69 2HD ARG 69 -16.210 -18.124 -32.866 541 HE ARG 69 HE ARG 69 -16.099 -20.904 -33.774 542 1HH1 ARG 69 1HH1 ARG 69 -17.967 -17.905 -33.338 543 2HH1 ARG 69 2HH1 ARG 69 -19.389 -18.545 -34.002 544 1HH2 ARG 69 1HH2 ARG 69 -18.069 -21.752 -34.681 545 2HH2 ARG 69 2HH2 ARG 69 -19.469 -20.793 -34.769 546 H ILE 70 H ILE 70 -15.657 -14.966 -33.650 547 HA ILE 70 HA ILE 70 -13.205 -14.133 -32.413 548 HB ILE 70 HB ILE 70 -16.017 -13.399 -31.701 549 1HG1 ILE 70 1HG1 ILE 70 -15.427 -11.171 -32.923 550 2HG1 ILE 70 2HG1 ILE 70 -14.219 -12.171 -33.716 551 1HG2 ILE 70 1HG2 ILE 70 -14.388 -12.860 -30.002 552 2HG2 ILE 70 2HG2 ILE 70 -15.051 -11.390 -30.710 553 3HG2 ILE 70 3HG2 ILE 70 -13.438 -11.935 -31.171 554 1HD1 ILE 70 1HD1 ILE 70 -15.938 -13.549 -34.733 555 2HD1 ILE 70 2HD1 ILE 70 -16.287 -11.858 -35.073 556 3HD1 ILE 70 3HD1 ILE 70 -17.191 -12.706 -33.824 557 H VAL 71 H VAL 71 -12.650 -14.841 -30.671 558 HA VAL 71 HA VAL 71 -14.387 -16.687 -29.142 559 HB VAL 71 HB VAL 71 -11.397 -16.431 -28.816 560 1HG1 VAL 71 1HG1 VAL 71 -11.543 -18.688 -27.919 561 2HG1 VAL 71 2HG1 VAL 71 -13.287 -18.684 -28.190 562 3HG1 VAL 71 3HG1 VAL 71 -12.574 -17.568 -27.026 563 1HG2 VAL 71 1HG2 VAL 71 -11.145 -18.362 -30.332 564 2HG2 VAL 71 2HG2 VAL 71 -11.755 -16.901 -31.111 565 3HG2 VAL 71 3HG2 VAL 71 -12.869 -18.222 -30.745 566 H LEU 72 H LEU 72 -12.391 -13.854 -29.039 567 HA LEU 72 HA LEU 72 -13.601 -12.991 -26.583 568 1HB LEU 72 1HB LEU 72 -10.565 -13.211 -26.744 569 2HB LEU 72 2HB LEU 72 -11.439 -12.375 -25.495 570 HG LEU 72 HG LEU 72 -12.420 -14.793 -25.033 571 1HD1 LEU 72 1HD1 LEU 72 -11.348 -15.863 -26.916 572 2HD1 LEU 72 2HD1 LEU 72 -10.798 -16.542 -25.383 573 3HD1 LEU 72 3HD1 LEU 72 -9.763 -15.426 -26.275 574 1HD2 LEU 72 1HD2 LEU 72 -10.573 -15.175 -23.442 575 2HD2 LEU 72 2HD2 LEU 72 -11.217 -13.535 -23.403 576 3HD2 LEU 72 3HD2 LEU 72 -9.688 -13.863 -24.219 577 H ASN 73 H ASN 73 -14.064 -10.852 -27.208 578 HA ASN 73 HA ASN 73 -11.876 -9.484 -28.637 579 1HB ASN 73 1HB ASN 73 -13.307 -8.199 -30.045 580 2HB ASN 73 2HB ASN 73 -13.858 -9.849 -30.176 581 1HD2 ASN 73 1HD2 ASN 73 -15.570 -9.871 -27.749 582 2HD2 ASN 73 2HD2 ASN 73 -16.822 -8.775 -28.111 583 H ASN 74 H ASN 74 -12.587 -9.643 -25.834 584 HA ASN 74 HA ASN 74 -12.367 -6.835 -25.265 585 1HB ASN 74 1HB ASN 74 -14.847 -7.315 -25.113 586 2HB ASN 74 2HB ASN 74 -14.501 -8.497 -23.867 587 1HD2 ASN 74 1HD2 ASN 74 -16.178 -6.253 -23.598 588 2HD2 ASN 74 2HD2 ASN 74 -15.522 -5.212 -22.399 589 H CYS 75 H CYS 75 -10.258 -7.717 -24.940 590 HA CYS 75 HA CYS 75 -10.036 -8.759 -22.249 591 1HB CYS 75 1HB CYS 75 -8.496 -9.535 -24.694 592 2HB CYS 75 2HB CYS 75 -7.767 -9.657 -23.092 593 H GLN 76 H GLN 76 -8.644 -7.716 -20.950 594 HA GLN 76 HA GLN 76 -7.308 -5.494 -22.097 595 1HB GLN 76 1HB GLN 76 -9.349 -5.399 -19.869 596 2HB GLN 76 2HB GLN 76 -8.293 -4.060 -20.325 597 1HG GLN 76 1HG GLN 76 -9.197 -4.000 -22.492 598 2HG GLN 76 2HG GLN 76 -10.228 -5.380 -22.229 599 1HE2 GLN 76 1HE2 GLN 76 -12.195 -4.344 -22.502 600 2HE2 GLN 76 2HE2 GLN 76 -12.769 -3.080 -21.489 601 H LEU 77 H LEU 77 -5.529 -5.663 -21.461 602 HA LEU 77 HA LEU 77 -4.980 -7.695 -19.566 603 1HB LEU 77 1HB LEU 77 -3.951 -8.103 -21.597 604 2HB LEU 77 2HB LEU 77 -3.440 -6.456 -21.797 605 HG LEU 77 HG LEU 77 -1.619 -8.156 -21.530 606 1HD1 LEU 77 1HD1 LEU 77 -0.345 -6.721 -19.851 607 2HD1 LEU 77 2HD1 LEU 77 -1.821 -5.776 -19.751 608 3HD1 LEU 77 3HD1 LEU 77 -0.997 -5.949 -21.293 609 1HD2 LEU 77 1HD2 LEU 77 -1.093 -8.970 -19.292 610 2HD2 LEU 77 2HD2 LEU 77 -2.700 -9.526 -19.783 611 3HD2 LEU 77 3HD2 LEU 77 -2.537 -8.187 -18.655 612 H GLN 78 H GLN 78 -3.843 -7.353 -17.536 613 HA GLN 78 HA GLN 78 -3.374 -4.638 -16.769 614 1HB GLN 78 1HB GLN 78 -2.662 -5.573 -14.574 615 2HB GLN 78 2HB GLN 78 -4.263 -6.096 -15.062 616 1HG GLN 78 1HG GLN 78 -3.361 -8.244 -15.725 617 2HG GLN 78 2HG GLN 78 -1.743 -7.701 -15.280 618 1HE2 GLN 78 1HE2 GLN 78 -2.629 -6.291 -12.896 619 2HE2 GLN 78 2HE2 GLN 78 -3.054 -7.482 -11.728 620 H ASN 79 H ASN 79 -1.238 -7.511 -17.127 621 HA ASN 79 HA ASN 79 0.910 -6.242 -18.301 622 1HB ASN 79 1HB ASN 79 1.214 -5.122 -16.111 623 2HB ASN 79 2HB ASN 79 1.068 -6.668 -15.293 624 1HD2 ASN 79 1HD2 ASN 79 3.017 -6.297 -14.313 625 2HD2 ASN 79 2HD2 ASN 79 4.523 -6.511 -15.120 626 HA PRO 80 HA PRO 80 0.613 -10.636 -18.627 627 1HB PRO 80 1HB PRO 80 2.558 -11.150 -20.459 628 2HB PRO 80 2HB PRO 80 0.999 -10.432 -20.890 629 1HG PRO 80 1HG PRO 80 3.596 -9.045 -20.293 630 2HG PRO 80 2HG PRO 80 2.537 -8.836 -21.702 631 1HD PRO 80 1HD PRO 80 2.345 -7.105 -19.705 632 2HD PRO 80 2HD PRO 80 0.910 -7.828 -20.515 633 H GLN 81 H GLN 81 3.600 -8.925 -17.954 634 HA GLN 81 HA GLN 81 5.080 -11.210 -17.298 635 1HB GLN 81 1HB GLN 81 5.926 -9.169 -18.387 636 2HB GLN 81 2HB GLN 81 5.662 -8.345 -16.845 637 1HG GLN 81 1HG GLN 81 7.198 -9.830 -15.769 638 2HG GLN 81 2HG GLN 81 7.454 -10.670 -17.310 639 1HE2 GLN 81 1HE2 GLN 81 8.612 -9.640 -18.930 640 2HE2 GLN 81 2HE2 GLN 81 9.649 -8.291 -18.607 641 H ARG 82 H ARG 82 3.590 -11.826 -15.814 642 HA ARG 82 HA ARG 82 3.778 -10.562 -13.190 643 1HB ARG 82 1HB ARG 82 1.809 -11.966 -12.504 644 2HB ARG 82 2HB ARG 82 1.454 -10.858 -13.809 645 1HG ARG 82 1HG ARG 82 0.582 -12.578 -14.947 646 2HG ARG 82 2HG ARG 82 2.192 -13.297 -15.020 647 1HD ARG 82 1HD ARG 82 0.168 -13.704 -12.803 648 2HD ARG 82 2HD ARG 82 0.547 -14.866 -14.072 649 HE ARG 82 HE ARG 82 2.932 -14.326 -12.978 650 1HH1 ARG 82 1HH1 ARG 82 -0.086 -15.675 -11.698 651 2HH1 ARG 82 2HH1 ARG 82 0.634 -16.371 -10.319 652 1HH2 ARG 82 1HH2 ARG 82 3.910 -15.253 -11.093 653 2HH2 ARG 82 2HH2 ARG 82 2.960 -16.101 -9.961 Start of MODEL 7 1 H MET 1 H MET 1 9.734 -21.442 -11.866 2 HA MET 1 HA MET 1 10.474 -21.220 -14.098 3 1HB MET 1 1HB MET 1 10.108 -23.485 -14.879 4 2HB MET 1 2HB MET 1 8.381 -23.350 -14.607 5 1HG MET 1 1HG MET 1 8.922 -23.227 -16.966 6 2HG MET 1 2HG MET 1 8.216 -21.714 -16.406 7 1HE MET 1 1HE MET 1 9.754 -22.068 -19.184 8 2HE MET 1 2HE MET 1 10.715 -20.589 -19.212 9 3HE MET 1 3HE MET 1 9.046 -20.546 -18.645 10 H GLN 2 H GLN 2 9.653 -19.374 -14.970 11 HA GLN 2 HA GLN 2 6.964 -18.675 -14.109 12 1HB GLN 2 1HB GLN 2 7.538 -16.359 -14.427 13 2HB GLN 2 2HB GLN 2 8.719 -17.114 -13.373 14 1HG GLN 2 1HG GLN 2 9.099 -16.933 -16.240 15 2HG GLN 2 2HG GLN 2 9.509 -15.515 -15.240 16 1HE2 GLN 2 1HE2 GLN 2 11.202 -15.845 -13.692 17 2HE2 GLN 2 2HE2 GLN 2 12.422 -17.045 -13.921 18 H THR 3 H THR 3 5.468 -17.961 -15.487 19 HA THR 3 HA THR 3 6.074 -17.938 -18.366 20 HB THR 3 HB THR 3 3.422 -18.965 -17.382 21 HG1 THR 3 HG1 THR 3 5.073 -20.219 -16.319 22 1HG2 THR 3 1HG2 THR 3 3.822 -18.506 -19.760 23 2HG2 THR 3 2HG2 THR 3 3.533 -20.223 -19.486 24 3HG2 THR 3 3HG2 THR 3 5.174 -19.638 -19.752 25 H ASP 4 H ASP 4 5.083 -16.268 -19.325 26 HA ASP 4 HA ASP 4 4.014 -14.318 -17.461 27 1HB ASP 4 1HB ASP 4 4.491 -14.330 -20.405 28 2HB ASP 4 2HB ASP 4 3.760 -12.929 -19.598 29 H THR 5 H THR 5 1.812 -13.579 -17.560 30 HA THR 5 HA THR 5 0.096 -15.025 -19.331 31 HB THR 5 HB THR 5 0.434 -16.618 -17.466 32 HG1 THR 5 HG1 THR 5 -1.393 -16.961 -18.306 33 1HG2 THR 5 1HG2 THR 5 -0.873 -14.489 -15.783 34 2HG2 THR 5 2HG2 THR 5 0.803 -15.019 -15.671 35 3HG2 THR 5 3HG2 THR 5 -0.504 -16.130 -15.259 36 H LEU 6 H LEU 6 -2.084 -14.250 -19.245 37 HA LEU 6 HA LEU 6 -1.948 -11.499 -18.583 38 1HB LEU 6 1HB LEU 6 -3.741 -12.992 -20.459 39 2HB LEU 6 2HB LEU 6 -4.104 -11.329 -20.055 40 HG LEU 6 HG LEU 6 -1.624 -10.953 -20.652 41 1HD1 LEU 6 1HD1 LEU 6 -0.942 -13.158 -21.030 42 2HD1 LEU 6 2HD1 LEU 6 -0.810 -12.200 -22.502 43 3HD1 LEU 6 3HD1 LEU 6 -2.138 -13.356 -22.321 44 1HD2 LEU 6 1HD2 LEU 6 -2.256 -10.370 -22.937 45 2HD2 LEU 6 2HD2 LEU 6 -3.415 -9.823 -21.733 46 3HD2 LEU 6 3HD2 LEU 6 -3.781 -11.241 -22.725 47 H GLU 7 H GLU 7 -4.943 -11.151 -18.522 48 HA GLU 7 HA GLU 7 -4.894 -10.448 -15.807 49 1HB GLU 7 1HB GLU 7 -5.724 -9.139 -17.705 50 2HB GLU 7 2HB GLU 7 -6.950 -10.345 -18.000 51 1HG GLU 7 1HG GLU 7 -7.714 -8.314 -16.956 52 2HG GLU 7 2HG GLU 7 -8.082 -9.749 -15.949 53 H TYR 8 H TYR 8 -5.926 -13.069 -17.638 54 HA TYR 8 HA TYR 8 -7.160 -14.673 -17.562 55 1HB TYR 8 1HB TYR 8 -6.951 -16.236 -15.641 56 2HB TYR 8 2HB TYR 8 -5.443 -15.527 -16.188 57 HD1 TYR 8 HD1 TYR 8 -4.052 -14.367 -14.666 58 HD2 TYR 8 HD2 TYR 8 -8.032 -15.321 -13.532 59 HE1 TYR 8 HE1 TYR 8 -3.564 -13.664 -12.368 60 HE2 TYR 8 HE2 TYR 8 -7.555 -14.622 -11.234 61 HH TYR 8 HH TYR 8 -4.768 -12.873 -10.410 62 H GLN 9 H GLN 9 -8.678 -12.192 -16.380 63 HA GLN 9 HA GLN 9 -11.081 -13.670 -15.714 64 1HB GLN 9 1HB GLN 9 -11.495 -12.256 -13.711 65 2HB GLN 9 2HB GLN 9 -10.173 -13.407 -13.542 66 1HG GLN 9 1HG GLN 9 -9.092 -11.603 -12.631 67 2HG GLN 9 2HG GLN 9 -8.842 -11.253 -14.345 68 1HE2 GLN 9 1HE2 GLN 9 -8.601 -9.036 -13.773 69 2HE2 GLN 9 2HE2 GLN 9 -9.986 -8.060 -13.485 70 H CYS 10 H CYS 10 -10.525 -12.545 -17.871 71 HA CYS 10 HA CYS 10 -11.264 -9.813 -18.256 72 1HB CYS 10 1HB CYS 10 -11.375 -12.023 -20.289 73 2HB CYS 10 2HB CYS 10 -11.032 -10.311 -20.557 74 H ASP 11 H ASP 11 -13.253 -9.258 -19.660 75 HA ASP 11 HA ASP 11 -15.515 -9.844 -18.213 76 1HB ASP 11 1HB ASP 11 -15.332 -7.862 -19.653 77 2HB ASP 11 2HB ASP 11 -15.465 -8.895 -21.073 78 H GLU 12 H GLU 12 -14.482 -11.449 -21.139 79 HA GLU 12 HA GLU 12 -16.966 -12.997 -21.056 80 1HB GLU 12 1HB GLU 12 -14.864 -13.007 -23.190 81 2HB GLU 12 2HB GLU 12 -16.498 -13.660 -23.298 82 1HG GLU 12 1HG GLU 12 -17.320 -11.339 -22.964 83 2HG GLU 12 2HG GLU 12 -15.622 -10.858 -23.032 84 H LYS 13 H LYS 13 -13.523 -13.405 -20.564 85 HA LYS 13 HA LYS 13 -13.894 -16.303 -20.423 86 1HB LYS 13 1HB LYS 13 -11.804 -15.035 -22.199 87 2HB LYS 13 2HB LYS 13 -12.113 -16.746 -21.988 88 1HG LYS 13 1HG LYS 13 -14.091 -14.826 -23.111 89 2HG LYS 13 2HG LYS 13 -12.943 -15.685 -24.117 90 1HD LYS 13 1HD LYS 13 -14.786 -17.169 -22.242 91 2HD LYS 13 2HD LYS 13 -15.314 -16.683 -23.854 92 1HE LYS 13 1HE LYS 13 -12.838 -18.323 -23.336 93 2HE LYS 13 2HE LYS 13 -14.414 -19.025 -23.693 94 1HZ LYS 13 1HZ LYS 13 -14.441 -17.899 -25.781 95 2HZ LYS 13 2HZ LYS 13 -13.025 -18.803 -25.695 96 3HZ LYS 13 3HZ LYS 13 -12.991 -17.112 -25.467 97 HA PRO 14 HA PRO 14 -10.601 -15.415 -17.724 98 1HB PRO 14 1HB PRO 14 -9.813 -18.007 -17.095 99 2HB PRO 14 2HB PRO 14 -11.154 -17.165 -16.316 100 1HG PRO 14 1HG PRO 14 -11.217 -19.332 -18.291 101 2HG PRO 14 2HG PRO 14 -12.486 -18.781 -17.188 102 1HD PRO 14 1HD PRO 14 -12.217 -18.236 -19.983 103 2HD PRO 14 2HD PRO 14 -13.462 -17.640 -18.873 104 H LEU 15 H LEU 15 -8.773 -14.676 -18.790 105 HA LEU 15 HA LEU 15 -7.846 -16.126 -21.108 106 1HB LEU 15 1HB LEU 15 -8.514 -13.761 -21.307 107 2HB LEU 15 2HB LEU 15 -7.304 -13.341 -20.119 108 HG LEU 15 HG LEU 15 -5.554 -14.100 -21.708 109 1HD1 LEU 15 1HD1 LEU 15 -6.153 -14.424 -24.038 110 2HD1 LEU 15 2HD1 LEU 15 -7.859 -14.270 -23.623 111 3HD1 LEU 15 3HD1 LEU 15 -6.922 -15.634 -23.009 112 1HD2 LEU 15 1HD2 LEU 15 -7.422 -11.960 -22.699 113 2HD2 LEU 15 2HD2 LEU 15 -5.744 -12.171 -23.195 114 3HD2 LEU 15 3HD2 LEU 15 -6.123 -11.755 -21.523 115 H THR 16 H THR 16 -6.874 -17.670 -19.737 116 HA THR 16 HA THR 16 -4.731 -16.518 -18.335 117 HB THR 16 HB THR 16 -5.338 -19.488 -18.191 118 HG1 THR 16 HG1 THR 16 -6.924 -17.451 -17.632 119 1HG2 THR 16 1HG2 THR 16 -3.264 -18.660 -17.146 120 2HG2 THR 16 2HG2 THR 16 -4.433 -19.150 -15.903 121 3HG2 THR 16 3HG2 THR 16 -4.210 -17.438 -16.298 122 H VAL 17 H VAL 17 -3.122 -16.241 -19.821 123 HA VAL 17 HA VAL 17 -2.726 -18.121 -22.033 124 HB VAL 17 HB VAL 17 -1.755 -15.288 -21.620 125 1HG1 VAL 17 1HG1 VAL 17 -1.035 -15.369 -23.977 126 2HG1 VAL 17 2HG1 VAL 17 -1.517 -17.063 -24.022 127 3HG1 VAL 17 3HG1 VAL 17 -0.152 -16.575 -23.032 128 1HG2 VAL 17 1HG2 VAL 17 -3.844 -16.429 -23.449 129 2HG2 VAL 17 2HG2 VAL 17 -3.343 -14.738 -23.388 130 3HG2 VAL 17 3HG2 VAL 17 -4.136 -15.486 -21.995 131 H LYS 18 H LYS 18 -0.710 -19.033 -22.506 132 HA LYS 18 HA LYS 18 1.230 -18.703 -20.390 133 1HB LYS 18 1HB LYS 18 0.757 -20.884 -22.397 134 2HB LYS 18 2HB LYS 18 2.333 -20.681 -21.673 135 1HG LYS 18 1HG LYS 18 1.038 -22.436 -20.567 136 2HG LYS 18 2HG LYS 18 1.416 -21.106 -19.471 137 1HD LYS 18 1HD LYS 18 -0.764 -20.281 -19.601 138 2HD LYS 18 2HD LYS 18 -1.215 -21.396 -20.905 139 1HE LYS 18 1HE LYS 18 -2.137 -22.178 -18.784 140 2HE LYS 18 2HE LYS 18 -0.877 -23.283 -19.318 141 1HZ LYS 18 1HZ LYS 18 0.656 -22.230 -17.727 142 2HZ LYS 18 2HZ LYS 18 -0.732 -22.805 -16.965 143 3HZ LYS 18 3HZ LYS 18 -0.576 -21.181 -17.227 144 H LEU 19 H LEU 19 1.783 -16.674 -21.150 145 HA LEU 19 HA LEU 19 2.926 -16.393 -23.750 146 1HB LEU 19 1HB LEU 19 2.784 -14.806 -21.269 147 2HB LEU 19 2HB LEU 19 4.088 -14.445 -22.406 148 HG LEU 19 HG LEU 19 1.149 -14.331 -23.147 149 1HD1 LEU 19 1HD1 LEU 19 1.380 -11.902 -22.868 150 2HD1 LEU 19 2HD1 LEU 19 3.016 -12.127 -22.246 151 3HD1 LEU 19 3HD1 LEU 19 1.633 -12.739 -21.339 152 1HD2 LEU 19 1HD2 LEU 19 1.973 -13.012 -24.998 153 2HD2 LEU 19 2HD2 LEU 19 2.833 -14.559 -24.970 154 3HD2 LEU 19 3HD2 LEU 19 3.612 -13.102 -24.369 155 H ASN 20 H ASN 20 4.430 -17.568 -24.128 156 HA ASN 20 HA ASN 20 6.096 -18.757 -22.144 157 1HB ASN 20 1HB ASN 20 5.443 -19.618 -24.534 158 2HB ASN 20 2HB ASN 20 6.783 -18.602 -25.054 159 1HD2 ASN 20 1HD2 ASN 20 6.472 -21.517 -25.318 160 2HD2 ASN 20 2HD2 ASN 20 7.812 -22.196 -24.495 161 H ASN 21 H ASN 21 8.487 -18.513 -22.119 162 HA ASN 21 HA ASN 21 9.102 -15.900 -21.411 163 1HB ASN 21 1HB ASN 21 10.232 -18.002 -20.568 164 2HB ASN 21 2HB ASN 21 11.184 -17.989 -22.044 165 1HD2 ASN 21 1HD2 ASN 21 12.001 -17.764 -19.229 166 2HD2 ASN 21 2HD2 ASN 21 12.904 -16.308 -19.111 167 HA PRO 22 HA PRO 22 11.583 -15.169 -25.536 168 1HB PRO 22 1HB PRO 22 10.317 -17.039 -27.448 169 2HB PRO 22 2HB PRO 22 12.026 -16.663 -27.225 170 1HG PRO 22 1HG PRO 22 11.041 -19.019 -26.461 171 2HG PRO 22 2HG PRO 22 12.281 -18.187 -25.504 172 1HD PRO 22 1HD PRO 22 9.321 -18.334 -25.040 173 2HD PRO 22 2HD PRO 22 10.645 -18.524 -23.880 174 H ARG 23 H ARG 23 8.295 -15.870 -25.139 175 HA ARG 23 HA ARG 23 6.347 -15.082 -25.828 176 1HB ARG 23 1HB ARG 23 7.932 -12.560 -25.839 177 2HB ARG 23 2HB ARG 23 6.186 -12.609 -26.081 178 1HG ARG 23 1HG ARG 23 5.948 -13.758 -23.982 179 2HG ARG 23 2HG ARG 23 7.675 -13.620 -23.688 180 1HD ARG 23 1HD ARG 23 7.497 -11.130 -23.915 181 2HD ARG 23 2HD ARG 23 5.757 -11.302 -24.066 182 HE ARG 23 HE ARG 23 6.594 -12.439 -21.616 183 1HH1 ARG 23 1HH1 ARG 23 6.186 -9.286 -23.211 184 2HH1 ARG 23 2HH1 ARG 23 6.050 -8.404 -21.772 185 1HH2 ARG 23 1HH2 ARG 23 6.378 -11.190 -19.597 186 2HH2 ARG 23 2HH2 ARG 23 6.157 -9.508 -19.657 187 H GLN 24 H GLN 24 7.300 -16.333 -27.717 188 HA GLN 24 HA GLN 24 6.324 -14.859 -29.967 189 1HB GLN 24 1HB GLN 24 8.341 -17.107 -29.992 190 2HB GLN 24 2HB GLN 24 7.632 -16.413 -31.443 191 1HG GLN 24 1HG GLN 24 8.626 -14.257 -30.905 192 2HG GLN 24 2HG GLN 24 9.306 -14.935 -29.429 193 1HE2 GLN 24 1HE2 GLN 24 10.605 -13.714 -31.720 194 2HE2 GLN 24 2HE2 GLN 24 11.735 -14.874 -32.296 195 H GLU 25 H GLU 25 5.442 -16.866 -27.719 196 HA GLU 25 HA GLU 25 3.605 -18.429 -29.330 197 1HB GLU 25 1HB GLU 25 5.611 -19.827 -29.227 198 2HB GLU 25 2HB GLU 25 5.622 -19.676 -27.476 199 1HG GLU 25 1HG GLU 25 3.372 -20.807 -27.489 200 2HG GLU 25 2HG GLU 25 3.656 -21.151 -29.195 201 H VAL 26 H VAL 26 1.846 -18.788 -28.264 202 HA VAL 26 HA VAL 26 1.627 -18.520 -25.284 203 HB VAL 26 HB VAL 26 -0.460 -17.407 -25.518 204 1HG1 VAL 26 1HG1 VAL 26 0.269 -15.187 -26.310 205 2HG1 VAL 26 2HG1 VAL 26 1.720 -15.948 -26.975 206 3HG1 VAL 26 3HG1 VAL 26 1.414 -15.983 -25.235 207 1HG2 VAL 26 1HG2 VAL 26 -1.232 -16.419 -27.659 208 2HG2 VAL 26 2HG2 VAL 26 -1.243 -18.183 -27.634 209 3HG2 VAL 26 3HG2 VAL 26 0.048 -17.330 -28.473 210 H SER 27 H SER 27 0.643 -20.090 -24.360 211 HA SER 27 HA SER 27 -1.098 -21.698 -26.055 212 1HB SER 27 1HB SER 27 -0.090 -22.387 -23.255 213 2HB SER 27 2HB SER 27 -1.059 -23.397 -24.323 214 HG SER 27 HG SER 27 1.460 -22.400 -25.108 215 H PHE 28 H PHE 28 -3.094 -21.273 -25.952 216 HA PHE 28 HA PHE 28 -4.079 -19.731 -23.711 217 1HB PHE 28 1HB PHE 28 -3.909 -18.003 -24.983 218 2HB PHE 28 2HB PHE 28 -3.755 -18.905 -26.491 219 HD1 PHE 28 HD1 PHE 28 -5.780 -19.358 -27.810 220 HD2 PHE 28 HD2 PHE 28 -5.987 -17.126 -24.211 221 HE1 PHE 28 HE1 PHE 28 -8.001 -18.549 -28.461 222 HE2 PHE 28 HE2 PHE 28 -8.228 -16.316 -24.850 223 HZ PHE 28 HZ PHE 28 -9.232 -17.026 -26.975 224 H VAL 29 H VAL 29 -6.037 -19.946 -23.179 225 HA VAL 29 HA VAL 29 -7.404 -22.351 -23.948 226 HB VAL 29 HB VAL 29 -7.181 -21.974 -21.567 227 1HG1 VAL 29 1HG1 VAL 29 -8.443 -19.259 -21.950 228 2HG1 VAL 29 2HG1 VAL 29 -6.762 -19.575 -21.579 229 3HG1 VAL 29 3HG1 VAL 29 -8.011 -19.979 -20.398 230 1HG2 VAL 29 1HG2 VAL 29 -10.005 -21.310 -22.401 231 2HG2 VAL 29 2HG2 VAL 29 -9.525 -21.897 -20.809 232 3HG2 VAL 29 3HG2 VAL 29 -9.324 -22.928 -22.229 233 H TYR 30 H TYR 30 -8.518 -22.177 -25.573 234 HA TYR 30 HA TYR 30 -9.740 -19.619 -26.347 235 1HB TYR 30 1HB TYR 30 -10.270 -20.509 -28.497 236 2HB TYR 30 2HB TYR 30 -8.650 -21.044 -28.106 237 HD1 TYR 30 HD1 TYR 30 -11.954 -22.011 -29.070 238 HD2 TYR 30 HD2 TYR 30 -8.367 -23.478 -27.322 239 HE1 TYR 30 HE1 TYR 30 -12.643 -24.306 -29.599 240 HE2 TYR 30 HE2 TYR 30 -9.051 -25.767 -27.855 241 HH TYR 30 HH TYR 30 -11.138 -27.033 -28.286 242 H ASP 31 H ASP 31 -10.636 -22.361 -24.781 243 HA ASP 31 HA ASP 31 -13.317 -21.406 -24.513 244 1HB ASP 31 1HB ASP 31 -13.486 -22.576 -26.579 245 2HB ASP 31 2HB ASP 31 -12.719 -23.998 -25.908 246 H ASN 32 H ASN 32 -11.777 -24.625 -24.142 247 HA ASN 32 HA ASN 32 -11.657 -24.171 -21.261 248 1HB ASN 32 1HB ASN 32 -13.890 -25.204 -21.741 249 2HB ASN 32 2HB ASN 32 -13.068 -26.569 -22.470 250 1HD2 ASN 32 1HD2 ASN 32 -13.850 -24.960 -19.495 251 2HD2 ASN 32 2HD2 ASN 32 -13.462 -26.255 -18.437 252 H GLN 33 H GLN 33 -9.826 -24.733 -23.808 253 HA GLN 33 HA GLN 33 -8.059 -26.524 -22.514 254 1HB GLN 33 1HB GLN 33 -7.954 -28.118 -24.299 255 2HB GLN 33 2HB GLN 33 -9.641 -28.041 -23.815 256 1HG GLN 33 1HG GLN 33 -10.011 -26.455 -25.676 257 2HG GLN 33 2HG GLN 33 -8.354 -26.776 -26.175 258 1HE2 GLN 33 1HE2 GLN 33 -8.890 -27.739 -28.151 259 2HE2 GLN 33 2HE2 GLN 33 -9.709 -29.244 -28.264 260 H LEU 34 H LEU 34 -6.133 -26.588 -23.871 261 HA LEU 34 HA LEU 34 -5.826 -23.820 -24.560 262 1HB LEU 34 1HB LEU 34 -3.921 -25.926 -23.678 263 2HB LEU 34 2HB LEU 34 -3.390 -24.299 -24.106 264 HG LEU 34 HG LEU 34 -5.188 -25.091 -21.793 265 1HD1 LEU 34 1HD1 LEU 34 -2.321 -24.168 -21.848 266 2HD1 LEU 34 2HD1 LEU 34 -2.877 -25.807 -21.522 267 3HD1 LEU 34 3HD1 LEU 34 -3.277 -24.501 -20.403 268 1HD2 LEU 34 1HD2 LEU 34 -4.928 -22.796 -21.047 269 2HD2 LEU 34 2HD2 LEU 34 -5.658 -22.842 -22.656 270 3HD2 LEU 34 3HD2 LEU 34 -3.957 -22.430 -22.472 271 H LEU 35 H LEU 35 -4.986 -23.279 -26.545 272 HA LEU 35 HA LEU 35 -3.523 -25.323 -28.022 273 1HB LEU 35 1HB LEU 35 -4.448 -24.812 -30.151 274 2HB LEU 35 2HB LEU 35 -5.824 -24.945 -29.101 275 HG LEU 35 HG LEU 35 -6.322 -23.309 -30.546 276 1HD1 LEU 35 1HD1 LEU 35 -6.964 -22.558 -28.415 277 2HD1 LEU 35 2HD1 LEU 35 -6.459 -21.157 -29.358 278 3HD1 LEU 35 3HD1 LEU 35 -5.386 -21.825 -28.126 279 1HD2 LEU 35 1HD2 LEU 35 -3.615 -22.048 -30.254 280 2HD2 LEU 35 2HD2 LEU 35 -4.950 -21.344 -31.170 281 3HD2 LEU 35 3HD2 LEU 35 -4.269 -22.895 -31.657 282 H HIS 36 H HIS 36 -2.196 -24.063 -29.773 283 HA HIS 36 HA HIS 36 -1.207 -21.792 -28.263 284 1HB HIS 36 1HB HIS 36 1.165 -22.357 -28.662 285 2HB HIS 36 2HB HIS 36 0.338 -23.549 -27.686 286 HD2 HIS 36 HD2 HIS 36 1.965 -23.182 -31.210 287 HE1 HIS 36 HE1 HIS 36 1.366 -27.276 -30.362 288 HE2 HIS 36 HE2 HIS 36 2.708 -25.624 -31.668 289 H LEU 37 H LEU 37 -0.701 -20.086 -29.151 290 HA LEU 37 HA LEU 37 -0.823 -19.868 -32.110 291 1HB LEU 37 1HB LEU 37 -1.384 -17.678 -30.145 292 2HB LEU 37 2HB LEU 37 -1.588 -17.628 -31.852 293 HG LEU 37 HG LEU 37 -3.304 -19.587 -31.422 294 1HD1 LEU 37 1HD1 LEU 37 -2.861 -19.855 -29.069 295 2HD1 LEU 37 2HD1 LEU 37 -4.536 -19.396 -29.358 296 3HD1 LEU 37 3HD1 LEU 37 -3.384 -18.195 -28.760 297 1HD2 LEU 37 1HD2 LEU 37 -3.938 -16.694 -30.882 298 2HD2 LEU 37 2HD2 LEU 37 -5.142 -17.950 -31.169 299 3HD2 LEU 37 3HD2 LEU 37 -3.979 -17.544 -32.433 300 H LYS 38 H LYS 38 0.550 -18.364 -33.001 301 HA LYS 38 HA LYS 38 2.811 -17.831 -31.258 302 1HB LYS 38 1HB LYS 38 4.258 -18.263 -33.151 303 2HB LYS 38 2HB LYS 38 3.309 -19.660 -32.596 304 1HG LYS 38 1HG LYS 38 1.911 -19.593 -34.483 305 2HG LYS 38 2HG LYS 38 2.482 -17.988 -34.941 306 1HD LYS 38 1HD LYS 38 4.615 -18.811 -35.469 307 2HD LYS 38 2HD LYS 38 4.237 -20.414 -34.839 308 1HE LYS 38 1HE LYS 38 2.788 -19.133 -37.162 309 2HE LYS 38 2HE LYS 38 4.135 -20.256 -37.352 310 1HZ LYS 38 1HZ LYS 38 2.837 -21.929 -36.185 311 2HZ LYS 38 2HZ LYS 38 2.067 -21.409 -37.577 312 3HZ LYS 38 3HZ LYS 38 1.478 -20.923 -36.096 313 H GLN 39 H GLN 39 4.042 -16.177 -31.850 314 HA GLN 39 HA GLN 39 2.606 -13.848 -32.791 315 1HB GLN 39 1HB GLN 39 4.125 -13.491 -31.120 316 2HB GLN 39 2HB GLN 39 5.472 -14.290 -31.969 317 1HG GLN 39 1HG GLN 39 5.268 -12.385 -33.652 318 2HG GLN 39 2HG GLN 39 4.178 -11.610 -32.501 319 1HE2 GLN 39 1HE2 GLN 39 5.021 -10.767 -30.606 320 2HE2 GLN 39 2HE2 GLN 39 6.713 -10.564 -30.364 321 H GLY 40 H GLY 40 2.140 -13.732 -34.669 322 1HA GLY 40 1HA GLY 40 3.971 -13.471 -36.833 323 2HA GLY 40 2HA GLY 40 3.075 -14.995 -36.929 324 H ILE 41 H ILE 41 2.797 -12.704 -38.717 325 HA ILE 41 HA ILE 41 1.188 -11.481 -39.703 326 HB ILE 41 HB ILE 41 -0.341 -13.441 -38.072 327 1HG1 ILE 41 1HG1 ILE 41 -1.480 -13.962 -40.234 328 2HG1 ILE 41 2HG1 ILE 41 -0.498 -12.706 -40.978 329 1HG2 ILE 41 1HG2 ILE 41 -1.710 -11.603 -37.516 330 2HG2 ILE 41 2HG2 ILE 41 -2.595 -12.666 -38.618 331 3HG2 ILE 41 3HG2 ILE 41 -1.897 -11.148 -39.209 332 1HD1 ILE 41 1HD1 ILE 41 0.412 -14.903 -41.407 333 2HD1 ILE 41 2HD1 ILE 41 0.495 -15.224 -39.677 334 3HD1 ILE 41 3HD1 ILE 41 1.514 -13.972 -40.390 335 H SER 42 H SER 42 2.548 -10.872 -37.141 336 HA SER 42 HA SER 42 0.726 -9.176 -35.713 337 1HB SER 42 1HB SER 42 2.259 -10.704 -34.580 338 2HB SER 42 2HB SER 42 3.629 -9.772 -35.189 339 HG SER 42 HG SER 42 3.362 -8.665 -33.438 340 H ALA 43 H ALA 43 0.439 -7.777 -37.580 341 HA ALA 43 HA ALA 43 2.495 -6.082 -38.267 342 1HB ALA 43 1HB ALA 43 0.777 -4.817 -39.513 343 2HB ALA 43 2HB ALA 43 -0.466 -5.802 -38.741 344 3HB ALA 43 3HB ALA 43 0.708 -6.552 -39.823 345 H SER 44 H SER 44 -0.162 -5.997 -35.976 346 HA SER 44 HA SER 44 0.881 -3.530 -34.830 347 1HB SER 44 1HB SER 44 -1.160 -3.092 -36.282 348 2HB SER 44 2HB SER 44 -2.054 -4.150 -35.194 349 HG SER 44 HG SER 44 -2.138 -1.829 -34.838 350 H GLY 45 H GLY 45 1.118 -3.718 -32.671 351 1HA GLY 45 1HA GLY 45 0.798 -4.489 -30.489 352 2HA GLY 45 2HA GLY 45 -0.487 -5.539 -31.066 353 H ALA 46 H ALA 46 0.002 -7.486 -30.482 354 HA ALA 46 HA ALA 46 2.361 -8.647 -31.563 355 1HB ALA 46 1HB ALA 46 2.659 -9.881 -29.417 356 2HB ALA 46 2HB ALA 46 1.516 -8.745 -28.666 357 3HB ALA 46 3HB ALA 46 3.059 -8.164 -29.295 358 H ARG 47 H ARG 47 1.393 -10.008 -32.787 359 HA ARG 47 HA ARG 47 -1.178 -10.805 -31.866 360 1HB ARG 47 1HB ARG 47 -0.168 -10.817 -34.704 361 2HB ARG 47 2HB ARG 47 -1.728 -11.443 -34.220 362 1HG ARG 47 1HG ARG 47 -2.377 -9.200 -33.448 363 2HG ARG 47 2HG ARG 47 -0.813 -8.579 -33.992 364 1HD ARG 47 1HD ARG 47 -1.333 -9.419 -36.268 365 2HD ARG 47 2HD ARG 47 -2.922 -9.895 -35.688 366 HE ARG 47 HE ARG 47 -2.937 -7.309 -35.096 367 1HH1 ARG 47 1HH1 ARG 47 -1.751 -8.876 -38.077 368 2HH1 ARG 47 2HH1 ARG 47 -2.344 -7.677 -39.101 369 1HH2 ARG 47 1HH2 ARG 47 -3.703 -5.627 -36.554 370 2HH2 ARG 47 2HH2 ARG 47 -3.462 -5.790 -38.236 371 H TYR 48 H TYR 48 -0.930 -12.679 -30.872 372 HA TYR 48 HA TYR 48 0.661 -14.836 -31.986 373 1HB TYR 48 1HB TYR 48 -1.082 -14.669 -29.520 374 2HB TYR 48 2HB TYR 48 0.085 -15.932 -29.919 375 HD1 TYR 48 HD1 TYR 48 2.508 -15.502 -29.744 376 HD2 TYR 48 HD2 TYR 48 -0.343 -12.559 -28.603 377 HE1 TYR 48 HE1 TYR 48 4.277 -14.233 -28.594 378 HE2 TYR 48 HE2 TYR 48 1.409 -11.292 -27.456 379 HH TYR 48 HH TYR 48 3.529 -11.566 -26.535 380 H THR 49 H THR 49 -0.222 -15.831 -33.494 381 HA THR 49 HA THR 49 -3.080 -16.149 -33.523 382 HB THR 49 HB THR 49 -1.473 -14.660 -35.607 383 HG1 THR 49 HG1 THR 49 -2.549 -13.789 -33.542 384 1HG2 THR 49 1HG2 THR 49 -3.078 -16.127 -36.751 385 2HG2 THR 49 2HG2 THR 49 -3.585 -14.443 -36.885 386 3HG2 THR 49 3HG2 THR 49 -4.379 -15.519 -35.730 387 H ASP 50 H ASP 50 -3.556 -18.053 -34.637 388 HA ASP 50 HA ASP 50 -1.351 -19.128 -36.221 389 1HB ASP 50 1HB ASP 50 -1.750 -20.260 -33.925 390 2HB ASP 50 2HB ASP 50 -3.156 -20.984 -34.698 391 H GLY 51 H GLY 51 -4.358 -17.939 -36.317 392 1HA GLY 51 1HA GLY 51 -5.421 -17.855 -38.487 393 2HA GLY 51 2HA GLY 51 -5.057 -19.569 -38.665 394 H ILE 52 H ILE 52 -5.765 -20.314 -36.060 395 HA ILE 52 HA ILE 52 -8.520 -20.875 -36.403 396 HB ILE 52 HB ILE 52 -6.806 -21.166 -33.904 397 1HG1 ILE 52 1HG1 ILE 52 -6.887 -23.665 -34.461 398 2HG1 ILE 52 2HG1 ILE 52 -7.557 -23.218 -36.016 399 1HG2 ILE 52 1HG2 ILE 52 -8.519 -22.729 -33.058 400 2HG2 ILE 52 2HG2 ILE 52 -9.529 -22.349 -34.451 401 3HG2 ILE 52 3HG2 ILE 52 -9.142 -21.094 -33.276 402 1HD1 ILE 52 1HD1 ILE 52 -4.831 -22.454 -34.982 403 2HD1 ILE 52 2HD1 ILE 52 -5.485 -22.052 -36.574 404 3HD1 ILE 52 3HD1 ILE 52 -5.184 -23.731 -36.145 405 H TYR 53 H TYR 53 -6.718 -18.694 -34.353 406 HA TYR 53 HA TYR 53 -8.857 -16.806 -34.470 407 1HB TYR 53 1HB TYR 53 -7.678 -17.596 -31.784 408 2HB TYR 53 2HB TYR 53 -8.702 -16.209 -32.157 409 HD1 TYR 53 HD1 TYR 53 -11.070 -16.730 -33.084 410 HD2 TYR 53 HD2 TYR 53 -8.676 -19.614 -31.078 411 HE1 TYR 53 HE1 TYR 53 -13.069 -18.086 -32.663 412 HE2 TYR 53 HE2 TYR 53 -10.672 -20.983 -30.653 413 HH TYR 53 HH TYR 53 -13.177 -20.542 -30.438 414 H VAL 54 H VAL 54 -8.018 -14.787 -33.457 415 HA VAL 54 HA VAL 54 -5.167 -14.446 -34.011 416 HB VAL 54 HB VAL 54 -7.556 -12.736 -34.436 417 1HG1 VAL 54 1HG1 VAL 54 -5.943 -11.040 -35.472 418 2HG1 VAL 54 2HG1 VAL 54 -4.609 -12.082 -34.977 419 3HG1 VAL 54 3HG1 VAL 54 -5.624 -11.314 -33.758 420 1HG2 VAL 54 1HG2 VAL 54 -7.353 -14.361 -36.184 421 2HG2 VAL 54 2HG2 VAL 54 -5.668 -13.928 -36.467 422 3HG2 VAL 54 3HG2 VAL 54 -6.947 -12.783 -36.856 423 H PHE 55 H PHE 55 -4.303 -14.228 -31.968 424 HA PHE 55 HA PHE 55 -5.871 -12.809 -29.984 425 1HB PHE 55 1HB PHE 55 -5.060 -14.992 -29.269 426 2HB PHE 55 2HB PHE 55 -3.421 -14.571 -29.734 427 HD1 PHE 55 HD1 PHE 55 -5.959 -12.728 -27.715 428 HD2 PHE 55 HD2 PHE 55 -2.144 -14.586 -27.821 429 HE1 PHE 55 HE1 PHE 55 -5.563 -12.030 -25.410 430 HE2 PHE 55 HE2 PHE 55 -1.721 -13.865 -25.519 431 HZ PHE 55 HZ PHE 55 -3.429 -12.586 -24.302 432 H TRP 56 H TRP 56 -5.599 -10.749 -30.179 433 HA TRP 56 HA TRP 56 -3.014 -9.700 -30.856 434 1HB TRP 56 1HB TRP 56 -4.699 -8.826 -32.252 435 2HB TRP 56 2HB TRP 56 -5.773 -8.500 -30.886 436 HD1 TRP 56 HD1 TRP 56 -2.125 -7.309 -30.704 437 HE1 TRP 56 HE1 TRP 56 -2.082 -4.739 -30.777 438 HE3 TRP 56 HE3 TRP 56 -7.011 -6.456 -31.903 439 HZ2 TRP 56 HZ2 TRP 56 -3.864 -2.630 -31.350 440 HZ3 TRP 56 HZ3 TRP 56 -7.759 -4.131 -32.222 441 HH2 TRP 56 HH2 TRP 56 -6.216 -2.264 -31.950 442 H SER 57 H SER 57 -1.905 -9.223 -29.456 443 HA SER 57 HA SER 57 -2.846 -8.582 -26.760 444 1HB SER 57 1HB SER 57 -0.112 -9.423 -27.744 445 2HB SER 57 2HB SER 57 -0.556 -9.184 -26.040 446 HG SER 57 HG SER 57 -2.018 -10.925 -27.674 447 H LYS 58 H LYS 58 -3.257 -6.471 -26.874 448 HA LYS 58 HA LYS 58 -1.696 -4.713 -28.516 449 1HB LYS 58 1HB LYS 58 -4.190 -4.716 -28.217 450 2HB LYS 58 2HB LYS 58 -3.946 -4.198 -26.556 451 1HG LYS 58 1HG LYS 58 -3.238 -2.608 -29.034 452 2HG LYS 58 2HG LYS 58 -4.699 -2.403 -28.076 453 1HD LYS 58 1HD LYS 58 -3.232 -1.927 -26.123 454 2HD LYS 58 2HD LYS 58 -1.886 -2.002 -27.267 455 1HE LYS 58 1HE LYS 58 -2.875 -0.139 -28.541 456 2HE LYS 58 2HE LYS 58 -4.187 -0.043 -27.366 457 1HZ LYS 58 1HZ LYS 58 -2.451 0.372 -25.650 458 2HZ LYS 58 2HZ LYS 58 -2.613 1.596 -26.779 459 3HZ LYS 58 3HZ LYS 58 -1.314 0.506 -26.890 460 H GLY 59 H GLY 59 -1.965 -5.736 -25.240 461 1HA GLY 59 1HA GLY 59 0.095 -5.566 -23.918 462 2HA GLY 59 2HA GLY 59 0.198 -3.889 -24.462 463 H ASP 60 H ASP 60 -2.149 -2.890 -24.201 464 HA ASP 60 HA ASP 60 -2.599 -2.718 -21.341 465 1HB ASP 60 1HB ASP 60 -4.209 -1.441 -23.553 466 2HB ASP 60 2HB ASP 60 -4.077 -0.931 -21.878 467 H GLU 61 H GLU 61 -4.022 -3.930 -24.254 468 HA GLU 61 HA GLU 61 -6.112 -5.207 -22.752 469 1HB GLU 61 1HB GLU 61 -7.569 -4.807 -24.734 470 2HB GLU 61 2HB GLU 61 -7.258 -3.379 -23.733 471 1HG GLU 61 1HG GLU 61 -5.600 -2.661 -25.365 472 2HG GLU 61 2HG GLU 61 -5.929 -4.117 -26.307 473 H ALA 62 H ALA 62 -7.121 -6.867 -24.150 474 HA ALA 62 HA ALA 62 -5.346 -7.978 -26.061 475 1HB ALA 62 1HB ALA 62 -4.581 -8.927 -23.953 476 2HB ALA 62 2HB ALA 62 -5.369 -10.155 -24.938 477 3HB ALA 62 3HB ALA 62 -6.233 -9.429 -23.576 478 H THR 63 H THR 63 -6.573 -9.022 -27.539 479 HA THR 63 HA THR 63 -9.325 -9.691 -26.944 480 HB THR 63 HB THR 63 -9.288 -7.354 -27.851 481 HG1 THR 63 HG1 THR 63 -10.872 -7.684 -29.373 482 1HG2 THR 63 1HG2 THR 63 -7.324 -7.528 -29.214 483 2HG2 THR 63 2HG2 THR 63 -8.708 -7.015 -30.210 484 3HG2 THR 63 3HG2 THR 63 -8.152 -8.708 -30.241 485 H VAL 64 H VAL 64 -10.181 -11.029 -28.695 486 HA VAL 64 HA VAL 64 -8.138 -12.553 -30.183 487 HB VAL 64 HB VAL 64 -10.318 -14.012 -28.704 488 1HG1 VAL 64 1HG1 VAL 64 -7.722 -14.909 -29.909 489 2HG1 VAL 64 2HG1 VAL 64 -9.363 -15.151 -30.531 490 3HG1 VAL 64 3HG1 VAL 64 -8.864 -15.945 -29.041 491 1HG2 VAL 64 1HG2 VAL 64 -8.890 -12.890 -26.988 492 2HG2 VAL 64 2HG2 VAL 64 -7.500 -13.794 -27.635 493 3HG2 VAL 64 3HG2 VAL 64 -8.862 -14.645 -26.927 494 H TYR 65 H TYR 65 -8.886 -12.189 -32.170 495 HA TYR 65 HA TYR 65 -11.822 -12.351 -32.711 496 1HB TYR 65 1HB TYR 65 -10.998 -10.060 -32.356 497 2HB TYR 65 2HB TYR 65 -9.828 -10.343 -33.643 498 HD1 TYR 65 HD1 TYR 65 -11.042 -11.013 -36.012 499 HD2 TYR 65 HD2 TYR 65 -12.838 -8.796 -32.859 500 HE1 TYR 65 HE1 TYR 65 -12.587 -9.985 -37.620 501 HE2 TYR 65 HE2 TYR 65 -14.401 -7.787 -34.459 502 HH TYR 65 HH TYR 65 -14.870 -8.935 -37.545 503 H LYS 66 H LYS 66 -11.763 -14.263 -34.024 504 HA LYS 66 HA LYS 66 -10.181 -13.922 -36.400 505 1HB LYS 66 1HB LYS 66 -10.608 -16.285 -35.105 506 2HB LYS 66 2HB LYS 66 -12.090 -16.222 -36.051 507 1HG LYS 66 1HG LYS 66 -10.140 -15.512 -37.854 508 2HG LYS 66 2HG LYS 66 -9.380 -16.782 -36.912 509 1HD LYS 66 1HD LYS 66 -12.068 -17.063 -38.298 510 2HD LYS 66 2HD LYS 66 -10.545 -17.531 -39.037 511 1HE LYS 66 1HE LYS 66 -10.208 -19.080 -37.081 512 2HE LYS 66 2HE LYS 66 -11.858 -18.704 -36.594 513 1HZ LYS 66 1HZ LYS 66 -11.079 -19.914 -39.195 514 2HZ LYS 66 2HZ LYS 66 -12.669 -19.654 -38.680 515 3HZ LYS 66 3HZ LYS 66 -11.688 -20.752 -37.880 516 H ARG 67 H ARG 67 -11.557 -14.284 -38.276 517 HA ARG 67 HA ARG 67 -13.611 -12.426 -38.590 518 1HB ARG 67 1HB ARG 67 -12.173 -13.293 -40.389 519 2HB ARG 67 2HB ARG 67 -12.875 -14.884 -40.217 520 1HG ARG 67 1HG ARG 67 -14.388 -12.447 -41.148 521 2HG ARG 67 2HG ARG 67 -13.594 -13.590 -42.229 522 1HD ARG 67 1HD ARG 67 -15.669 -14.238 -40.223 523 2HD ARG 67 2HD ARG 67 -16.081 -13.983 -41.940 524 HE ARG 67 HE ARG 67 -14.541 -16.232 -40.733 525 1HH1 ARG 67 1HH1 ARG 67 -16.341 -14.982 -43.511 526 2HH1 ARG 67 2HH1 ARG 67 -16.638 -16.509 -44.192 527 1HH2 ARG 67 1HH2 ARG 67 -14.927 -18.317 -41.648 528 2HH2 ARG 67 2HH2 ARG 67 -15.801 -18.468 -43.097 529 H ASP 68 H ASP 68 -13.604 -15.745 -37.738 530 HA ASP 68 HA ASP 68 -16.350 -16.323 -38.297 531 1HB ASP 68 1HB ASP 68 -14.304 -17.890 -36.736 532 2HB ASP 68 2HB ASP 68 -15.883 -18.475 -37.222 533 H ARG 69 H ARG 69 -14.338 -15.655 -35.583 534 HA ARG 69 HA ARG 69 -16.454 -14.887 -34.089 535 1HB ARG 69 1HB ARG 69 -16.967 -17.263 -33.918 536 2HB ARG 69 2HB ARG 69 -15.358 -17.582 -33.285 537 1HG ARG 69 1HG ARG 69 -15.858 -16.138 -31.355 538 2HG ARG 69 2HG ARG 69 -17.485 -15.916 -31.982 539 1HD ARG 69 1HD ARG 69 -17.923 -18.252 -31.765 540 2HD ARG 69 2HD ARG 69 -16.258 -18.531 -31.222 541 HE ARG 69 HE ARG 69 -17.081 -16.711 -29.489 542 1HH1 ARG 69 1HH1 ARG 69 -18.664 -19.682 -30.547 543 2HH1 ARG 69 2HH1 ARG 69 -19.439 -19.990 -29.073 544 1HH2 ARG 69 1HH2 ARG 69 -18.161 -17.099 -27.423 545 2HH2 ARG 69 2HH2 ARG 69 -19.131 -18.481 -27.252 546 H ILE 70 H ILE 70 -15.784 -13.688 -32.726 547 HA ILE 70 HA ILE 70 -13.117 -13.299 -31.643 548 HB ILE 70 HB ILE 70 -15.702 -12.152 -30.706 549 1HG1 ILE 70 1HG1 ILE 70 -14.013 -10.994 -32.865 550 2HG1 ILE 70 2HG1 ILE 70 -15.499 -11.894 -33.179 551 1HG2 ILE 70 1HG2 ILE 70 -12.861 -11.151 -30.682 552 2HG2 ILE 70 2HG2 ILE 70 -13.857 -11.594 -29.286 553 3HG2 ILE 70 3HG2 ILE 70 -14.244 -10.160 -30.249 554 1HD1 ILE 70 1HD1 ILE 70 -15.276 -9.293 -31.647 555 2HD1 ILE 70 2HD1 ILE 70 -16.772 -10.187 -31.935 556 3HD1 ILE 70 3HD1 ILE 70 -15.890 -9.479 -33.289 557 H VAL 71 H VAL 71 -12.596 -14.123 -29.848 558 HA VAL 71 HA VAL 71 -14.677 -15.366 -28.212 559 HB VAL 71 HB VAL 71 -13.134 -17.157 -27.409 560 1HG1 VAL 71 1HG1 VAL 71 -13.326 -18.525 -29.434 561 2HG1 VAL 71 2HG1 VAL 71 -13.725 -17.075 -30.352 562 3HG1 VAL 71 3HG1 VAL 71 -14.803 -17.634 -29.070 563 1HG2 VAL 71 1HG2 VAL 71 -11.009 -16.131 -27.977 564 2HG2 VAL 71 2HG2 VAL 71 -11.414 -16.219 -29.691 565 3HG2 VAL 71 3HG2 VAL 71 -11.173 -17.701 -28.763 566 H LEU 72 H LEU 72 -13.027 -12.869 -28.178 567 HA LEU 72 HA LEU 72 -13.567 -12.252 -25.538 568 1HB LEU 72 1HB LEU 72 -11.100 -13.622 -25.666 569 2HB LEU 72 2HB LEU 72 -10.685 -11.914 -25.634 570 HG LEU 72 HG LEU 72 -12.332 -13.344 -23.570 571 1HD1 LEU 72 1HD1 LEU 72 -9.533 -12.263 -23.478 572 2HD1 LEU 72 2HD1 LEU 72 -10.014 -13.962 -23.462 573 3HD1 LEU 72 3HD1 LEU 72 -10.429 -12.914 -22.107 574 1HD2 LEU 72 1HD2 LEU 72 -11.382 -10.484 -23.665 575 2HD2 LEU 72 2HD2 LEU 72 -12.191 -11.252 -22.301 576 3HD2 LEU 72 3HD2 LEU 72 -13.052 -11.026 -23.820 577 H ASN 73 H ASN 73 -14.007 -10.125 -25.886 578 HA ASN 73 HA ASN 73 -12.177 -8.703 -27.728 579 1HB ASN 73 1HB ASN 73 -13.941 -7.634 -28.825 580 2HB ASN 73 2HB ASN 73 -14.510 -9.270 -28.549 581 1HD2 ASN 73 1HD2 ASN 73 -16.084 -9.611 -26.769 582 2HD2 ASN 73 2HD2 ASN 73 -17.102 -8.292 -26.325 583 H ASN 74 H ASN 74 -12.439 -8.861 -24.766 584 HA ASN 74 HA ASN 74 -11.829 -6.182 -24.216 585 1HB ASN 74 1HB ASN 74 -14.275 -5.852 -24.218 586 2HB ASN 74 2HB ASN 74 -14.453 -7.126 -23.014 587 1HD2 ASN 74 1HD2 ASN 74 -15.412 -5.688 -21.536 588 2HD2 ASN 74 2HD2 ASN 74 -14.481 -4.522 -20.673 589 H CYS 75 H CYS 75 -10.033 -7.168 -23.526 590 HA CYS 75 HA CYS 75 -10.296 -7.886 -20.746 591 1HB CYS 75 1HB CYS 75 -9.740 -9.971 -22.103 592 2HB CYS 75 2HB CYS 75 -8.270 -9.119 -22.594 593 H GLN 76 H GLN 76 -8.631 -6.985 -19.549 594 HA GLN 76 HA GLN 76 -6.937 -5.159 -20.948 595 1HB GLN 76 1HB GLN 76 -8.871 -4.381 -18.757 596 2HB GLN 76 2HB GLN 76 -7.620 -3.337 -19.425 597 1HG GLN 76 1HG GLN 76 -8.587 -3.451 -21.577 598 2HG GLN 76 2HG GLN 76 -9.855 -4.537 -21.070 599 1HE2 GLN 76 1HE2 GLN 76 -11.600 -3.185 -21.462 600 2HE2 GLN 76 2HE2 GLN 76 -11.850 -1.681 -20.661 601 H LEU 77 H LEU 77 -5.163 -5.239 -20.145 602 HA LEU 77 HA LEU 77 -4.901 -7.424 -18.351 603 1HB LEU 77 1HB LEU 77 -3.845 -7.735 -20.387 604 2HB LEU 77 2HB LEU 77 -3.049 -6.185 -20.320 605 HG LEU 77 HG LEU 77 -1.522 -7.032 -18.604 606 1HD1 LEU 77 1HD1 LEU 77 -1.477 -9.398 -18.068 607 2HD1 LEU 77 2HD1 LEU 77 -2.969 -9.638 -18.991 608 3HD1 LEU 77 3HD1 LEU 77 -2.977 -8.644 -17.534 609 1HD2 LEU 77 1HD2 LEU 77 -1.775 -8.655 -21.115 610 2HD2 LEU 77 2HD2 LEU 77 -0.402 -8.735 -20.041 611 3HD2 LEU 77 3HD2 LEU 77 -0.789 -7.210 -20.860 612 H GLN 78 H GLN 78 -4.097 -7.302 -16.300 613 HA GLN 78 HA GLN 78 -3.031 -5.165 -14.861 614 1HB GLN 78 1HB GLN 78 -2.030 -8.035 -14.686 615 2HB GLN 78 2HB GLN 78 -1.688 -6.789 -13.509 616 1HG GLN 78 1HG GLN 78 -4.363 -7.983 -14.142 617 2HG GLN 78 2HG GLN 78 -3.377 -8.317 -12.715 618 1HE2 GLN 78 1HE2 GLN 78 -5.477 -6.201 -14.257 619 2HE2 GLN 78 2HE2 GLN 78 -5.740 -5.073 -12.965 620 H ASN 79 H ASN 79 -0.915 -7.744 -16.232 621 HA ASN 79 HA ASN 79 0.844 -6.374 -17.759 622 1HB ASN 79 1HB ASN 79 1.575 -5.309 -15.539 623 2HB ASN 79 2HB ASN 79 1.832 -6.932 -14.913 624 1HD2 ASN 79 1HD2 ASN 79 3.041 -4.451 -16.973 625 2HD2 ASN 79 2HD2 ASN 79 4.588 -5.158 -17.293 626 HA PRO 80 HA PRO 80 0.885 -10.683 -18.217 627 1HB PRO 80 1HB PRO 80 3.472 -11.022 -19.333 628 2HB PRO 80 2HB PRO 80 1.938 -10.904 -20.203 629 1HG PRO 80 1HG PRO 80 4.015 -8.876 -19.725 630 2HG PRO 80 2HG PRO 80 2.804 -8.954 -21.005 631 1HD PRO 80 1HD PRO 80 2.672 -7.192 -18.900 632 2HD PRO 80 2HD PRO 80 1.271 -7.806 -19.815 633 H GLN 81 H GLN 81 3.770 -9.248 -16.600 634 HA GLN 81 HA GLN 81 3.906 -11.711 -15.212 635 1HB GLN 81 1HB GLN 81 6.000 -10.921 -16.147 636 2HB GLN 81 2HB GLN 81 5.831 -9.427 -15.196 637 1HG GLN 81 1HG GLN 81 5.817 -10.670 -13.199 638 2HG GLN 81 2HG GLN 81 5.971 -12.190 -14.084 639 1HE2 GLN 81 1HE2 GLN 81 7.701 -11.130 -12.031 640 2HE2 GLN 81 2HE2 GLN 81 9.273 -10.938 -12.713 641 H ARG 82 H ARG 82 2.210 -11.383 -14.170 642 HA ARG 82 HA ARG 82 2.044 -9.181 -12.276 643 1HB ARG 82 1HB ARG 82 -0.375 -9.887 -11.924 644 2HB ARG 82 2HB ARG 82 0.011 -9.244 -13.504 645 1HG ARG 82 1HG ARG 82 -1.494 -11.072 -13.810 646 2HG ARG 82 2HG ARG 82 0.090 -11.612 -14.354 647 1HD ARG 82 1HD ARG 82 0.417 -12.774 -12.233 648 2HD ARG 82 2HD ARG 82 -1.148 -12.192 -11.675 649 HE ARG 82 HE ARG 82 -1.770 -13.468 -13.929 650 1HH1 ARG 82 1HH1 ARG 82 0.262 -14.484 -11.211 651 2HH1 ARG 82 2HH1 ARG 82 -0.237 -16.104 -11.217 652 1HH2 ARG 82 1HH2 ARG 82 -2.468 -15.758 -13.966 653 2HH2 ARG 82 2HH2 ARG 82 -1.834 -16.833 -12.813 Start of MODEL 8 1 H MET 1 H MET 1 5.358 -22.474 -12.145 2 HA MET 1 HA MET 1 4.120 -23.356 -13.980 3 1HB MET 1 1HB MET 1 3.060 -20.534 -14.195 4 2HB MET 1 2HB MET 1 2.957 -21.710 -15.495 5 1HG MET 1 1HG MET 1 1.753 -22.040 -12.757 6 2HG MET 1 2HG MET 1 0.881 -21.516 -14.196 7 1HE MET 1 1HE MET 1 0.009 -23.965 -12.338 8 2HE MET 1 2HE MET 1 -0.470 -25.136 -13.567 9 3HE MET 1 3HE MET 1 -0.888 -23.434 -13.760 10 H GLN 2 H GLN 2 6.051 -20.456 -13.514 11 HA GLN 2 HA GLN 2 7.999 -19.819 -14.377 12 1HB GLN 2 1HB GLN 2 8.481 -22.316 -14.271 13 2HB GLN 2 2HB GLN 2 8.015 -22.410 -15.956 14 1HG GLN 2 1HG GLN 2 9.861 -20.918 -16.540 15 2HG GLN 2 2HG GLN 2 10.324 -20.839 -14.839 16 1HE2 GLN 2 1HE2 GLN 2 11.846 -21.825 -17.092 17 2HE2 GLN 2 2HE2 GLN 2 12.243 -23.470 -16.735 18 H THR 3 H THR 3 5.320 -19.588 -15.758 19 HA THR 3 HA THR 3 6.234 -18.505 -18.361 20 HB THR 3 HB THR 3 3.504 -19.155 -18.552 21 HG1 THR 3 HG1 THR 3 5.039 -21.172 -17.322 22 1HG2 THR 3 1HG2 THR 3 4.282 -20.665 -20.322 23 2HG2 THR 3 2HG2 THR 3 5.938 -20.516 -19.696 24 3HG2 THR 3 3HG2 THR 3 5.098 -19.096 -20.335 25 H ASP 4 H ASP 4 5.033 -16.704 -19.069 26 HA ASP 4 HA ASP 4 3.990 -15.273 -16.800 27 1HB ASP 4 1HB ASP 4 4.012 -14.338 -19.702 28 2HB ASP 4 2HB ASP 4 3.727 -13.326 -18.294 29 H THR 5 H THR 5 1.706 -14.547 -16.777 30 HA THR 5 HA THR 5 0.029 -15.986 -18.636 31 HB THR 5 HB THR 5 -0.162 -16.421 -15.628 32 HG1 THR 5 HG1 THR 5 1.107 -17.606 -17.596 33 1HG2 THR 5 1HG2 THR 5 -2.402 -16.315 -16.680 34 2HG2 THR 5 2HG2 THR 5 -2.010 -17.948 -16.140 35 3HG2 THR 5 3HG2 THR 5 -1.891 -17.530 -17.850 36 H LEU 6 H LEU 6 -1.904 -14.952 -19.059 37 HA LEU 6 HA LEU 6 -1.892 -12.308 -18.290 38 1HB LEU 6 1HB LEU 6 -3.344 -13.991 -20.204 39 2HB LEU 6 2HB LEU 6 -4.161 -12.510 -19.782 40 HG LEU 6 HG LEU 6 -1.947 -11.410 -20.212 41 1HD1 LEU 6 1HD1 LEU 6 -0.542 -13.325 -20.367 42 2HD1 LEU 6 2HD1 LEU 6 -0.438 -12.257 -21.750 43 3HD1 LEU 6 3HD1 LEU 6 -1.318 -13.775 -21.902 44 1HD2 LEU 6 1HD2 LEU 6 -2.417 -11.147 -22.633 45 2HD2 LEU 6 2HD2 LEU 6 -3.815 -10.937 -21.584 46 3HD2 LEU 6 3HD2 LEU 6 -3.616 -12.441 -22.488 47 H GLU 7 H GLU 7 -4.826 -11.906 -18.261 48 HA GLU 7 HA GLU 7 -4.828 -11.291 -15.603 49 1HB GLU 7 1HB GLU 7 -5.793 -10.128 -17.561 50 2HB GLU 7 2HB GLU 7 -7.076 -11.328 -17.580 51 1HG GLU 7 1HG GLU 7 -7.650 -9.225 -16.435 52 2HG GLU 7 2HG GLU 7 -7.812 -10.709 -15.469 53 H TYR 8 H TYR 8 -5.699 -13.980 -17.401 54 HA TYR 8 HA TYR 8 -6.912 -15.539 -17.451 55 1HB TYR 8 1HB TYR 8 -6.990 -17.157 -15.415 56 2HB TYR 8 2HB TYR 8 -5.452 -16.727 -16.125 57 HD1 TYR 8 HD1 TYR 8 -7.717 -16.020 -13.263 58 HD2 TYR 8 HD2 TYR 8 -3.752 -15.816 -14.788 59 HE1 TYR 8 HE1 TYR 8 -6.881 -15.453 -11.025 60 HE2 TYR 8 HE2 TYR 8 -2.910 -15.246 -12.556 61 HH TYR 8 HH TYR 8 -3.765 -14.264 -10.511 62 H GLN 9 H GLN 9 -8.401 -13.182 -16.863 63 HA GLN 9 HA GLN 9 -10.889 -14.382 -16.460 64 1HB GLN 9 1HB GLN 9 -9.820 -12.399 -14.502 65 2HB GLN 9 2HB GLN 9 -11.530 -12.399 -14.916 66 1HG GLN 9 1HG GLN 9 -9.972 -14.712 -13.889 67 2HG GLN 9 2HG GLN 9 -11.089 -13.708 -12.917 68 1HE2 GLN 9 1HE2 GLN 9 -11.154 -16.552 -13.396 69 2HE2 GLN 9 2HE2 GLN 9 -12.654 -16.879 -14.202 70 H CYS 10 H CYS 10 -12.153 -13.610 -17.593 71 HA CYS 10 HA CYS 10 -12.060 -10.944 -18.691 72 1HB CYS 10 1HB CYS 10 -11.623 -13.462 -20.199 73 2HB CYS 10 2HB CYS 10 -12.458 -12.154 -21.056 74 H ASP 11 H ASP 11 -14.140 -10.529 -19.813 75 HA ASP 11 HA ASP 11 -16.250 -11.758 -18.301 76 1HB ASP 11 1HB ASP 11 -16.242 -9.341 -18.889 77 2HB ASP 11 2HB ASP 11 -16.440 -9.793 -20.582 78 H GLU 12 H GLU 12 -14.660 -12.518 -21.053 79 HA GLU 12 HA GLU 12 -16.827 -13.629 -22.556 80 1HB GLU 12 1HB GLU 12 -13.852 -13.674 -22.922 81 2HB GLU 12 2HB GLU 12 -15.062 -14.145 -24.103 82 1HG GLU 12 1HG GLU 12 -14.917 -11.393 -22.947 83 2HG GLU 12 2HG GLU 12 -14.019 -11.864 -24.391 84 H LYS 13 H LYS 13 -13.804 -14.688 -21.063 85 HA LYS 13 HA LYS 13 -14.641 -17.403 -20.532 86 1HB LYS 13 1HB LYS 13 -12.309 -16.819 -22.391 87 2HB LYS 13 2HB LYS 13 -13.004 -18.377 -22.007 88 1HG LYS 13 1HG LYS 13 -14.524 -16.286 -23.413 89 2HG LYS 13 2HG LYS 13 -13.417 -17.292 -24.325 90 1HD LYS 13 1HD LYS 13 -14.592 -19.302 -23.685 91 2HD LYS 13 2HD LYS 13 -15.698 -18.392 -22.622 92 1HE LYS 13 1HE LYS 13 -15.454 -18.211 -25.629 93 2HE LYS 13 2HE LYS 13 -16.695 -19.092 -24.743 94 1HZ LYS 13 1HZ LYS 13 -17.548 -16.992 -25.448 95 2HZ LYS 13 2HZ LYS 13 -16.291 -16.151 -24.758 96 3HZ LYS 13 3HZ LYS 13 -17.400 -16.960 -23.777 97 HA PRO 14 HA PRO 14 -11.081 -16.380 -17.934 98 1HB PRO 14 1HB PRO 14 -9.840 -19.037 -18.321 99 2HB PRO 14 2HB PRO 14 -10.446 -18.317 -16.828 100 1HG PRO 14 1HG PRO 14 -11.742 -20.350 -18.029 101 2HG PRO 14 2HG PRO 14 -12.607 -19.052 -17.188 102 1HD PRO 14 1HD PRO 14 -12.147 -19.418 -20.126 103 2HD PRO 14 2HD PRO 14 -13.629 -18.933 -19.271 104 H LEU 15 H LEU 15 -8.921 -15.654 -18.296 105 HA LEU 15 HA LEU 15 -8.061 -15.948 -21.083 106 1HB LEU 15 1HB LEU 15 -8.764 -13.670 -20.439 107 2HB LEU 15 2HB LEU 15 -7.550 -13.673 -19.175 108 HG LEU 15 HG LEU 15 -5.792 -13.864 -20.913 109 1HD1 LEU 15 1HD1 LEU 15 -6.323 -13.459 -23.234 110 2HD1 LEU 15 2HD1 LEU 15 -8.040 -13.379 -22.837 111 3HD1 LEU 15 3HD1 LEU 15 -7.168 -14.898 -22.643 112 1HD2 LEU 15 1HD2 LEU 15 -5.973 -11.531 -21.697 113 2HD2 LEU 15 2HD2 LEU 15 -6.330 -11.699 -19.977 114 3HD2 LEU 15 3HD2 LEU 15 -7.645 -11.497 -21.131 115 H THR 16 H THR 16 -7.184 -17.929 -19.888 116 HA THR 16 HA THR 16 -4.815 -17.222 -18.455 117 HB THR 16 HB THR 16 -5.648 -20.083 -18.964 118 HG1 THR 16 HG1 THR 16 -7.290 -19.864 -17.592 119 1HG2 THR 16 1HG2 THR 16 -4.348 -18.608 -16.674 120 2HG2 THR 16 2HG2 THR 16 -3.509 -19.615 -17.839 121 3HG2 THR 16 3HG2 THR 16 -4.656 -20.344 -16.703 122 H VAL 17 H VAL 17 -3.207 -16.790 -19.673 123 HA VAL 17 HA VAL 17 -2.707 -18.196 -22.229 124 HB VAL 17 HB VAL 17 -1.785 -15.509 -21.253 125 1HG1 VAL 17 1HG1 VAL 17 -1.015 -15.138 -23.549 126 2HG1 VAL 17 2HG1 VAL 17 -1.644 -16.712 -23.982 127 3HG1 VAL 17 3HG1 VAL 17 -0.254 -16.602 -22.900 128 1HG2 VAL 17 1HG2 VAL 17 -3.920 -16.117 -23.288 129 2HG2 VAL 17 2HG2 VAL 17 -3.318 -14.515 -22.873 130 3HG2 VAL 17 3HG2 VAL 17 -4.179 -15.475 -21.667 131 H LYS 18 H LYS 18 -0.725 -19.197 -22.411 132 HA LYS 18 HA LYS 18 1.038 -18.862 -20.123 133 1HB LYS 18 1HB LYS 18 0.845 -21.021 -22.227 134 2HB LYS 18 2HB LYS 18 2.253 -20.854 -21.220 135 1HG LYS 18 1HG LYS 18 0.711 -22.643 -20.476 136 2HG LYS 18 2HG LYS 18 1.015 -21.426 -19.244 137 1HD LYS 18 1HD LYS 18 -1.133 -20.431 -19.668 138 2HD LYS 18 2HD LYS 18 -1.424 -21.529 -21.021 139 1HE LYS 18 1HE LYS 18 -2.644 -22.246 -18.996 140 2HE LYS 18 2HE LYS 18 -1.436 -23.429 -19.482 141 1HZ LYS 18 1HZ LYS 18 0.028 -22.588 -17.754 142 2HZ LYS 18 2HZ LYS 18 -1.423 -23.082 -17.083 143 3HZ LYS 18 3HZ LYS 18 -1.101 -21.449 -17.260 144 H LEU 19 H LEU 19 1.880 -16.980 -20.718 145 HA LEU 19 HA LEU 19 2.868 -16.489 -23.340 146 1HB LEU 19 1HB LEU 19 2.629 -15.086 -20.840 147 2HB LEU 19 2HB LEU 19 4.147 -14.743 -21.688 148 HG LEU 19 HG LEU 19 1.352 -14.307 -22.780 149 1HD1 LEU 19 1HD1 LEU 19 1.871 -11.930 -22.457 150 2HD1 LEU 19 2HD1 LEU 19 3.428 -12.367 -21.751 151 3HD1 LEU 19 3HD1 LEU 19 1.938 -12.800 -20.921 152 1HD2 LEU 19 1HD2 LEU 19 4.065 -13.506 -23.842 153 2HD2 LEU 19 2HD2 LEU 19 2.509 -13.094 -24.559 154 3HD2 LEU 19 3HD2 LEU 19 3.045 -14.773 -24.522 155 H ASN 20 H ASN 20 4.258 -17.846 -23.849 156 HA ASN 20 HA ASN 20 6.477 -18.543 -22.149 157 1HB ASN 20 1HB ASN 20 6.109 -19.024 -25.149 158 2HB ASN 20 2HB ASN 20 7.451 -19.662 -24.212 159 1HD2 ASN 20 1HD2 ASN 20 4.043 -19.901 -24.886 160 2HD2 ASN 20 2HD2 ASN 20 3.771 -21.416 -24.101 161 H ASN 21 H ASN 21 7.484 -16.757 -21.606 162 HA ASN 21 HA ASN 21 7.482 -14.327 -22.735 163 1HB ASN 21 1HB ASN 21 8.240 -14.930 -20.443 164 2HB ASN 21 2HB ASN 21 9.839 -15.254 -21.110 165 1HD2 ASN 21 1HD2 ASN 21 7.536 -12.948 -20.237 166 2HD2 ASN 21 2HD2 ASN 21 8.486 -11.506 -20.437 167 HA PRO 22 HA PRO 22 11.584 -14.462 -25.027 168 1HB PRO 22 1HB PRO 22 12.714 -17.140 -25.124 169 2HB PRO 22 2HB PRO 22 13.412 -15.677 -24.425 170 1HG PRO 22 1HG PRO 22 12.616 -17.769 -22.887 171 2HG PRO 22 2HG PRO 22 12.532 -16.089 -22.331 172 1HD PRO 22 1HD PRO 22 10.380 -17.790 -23.532 173 2HD PRO 22 2HD PRO 22 10.298 -16.808 -22.053 174 H ARG 23 H ARG 23 9.608 -17.254 -25.328 175 HA ARG 23 HA ARG 23 10.305 -17.841 -28.079 176 1HB ARG 23 1HB ARG 23 8.059 -18.932 -26.384 177 2HB ARG 23 2HB ARG 23 8.540 -19.548 -27.959 178 1HG ARG 23 1HG ARG 23 10.724 -20.117 -27.066 179 2HG ARG 23 2HG ARG 23 10.202 -19.462 -25.501 180 1HD ARG 23 1HD ARG 23 10.078 -21.926 -25.564 181 2HD ARG 23 2HD ARG 23 8.512 -21.173 -25.293 182 HE ARG 23 HE ARG 23 8.316 -21.533 -27.878 183 1HH1 ARG 23 1HH1 ARG 23 9.805 -23.754 -25.588 184 2HH1 ARG 23 2HH1 ARG 23 9.380 -25.151 -26.451 185 1HH2 ARG 23 1HH2 ARG 23 7.691 -23.418 -29.031 186 2HH2 ARG 23 2HH2 ARG 23 8.151 -24.966 -28.465 187 H GLN 24 H GLN 24 7.872 -16.062 -26.374 188 HA GLN 24 HA GLN 24 6.207 -14.748 -26.951 189 1HB GLN 24 1HB GLN 24 7.811 -14.738 -29.436 190 2HB GLN 24 2HB GLN 24 6.315 -13.788 -29.343 191 1HG GLN 24 1HG GLN 24 7.249 -12.571 -27.449 192 2HG GLN 24 2HG GLN 24 8.704 -13.562 -27.522 193 1HE2 GLN 24 1HE2 GLN 24 6.848 -11.115 -29.101 194 2HE2 GLN 24 2HE2 GLN 24 8.085 -10.522 -30.123 195 H GLU 25 H GLU 25 5.919 -17.544 -27.131 196 HA GLU 25 HA GLU 25 3.601 -17.457 -28.897 197 1HB GLU 25 1HB GLU 25 3.797 -19.793 -29.347 198 2HB GLU 25 2HB GLU 25 5.394 -19.096 -29.589 199 1HG GLU 25 1HG GLU 25 5.846 -19.847 -27.183 200 2HG GLU 25 2HG GLU 25 4.361 -20.795 -27.434 201 H VAL 26 H VAL 26 1.786 -18.460 -28.066 202 HA VAL 26 HA VAL 26 1.691 -18.504 -25.075 203 HB VAL 26 HB VAL 26 -0.462 -17.495 -25.194 204 1HG1 VAL 26 1HG1 VAL 26 1.620 -15.884 -26.660 205 2HG1 VAL 26 2HG1 VAL 26 1.402 -16.004 -24.912 206 3HG1 VAL 26 3HG1 VAL 26 0.178 -15.208 -25.902 207 1HG2 VAL 26 1HG2 VAL 26 -1.233 -18.217 -27.383 208 2HG2 VAL 26 2HG2 VAL 26 -0.032 -17.190 -28.165 209 3HG2 VAL 26 3HG2 VAL 26 -1.354 -16.461 -27.257 210 H SER 27 H SER 27 0.864 -20.162 -24.177 211 HA SER 27 HA SER 27 -0.690 -21.930 -25.880 212 1HB SER 27 1HB SER 27 -0.180 -22.399 -22.948 213 2HB SER 27 2HB SER 27 -0.460 -23.526 -24.257 214 HG SER 27 HG SER 27 1.605 -23.738 -24.292 215 H PHE 28 H PHE 28 -2.725 -21.498 -25.924 216 HA PHE 28 HA PHE 28 -3.786 -19.973 -23.718 217 1HB PHE 28 1HB PHE 28 -3.331 -18.415 -25.453 218 2HB PHE 28 2HB PHE 28 -4.250 -19.360 -26.642 219 HD1 PHE 28 HD1 PHE 28 -4.768 -17.968 -23.244 220 HD2 PHE 28 HD2 PHE 28 -6.286 -18.408 -27.169 221 HE1 PHE 28 HE1 PHE 28 -6.732 -16.719 -22.600 222 HE2 PHE 28 HE2 PHE 28 -8.287 -17.140 -26.547 223 HZ PHE 28 HZ PHE 28 -8.519 -16.283 -24.248 224 H VAL 29 H VAL 29 -5.979 -19.951 -23.600 225 HA VAL 29 HA VAL 29 -6.875 -22.630 -23.590 226 HB VAL 29 HB VAL 29 -6.603 -21.349 -21.546 227 1HG1 VAL 29 1HG1 VAL 29 -8.100 -19.534 -20.887 228 2HG1 VAL 29 2HG1 VAL 29 -8.771 -19.517 -22.514 229 3HG1 VAL 29 3HG1 VAL 29 -7.099 -19.108 -22.274 230 1HG2 VAL 29 1HG2 VAL 29 -9.431 -22.189 -22.144 231 2HG2 VAL 29 2HG2 VAL 29 -8.792 -21.862 -20.525 232 3HG2 VAL 29 3HG2 VAL 29 -8.102 -23.164 -21.496 233 H TYR 30 H TYR 30 -8.069 -23.229 -24.974 234 HA TYR 30 HA TYR 30 -10.110 -21.588 -26.384 235 1HB TYR 30 1HB TYR 30 -8.599 -23.111 -27.711 236 2HB TYR 30 2HB TYR 30 -9.265 -24.480 -26.846 237 HD1 TYR 30 HD1 TYR 30 -11.095 -21.569 -28.346 238 HD2 TYR 30 HD2 TYR 30 -10.287 -25.743 -28.529 239 HE1 TYR 30 HE1 TYR 30 -12.790 -21.817 -30.102 240 HE2 TYR 30 HE2 TYR 30 -11.989 -26.000 -30.278 241 HH TYR 30 HH TYR 30 -13.238 -23.381 -31.940 242 H ASP 31 H ASP 31 -10.368 -22.005 -23.725 243 HA ASP 31 HA ASP 31 -11.786 -22.505 -22.071 244 1HB ASP 31 1HB ASP 31 -13.623 -21.919 -23.562 245 2HB ASP 31 2HB ASP 31 -13.604 -23.527 -24.270 246 H ASN 32 H ASN 32 -10.845 -23.833 -20.801 247 HA ASN 32 HA ASN 32 -10.362 -25.651 -19.608 248 1HB ASN 32 1HB ASN 32 -12.789 -26.245 -19.940 249 2HB ASN 32 2HB ASN 32 -12.331 -27.193 -21.343 250 1HD2 ASN 32 1HD2 ASN 32 -11.390 -29.263 -21.006 251 2HD2 ASN 32 2HD2 ASN 32 -11.324 -29.993 -19.450 252 H GLN 33 H GLN 33 -9.236 -25.268 -22.624 253 HA GLN 33 HA GLN 33 -7.436 -27.464 -22.342 254 1HB GLN 33 1HB GLN 33 -7.718 -28.186 -24.633 255 2HB GLN 33 2HB GLN 33 -9.230 -28.412 -23.765 256 1HG GLN 33 1HG GLN 33 -10.045 -26.304 -24.725 257 2HG GLN 33 2HG GLN 33 -8.504 -26.199 -25.591 258 1HE2 GLN 33 1HE2 GLN 33 -8.330 -29.002 -26.191 259 2HE2 GLN 33 2HE2 GLN 33 -9.505 -29.323 -27.402 260 H LEU 34 H LEU 34 -5.648 -27.124 -23.699 261 HA LEU 34 HA LEU 34 -5.436 -24.298 -24.154 262 1HB LEU 34 1HB LEU 34 -3.422 -26.114 -22.852 263 2HB LEU 34 2HB LEU 34 -2.997 -24.511 -23.419 264 HG LEU 34 HG LEU 34 -3.238 -24.400 -21.039 265 1HD1 LEU 34 1HD1 LEU 34 -5.691 -23.245 -22.170 266 2HD1 LEU 34 2HD1 LEU 34 -4.083 -22.521 -22.146 267 3HD1 LEU 34 3HD1 LEU 34 -4.936 -22.841 -20.633 268 1HD2 LEU 34 1HD2 LEU 34 -5.234 -25.079 -19.812 269 2HD2 LEU 34 2HD2 LEU 34 -4.477 -26.449 -20.629 270 3HD2 LEU 34 3HD2 LEU 34 -5.934 -25.715 -21.302 271 H LEU 35 H LEU 35 -4.509 -23.835 -26.161 272 HA LEU 35 HA LEU 35 -2.636 -25.744 -27.284 273 1HB LEU 35 1HB LEU 35 -3.414 -25.504 -29.589 274 2HB LEU 35 2HB LEU 35 -4.652 -26.163 -28.559 275 HG LEU 35 HG LEU 35 -5.584 -24.806 -30.227 276 1HD1 LEU 35 1HD1 LEU 35 -6.908 -23.197 -28.944 277 2HD1 LEU 35 2HD1 LEU 35 -5.833 -23.457 -27.570 278 3HD1 LEU 35 3HD1 LEU 35 -6.801 -24.793 -28.200 279 1HD2 LEU 35 1HD2 LEU 35 -3.932 -22.496 -29.235 280 2HD2 LEU 35 2HD2 LEU 35 -5.254 -22.358 -30.394 281 3HD2 LEU 35 3HD2 LEU 35 -3.818 -23.296 -30.804 282 H HIS 36 H HIS 36 -1.479 -24.614 -29.234 283 HA HIS 36 HA HIS 36 -0.550 -22.211 -27.883 284 1HB HIS 36 1HB HIS 36 1.740 -22.683 -28.592 285 2HB HIS 36 2HB HIS 36 1.078 -23.978 -27.611 286 HD2 HIS 36 HD2 HIS 36 0.057 -26.169 -29.428 287 HE1 HIS 36 HE1 HIS 36 3.267 -25.441 -32.077 288 HE2 HIS 36 HE2 HIS 36 1.281 -26.913 -31.570 289 H LEU 37 H LEU 37 0.047 -20.548 -28.897 290 HA LEU 37 HA LEU 37 -0.384 -20.325 -31.815 291 1HB LEU 37 1HB LEU 37 -1.209 -18.189 -29.875 292 2HB LEU 37 2HB LEU 37 -1.406 -18.158 -31.579 293 HG LEU 37 HG LEU 37 -2.867 -20.347 -31.085 294 1HD1 LEU 37 1HD1 LEU 37 -2.500 -20.402 -28.720 295 2HD1 LEU 37 2HD1 LEU 37 -4.203 -20.113 -29.067 296 3HD1 LEU 37 3HD1 LEU 37 -3.169 -18.780 -28.548 297 1HD2 LEU 37 1HD2 LEU 37 -3.805 -17.499 -30.865 298 2HD2 LEU 37 2HD2 LEU 37 -4.877 -18.892 -30.976 299 3HD2 LEU 37 3HD2 LEU 37 -3.762 -18.548 -32.293 300 H LYS 38 H LYS 38 0.777 -18.652 -32.693 301 HA LYS 38 HA LYS 38 3.023 -17.889 -31.016 302 1HB LYS 38 1HB LYS 38 4.302 -18.153 -33.151 303 2HB LYS 38 2HB LYS 38 3.797 -19.591 -32.214 304 1HG LYS 38 1HG LYS 38 2.050 -20.049 -33.740 305 2HG LYS 38 2HG LYS 38 2.321 -18.527 -34.588 306 1HD LYS 38 1HD LYS 38 4.311 -19.200 -35.414 307 2HD LYS 38 2HD LYS 38 4.452 -20.542 -34.282 308 1HE LYS 38 1HE LYS 38 3.811 -21.434 -36.519 309 2HE LYS 38 2HE LYS 38 2.537 -21.696 -35.343 310 1HZ LYS 38 1HZ LYS 38 1.626 -19.455 -36.360 311 2HZ LYS 38 2HZ LYS 38 1.363 -20.941 -37.053 312 3HZ LYS 38 3HZ LYS 38 2.576 -19.940 -37.685 313 H GLN 39 H GLN 39 4.108 -16.161 -31.736 314 HA GLN 39 HA GLN 39 2.276 -14.115 -32.663 315 1HB GLN 39 1HB GLN 39 3.493 -13.685 -30.607 316 2HB GLN 39 2HB GLN 39 5.024 -13.727 -31.495 317 1HG GLN 39 1HG GLN 39 4.151 -11.835 -32.880 318 2HG GLN 39 2HG GLN 39 2.772 -11.747 -31.794 319 1HE2 GLN 39 1HE2 GLN 39 4.772 -9.758 -32.395 320 2HE2 GLN 39 2HE2 GLN 39 5.533 -9.357 -30.905 321 H GLY 40 H GLY 40 2.198 -13.618 -34.512 322 1HA GLY 40 1HA GLY 40 4.577 -13.402 -36.236 323 2HA GLY 40 2HA GLY 40 2.930 -13.636 -36.844 324 H ILE 41 H ILE 41 3.726 -11.595 -38.042 325 HA ILE 41 HA ILE 41 3.787 -9.192 -36.471 326 HB ILE 41 HB ILE 41 3.665 -9.544 -39.473 327 1HG1 ILE 41 1HG1 ILE 41 5.709 -10.513 -38.588 328 2HG1 ILE 41 2HG1 ILE 41 6.091 -9.008 -39.411 329 1HG2 ILE 41 1HG2 ILE 41 4.295 -7.079 -37.857 330 2HG2 ILE 41 2HG2 ILE 41 2.859 -7.345 -38.842 331 3HG2 ILE 41 3HG2 ILE 41 4.444 -7.217 -39.611 332 1HD1 ILE 41 1HD1 ILE 41 6.245 -7.885 -37.230 333 2HD1 ILE 41 2HD1 ILE 41 7.380 -9.222 -37.382 334 3HD1 ILE 41 3HD1 ILE 41 5.911 -9.424 -36.429 335 H SER 42 H SER 42 2.053 -8.385 -35.630 336 HA SER 42 HA SER 42 -0.614 -8.843 -36.725 337 1HB SER 42 1HB SER 42 0.050 -8.925 -34.230 338 2HB SER 42 2HB SER 42 0.189 -7.187 -34.353 339 HG SER 42 HG SER 42 -1.823 -7.010 -34.214 340 H ALA 43 H ALA 43 1.856 -6.643 -36.828 341 HA ALA 43 HA ALA 43 2.253 -4.566 -37.669 342 1HB ALA 43 1HB ALA 43 0.606 -3.369 -39.043 343 2HB ALA 43 2HB ALA 43 -0.671 -4.456 -38.502 344 3HB ALA 43 3HB ALA 43 0.640 -5.069 -39.506 345 H SER 44 H SER 44 -0.778 -4.775 -35.957 346 HA SER 44 HA SER 44 0.196 -2.742 -34.076 347 1HB SER 44 1HB SER 44 -2.687 -3.286 -34.890 348 2HB SER 44 2HB SER 44 -2.142 -2.058 -33.745 349 HG SER 44 HG SER 44 -1.801 -0.800 -35.331 350 H GLY 45 H GLY 45 0.539 -3.763 -32.120 351 1HA GLY 45 1HA GLY 45 -0.200 -5.048 -30.270 352 2HA GLY 45 2HA GLY 45 -1.288 -5.922 -31.327 353 H ALA 46 H ALA 46 -0.773 -7.961 -31.182 354 HA ALA 46 HA ALA 46 1.794 -8.889 -31.907 355 1HB ALA 46 1HB ALA 46 1.801 -10.290 -29.817 356 2HB ALA 46 2HB ALA 46 0.501 -9.230 -29.226 357 3HB ALA 46 3HB ALA 46 2.096 -8.564 -29.544 358 H ARG 47 H ARG 47 1.286 -10.642 -33.131 359 HA ARG 47 HA ARG 47 -1.505 -11.198 -33.041 360 1HB ARG 47 1HB ARG 47 -0.594 -10.276 -35.202 361 2HB ARG 47 2HB ARG 47 0.425 -11.677 -35.328 362 1HG ARG 47 1HG ARG 47 -1.435 -11.744 -36.775 363 2HG ARG 47 2HG ARG 47 -1.534 -13.072 -35.597 364 1HD ARG 47 1HD ARG 47 -3.718 -12.038 -35.935 365 2HD ARG 47 2HD ARG 47 -3.125 -11.737 -34.298 366 HE ARG 47 HE ARG 47 -2.507 -9.475 -35.083 367 1HH1 ARG 47 1HH1 ARG 47 -4.935 -11.229 -37.013 368 2HH1 ARG 47 2HH1 ARG 47 -5.750 -9.801 -37.459 369 1HH2 ARG 47 1HH2 ARG 47 -3.648 -7.576 -35.726 370 2HH2 ARG 47 2HH2 ARG 47 -5.032 -7.701 -36.717 371 H TYR 48 H TYR 48 -1.467 -13.122 -31.518 372 HA TYR 48 HA TYR 48 0.380 -15.251 -32.227 373 1HB TYR 48 1HB TYR 48 -1.515 -15.118 -29.848 374 2HB TYR 48 2HB TYR 48 -0.151 -16.189 -30.157 375 HD1 TYR 48 HD1 TYR 48 2.021 -15.683 -29.438 376 HD2 TYR 48 HD2 TYR 48 -0.993 -12.687 -29.238 377 HE1 TYR 48 HE1 TYR 48 3.489 -14.289 -28.039 378 HE2 TYR 48 HE2 TYR 48 0.465 -11.302 -27.845 379 HH TYR 48 HH TYR 48 2.385 -11.596 -26.310 380 H THR 49 H THR 49 -0.434 -16.500 -33.728 381 HA THR 49 HA THR 49 -3.216 -17.209 -33.494 382 HB THR 49 HB THR 49 -2.153 -15.794 -35.941 383 HG1 THR 49 HG1 THR 49 -3.230 -14.923 -33.723 384 1HG2 THR 49 1HG2 THR 49 -3.711 -17.576 -36.568 385 2HG2 THR 49 2HG2 THR 49 -4.449 -15.995 -36.826 386 3HG2 THR 49 3HG2 THR 49 -4.898 -16.965 -35.420 387 H ASP 50 H ASP 50 -3.546 -19.292 -34.265 388 HA ASP 50 HA ASP 50 -1.980 -20.210 -36.446 389 1HB ASP 50 1HB ASP 50 -0.493 -20.704 -34.454 390 2HB ASP 50 2HB ASP 50 -1.742 -21.847 -33.943 391 H GLY 51 H GLY 51 -4.169 -20.138 -37.195 392 1HA GLY 51 1HA GLY 51 -5.502 -21.576 -38.423 393 2HA GLY 51 2HA GLY 51 -5.007 -22.886 -37.379 394 H ILE 52 H ILE 52 -5.841 -21.972 -34.972 395 HA ILE 52 HA ILE 52 -8.630 -22.712 -35.307 396 HB ILE 52 HB ILE 52 -7.156 -22.267 -32.679 397 1HG1 ILE 52 1HG1 ILE 52 -7.426 -24.809 -32.451 398 2HG1 ILE 52 2HG1 ILE 52 -7.870 -24.830 -34.147 399 1HG2 ILE 52 1HG2 ILE 52 -9.554 -21.907 -32.422 400 2HG2 ILE 52 2HG2 ILE 52 -9.061 -23.382 -31.593 401 3HG2 ILE 52 3HG2 ILE 52 -9.886 -23.480 -33.147 402 1HD1 ILE 52 1HD1 ILE 52 -5.228 -23.958 -32.999 403 2HD1 ILE 52 2HD1 ILE 52 -5.649 -23.982 -34.713 404 3HD1 ILE 52 3HD1 ILE 52 -5.565 -25.493 -33.802 405 H TYR 53 H TYR 53 -6.982 -20.003 -33.765 406 HA TYR 53 HA TYR 53 -9.073 -18.254 -34.560 407 1HB TYR 53 1HB TYR 53 -9.278 -17.272 -32.256 408 2HB TYR 53 2HB TYR 53 -10.197 -18.737 -32.574 409 HD1 TYR 53 HD1 TYR 53 -10.100 -20.452 -31.024 410 HD2 TYR 53 HD2 TYR 53 -6.932 -17.636 -31.081 411 HE1 TYR 53 HE1 TYR 53 -9.138 -21.506 -29.040 412 HE2 TYR 53 HE2 TYR 53 -5.957 -18.685 -29.092 413 HH TYR 53 HH TYR 53 -6.782 -20.096 -27.157 414 H VAL 54 H VAL 54 -8.586 -16.044 -33.807 415 HA VAL 54 HA VAL 54 -5.732 -15.557 -34.146 416 HB VAL 54 HB VAL 54 -8.178 -13.898 -34.568 417 1HG1 VAL 54 1HG1 VAL 54 -5.273 -13.215 -35.129 418 2HG1 VAL 54 2HG1 VAL 54 -6.303 -12.455 -33.915 419 3HG1 VAL 54 3HG1 VAL 54 -6.637 -12.217 -35.632 420 1HG2 VAL 54 1HG2 VAL 54 -7.615 -14.001 -36.977 421 2HG2 VAL 54 2HG2 VAL 54 -7.956 -15.584 -36.275 422 3HG2 VAL 54 3HG2 VAL 54 -6.290 -15.096 -36.586 423 H PHE 55 H PHE 55 -4.818 -15.260 -32.166 424 HA PHE 55 HA PHE 55 -6.362 -13.885 -30.127 425 1HB PHE 55 1HB PHE 55 -5.122 -15.955 -29.474 426 2HB PHE 55 2HB PHE 55 -3.620 -15.199 -29.977 427 HD1 PHE 55 HD1 PHE 55 -2.629 -13.435 -28.609 428 HD2 PHE 55 HD2 PHE 55 -6.176 -15.402 -27.408 429 HE1 PHE 55 HE1 PHE 55 -2.323 -12.564 -26.320 430 HE2 PHE 55 HE2 PHE 55 -5.900 -14.539 -25.129 431 HZ PHE 55 HZ PHE 55 -3.971 -13.114 -24.579 432 H TRP 56 H TRP 56 -6.380 -11.758 -30.675 433 HA TRP 56 HA TRP 56 -3.895 -10.594 -31.460 434 1HB TRP 56 1HB TRP 56 -5.658 -10.089 -32.976 435 2HB TRP 56 2HB TRP 56 -6.731 -9.595 -31.658 436 HD1 TRP 56 HD1 TRP 56 -3.094 -8.494 -32.421 437 HE1 TRP 56 HE1 TRP 56 -3.040 -5.932 -32.531 438 HE3 TRP 56 HE3 TRP 56 -8.082 -7.555 -31.833 439 HZ2 TRP 56 HZ2 TRP 56 -4.867 -3.796 -32.431 440 HZ3 TRP 56 HZ3 TRP 56 -8.851 -5.217 -31.865 441 HH2 TRP 56 HH2 TRP 56 -7.275 -3.377 -32.157 442 H SER 57 H SER 57 -2.881 -9.749 -30.143 443 HA SER 57 HA SER 57 -3.966 -8.853 -27.559 444 1HB SER 57 1HB SER 57 -2.297 -10.743 -27.535 445 2HB SER 57 2HB SER 57 -1.143 -9.644 -28.287 446 HG SER 57 HG SER 57 -0.689 -9.043 -26.332 447 H LYS 58 H LYS 58 -4.229 -6.616 -27.758 448 HA LYS 58 HA LYS 58 -2.384 -5.214 -29.449 449 1HB LYS 58 1HB LYS 58 -4.810 -4.761 -29.452 450 2HB LYS 58 2HB LYS 58 -4.689 -4.280 -27.773 451 1HG LYS 58 1HG LYS 58 -3.426 -2.364 -28.314 452 2HG LYS 58 2HG LYS 58 -3.201 -2.908 -29.982 453 1HD LYS 58 1HD LYS 58 -5.554 -2.811 -30.357 454 2HD LYS 58 2HD LYS 58 -5.829 -2.293 -28.695 455 1HE LYS 58 1HE LYS 58 -4.594 -0.230 -29.082 456 2HE LYS 58 2HE LYS 58 -4.163 -0.750 -30.708 457 1HZ LYS 58 1HZ LYS 58 -6.912 -0.146 -29.744 458 2HZ LYS 58 2HZ LYS 58 -6.514 -0.668 -31.290 459 3HZ LYS 58 3HZ LYS 58 -5.978 0.831 -30.750 460 H GLY 59 H GLY 59 -2.843 -6.031 -26.169 461 1HA GLY 59 1HA GLY 59 -0.485 -5.578 -25.112 462 2HA GLY 59 2HA GLY 59 -1.090 -3.923 -25.197 463 H ASP 60 H ASP 60 -2.981 -3.398 -24.064 464 HA ASP 60 HA ASP 60 -3.210 -4.898 -21.554 465 1HB ASP 60 1HB ASP 60 -4.354 -2.195 -22.325 466 2HB ASP 60 2HB ASP 60 -4.471 -2.935 -20.740 467 H GLU 61 H GLU 61 -4.556 -4.858 -24.490 468 HA GLU 61 HA GLU 61 -7.093 -5.814 -23.542 469 1HB GLU 61 1HB GLU 61 -8.181 -4.534 -25.406 470 2HB GLU 61 2HB GLU 61 -7.561 -3.539 -24.090 471 1HG GLU 61 1HG GLU 61 -5.499 -3.231 -25.508 472 2HG GLU 61 2HG GLU 61 -6.444 -3.942 -26.821 473 H ALA 62 H ALA 62 -7.999 -7.383 -24.947 474 HA ALA 62 HA ALA 62 -6.284 -8.272 -27.054 475 1HB ALA 62 1HB ALA 62 -7.117 -9.932 -24.690 476 2HB ALA 62 2HB ALA 62 -5.471 -9.422 -25.070 477 3HB ALA 62 3HB ALA 62 -6.310 -10.564 -26.127 478 H THR 63 H THR 63 -7.417 -9.446 -28.474 479 HA THR 63 HA THR 63 -10.199 -10.112 -27.991 480 HB THR 63 HB THR 63 -9.288 -8.433 -30.336 481 HG1 THR 63 HG1 THR 63 -10.132 -7.903 -27.875 482 1HG2 THR 63 1HG2 THR 63 -11.675 -8.350 -30.949 483 2HG2 THR 63 2HG2 THR 63 -12.054 -9.421 -29.602 484 3HG2 THR 63 3HG2 THR 63 -11.091 -10.018 -30.954 485 H VAL 64 H VAL 64 -10.573 -12.091 -28.635 486 HA VAL 64 HA VAL 64 -8.677 -13.373 -30.431 487 HB VAL 64 HB VAL 64 -10.538 -14.665 -28.452 488 1HG1 VAL 64 1HG1 VAL 64 -9.831 -16.096 -30.185 489 2HG1 VAL 64 2HG1 VAL 64 -9.027 -16.559 -28.693 490 3HG1 VAL 64 3HG1 VAL 64 -8.131 -15.672 -29.941 491 1HG2 VAL 64 1HG2 VAL 64 -7.639 -13.950 -28.029 492 2HG2 VAL 64 2HG2 VAL 64 -8.633 -14.937 -26.952 493 3HG2 VAL 64 3HG2 VAL 64 -9.028 -13.237 -27.208 494 H TYR 65 H TYR 65 -9.593 -13.184 -32.326 495 HA TYR 65 HA TYR 65 -12.389 -14.003 -32.727 496 1HB TYR 65 1HB TYR 65 -12.696 -11.745 -32.779 497 2HB TYR 65 2HB TYR 65 -11.084 -11.414 -33.405 498 HD1 TYR 65 HD1 TYR 65 -10.735 -11.172 -35.785 499 HD2 TYR 65 HD2 TYR 65 -14.554 -12.470 -34.401 500 HE1 TYR 65 HE1 TYR 65 -11.671 -10.844 -38.033 501 HE2 TYR 65 HE2 TYR 65 -15.477 -12.143 -36.637 502 HH TYR 65 HH TYR 65 -15.020 -10.879 -38.651 503 H LYS 66 H LYS 66 -12.041 -15.870 -33.840 504 HA LYS 66 HA LYS 66 -10.534 -15.587 -36.257 505 1HB LYS 66 1HB LYS 66 -10.873 -17.843 -34.858 506 2HB LYS 66 2HB LYS 66 -12.455 -17.805 -35.600 507 1HG LYS 66 1HG LYS 66 -11.134 -17.398 -37.803 508 2HG LYS 66 2HG LYS 66 -9.819 -18.159 -36.910 509 1HD LYS 66 1HD LYS 66 -11.257 -20.113 -36.520 510 2HD LYS 66 2HD LYS 66 -12.547 -19.318 -37.436 511 1HE LYS 66 1HE LYS 66 -10.908 -19.152 -39.354 512 2HE LYS 66 2HE LYS 66 -9.876 -20.256 -38.445 513 1HZ LYS 66 1HZ LYS 66 -11.211 -21.442 -40.025 514 2HZ LYS 66 2HZ LYS 66 -12.619 -20.760 -39.416 515 3HZ LYS 66 3HZ LYS 66 -11.742 -21.870 -38.476 516 H ARG 67 H ARG 67 -11.770 -15.635 -38.053 517 HA ARG 67 HA ARG 67 -14.007 -13.985 -38.265 518 1HB ARG 67 1HB ARG 67 -12.580 -14.496 -40.144 519 2HB ARG 67 2HB ARG 67 -13.113 -16.167 -40.121 520 1HG ARG 67 1HG ARG 67 -15.367 -15.449 -40.710 521 2HG ARG 67 2HG ARG 67 -14.807 -13.773 -40.758 522 1HD ARG 67 1HD ARG 67 -13.244 -14.301 -42.478 523 2HD ARG 67 2HD ARG 67 -13.667 -16.010 -42.369 524 HE ARG 67 HE ARG 67 -15.928 -14.407 -42.903 525 1HH1 ARG 67 1HH1 ARG 67 -13.101 -15.855 -44.502 526 2HH1 ARG 67 2HH1 ARG 67 -13.849 -15.955 -46.020 527 1HH2 ARG 67 1HH2 ARG 67 -16.935 -14.558 -45.005 528 2HH2 ARG 67 2HH2 ARG 67 -16.066 -15.199 -46.327 529 H ASP 68 H ASP 68 -13.846 -17.441 -37.792 530 HA ASP 68 HA ASP 68 -16.699 -17.815 -38.165 531 1HB ASP 68 1HB ASP 68 -14.588 -19.844 -37.437 532 2HB ASP 68 2HB ASP 68 -16.245 -20.176 -37.891 533 H ARG 69 H ARG 69 -14.431 -17.218 -35.710 534 HA ARG 69 HA ARG 69 -16.380 -17.712 -33.810 535 1HB ARG 69 1HB ARG 69 -15.709 -20.016 -34.165 536 2HB ARG 69 2HB ARG 69 -14.062 -19.620 -33.707 537 1HG ARG 69 1HG ARG 69 -15.268 -20.729 -31.880 538 2HG ARG 69 2HG ARG 69 -14.790 -19.078 -31.456 539 1HD ARG 69 1HD ARG 69 -17.001 -18.262 -31.868 540 2HD ARG 69 2HD ARG 69 -17.517 -19.820 -32.499 541 HE ARG 69 HE ARG 69 -16.932 -20.591 -30.128 542 1HH1 ARG 69 1HH1 ARG 69 -18.247 -17.387 -30.867 543 2HH1 ARG 69 2HH1 ARG 69 -19.135 -17.253 -29.427 544 1HH2 ARG 69 1HH2 ARG 69 -18.207 -20.439 -28.163 545 2HH2 ARG 69 2HH2 ARG 69 -19.130 -19.040 -27.868 546 H ILE 70 H ILE 70 -16.085 -15.904 -32.732 547 HA ILE 70 HA ILE 70 -13.567 -15.024 -31.514 548 HB ILE 70 HB ILE 70 -16.411 -14.270 -30.883 549 1HG1 ILE 70 1HG1 ILE 70 -14.465 -12.805 -32.545 550 2HG1 ILE 70 2HG1 ILE 70 -15.801 -13.748 -33.240 551 1HG2 ILE 70 1HG2 ILE 70 -15.454 -12.236 -29.875 552 2HG2 ILE 70 2HG2 ILE 70 -13.836 -12.836 -30.239 553 3HG2 ILE 70 3HG2 ILE 70 -14.859 -13.707 -29.099 554 1HD1 ILE 70 1HD1 ILE 70 -15.991 -11.253 -31.526 555 2HD1 ILE 70 2HD1 ILE 70 -17.376 -12.184 -32.096 556 3HD1 ILE 70 3HD1 ILE 70 -16.331 -11.361 -33.252 557 H VAL 71 H VAL 71 -13.021 -15.484 -29.678 558 HA VAL 71 HA VAL 71 -14.885 -16.977 -27.983 559 HB VAL 71 HB VAL 71 -12.839 -18.130 -26.853 560 1HG1 VAL 71 1HG1 VAL 71 -12.921 -19.986 -28.428 561 2HG1 VAL 71 2HG1 VAL 71 -13.643 -18.932 -29.645 562 3HG1 VAL 71 3HG1 VAL 71 -14.539 -19.320 -28.174 563 1HG2 VAL 71 1HG2 VAL 71 -10.961 -18.583 -28.313 564 2HG2 VAL 71 2HG2 VAL 71 -11.107 -16.841 -28.054 565 3HG2 VAL 71 3HG2 VAL 71 -11.653 -17.560 -29.567 566 H LEU 72 H LEU 72 -12.631 -14.449 -28.143 567 HA LEU 72 HA LEU 72 -13.689 -13.606 -25.580 568 1HB LEU 72 1HB LEU 72 -10.680 -13.824 -25.931 569 2HB LEU 72 2HB LEU 72 -11.457 -12.974 -24.625 570 HG LEU 72 HG LEU 72 -12.476 -15.312 -24.067 571 1HD1 LEU 72 1HD1 LEU 72 -10.991 -17.178 -24.596 572 2HD1 LEU 72 2HD1 LEU 72 -10.081 -16.124 -25.686 573 3HD1 LEU 72 3HD1 LEU 72 -11.772 -16.492 -26.018 574 1HD2 LEU 72 1HD2 LEU 72 -10.986 -14.158 -22.591 575 2HD2 LEU 72 2HD2 LEU 72 -9.603 -14.608 -23.577 576 3HD2 LEU 72 3HD2 LEU 72 -10.487 -15.849 -22.690 577 H ASN 73 H ASN 73 -14.519 -11.616 -26.380 578 HA ASN 73 HA ASN 73 -12.481 -9.993 -27.748 579 1HB ASN 73 1HB ASN 73 -14.165 -8.767 -28.989 580 2HB ASN 73 2HB ASN 73 -14.478 -10.477 -29.186 581 1HD2 ASN 73 1HD2 ASN 73 -16.381 -11.325 -28.380 582 2HD2 ASN 73 2HD2 ASN 73 -17.641 -10.361 -27.744 583 H ASN 74 H ASN 74 -13.016 -10.239 -24.877 584 HA ASN 74 HA ASN 74 -13.039 -7.462 -24.224 585 1HB ASN 74 1HB ASN 74 -15.476 -8.198 -24.005 586 2HB ASN 74 2HB ASN 74 -14.938 -9.307 -22.754 587 1HD2 ASN 74 1HD2 ASN 74 -15.464 -6.010 -23.582 588 2HD2 ASN 74 2HD2 ASN 74 -15.282 -5.334 -22.009 589 H CYS 75 H CYS 75 -10.979 -7.936 -23.864 590 HA CYS 75 HA CYS 75 -10.397 -9.252 -21.397 591 1HB CYS 75 1HB CYS 75 -9.229 -9.932 -24.063 592 2HB CYS 75 2HB CYS 75 -8.287 -10.148 -22.584 593 H GLN 76 H GLN 76 -9.089 -8.131 -20.221 594 HA GLN 76 HA GLN 76 -7.584 -6.043 -21.320 595 1HB GLN 76 1HB GLN 76 -8.846 -4.644 -19.451 596 2HB GLN 76 2HB GLN 76 -9.438 -4.739 -21.122 597 1HG GLN 76 1HG GLN 76 -10.762 -6.542 -20.588 598 2HG GLN 76 2HG GLN 76 -10.187 -6.494 -18.904 599 1HE2 GLN 76 1HE2 GLN 76 -12.990 -6.201 -19.902 600 2HE2 GLN 76 2HE2 GLN 76 -13.526 -4.644 -19.391 601 H LEU 77 H LEU 77 -6.061 -6.482 -20.503 602 HA LEU 77 HA LEU 77 -5.675 -8.309 -18.337 603 1HB LEU 77 1HB LEU 77 -4.504 -8.770 -20.298 604 2HB LEU 77 2HB LEU 77 -3.901 -7.140 -20.423 605 HG LEU 77 HG LEU 77 -2.344 -7.652 -18.479 606 1HD1 LEU 77 1HD1 LEU 77 -3.602 -9.373 -17.441 607 2HD1 LEU 77 2HD1 LEU 77 -1.978 -9.916 -17.878 608 3HD1 LEU 77 3HD1 LEU 77 -3.370 -10.417 -18.840 609 1HD2 LEU 77 1HD2 LEU 77 -2.207 -9.365 -20.944 610 2HD2 LEU 77 2HD2 LEU 77 -0.874 -9.063 -19.843 611 3HD2 LEU 77 3HD2 LEU 77 -1.572 -7.729 -20.764 612 H GLN 78 H GLN 78 -4.511 -7.813 -16.331 613 HA GLN 78 HA GLN 78 -3.915 -4.979 -15.926 614 1HB GLN 78 1HB GLN 78 -3.649 -7.339 -14.049 615 2HB GLN 78 2HB GLN 78 -3.207 -5.699 -13.616 616 1HG GLN 78 1HG GLN 78 -5.535 -5.008 -13.930 617 2HG GLN 78 2HG GLN 78 -5.958 -6.671 -14.341 618 1HE2 GLN 78 1HE2 GLN 78 -5.959 -8.221 -12.740 619 2HE2 GLN 78 2HE2 GLN 78 -5.969 -7.840 -11.063 620 H ASN 79 H ASN 79 -2.052 -8.013 -15.447 621 HA ASN 79 HA ASN 79 0.248 -6.980 -16.729 622 1HB ASN 79 1HB ASN 79 0.582 -5.932 -14.527 623 2HB ASN 79 2HB ASN 79 0.197 -7.446 -13.721 624 1HD2 ASN 79 1HD2 ASN 79 2.136 -7.549 -12.665 625 2HD2 ASN 79 2HD2 ASN 79 3.632 -7.883 -13.443 626 HA PRO 80 HA PRO 80 -0.219 -11.247 -16.872 627 1HB PRO 80 1HB PRO 80 1.366 -11.901 -18.947 628 2HB PRO 80 2HB PRO 80 -0.168 -11.039 -19.148 629 1HG PRO 80 1HG PRO 80 2.624 -9.950 -19.094 630 2HG PRO 80 2HG PRO 80 1.280 -9.514 -20.163 631 1HD PRO 80 1HD PRO 80 2.003 -8.083 -17.905 632 2HD PRO 80 2HD PRO 80 0.383 -8.079 -18.645 633 H GLN 81 H GLN 81 2.737 -9.638 -16.041 634 HA GLN 81 HA GLN 81 4.094 -12.115 -15.810 635 1HB GLN 81 1HB GLN 81 5.156 -10.554 -17.214 636 2HB GLN 81 2HB GLN 81 5.126 -9.341 -15.920 637 1HG GLN 81 1HG GLN 81 6.590 -10.543 -14.632 638 2HG GLN 81 2HG GLN 81 6.499 -11.968 -15.682 639 1HE2 GLN 81 1HE2 GLN 81 7.469 -11.876 -17.664 640 2HE2 GLN 81 2HE2 GLN 81 8.771 -10.789 -18.050 641 H ARG 82 H ARG 82 2.909 -12.507 -14.127 642 HA ARG 82 HA ARG 82 2.262 -12.426 -11.796 643 1HB ARG 82 1HB ARG 82 4.976 -13.658 -12.147 644 2HB ARG 82 2HB ARG 82 4.062 -13.799 -10.654 645 1HG ARG 82 1HG ARG 82 3.015 -14.660 -13.337 646 2HG ARG 82 2HG ARG 82 3.860 -15.733 -12.221 647 1HD ARG 82 1HD ARG 82 2.177 -15.477 -10.564 648 2HD ARG 82 2HD ARG 82 1.379 -14.186 -11.454 649 HE ARG 82 HE ARG 82 0.903 -15.859 -13.158 650 1HH1 ARG 82 1HH1 ARG 82 1.461 -16.925 -9.826 651 2HH1 ARG 82 2HH1 ARG 82 0.463 -18.291 -9.904 652 1HH2 ARG 82 1HH2 ARG 82 -0.525 -17.781 -13.293 653 2HH2 ARG 82 2HH2 ARG 82 -0.672 -18.806 -11.955 Start of MODEL 9 1 H MET 1 H MET 1 11.816 -21.722 -15.647 2 HA MET 1 HA MET 1 10.898 -19.631 -15.272 3 1HB MET 1 1HB MET 1 10.298 -18.116 -17.037 4 2HB MET 1 2HB MET 1 11.975 -18.540 -17.320 5 1HG MET 1 1HG MET 1 9.602 -19.712 -18.784 6 2HG MET 1 2HG MET 1 10.630 -18.423 -19.390 7 1HE MET 1 1HE MET 1 13.099 -18.749 -20.195 8 2HE MET 1 2HE MET 1 13.990 -20.266 -20.086 9 3HE MET 1 3HE MET 1 13.573 -19.386 -18.617 10 H GLN 2 H GLN 2 8.548 -19.499 -15.270 11 HA GLN 2 HA GLN 2 7.326 -22.006 -16.050 12 1HB GLN 2 1HB GLN 2 5.904 -19.544 -15.017 13 2HB GLN 2 2HB GLN 2 5.365 -21.210 -14.932 14 1HG GLN 2 1HG GLN 2 7.180 -21.699 -13.363 15 2HG GLN 2 2HG GLN 2 7.656 -20.002 -13.408 16 1HE2 GLN 2 1HE2 GLN 2 6.221 -18.462 -12.540 17 2HE2 GLN 2 2HE2 GLN 2 5.044 -18.896 -11.366 18 H THR 3 H THR 3 5.071 -21.674 -17.227 19 HA THR 3 HA THR 3 5.661 -20.153 -19.613 20 HB THR 3 HB THR 3 2.915 -21.267 -19.080 21 HG1 THR 3 HG1 THR 3 5.010 -22.781 -18.693 22 1HG2 THR 3 1HG2 THR 3 3.170 -21.865 -21.480 23 2HG2 THR 3 2HG2 THR 3 4.748 -21.087 -21.452 24 3HG2 THR 3 3HG2 THR 3 3.290 -20.137 -21.152 25 H ASP 4 H ASP 4 5.150 -18.141 -19.917 26 HA ASP 4 HA ASP 4 4.355 -16.491 -17.735 27 1HB ASP 4 1HB ASP 4 5.995 -16.088 -19.621 28 2HB ASP 4 2HB ASP 4 4.619 -15.816 -20.657 29 H THR 5 H THR 5 2.391 -14.958 -17.827 30 HA THR 5 HA THR 5 0.202 -16.074 -19.374 31 HB THR 5 HB THR 5 0.287 -16.405 -16.376 32 HG1 THR 5 HG1 THR 5 0.862 -17.956 -18.474 33 1HG2 THR 5 1HG2 THR 5 -1.947 -17.080 -18.292 34 2HG2 THR 5 2HG2 THR 5 -1.978 -15.790 -17.092 35 3HG2 THR 5 3HG2 THR 5 -1.912 -17.475 -16.572 36 H LEU 6 H LEU 6 -1.657 -14.751 -19.500 37 HA LEU 6 HA LEU 6 -1.254 -12.109 -18.722 38 1HB LEU 6 1HB LEU 6 -3.166 -13.616 -20.405 39 2HB LEU 6 2HB LEU 6 -3.689 -12.048 -19.838 40 HG LEU 6 HG LEU 6 -1.508 -11.194 -20.658 41 1HD1 LEU 6 1HD1 LEU 6 -0.272 -13.169 -20.970 42 2HD1 LEU 6 2HD1 LEU 6 -0.324 -12.174 -22.408 43 3HD1 LEU 6 3HD1 LEU 6 -1.311 -13.636 -22.336 44 1HD2 LEU 6 1HD2 LEU 6 -2.296 -10.891 -22.984 45 2HD2 LEU 6 2HD2 LEU 6 -3.525 -10.577 -21.765 46 3HD2 LEU 6 3HD2 LEU 6 -3.550 -12.093 -22.675 47 H GLU 7 H GLU 7 -4.133 -11.452 -18.211 48 HA GLU 7 HA GLU 7 -3.666 -11.427 -15.437 49 1HB GLU 7 1HB GLU 7 -4.476 -9.483 -16.701 50 2HB GLU 7 2HB GLU 7 -5.956 -10.351 -17.070 51 1HG GLU 7 1HG GLU 7 -6.504 -10.477 -14.746 52 2HG GLU 7 2HG GLU 7 -4.995 -9.678 -14.327 53 H TYR 8 H TYR 8 -5.246 -13.419 -17.675 54 HA TYR 8 HA TYR 8 -6.781 -14.730 -17.857 55 1HB TYR 8 1HB TYR 8 -6.856 -16.671 -16.318 56 2HB TYR 8 2HB TYR 8 -5.235 -16.151 -16.712 57 HD1 TYR 8 HD1 TYR 8 -3.730 -15.377 -14.975 58 HD2 TYR 8 HD2 TYR 8 -7.763 -16.374 -14.061 59 HE1 TYR 8 HE1 TYR 8 -3.184 -15.389 -12.579 60 HE2 TYR 8 HE2 TYR 8 -7.230 -16.376 -11.672 61 HH TYR 8 HH TYR 8 -4.567 -15.003 -10.439 62 H GLN 9 H GLN 9 -7.812 -12.286 -16.806 63 HA GLN 9 HA GLN 9 -10.194 -13.225 -15.524 64 1HB GLN 9 1HB GLN 9 -8.440 -11.001 -14.504 65 2HB GLN 9 2HB GLN 9 -10.122 -11.203 -14.036 66 1HG GLN 9 1HG GLN 9 -9.718 -13.264 -13.061 67 2HG GLN 9 2HG GLN 9 -8.101 -13.365 -13.745 68 1HE2 GLN 9 1HE2 GLN 9 -6.461 -12.149 -12.863 69 2HE2 GLN 9 2HE2 GLN 9 -6.547 -11.431 -11.290 70 H CYS 10 H CYS 10 -11.317 -12.918 -17.159 71 HA CYS 10 HA CYS 10 -11.721 -10.197 -17.983 72 1HB CYS 10 1HB CYS 10 -11.397 -12.573 -19.843 73 2HB CYS 10 2HB CYS 10 -11.943 -10.947 -20.357 74 H ASP 11 H ASP 11 -13.934 -9.853 -18.339 75 HA ASP 11 HA ASP 11 -15.549 -11.415 -16.673 76 1HB ASP 11 1HB ASP 11 -15.881 -8.986 -17.156 77 2HB ASP 11 2HB ASP 11 -16.557 -9.442 -18.718 78 H GLU 12 H GLU 12 -15.004 -11.702 -20.060 79 HA GLU 12 HA GLU 12 -17.330 -13.371 -20.460 80 1HB GLU 12 1HB GLU 12 -15.063 -12.685 -22.306 81 2HB GLU 12 2HB GLU 12 -16.496 -13.594 -22.760 82 1HG GLU 12 1HG GLU 12 -16.415 -10.816 -21.740 83 2HG GLU 12 2HG GLU 12 -16.542 -11.241 -23.456 84 H LYS 13 H LYS 13 -13.813 -13.732 -20.325 85 HA LYS 13 HA LYS 13 -14.146 -16.649 -20.155 86 1HB LYS 13 1HB LYS 13 -12.118 -15.362 -21.970 87 2HB LYS 13 2HB LYS 13 -12.536 -17.051 -21.850 88 1HG LYS 13 1HG LYS 13 -14.725 -15.292 -22.655 89 2HG LYS 13 2HG LYS 13 -13.397 -15.324 -23.782 90 1HD LYS 13 1HD LYS 13 -15.067 -17.051 -24.371 91 2HD LYS 13 2HD LYS 13 -13.544 -17.792 -23.908 92 1HE LYS 13 1HE LYS 13 -14.455 -18.265 -21.679 93 2HE LYS 13 2HE LYS 13 -15.985 -17.516 -22.153 94 1HZ LYS 13 1HZ LYS 13 -14.765 -19.834 -23.520 95 2HZ LYS 13 2HZ LYS 13 -16.307 -19.223 -23.794 96 3HZ LYS 13 3HZ LYS 13 -15.960 -20.005 -22.347 97 HA PRO 14 HA PRO 14 -10.684 -15.543 -17.587 98 1HB PRO 14 1HB PRO 14 -10.051 -18.409 -17.313 99 2HB PRO 14 2HB PRO 14 -10.547 -17.282 -16.049 100 1HG PRO 14 1HG PRO 14 -12.153 -19.279 -16.982 101 2HG PRO 14 2HG PRO 14 -12.771 -17.757 -16.318 102 1HD PRO 14 1HD PRO 14 -12.495 -18.605 -19.173 103 2HD PRO 14 2HD PRO 14 -13.776 -17.652 -18.390 104 H LEU 15 H LEU 15 -8.620 -15.094 -18.538 105 HA LEU 15 HA LEU 15 -8.159 -16.579 -20.973 106 1HB LEU 15 1HB LEU 15 -8.930 -14.314 -21.440 107 2HB LEU 15 2HB LEU 15 -7.649 -13.663 -20.435 108 HG LEU 15 HG LEU 15 -5.982 -14.497 -21.961 109 1HD1 LEU 15 1HD1 LEU 15 -8.322 -15.447 -23.630 110 2HD1 LEU 15 2HD1 LEU 15 -7.134 -16.465 -22.815 111 3HD1 LEU 15 3HD1 LEU 15 -6.638 -15.434 -24.154 112 1HD2 LEU 15 1HD2 LEU 15 -8.125 -12.884 -23.339 113 2HD2 LEU 15 2HD2 LEU 15 -6.445 -13.002 -23.860 114 3HD2 LEU 15 3HD2 LEU 15 -6.837 -12.257 -22.311 115 H THR 16 H THR 16 -7.026 -17.931 -19.621 116 HA THR 16 HA THR 16 -4.600 -16.907 -18.530 117 HB THR 16 HB THR 16 -5.271 -19.844 -18.735 118 HG1 THR 16 HG1 THR 16 -6.309 -18.869 -16.479 119 1HG2 THR 16 1HG2 THR 16 -4.113 -18.078 -16.599 120 2HG2 THR 16 2HG2 THR 16 -3.181 -19.118 -17.680 121 3HG2 THR 16 3HG2 THR 16 -4.263 -19.837 -16.476 122 H VAL 17 H VAL 17 -3.261 -16.404 -20.073 123 HA VAL 17 HA VAL 17 -3.049 -17.958 -22.535 124 HB VAL 17 HB VAL 17 -1.758 -15.384 -21.646 125 1HG1 VAL 17 1HG1 VAL 17 -0.409 -16.715 -23.360 126 2HG1 VAL 17 2HG1 VAL 17 -0.943 -15.134 -23.897 127 3HG1 VAL 17 3HG1 VAL 17 -1.830 -16.564 -24.402 128 1HG2 VAL 17 1HG2 VAL 17 -3.257 -14.329 -23.286 129 2HG2 VAL 17 2HG2 VAL 17 -4.117 -15.148 -21.977 130 3HG2 VAL 17 3HG2 VAL 17 -4.013 -15.900 -23.568 131 H LYS 18 H LYS 18 -1.386 -19.348 -22.817 132 HA LYS 18 HA LYS 18 0.635 -19.201 -20.778 133 1HB LYS 18 1HB LYS 18 -0.254 -21.473 -22.539 134 2HB LYS 18 2HB LYS 18 1.317 -21.513 -21.768 135 1HG LYS 18 1HG LYS 18 -0.160 -22.776 -20.397 136 2HG LYS 18 2HG LYS 18 0.136 -21.252 -19.568 137 1HD LYS 18 1HD LYS 18 -1.942 -20.375 -20.380 138 2HD LYS 18 2HD LYS 18 -2.274 -21.874 -21.253 139 1HE LYS 18 1HE LYS 18 -2.064 -21.498 -18.261 140 2HE LYS 18 2HE LYS 18 -3.533 -21.829 -19.170 141 1HZ LYS 18 1HZ LYS 18 -2.477 -23.996 -19.819 142 2HZ LYS 18 2HZ LYS 18 -2.833 -23.837 -18.185 143 3HZ LYS 18 3HZ LYS 18 -1.245 -23.654 -18.707 144 H LEU 19 H LEU 19 1.707 -17.576 -21.517 145 HA LEU 19 HA LEU 19 2.679 -17.341 -24.178 146 1HB LEU 19 1HB LEU 19 2.940 -15.904 -21.641 147 2HB LEU 19 2HB LEU 19 4.323 -15.772 -22.728 148 HG LEU 19 HG LEU 19 1.496 -15.055 -23.545 149 1HD1 LEU 19 1HD1 LEU 19 2.225 -13.683 -21.620 150 2HD1 LEU 19 2HD1 LEU 19 2.137 -12.737 -23.109 151 3HD1 LEU 19 3HD1 LEU 19 3.699 -13.276 -22.494 152 1HD2 LEU 19 1HD2 LEU 19 3.118 -15.516 -25.339 153 2HD2 LEU 19 2HD2 LEU 19 4.214 -14.333 -24.632 154 3HD2 LEU 19 3HD2 LEU 19 2.659 -13.815 -25.281 155 H ASN 20 H ASN 20 3.584 -19.091 -24.624 156 HA ASN 20 HA ASN 20 5.744 -20.179 -23.042 157 1HB ASN 20 1HB ASN 20 4.235 -21.615 -24.506 158 2HB ASN 20 2HB ASN 20 5.038 -20.915 -25.902 159 1HD2 ASN 20 1HD2 ASN 20 4.899 -23.679 -25.024 160 2HD2 ASN 20 2HD2 ASN 20 6.517 -24.209 -24.817 161 H ASN 21 H ASN 21 7.061 -18.582 -22.835 162 HA ASN 21 HA ASN 21 7.807 -16.554 -24.417 163 1HB ASN 21 1HB ASN 21 8.320 -16.792 -22.019 164 2HB ASN 21 2HB ASN 21 9.610 -17.905 -22.414 165 1HD2 ASN 21 1HD2 ASN 21 9.659 -15.391 -20.972 166 2HD2 ASN 21 2HD2 ASN 21 10.768 -14.368 -21.778 167 HA PRO 22 HA PRO 22 11.705 -18.543 -26.376 168 1HB PRO 22 1HB PRO 22 11.419 -21.458 -26.148 169 2HB PRO 22 2HB PRO 22 12.806 -20.445 -25.749 170 1HG PRO 22 1HG PRO 22 11.349 -21.647 -23.845 171 2HG PRO 22 2HG PRO 22 12.061 -20.042 -23.601 172 1HD PRO 22 1HD PRO 22 9.257 -20.786 -24.338 173 2HD PRO 22 2HD PRO 22 9.815 -19.617 -23.127 174 H ARG 23 H ARG 23 8.623 -19.967 -26.548 175 HA ARG 23 HA ARG 23 8.941 -20.922 -29.318 176 1HB ARG 23 1HB ARG 23 6.683 -21.167 -27.343 177 2HB ARG 23 2HB ARG 23 6.619 -21.785 -28.987 178 1HG ARG 23 1HG ARG 23 8.793 -22.623 -27.118 179 2HG ARG 23 2HG ARG 23 7.205 -23.385 -27.057 180 1HD ARG 23 1HD ARG 23 8.847 -23.163 -29.561 181 2HD ARG 23 2HD ARG 23 8.916 -24.557 -28.477 182 HE ARG 23 HE ARG 23 6.252 -23.855 -29.361 183 1HH1 ARG 23 1HH1 ARG 23 9.135 -25.645 -30.302 184 2HH1 ARG 23 2HH1 ARG 23 8.276 -26.881 -31.080 185 1HH2 ARG 23 1HH2 ARG 23 5.088 -25.508 -30.400 186 2HH2 ARG 23 2HH2 ARG 23 5.886 -26.811 -31.147 187 H GLN 24 H GLN 24 7.593 -18.331 -27.498 188 HA GLN 24 HA GLN 24 6.323 -16.596 -27.849 189 1HB GLN 24 1HB GLN 24 7.401 -16.979 -30.578 190 2HB GLN 24 2HB GLN 24 6.353 -15.595 -30.210 191 1HG GLN 24 1HG GLN 24 8.078 -15.128 -28.349 192 2HG GLN 24 2HG GLN 24 9.118 -16.240 -29.240 193 1HE2 GLN 24 1HE2 GLN 24 7.527 -13.194 -29.255 194 2HE2 GLN 24 2HE2 GLN 24 8.382 -12.512 -30.587 195 H GLU 25 H GLU 25 5.176 -19.201 -28.034 196 HA GLU 25 HA GLU 25 2.807 -18.479 -29.568 197 1HB GLU 25 1HB GLU 25 2.289 -20.786 -29.868 198 2HB GLU 25 2HB GLU 25 3.986 -20.613 -30.287 199 1HG GLU 25 1HG GLU 25 4.562 -21.445 -28.009 200 2HG GLU 25 2HG GLU 25 2.814 -21.672 -27.781 201 H VAL 26 H VAL 26 0.847 -19.158 -28.552 202 HA VAL 26 HA VAL 26 0.965 -19.192 -25.588 203 HB VAL 26 HB VAL 26 -0.869 -17.707 -25.508 204 1HG1 VAL 26 1HG1 VAL 26 1.274 -16.677 -25.360 205 2HG1 VAL 26 2HG1 VAL 26 0.223 -15.601 -26.281 206 3HG1 VAL 26 3HG1 VAL 26 1.417 -16.601 -27.113 207 1HG2 VAL 26 1HG2 VAL 26 -1.996 -18.125 -27.607 208 2HG2 VAL 26 2HG2 VAL 26 -0.649 -17.424 -28.500 209 3HG2 VAL 26 3HG2 VAL 26 -1.650 -16.398 -27.472 210 H SER 27 H SER 27 -0.171 -20.651 -24.715 211 HA SER 27 HA SER 27 -2.316 -21.768 -26.344 212 1HB SER 27 1HB SER 27 -0.962 -22.921 -23.880 213 2HB SER 27 2HB SER 27 -2.387 -23.588 -24.692 214 HG SER 27 HG SER 27 0.301 -23.532 -25.589 215 H PHE 28 H PHE 28 -4.164 -21.001 -25.949 216 HA PHE 28 HA PHE 28 -4.564 -19.808 -23.292 217 1HB PHE 28 1HB PHE 28 -5.735 -17.995 -24.113 218 2HB PHE 28 2HB PHE 28 -4.557 -18.247 -25.382 219 HD1 PHE 28 HD1 PHE 28 -5.401 -19.659 -27.429 220 HD2 PHE 28 HD2 PHE 28 -7.973 -17.792 -24.621 221 HE1 PHE 28 HE1 PHE 28 -7.235 -19.675 -29.081 222 HE2 PHE 28 HE2 PHE 28 -9.802 -17.818 -26.249 223 HZ PHE 28 HZ PHE 28 -9.434 -18.757 -28.491 224 H VAL 29 H VAL 29 -6.996 -19.496 -23.017 225 HA VAL 29 HA VAL 29 -8.076 -22.220 -23.086 226 HB VAL 29 HB VAL 29 -9.216 -20.166 -21.313 227 1HG1 VAL 29 1HG1 VAL 29 -9.480 -21.988 -19.731 228 2HG1 VAL 29 2HG1 VAL 29 -8.719 -23.071 -20.896 229 3HG1 VAL 29 3HG1 VAL 29 -10.240 -22.272 -21.295 230 1HG2 VAL 29 1HG2 VAL 29 -6.548 -21.399 -20.629 231 2HG2 VAL 29 2HG2 VAL 29 -7.590 -20.525 -19.497 232 3HG2 VAL 29 3HG2 VAL 29 -6.916 -19.688 -20.883 233 H TYR 30 H TYR 30 -9.460 -22.235 -24.728 234 HA TYR 30 HA TYR 30 -11.146 -20.040 -25.595 235 1HB TYR 30 1HB TYR 30 -10.856 -21.854 -27.177 236 2HB TYR 30 2HB TYR 30 -11.454 -23.034 -26.016 237 HD1 TYR 30 HD1 TYR 30 -13.629 -23.749 -26.253 238 HD2 TYR 30 HD2 TYR 30 -12.591 -19.908 -27.734 239 HE1 TYR 30 HE1 TYR 30 -15.909 -23.470 -27.101 240 HE2 TYR 30 HE2 TYR 30 -14.882 -19.629 -28.606 241 HH TYR 30 HH TYR 30 -17.393 -21.760 -27.714 242 H ASP 31 H ASP 31 -11.589 -22.703 -23.429 243 HA ASP 31 HA ASP 31 -13.395 -21.201 -21.862 244 1HB ASP 31 1HB ASP 31 -14.908 -21.971 -23.661 245 2HB ASP 31 2HB ASP 31 -14.541 -23.639 -23.236 246 H ASN 32 H ASN 32 -12.757 -24.609 -22.632 247 HA ASN 32 HA ASN 32 -11.327 -24.853 -20.111 248 1HB ASN 32 1HB ASN 32 -13.730 -25.488 -19.672 249 2HB ASN 32 2HB ASN 32 -13.563 -26.750 -20.884 250 1HD2 ASN 32 1HD2 ASN 32 -13.930 -28.395 -19.492 251 2HD2 ASN 32 2HD2 ASN 32 -12.844 -28.878 -18.240 252 H GLN 33 H GLN 33 -10.328 -24.658 -22.659 253 HA GLN 33 HA GLN 33 -9.003 -27.156 -22.986 254 1HB GLN 33 1HB GLN 33 -9.464 -27.362 -25.345 255 2HB GLN 33 2HB GLN 33 -11.017 -27.339 -24.523 256 1HG GLN 33 1HG GLN 33 -11.372 -25.065 -25.121 257 2HG GLN 33 2HG GLN 33 -9.717 -24.974 -25.740 258 1HE2 GLN 33 1HE2 GLN 33 -12.912 -26.242 -26.329 259 2HE2 GLN 33 2HE2 GLN 33 -12.659 -26.617 -27.991 260 H LEU 34 H LEU 34 -7.166 -26.803 -24.175 261 HA LEU 34 HA LEU 34 -6.510 -24.005 -24.117 262 1HB LEU 34 1HB LEU 34 -4.810 -26.370 -23.453 263 2HB LEU 34 2HB LEU 34 -4.129 -24.770 -23.769 264 HG LEU 34 HG LEU 34 -4.145 -25.102 -21.414 265 1HD1 LEU 34 1HD1 LEU 34 -5.560 -23.352 -20.547 266 2HD1 LEU 34 2HD1 LEU 34 -6.488 -23.321 -22.031 267 3HD1 LEU 34 3HD1 LEU 34 -4.784 -22.873 -22.052 268 1HD2 LEU 34 1HD2 LEU 34 -6.149 -25.665 -20.110 269 2HD2 LEU 34 2HD2 LEU 34 -5.704 -26.950 -21.234 270 3HD2 LEU 34 3HD2 LEU 34 -7.051 -25.874 -21.610 271 H LEU 35 H LEU 35 -6.009 -23.261 -25.960 272 HA LEU 35 HA LEU 35 -4.965 -25.021 -28.051 273 1HB LEU 35 1HB LEU 35 -6.301 -23.914 -29.795 274 2HB LEU 35 2HB LEU 35 -7.301 -24.723 -28.616 275 HG LEU 35 HG LEU 35 -6.856 -21.733 -28.657 276 1HD1 LEU 35 1HD1 LEU 35 -9.078 -21.632 -29.661 277 2HD1 LEU 35 2HD1 LEU 35 -9.096 -23.395 -29.779 278 3HD1 LEU 35 3HD1 LEU 35 -7.920 -22.459 -30.700 279 1HD2 LEU 35 1HD2 LEU 35 -8.831 -21.665 -27.263 280 2HD2 LEU 35 2HD2 LEU 35 -7.609 -22.662 -26.488 281 3HD2 LEU 35 3HD2 LEU 35 -8.972 -23.419 -27.315 282 H HIS 36 H HIS 36 -3.743 -23.848 -29.782 283 HA HIS 36 HA HIS 36 -2.245 -21.831 -28.329 284 1HB HIS 36 1HB HIS 36 -0.280 -22.724 -29.281 285 2HB HIS 36 2HB HIS 36 -1.226 -24.026 -28.556 286 HD2 HIS 36 HD2 HIS 36 0.150 -22.938 -32.005 287 HE1 HIS 36 HE1 HIS 36 -2.233 -26.364 -32.665 288 HE2 HIS 36 HE2 HIS 36 -1.153 -24.314 -33.686 289 H LEU 37 H LEU 37 -1.191 -20.346 -29.439 290 HA LEU 37 HA LEU 37 -1.653 -19.839 -32.327 291 1HB LEU 37 1HB LEU 37 -1.974 -17.605 -30.357 292 2HB LEU 37 2HB LEU 37 -2.218 -17.559 -32.060 293 HG LEU 37 HG LEU 37 -4.045 -19.372 -31.513 294 1HD1 LEU 37 1HD1 LEU 37 -3.630 -19.505 -29.164 295 2HD1 LEU 37 2HD1 LEU 37 -5.244 -18.851 -29.449 296 3HD1 LEU 37 3HD1 LEU 37 -3.927 -17.777 -28.976 297 1HD2 LEU 37 1HD2 LEU 37 -4.359 -16.411 -31.279 298 2HD2 LEU 37 2HD2 LEU 37 -5.721 -17.531 -31.266 299 3HD2 LEU 37 3HD2 LEU 37 -4.663 -17.466 -32.671 300 H LYS 38 H LYS 38 -0.127 -18.453 -33.223 301 HA LYS 38 HA LYS 38 2.251 -18.293 -31.503 302 1HB LYS 38 1HB LYS 38 3.622 -18.547 -33.443 303 2HB LYS 38 2HB LYS 38 2.389 -19.816 -33.373 304 1HG LYS 38 1HG LYS 38 1.239 -19.026 -35.190 305 2HG LYS 38 2HG LYS 38 1.851 -17.383 -34.995 306 1HD LYS 38 1HD LYS 38 4.023 -18.100 -35.673 307 2HD LYS 38 2HD LYS 38 3.461 -19.758 -35.915 308 1HE LYS 38 1HE LYS 38 1.846 -18.945 -37.608 309 2HE LYS 38 2HE LYS 38 2.442 -17.304 -37.378 310 1HZ LYS 38 1HZ LYS 38 3.409 -18.279 -39.328 311 2HZ LYS 38 2HZ LYS 38 3.993 -19.596 -38.466 312 3HZ LYS 38 3HZ LYS 38 4.616 -18.061 -38.191 313 H GLN 39 H GLN 39 3.500 -16.442 -31.579 314 HA GLN 39 HA GLN 39 2.106 -14.089 -32.590 315 1HB GLN 39 1HB GLN 39 3.144 -14.374 -30.191 316 2HB GLN 39 2HB GLN 39 4.661 -14.021 -31.021 317 1HG GLN 39 1HG GLN 39 2.227 -12.256 -30.816 318 2HG GLN 39 2HG GLN 39 3.752 -12.032 -29.972 319 1HE2 GLN 39 1HE2 GLN 39 5.501 -11.228 -31.135 320 2HE2 GLN 39 2HE2 GLN 39 5.307 -10.457 -32.666 321 H GLY 40 H GLY 40 2.679 -13.476 -34.424 322 1HA GLY 40 1HA GLY 40 5.400 -13.045 -35.204 323 2HA GLY 40 2HA GLY 40 4.786 -14.487 -36.002 324 H ILE 41 H ILE 41 2.066 -13.221 -36.067 325 HA ILE 41 HA ILE 41 2.439 -11.921 -38.595 326 HB ILE 41 HB ILE 41 1.024 -13.878 -38.244 327 1HG1 ILE 41 1HG1 ILE 41 -0.549 -11.432 -38.995 328 2HG1 ILE 41 2HG1 ILE 41 0.515 -12.360 -40.061 329 1HG2 ILE 41 1HG2 ILE 41 0.243 -13.587 -36.012 330 2HG2 ILE 41 2HG2 ILE 41 -1.160 -13.655 -37.089 331 3HG2 ILE 41 3HG2 ILE 41 -0.612 -12.107 -36.456 332 1HD1 ILE 41 1HD1 ILE 41 -1.849 -12.904 -40.441 333 2HD1 ILE 41 2HD1 ILE 41 -1.977 -13.393 -38.745 334 3HD1 ILE 41 3HD1 ILE 41 -0.932 -14.292 -39.841 335 H SER 42 H SER 42 3.164 -10.521 -36.250 336 HA SER 42 HA SER 42 1.138 -8.701 -35.452 337 1HB SER 42 1HB SER 42 3.180 -7.649 -34.303 338 2HB SER 42 2HB SER 42 2.658 -9.269 -33.810 339 HG SER 42 HG SER 42 4.988 -8.485 -35.046 340 H ALA 43 H ALA 43 0.646 -7.902 -37.722 341 HA ALA 43 HA ALA 43 2.449 -6.229 -38.917 342 1HB ALA 43 1HB ALA 43 0.562 -5.325 -40.206 343 2HB ALA 43 2HB ALA 43 -0.559 -6.077 -39.087 344 3HB ALA 43 3HB ALA 43 0.476 -7.084 -40.108 345 H SER 44 H SER 44 0.159 -5.875 -36.369 346 HA SER 44 HA SER 44 1.362 -3.383 -35.554 347 1HB SER 44 1HB SER 44 -1.652 -3.776 -35.690 348 2HB SER 44 2HB SER 44 -0.803 -2.324 -35.160 349 HG SER 44 HG SER 44 0.140 -2.851 -37.517 350 H GLY 45 H GLY 45 1.151 -3.184 -33.215 351 1HA GLY 45 1HA GLY 45 1.061 -3.995 -31.065 352 2HA GLY 45 2HA GLY 45 -0.312 -4.960 -31.562 353 H ALA 46 H ALA 46 0.008 -7.052 -31.089 354 HA ALA 46 HA ALA 46 2.310 -8.375 -32.054 355 1HB ALA 46 1HB ALA 46 2.523 -9.530 -29.824 356 2HB ALA 46 2HB ALA 46 1.460 -8.283 -29.153 357 3HB ALA 46 3HB ALA 46 3.033 -7.839 -29.801 358 H ARG 47 H ARG 47 1.455 -10.289 -32.829 359 HA ARG 47 HA ARG 47 -1.245 -10.547 -32.024 360 1HB ARG 47 1HB ARG 47 -0.191 -10.602 -34.795 361 2HB ARG 47 2HB ARG 47 -1.671 -11.462 -34.416 362 1HG ARG 47 1HG ARG 47 -2.634 -9.354 -33.577 363 2HG ARG 47 2HG ARG 47 -1.162 -8.517 -34.088 364 1HD ARG 47 1HD ARG 47 -2.993 -8.404 -35.750 365 2HD ARG 47 2HD ARG 47 -1.510 -9.161 -36.353 366 HE ARG 47 HE ARG 47 -3.406 -11.025 -35.285 367 1HH1 ARG 47 1HH1 ARG 47 -2.529 -9.246 -38.181 368 2HH1 ARG 47 2HH1 ARG 47 -3.118 -10.391 -39.283 369 1HH2 ARG 47 1HH2 ARG 47 -4.212 -12.667 -36.770 370 2HH2 ARG 47 2HH2 ARG 47 -4.133 -12.395 -38.449 371 H TYR 48 H TYR 48 -1.561 -12.575 -31.144 372 HA TYR 48 HA TYR 48 0.111 -14.826 -31.931 373 1HB TYR 48 1HB TYR 48 -2.062 -14.829 -29.818 374 2HB TYR 48 2HB TYR 48 -0.643 -15.848 -29.990 375 HD1 TYR 48 HD1 TYR 48 -1.917 -12.725 -28.637 376 HD2 TYR 48 HD2 TYR 48 1.552 -15.068 -29.281 377 HE1 TYR 48 HE1 TYR 48 -0.708 -11.350 -27.005 378 HE2 TYR 48 HE2 TYR 48 2.787 -13.687 -27.649 379 HH TYR 48 HH TYR 48 1.255 -11.583 -25.517 380 H THR 49 H THR 49 -0.705 -15.831 -33.617 381 HA THR 49 HA THR 49 -3.541 -16.265 -33.648 382 HB THR 49 HB THR 49 -2.075 -14.921 -35.904 383 HG1 THR 49 HG1 THR 49 -3.279 -13.958 -33.868 384 1HG2 THR 49 1HG2 THR 49 -4.221 -14.900 -37.132 385 2HG2 THR 49 2HG2 THR 49 -4.948 -15.866 -35.842 386 3HG2 THR 49 3HG2 THR 49 -3.662 -16.546 -36.833 387 H ASP 50 H ASP 50 -3.954 -18.308 -34.451 388 HA ASP 50 HA ASP 50 -2.188 -19.441 -36.375 389 1HB ASP 50 1HB ASP 50 -1.052 -20.148 -34.262 390 2HB ASP 50 2HB ASP 50 -2.524 -21.007 -33.790 391 H GLY 51 H GLY 51 -4.288 -18.854 -37.246 392 1HA GLY 51 1HA GLY 51 -5.977 -19.644 -38.575 393 2HA GLY 51 2HA GLY 51 -5.574 -21.254 -38.037 394 H ILE 52 H ILE 52 -6.186 -20.602 -35.236 395 HA ILE 52 HA ILE 52 -8.998 -21.238 -35.538 396 HB ILE 52 HB ILE 52 -7.486 -21.271 -32.907 397 1HG1 ILE 52 1HG1 ILE 52 -7.819 -23.540 -34.900 398 2HG1 ILE 52 2HG1 ILE 52 -6.322 -22.652 -34.649 399 1HG2 ILE 52 1HG2 ILE 52 -9.229 -22.939 -32.339 400 2HG2 ILE 52 2HG2 ILE 52 -9.939 -22.723 -33.938 401 3HG2 ILE 52 3HG2 ILE 52 -9.939 -21.386 -32.789 402 1HD1 ILE 52 1HD1 ILE 52 -6.292 -24.796 -33.501 403 2HD1 ILE 52 2HD1 ILE 52 -7.739 -24.344 -32.597 404 3HD1 ILE 52 3HD1 ILE 52 -6.232 -23.463 -32.346 405 H TYR 53 H TYR 53 -7.065 -18.811 -33.849 406 HA TYR 53 HA TYR 53 -9.294 -16.946 -34.024 407 1HB TYR 53 1HB TYR 53 -7.966 -17.544 -31.348 408 2HB TYR 53 2HB TYR 53 -8.969 -16.142 -31.768 409 HD1 TYR 53 HD1 TYR 53 -9.032 -19.688 -30.859 410 HD2 TYR 53 HD2 TYR 53 -11.364 -16.445 -32.304 411 HE1 TYR 53 HE1 TYR 53 -11.085 -20.991 -30.471 412 HE2 TYR 53 HE2 TYR 53 -13.410 -17.731 -31.922 413 HH TYR 53 HH TYR 53 -14.069 -20.111 -31.778 414 H VAL 54 H VAL 54 -8.403 -14.824 -33.073 415 HA VAL 54 HA VAL 54 -5.649 -14.457 -33.997 416 HB VAL 54 HB VAL 54 -8.131 -12.941 -34.542 417 1HG1 VAL 54 1HG1 VAL 54 -5.262 -12.179 -35.270 418 2HG1 VAL 54 2HG1 VAL 54 -6.317 -11.316 -34.151 419 3HG1 VAL 54 3HG1 VAL 54 -6.677 -11.321 -35.876 420 1HG2 VAL 54 1HG2 VAL 54 -7.891 -14.774 -36.074 421 2HG2 VAL 54 2HG2 VAL 54 -6.250 -14.275 -36.491 422 3HG2 VAL 54 3HG2 VAL 54 -7.620 -13.274 -36.959 423 H PHE 55 H PHE 55 -4.655 -13.774 -32.180 424 HA PHE 55 HA PHE 55 -6.096 -12.078 -30.289 425 1HB PHE 55 1HB PHE 55 -3.488 -13.521 -30.220 426 2HB PHE 55 2HB PHE 55 -3.781 -12.157 -29.156 427 HD1 PHE 55 HD1 PHE 55 -4.276 -12.718 -27.047 428 HD2 PHE 55 HD2 PHE 55 -5.647 -15.215 -30.191 429 HE1 PHE 55 HE1 PHE 55 -5.300 -14.204 -25.400 430 HE2 PHE 55 HE2 PHE 55 -6.676 -16.712 -28.546 431 HZ PHE 55 HZ PHE 55 -6.504 -16.208 -26.154 432 H TRP 56 H TRP 56 -5.790 -10.005 -30.279 433 HA TRP 56 HA TRP 56 -3.342 -9.038 -31.479 434 1HB TRP 56 1HB TRP 56 -5.406 -8.391 -32.764 435 2HB TRP 56 2HB TRP 56 -5.908 -7.501 -31.309 436 HD1 TRP 56 HD1 TRP 56 -2.241 -7.250 -31.941 437 HE1 TRP 56 HE1 TRP 56 -1.642 -4.976 -32.885 438 HE3 TRP 56 HE3 TRP 56 -6.943 -5.593 -33.047 439 HZ2 TRP 56 HZ2 TRP 56 -2.974 -2.728 -33.987 440 HZ3 TRP 56 HZ3 TRP 56 -7.189 -3.363 -34.065 441 HH2 TRP 56 HH2 TRP 56 -5.245 -1.961 -34.520 442 H SER 57 H SER 57 -2.158 -8.440 -30.087 443 HA SER 57 HA SER 57 -3.071 -7.611 -27.439 444 1HB SER 57 1HB SER 57 -1.486 -9.524 -27.596 445 2HB SER 57 2HB SER 57 -0.333 -8.490 -28.419 446 HG SER 57 HG SER 57 -0.516 -7.156 -26.371 447 H LYS 58 H LYS 58 -3.199 -5.540 -27.249 448 HA LYS 58 HA LYS 58 -1.424 -3.795 -28.827 449 1HB LYS 58 1HB LYS 58 -4.146 -3.172 -27.628 450 2HB LYS 58 2HB LYS 58 -3.155 -2.151 -28.665 451 1HG LYS 58 1HG LYS 58 -3.587 -3.410 -30.571 452 2HG LYS 58 2HG LYS 58 -4.164 -4.793 -29.640 453 1HD LYS 58 1HD LYS 58 -6.023 -3.602 -30.716 454 2HD LYS 58 2HD LYS 58 -6.142 -3.526 -28.961 455 1HE LYS 58 1HE LYS 58 -5.058 -1.240 -29.115 456 2HE LYS 58 2HE LYS 58 -5.264 -1.370 -30.864 457 1HZ LYS 58 1HZ LYS 58 -7.447 -1.548 -28.890 458 2HZ LYS 58 2HZ LYS 58 -7.640 -1.474 -30.579 459 3HZ LYS 58 3HZ LYS 58 -7.048 -0.141 -29.716 460 H GLY 59 H GLY 59 -2.388 -1.544 -27.060 461 1HA GLY 59 1HA GLY 59 -0.372 -1.772 -25.073 462 2HA GLY 59 2HA GLY 59 -1.474 -0.424 -25.313 463 H ASP 60 H ASP 60 -1.327 -3.718 -24.091 464 HA ASP 60 HA ASP 60 -1.873 -4.646 -22.162 465 1HB ASP 60 1HB ASP 60 -2.743 -1.890 -21.332 466 2HB ASP 60 2HB ASP 60 -2.990 -3.299 -20.306 467 H GLU 61 H GLU 61 -3.634 -4.079 -24.507 468 HA GLU 61 HA GLU 61 -5.881 -5.172 -23.150 469 1HB GLU 61 1HB GLU 61 -7.402 -4.254 -24.900 470 2HB GLU 61 2HB GLU 61 -6.600 -3.007 -23.959 471 1HG GLU 61 1HG GLU 61 -5.014 -2.667 -25.734 472 2HG GLU 61 2HG GLU 61 -5.779 -3.960 -26.666 473 H ALA 62 H ALA 62 -6.813 -6.937 -24.118 474 HA ALA 62 HA ALA 62 -5.257 -8.022 -26.306 475 1HB ALA 62 1HB ALA 62 -4.647 -9.170 -24.258 476 2HB ALA 62 2HB ALA 62 -5.556 -10.251 -25.329 477 3HB ALA 62 3HB ALA 62 -6.354 -9.507 -23.936 478 H THR 63 H THR 63 -6.490 -8.329 -27.920 479 HA THR 63 HA THR 63 -9.381 -8.745 -27.579 480 HB THR 63 HB THR 63 -7.882 -7.506 -29.904 481 HG1 THR 63 HG1 THR 63 -8.620 -5.579 -29.067 482 1HG2 THR 63 1HG2 THR 63 -10.034 -8.582 -30.533 483 2HG2 THR 63 2HG2 THR 63 -10.101 -6.820 -30.676 484 3HG2 THR 63 3HG2 THR 63 -10.831 -7.621 -29.283 485 H VAL 64 H VAL 64 -10.312 -10.577 -28.554 486 HA VAL 64 HA VAL 64 -8.520 -12.226 -30.182 487 HB VAL 64 HB VAL 64 -10.625 -13.285 -28.300 488 1HG1 VAL 64 1HG1 VAL 64 -10.159 -14.738 -30.125 489 2HG1 VAL 64 2HG1 VAL 64 -9.479 -15.430 -28.654 490 3HG1 VAL 64 3HG1 VAL 64 -8.420 -14.645 -29.832 491 1HG2 VAL 64 1HG2 VAL 64 -8.820 -14.003 -26.804 492 2HG2 VAL 64 2HG2 VAL 64 -8.892 -12.246 -26.942 493 3HG2 VAL 64 3HG2 VAL 64 -7.648 -13.153 -27.810 494 H TYR 65 H TYR 65 -9.352 -12.027 -32.128 495 HA TYR 65 HA TYR 65 -12.270 -12.259 -32.551 496 1HB TYR 65 1HB TYR 65 -11.803 -9.950 -32.647 497 2HB TYR 65 2HB TYR 65 -10.334 -10.223 -33.592 498 HD1 TYR 65 HD1 TYR 65 -13.891 -9.504 -33.715 499 HD2 TYR 65 HD2 TYR 65 -10.629 -10.894 -36.064 500 HE1 TYR 65 HE1 TYR 65 -15.152 -9.023 -35.756 501 HE2 TYR 65 HE2 TYR 65 -11.896 -10.418 -38.110 502 HH TYR 65 HH TYR 65 -14.658 -8.531 -38.091 503 H LYS 66 H LYS 66 -12.188 -14.332 -33.525 504 HA LYS 66 HA LYS 66 -10.462 -14.538 -35.796 505 1HB LYS 66 1HB LYS 66 -11.231 -16.519 -34.214 506 2HB LYS 66 2HB LYS 66 -12.720 -16.411 -35.140 507 1HG LYS 66 1HG LYS 66 -10.722 -16.410 -37.057 508 2HG LYS 66 2HG LYS 66 -10.176 -17.563 -35.857 509 1HD LYS 66 1HD LYS 66 -12.835 -17.615 -37.290 510 2HD LYS 66 2HD LYS 66 -11.459 -18.645 -37.632 511 1HE LYS 66 1HE LYS 66 -11.684 -19.474 -35.223 512 2HE LYS 66 2HE LYS 66 -13.235 -18.641 -35.193 513 1HZ LYS 66 1HZ LYS 66 -13.630 -20.913 -35.795 514 2HZ LYS 66 2HZ LYS 66 -12.407 -20.853 -36.954 515 3HZ LYS 66 3HZ LYS 66 -13.815 -19.991 -37.214 516 H ARG 67 H ARG 67 -11.497 -14.914 -37.673 517 HA ARG 67 HA ARG 67 -13.315 -13.094 -38.731 518 1HB ARG 67 1HB ARG 67 -12.824 -15.893 -39.655 519 2HB ARG 67 2HB ARG 67 -13.610 -14.647 -40.611 520 1HG ARG 67 1HG ARG 67 -11.599 -13.375 -40.697 521 2HG ARG 67 2HG ARG 67 -10.795 -14.477 -39.570 522 1HD ARG 67 1HD ARG 67 -11.023 -16.280 -41.127 523 2HD ARG 67 2HD ARG 67 -11.904 -15.232 -42.242 524 HE ARG 67 HE ARG 67 -9.701 -13.872 -42.084 525 1HH1 ARG 67 1HH1 ARG 67 -9.875 -17.426 -42.234 526 2HH1 ARG 67 2HH1 ARG 67 -8.443 -17.598 -43.141 527 1HH2 ARG 67 1HH2 ARG 67 -7.782 -14.123 -43.349 528 2HH2 ARG 67 2HH2 ARG 67 -7.211 -15.658 -43.806 529 H ASP 68 H ASP 68 -13.932 -16.196 -37.232 530 HA ASP 68 HA ASP 68 -16.721 -16.181 -38.020 531 1HB ASP 68 1HB ASP 68 -15.190 -18.241 -36.432 532 2HB ASP 68 2HB ASP 68 -16.882 -18.368 -36.859 533 H ARG 69 H ARG 69 -14.728 -15.547 -35.268 534 HA ARG 69 HA ARG 69 -16.908 -14.730 -33.860 535 1HB ARG 69 1HB ARG 69 -17.229 -17.215 -33.767 536 2HB ARG 69 2HB ARG 69 -15.785 -17.296 -32.777 537 1HG ARG 69 1HG ARG 69 -16.933 -15.729 -31.175 538 2HG ARG 69 2HG ARG 69 -18.409 -15.997 -32.108 539 1HD ARG 69 1HD ARG 69 -17.995 -18.460 -31.797 540 2HD ARG 69 2HD ARG 69 -16.756 -18.005 -30.629 541 HE ARG 69 HE ARG 69 -19.610 -17.892 -30.351 542 1HH1 ARG 69 1HH1 ARG 69 -16.661 -16.506 -29.031 543 2HH1 ARG 69 2HH1 ARG 69 -17.159 -16.571 -27.405 544 1HH2 ARG 69 1HH2 ARG 69 -20.328 -17.999 -28.099 545 2HH2 ARG 69 2HH2 ARG 69 -19.310 -17.453 -26.858 546 H ILE 70 H ILE 70 -16.222 -13.492 -32.477 547 HA ILE 70 HA ILE 70 -13.571 -13.110 -31.245 548 HB ILE 70 HB ILE 70 -16.238 -11.963 -30.525 549 1HG1 ILE 70 1HG1 ILE 70 -14.163 -10.810 -32.325 550 2HG1 ILE 70 2HG1 ILE 70 -15.718 -11.441 -32.867 551 1HG2 ILE 70 1HG2 ILE 70 -14.990 -10.122 -29.498 552 2HG2 ILE 70 2HG2 ILE 70 -13.482 -10.952 -29.890 553 3HG2 ILE 70 3HG2 ILE 70 -14.625 -11.686 -28.767 554 1HD1 ILE 70 1HD1 ILE 70 -15.239 -8.999 -31.152 555 2HD1 ILE 70 2HD1 ILE 70 -16.825 -9.656 -31.534 556 3HD1 ILE 70 3HD1 ILE 70 -15.807 -9.016 -32.825 557 H VAL 71 H VAL 71 -13.068 -13.731 -29.361 558 HA VAL 71 HA VAL 71 -15.189 -15.010 -27.840 559 HB VAL 71 HB VAL 71 -13.726 -16.638 -26.729 560 1HG1 VAL 71 1HG1 VAL 71 -13.664 -16.709 -29.723 561 2HG1 VAL 71 2HG1 VAL 71 -14.942 -17.322 -28.670 562 3HG1 VAL 71 3HG1 VAL 71 -13.346 -18.088 -28.673 563 1HG2 VAL 71 1HG2 VAL 71 -11.594 -15.764 -28.666 564 2HG2 VAL 71 2HG2 VAL 71 -11.494 -17.092 -27.497 565 3HG2 VAL 71 3HG2 VAL 71 -11.581 -15.423 -26.934 566 H LEU 72 H LEU 72 -12.990 -12.612 -27.770 567 HA LEU 72 HA LEU 72 -13.710 -12.117 -24.974 568 1HB LEU 72 1HB LEU 72 -10.975 -12.358 -25.919 569 2HB LEU 72 2HB LEU 72 -11.272 -10.965 -24.850 570 HG LEU 72 HG LEU 72 -10.523 -12.547 -23.438 571 1HD1 LEU 72 1HD1 LEU 72 -12.219 -13.339 -22.072 572 2HD1 LEU 72 2HD1 LEU 72 -13.395 -13.174 -23.357 573 3HD1 LEU 72 3HD1 LEU 72 -12.622 -11.731 -22.684 574 1HD2 LEU 72 1HD2 LEU 72 -11.967 -14.665 -25.018 575 2HD2 LEU 72 2HD2 LEU 72 -10.968 -14.956 -23.590 576 3HD2 LEU 72 3HD2 LEU 72 -10.239 -14.332 -25.065 577 H ASN 73 H ASN 73 -11.551 -10.242 -26.543 578 HA ASN 73 HA ASN 73 -11.512 -8.096 -27.443 579 1HB ASN 73 1HB ASN 73 -13.407 -8.869 -28.896 580 2HB ASN 73 2HB ASN 73 -14.542 -8.314 -27.673 581 1HD2 ASN 73 1HD2 ASN 73 -15.533 -6.892 -29.095 582 2HD2 ASN 73 2HD2 ASN 73 -14.778 -5.457 -29.650 583 H ASN 74 H ASN 74 -12.037 -8.784 -24.634 584 HA ASN 74 HA ASN 74 -11.916 -6.112 -23.722 585 1HB ASN 74 1HB ASN 74 -14.394 -6.391 -23.626 586 2HB ASN 74 2HB ASN 74 -14.184 -7.800 -22.593 587 1HD2 ASN 74 1HD2 ASN 74 -15.246 -6.895 -20.820 588 2HD2 ASN 74 2HD2 ASN 74 -14.582 -5.611 -19.899 589 H CYS 75 H CYS 75 -9.901 -6.925 -23.359 590 HA CYS 75 HA CYS 75 -9.697 -8.143 -20.758 591 1HB CYS 75 1HB CYS 75 -8.322 -9.166 -23.236 592 2HB CYS 75 2HB CYS 75 -7.660 -9.443 -21.628 593 H GLN 76 H GLN 76 -8.132 -7.277 -19.606 594 HA GLN 76 HA GLN 76 -6.409 -5.387 -20.882 595 1HB GLN 76 1HB GLN 76 -8.390 -4.671 -18.719 596 2HB GLN 76 2HB GLN 76 -6.978 -3.688 -19.099 597 1HG GLN 76 1HG GLN 76 -7.742 -3.439 -21.369 598 2HG GLN 76 2HG GLN 76 -9.175 -4.393 -21.041 599 1HE2 GLN 76 1HE2 GLN 76 -7.563 -1.350 -20.531 600 2HE2 GLN 76 2HE2 GLN 76 -8.912 -0.495 -19.905 601 H LEU 77 H LEU 77 -4.680 -5.920 -20.327 602 HA LEU 77 HA LEU 77 -4.416 -8.039 -18.555 603 1HB LEU 77 1HB LEU 77 -3.298 -8.117 -20.606 604 2HB LEU 77 2HB LEU 77 -2.525 -6.581 -20.352 605 HG LEU 77 HG LEU 77 -0.965 -7.601 -18.750 606 1HD1 LEU 77 1HD1 LEU 77 -2.444 -9.198 -17.744 607 2HD1 LEU 77 2HD1 LEU 77 -0.991 -9.983 -18.365 608 3HD1 LEU 77 3HD1 LEU 77 -2.516 -10.109 -19.246 609 1HD2 LEU 77 1HD2 LEU 77 0.109 -9.194 -20.319 610 2HD2 LEU 77 2HD2 LEU 77 -0.328 -7.651 -21.046 611 3HD2 LEU 77 3HD2 LEU 77 -1.320 -9.076 -21.346 612 H GLN 78 H GLN 78 -3.379 -8.068 -16.440 613 HA GLN 78 HA GLN 78 -2.765 -5.548 -15.277 614 1HB GLN 78 1HB GLN 78 -2.132 -6.808 -13.254 615 2HB GLN 78 2HB GLN 78 -3.694 -7.320 -13.860 616 1HG GLN 78 1HG GLN 78 -2.624 -9.277 -14.849 617 2HG GLN 78 2HG GLN 78 -1.084 -8.752 -14.163 618 1HE2 GLN 78 1HE2 GLN 78 -0.835 -10.522 -12.803 619 2HE2 GLN 78 2HE2 GLN 78 -1.849 -10.787 -11.435 620 H ASN 79 H ASN 79 -0.804 -8.378 -16.119 621 HA ASN 79 HA ASN 79 1.101 -7.196 -17.590 622 1HB ASN 79 1HB ASN 79 1.724 -6.162 -15.244 623 2HB ASN 79 2HB ASN 79 2.219 -7.806 -14.837 624 1HD2 ASN 79 1HD2 ASN 79 2.853 -5.039 -16.774 625 2HD2 ASN 79 2HD2 ASN 79 4.415 -5.490 -17.326 626 HA PRO 80 HA PRO 80 0.907 -11.488 -17.747 627 1HB PRO 80 1HB PRO 80 2.768 -12.139 -19.587 628 2HB PRO 80 2HB PRO 80 1.269 -11.294 -19.991 629 1HG PRO 80 1HG PRO 80 4.009 -10.177 -19.552 630 2HG PRO 80 2HG PRO 80 2.832 -9.782 -20.819 631 1HD PRO 80 1HD PRO 80 3.186 -8.251 -18.584 632 2HD PRO 80 2HD PRO 80 1.644 -8.391 -19.462 633 H GLN 81 H GLN 81 3.491 -10.081 -16.188 634 HA GLN 81 HA GLN 81 5.194 -12.320 -16.056 635 1HB GLN 81 1HB GLN 81 6.443 -11.126 -14.288 636 2HB GLN 81 2HB GLN 81 6.193 -10.150 -15.730 637 1HG GLN 81 1HG GLN 81 4.406 -8.979 -14.668 638 2HG GLN 81 2HG GLN 81 4.543 -10.049 -13.273 639 1HE2 GLN 81 1HE2 GLN 81 6.219 -9.783 -11.866 640 2HE2 GLN 81 2HE2 GLN 81 7.242 -8.391 -11.821 641 H ARG 82 H ARG 82 3.823 -13.817 -15.562 642 HA ARG 82 HA ARG 82 3.204 -14.179 -12.711 643 1HB ARG 82 1HB ARG 82 2.065 -15.644 -15.111 644 2HB ARG 82 2HB ARG 82 1.660 -15.989 -13.440 645 1HG ARG 82 1HG ARG 82 1.113 -13.360 -14.819 646 2HG ARG 82 2HG ARG 82 -0.065 -14.662 -14.675 647 1HD ARG 82 1HD ARG 82 -0.503 -12.996 -12.963 648 2HD ARG 82 2HD ARG 82 0.095 -14.459 -12.194 649 HE ARG 82 HE ARG 82 2.212 -12.665 -12.747 650 1HH1 ARG 82 1HH1 ARG 82 -0.436 -13.092 -10.407 651 2HH1 ARG 82 2HH1 ARG 82 0.401 -12.259 -9.176 652 1HH2 ARG 82 1HH2 ARG 82 3.298 -11.590 -11.045 653 2HH2 ARG 82 2HH2 ARG 82 2.536 -11.388 -9.528 Start of MODEL 10 1 H MET 1 H MET 1 8.741 -23.821 -15.246 2 HA MET 1 HA MET 1 10.368 -22.298 -16.055 3 1HB MET 1 1HB MET 1 10.721 -23.931 -18.108 4 2HB MET 1 2HB MET 1 9.456 -22.964 -18.842 5 1HG MET 1 1HG MET 1 12.108 -21.944 -17.840 6 2HG MET 1 2HG MET 1 11.700 -22.247 -19.520 7 1HE MET 1 1HE MET 1 12.035 -18.391 -19.431 8 2HE MET 1 2HE MET 1 12.551 -19.893 -20.202 9 3HE MET 1 3HE MET 1 13.003 -19.556 -18.531 10 H GLN 2 H GLN 2 9.338 -20.434 -15.680 11 HA GLN 2 HA GLN 2 6.532 -20.342 -15.927 12 1HB GLN 2 1HB GLN 2 6.541 -18.175 -14.982 13 2HB GLN 2 2HB GLN 2 7.668 -19.178 -14.093 14 1HG GLN 2 1HG GLN 2 8.390 -17.380 -16.261 15 2HG GLN 2 2HG GLN 2 8.338 -16.786 -14.582 16 1HE2 GLN 2 1HE2 GLN 2 10.088 -18.494 -16.992 17 2HE2 GLN 2 2HE2 GLN 2 11.491 -18.843 -16.048 18 H THR 3 H THR 3 5.305 -19.902 -17.382 19 HA THR 3 HA THR 3 6.144 -18.493 -19.845 20 HB THR 3 HB THR 3 3.507 -19.816 -19.488 21 HG1 THR 3 HG1 THR 3 5.892 -21.110 -18.975 22 1HG2 THR 3 1HG2 THR 3 4.020 -20.646 -21.752 23 2HG2 THR 3 2HG2 THR 3 5.638 -19.961 -21.626 24 3HG2 THR 3 3HG2 THR 3 4.228 -18.898 -21.644 25 H ASP 4 H ASP 4 5.034 -16.639 -20.361 26 HA ASP 4 HA ASP 4 3.999 -15.249 -18.070 27 1HB ASP 4 1HB ASP 4 4.370 -14.483 -20.948 28 2HB ASP 4 2HB ASP 4 3.572 -13.370 -19.831 29 H THR 5 H THR 5 1.986 -15.405 -17.352 30 HA THR 5 HA THR 5 0.043 -16.424 -19.272 31 HB THR 5 HB THR 5 -0.058 -16.874 -16.304 32 HG1 THR 5 HG1 THR 5 1.842 -17.808 -17.596 33 1HG2 THR 5 1HG2 THR 5 -1.549 -18.727 -16.933 34 2HG2 THR 5 2HG2 THR 5 -1.365 -18.289 -18.629 35 3HG2 THR 5 3HG2 THR 5 -2.160 -17.178 -17.513 36 H LEU 6 H LEU 6 -1.700 -15.269 -19.598 37 HA LEU 6 HA LEU 6 -1.731 -12.709 -18.751 38 1HB LEU 6 1HB LEU 6 -3.280 -14.386 -20.571 39 2HB LEU 6 2HB LEU 6 -4.021 -12.865 -20.129 40 HG LEU 6 HG LEU 6 -1.948 -11.742 -20.736 41 1HD1 LEU 6 1HD1 LEU 6 -0.288 -13.207 -20.533 42 2HD1 LEU 6 2HD1 LEU 6 -0.332 -12.737 -22.220 43 3HD1 LEU 6 3HD1 LEU 6 -0.926 -14.334 -21.732 44 1HD2 LEU 6 1HD2 LEU 6 -3.753 -11.673 -22.298 45 2HD2 LEU 6 2HD2 LEU 6 -3.283 -13.239 -22.969 46 3HD2 LEU 6 3HD2 LEU 6 -2.237 -11.833 -23.183 47 H GLU 7 H GLU 7 -4.552 -12.089 -18.616 48 HA GLU 7 HA GLU 7 -4.234 -11.400 -15.944 49 1HB GLU 7 1HB GLU 7 -5.007 -10.024 -17.825 50 2HB GLU 7 2HB GLU 7 -6.520 -10.921 -17.806 51 1HG GLU 7 1HG GLU 7 -6.660 -8.821 -16.608 52 2HG GLU 7 2HG GLU 7 -6.940 -10.256 -15.589 53 H TYR 8 H TYR 8 -5.723 -13.877 -17.633 54 HA TYR 8 HA TYR 8 -7.273 -15.209 -17.556 55 1HB TYR 8 1HB TYR 8 -7.455 -16.723 -15.557 56 2HB TYR 8 2HB TYR 8 -5.804 -16.335 -15.999 57 HD1 TYR 8 HD1 TYR 8 -8.394 -16.008 -13.438 58 HD2 TYR 8 HD2 TYR 8 -4.433 -14.916 -14.511 59 HE1 TYR 8 HE1 TYR 8 -7.963 -15.294 -11.127 60 HE2 TYR 8 HE2 TYR 8 -4.001 -14.196 -12.203 61 HH TYR 8 HH TYR 8 -5.428 -13.359 -10.289 62 H GLN 9 H GLN 9 -8.296 -12.521 -17.112 63 HA GLN 9 HA GLN 9 -10.788 -13.033 -15.773 64 1HB GLN 9 1HB GLN 9 -8.861 -10.847 -15.000 65 2HB GLN 9 2HB GLN 9 -10.566 -10.838 -14.565 66 1HG GLN 9 1HG GLN 9 -10.357 -12.744 -13.278 67 2HG GLN 9 2HG GLN 9 -8.760 -13.111 -13.911 68 1HE2 GLN 9 1HE2 GLN 9 -7.013 -11.886 -13.231 69 2HE2 GLN 9 2HE2 GLN 9 -6.998 -11.001 -11.757 70 H CYS 10 H CYS 10 -11.897 -12.797 -17.404 71 HA CYS 10 HA CYS 10 -12.131 -10.184 -18.624 72 1HB CYS 10 1HB CYS 10 -11.876 -12.828 -20.056 73 2HB CYS 10 2HB CYS 10 -12.504 -11.397 -20.881 74 H ASP 11 H ASP 11 -14.349 -9.852 -19.245 75 HA ASP 11 HA ASP 11 -16.165 -11.017 -17.429 76 1HB ASP 11 1HB ASP 11 -16.793 -9.503 -19.955 77 2HB ASP 11 2HB ASP 11 -17.914 -9.813 -18.643 78 H GLU 12 H GLU 12 -15.169 -11.941 -20.588 79 HA GLU 12 HA GLU 12 -17.645 -13.227 -21.144 80 1HB GLU 12 1HB GLU 12 -16.750 -11.598 -22.678 81 2HB GLU 12 2HB GLU 12 -15.249 -12.473 -22.775 82 1HG GLU 12 1HG GLU 12 -16.231 -14.181 -24.033 83 2HG GLU 12 2HG GLU 12 -17.867 -13.602 -23.678 84 H LYS 13 H LYS 13 -14.228 -13.928 -20.552 85 HA LYS 13 HA LYS 13 -14.754 -16.680 -20.019 86 1HB LYS 13 1HB LYS 13 -12.682 -16.165 -22.170 87 2HB LYS 13 2HB LYS 13 -13.379 -17.685 -21.674 88 1HG LYS 13 1HG LYS 13 -15.569 -16.537 -22.635 89 2HG LYS 13 2HG LYS 13 -14.341 -15.627 -23.507 90 1HD LYS 13 1HD LYS 13 -13.437 -17.530 -24.565 91 2HD LYS 13 2HD LYS 13 -14.204 -18.634 -23.424 92 1HE LYS 13 1HE LYS 13 -15.648 -16.985 -25.492 93 2HE LYS 13 2HE LYS 13 -15.263 -18.701 -25.624 94 1HZ LYS 13 1HZ LYS 13 -17.038 -17.516 -23.537 95 2HZ LYS 13 2HZ LYS 13 -16.651 -19.156 -23.738 96 3HZ LYS 13 3HZ LYS 13 -17.527 -18.355 -24.917 97 HA PRO 14 HA PRO 14 -11.036 -15.567 -17.848 98 1HB PRO 14 1HB PRO 14 -9.927 -18.292 -18.017 99 2HB PRO 14 2HB PRO 14 -10.469 -17.415 -16.583 100 1HG PRO 14 1HG PRO 14 -11.833 -19.520 -17.601 101 2HG PRO 14 2HG PRO 14 -12.635 -18.172 -16.772 102 1HD PRO 14 1HD PRO 14 -12.380 -18.711 -19.708 103 2HD PRO 14 2HD PRO 14 -13.774 -18.105 -18.786 104 H LEU 15 H LEU 15 -8.857 -14.981 -18.440 105 HA LEU 15 HA LEU 15 -8.249 -15.587 -21.225 106 1HB LEU 15 1HB LEU 15 -8.677 -13.219 -20.725 107 2HB LEU 15 2HB LEU 15 -7.400 -13.270 -19.522 108 HG LEU 15 HG LEU 15 -5.787 -13.797 -21.336 109 1HD1 LEU 15 1HD1 LEU 15 -8.092 -13.181 -23.165 110 2HD1 LEU 15 2HD1 LEU 15 -7.291 -14.740 -22.962 111 3HD1 LEU 15 3HD1 LEU 15 -6.407 -13.377 -23.652 112 1HD2 LEU 15 1HD2 LEU 15 -7.345 -11.241 -21.387 113 2HD2 LEU 15 2HD2 LEU 15 -5.864 -11.459 -22.315 114 3HD2 LEU 15 3HD2 LEU 15 -5.828 -11.571 -20.550 115 H THR 16 H THR 16 -7.329 -17.523 -20.386 116 HA THR 16 HA THR 16 -4.926 -16.967 -18.968 117 HB THR 16 HB THR 16 -6.089 -19.724 -19.463 118 HG1 THR 16 HG1 THR 16 -6.611 -18.821 -17.001 119 1HG2 THR 16 1HG2 THR 16 -3.773 -19.587 -18.626 120 2HG2 THR 16 2HG2 THR 16 -4.866 -20.229 -17.390 121 3HG2 THR 16 3HG2 THR 16 -4.337 -18.539 -17.325 122 H VAL 17 H VAL 17 -3.240 -16.702 -20.333 123 HA VAL 17 HA VAL 17 -3.088 -18.260 -22.833 124 HB VAL 17 HB VAL 17 -2.371 -15.347 -22.408 125 1HG1 VAL 17 1HG1 VAL 17 -0.677 -16.472 -23.918 126 2HG1 VAL 17 2HG1 VAL 17 -1.663 -15.305 -24.777 127 3HG1 VAL 17 3HG1 VAL 17 -2.027 -17.017 -24.906 128 1HG2 VAL 17 1HG2 VAL 17 -4.040 -14.891 -24.102 129 2HG2 VAL 17 2HG2 VAL 17 -4.758 -15.794 -22.757 130 3HG2 VAL 17 3HG2 VAL 17 -4.328 -16.615 -24.265 131 H LYS 18 H LYS 18 -1.098 -19.079 -23.231 132 HA LYS 18 HA LYS 18 0.851 -18.473 -21.187 133 1HB LYS 18 1HB LYS 18 0.458 -20.838 -22.955 134 2HB LYS 18 2HB LYS 18 2.064 -20.465 -22.370 135 1HG LYS 18 1HG LYS 18 1.130 -22.076 -20.921 136 2HG LYS 18 2HG LYS 18 1.172 -20.530 -20.069 137 1HD LYS 18 1HD LYS 18 -1.195 -20.230 -20.535 138 2HD LYS 18 2HD LYS 18 -1.244 -21.796 -21.354 139 1HE LYS 18 1HE LYS 18 -0.612 -21.285 -18.440 140 2HE LYS 18 2HE LYS 18 -2.038 -22.094 -19.086 141 1HZ LYS 18 1HZ LYS 18 -0.423 -23.697 -18.243 142 2HZ LYS 18 2HZ LYS 18 0.761 -23.089 -19.255 143 3HZ LYS 18 3HZ LYS 18 -0.552 -23.884 -19.914 144 H LEU 19 H LEU 19 1.536 -16.579 -21.956 145 HA LEU 19 HA LEU 19 2.522 -16.256 -24.613 146 1HB LEU 19 1HB LEU 19 2.920 -14.847 -22.052 147 2HB LEU 19 2HB LEU 19 3.920 -14.412 -23.425 148 HG LEU 19 HG LEU 19 0.918 -14.103 -23.142 149 1HD1 LEU 19 1HD1 LEU 19 1.449 -11.695 -23.225 150 2HD1 LEU 19 2HD1 LEU 19 3.165 -12.095 -23.280 151 3HD1 LEU 19 3HD1 LEU 19 2.214 -12.492 -21.849 152 1HD2 LEU 19 1HD2 LEU 19 1.490 -14.594 -25.467 153 2HD2 LEU 19 2HD2 LEU 19 2.731 -13.353 -25.439 154 3HD2 LEU 19 3HD2 LEU 19 1.033 -12.902 -25.291 155 H ASN 20 H ASN 20 3.934 -17.493 -25.204 156 HA ASN 20 HA ASN 20 5.864 -18.733 -23.476 157 1HB ASN 20 1HB ASN 20 5.104 -19.657 -25.725 158 2HB ASN 20 2HB ASN 20 6.071 -18.387 -26.470 159 1HD2 ASN 20 1HD2 ASN 20 6.143 -21.375 -24.698 160 2HD2 ASN 20 2HD2 ASN 20 7.813 -21.712 -24.929 161 H ASN 21 H ASN 21 8.092 -18.239 -23.271 162 HA ASN 21 HA ASN 21 8.435 -15.684 -22.487 163 1HB ASN 21 1HB ASN 21 10.735 -17.517 -23.142 164 2HB ASN 21 2HB ASN 21 10.770 -16.123 -22.065 165 1HD2 ASN 21 1HD2 ASN 21 9.648 -16.230 -20.067 166 2HD2 ASN 21 2HD2 ASN 21 9.167 -17.759 -19.418 167 HA PRO 22 HA PRO 22 10.774 -13.972 -26.242 168 1HB PRO 22 1HB PRO 22 10.530 -15.761 -28.507 169 2HB PRO 22 2HB PRO 22 11.999 -15.192 -27.705 170 1HG PRO 22 1HG PRO 22 11.163 -17.788 -27.625 171 2HG PRO 22 2HG PRO 22 12.125 -17.029 -26.348 172 1HD PRO 22 1HD PRO 22 9.173 -17.515 -26.453 173 2HD PRO 22 2HD PRO 22 10.299 -17.749 -25.104 174 H ARG 23 H ARG 23 7.836 -15.455 -26.247 175 HA ARG 23 HA ARG 23 5.896 -15.277 -27.107 176 1HB ARG 23 1HB ARG 23 6.687 -12.415 -27.331 177 2HB ARG 23 2HB ARG 23 5.133 -12.992 -27.938 178 1HG ARG 23 1HG ARG 23 4.658 -12.246 -25.738 179 2HG ARG 23 2HG ARG 23 4.776 -14.004 -25.685 180 1HD ARG 23 1HD ARG 23 5.862 -13.012 -23.755 181 2HD ARG 23 2HD ARG 23 7.009 -13.876 -24.773 182 HE ARG 23 HE ARG 23 7.294 -11.385 -25.664 183 1HH1 ARG 23 1HH1 ARG 23 7.101 -12.579 -22.296 184 2HH1 ARG 23 2HH1 ARG 23 8.148 -11.396 -21.694 185 1HH2 ARG 23 1HH2 ARG 23 8.779 -9.791 -24.780 186 2HH2 ARG 23 2HH2 ARG 23 9.162 -9.816 -23.125 187 H GLN 24 H GLN 24 6.811 -16.683 -28.523 188 HA GLN 24 HA GLN 24 6.334 -15.810 -31.208 189 1HB GLN 24 1HB GLN 24 7.962 -18.150 -30.213 190 2HB GLN 24 2HB GLN 24 7.572 -17.904 -31.906 191 1HG GLN 24 1HG GLN 24 9.121 -15.962 -30.205 192 2HG GLN 24 2HG GLN 24 9.839 -17.154 -31.288 193 1HE2 GLN 24 1HE2 GLN 24 10.049 -14.268 -31.332 194 2HE2 GLN 24 2HE2 GLN 24 9.444 -13.729 -32.842 195 H GLU 25 H GLU 25 5.123 -17.532 -28.604 196 HA GLU 25 HA GLU 25 3.133 -18.939 -30.165 197 1HB GLU 25 1HB GLU 25 4.975 -20.543 -30.052 198 2HB GLU 25 2HB GLU 25 5.074 -20.337 -28.313 199 1HG GLU 25 1HG GLU 25 2.827 -21.315 -28.090 200 2HG GLU 25 2HG GLU 25 2.781 -21.552 -29.838 201 H VAL 26 H VAL 26 1.330 -19.380 -28.967 202 HA VAL 26 HA VAL 26 1.230 -18.881 -26.039 203 HB VAL 26 HB VAL 26 -0.842 -17.739 -26.231 204 1HG1 VAL 26 1HG1 VAL 26 1.282 -16.325 -27.824 205 2HG1 VAL 26 2HG1 VAL 26 1.157 -16.415 -26.072 206 3HG1 VAL 26 3HG1 VAL 26 -0.071 -15.538 -26.995 207 1HG2 VAL 26 1HG2 VAL 26 -1.657 -16.766 -28.368 208 2HG2 VAL 26 2HG2 VAL 26 -1.704 -18.529 -28.318 209 3HG2 VAL 26 3HG2 VAL 26 -0.418 -17.707 -29.201 210 H SER 27 H SER 27 0.125 -20.241 -24.992 211 HA SER 27 HA SER 27 -1.668 -21.982 -26.494 212 1HB SER 27 1HB SER 27 -0.783 -22.244 -23.602 213 2HB SER 27 2HB SER 27 -1.649 -23.427 -24.581 214 HG SER 27 HG SER 27 0.232 -23.315 -26.029 215 H PHE 28 H PHE 28 -3.693 -21.488 -26.428 216 HA PHE 28 HA PHE 28 -4.625 -19.696 -24.349 217 1HB PHE 28 1HB PHE 28 -4.196 -18.145 -25.850 218 2HB PHE 28 2HB PHE 28 -4.550 -19.138 -27.268 219 HD1 PHE 28 HD1 PHE 28 -6.671 -18.947 -28.319 220 HD2 PHE 28 HD2 PHE 28 -6.118 -17.229 -24.458 221 HE1 PHE 28 HE1 PHE 28 -8.859 -17.841 -28.491 222 HE2 PHE 28 HE2 PHE 28 -8.283 -16.126 -24.632 223 HZ PHE 28 HZ PHE 28 -9.668 -16.429 -26.647 224 H VAL 29 H VAL 29 -6.600 -19.666 -23.891 225 HA VAL 29 HA VAL 29 -8.002 -22.122 -24.138 226 HB VAL 29 HB VAL 29 -7.606 -21.239 -21.941 227 1HG1 VAL 29 1HG1 VAL 29 -8.519 -19.105 -21.138 228 2HG1 VAL 29 2HG1 VAL 29 -9.080 -18.744 -22.770 229 3HG1 VAL 29 3HG1 VAL 29 -7.365 -18.871 -22.454 230 1HG2 VAL 29 1HG2 VAL 29 -10.517 -20.952 -22.677 231 2HG2 VAL 29 2HG2 VAL 29 -9.897 -21.145 -21.037 232 3HG2 VAL 29 3HG2 VAL 29 -9.693 -22.442 -22.212 233 H TYR 30 H TYR 30 -9.211 -22.310 -25.686 234 HA TYR 30 HA TYR 30 -10.609 -20.370 -27.282 235 1HB TYR 30 1HB TYR 30 -10.182 -22.594 -28.185 236 2HB TYR 30 2HB TYR 30 -11.129 -23.336 -26.906 237 HD1 TYR 30 HD1 TYR 30 -11.304 -21.335 -30.010 238 HD2 TYR 30 HD2 TYR 30 -13.518 -23.477 -27.074 239 HE1 TYR 30 HE1 TYR 30 -13.302 -21.248 -31.450 240 HE2 TYR 30 HE2 TYR 30 -15.511 -23.394 -28.503 241 HH TYR 30 HH TYR 30 -15.415 -22.569 -31.735 242 H ASP 31 H ASP 31 -11.547 -22.373 -24.640 243 HA ASP 31 HA ASP 31 -13.340 -20.528 -23.564 244 1HB ASP 31 1HB ASP 31 -14.848 -21.196 -25.360 245 2HB ASP 31 2HB ASP 31 -14.648 -22.892 -24.942 246 H ASN 32 H ASN 32 -13.103 -24.050 -23.870 247 HA ASN 32 HA ASN 32 -12.242 -24.129 -21.077 248 1HB ASN 32 1HB ASN 32 -14.564 -25.564 -22.284 249 2HB ASN 32 2HB ASN 32 -13.586 -26.427 -21.105 250 1HD2 ASN 32 1HD2 ASN 32 -15.744 -23.692 -21.612 251 2HD2 ASN 32 2HD2 ASN 32 -16.068 -23.438 -19.944 252 H GLN 33 H GLN 33 -10.981 -24.433 -23.875 253 HA GLN 33 HA GLN 33 -9.388 -26.732 -23.224 254 1HB GLN 33 1HB GLN 33 -9.577 -27.687 -25.430 255 2HB GLN 33 2HB GLN 33 -11.214 -27.558 -24.802 256 1HG GLN 33 1HG GLN 33 -11.540 -25.519 -26.068 257 2HG GLN 33 2HG GLN 33 -9.890 -25.642 -26.671 258 1HE2 GLN 33 1HE2 GLN 33 -9.402 -27.266 -28.207 259 2HE2 GLN 33 2HE2 GLN 33 -10.650 -28.004 -29.131 260 H LEU 34 H LEU 34 -7.414 -26.558 -24.426 261 HA LEU 34 HA LEU 34 -7.076 -23.801 -25.149 262 1HB LEU 34 1HB LEU 34 -5.309 -25.572 -23.581 263 2HB LEU 34 2HB LEU 34 -4.556 -24.297 -24.524 264 HG LEU 34 HG LEU 34 -6.120 -22.719 -23.234 265 1HD1 LEU 34 1HD1 LEU 34 -6.327 -25.099 -21.420 266 2HD1 LEU 34 2HD1 LEU 34 -7.629 -24.357 -22.351 267 3HD1 LEU 34 3HD1 LEU 34 -6.854 -23.453 -21.046 268 1HD2 LEU 34 1HD2 LEU 34 -3.913 -24.165 -21.796 269 2HD2 LEU 34 2HD2 LEU 34 -4.560 -22.574 -21.366 270 3HD2 LEU 34 3HD2 LEU 34 -3.752 -22.816 -22.919 271 H LEU 35 H LEU 35 -5.825 -23.312 -26.838 272 HA LEU 35 HA LEU 35 -4.819 -25.505 -28.523 273 1HB LEU 35 1HB LEU 35 -6.102 -22.902 -29.338 274 2HB LEU 35 2HB LEU 35 -5.171 -23.887 -30.433 275 HG LEU 35 HG LEU 35 -7.373 -24.217 -30.903 276 1HD1 LEU 35 1HD1 LEU 35 -6.114 -26.249 -31.022 277 2HD1 LEU 35 2HD1 LEU 35 -7.762 -26.621 -30.526 278 3HD1 LEU 35 3HD1 LEU 35 -6.467 -26.615 -29.330 279 1HD2 LEU 35 1HD2 LEU 35 -7.940 -24.807 -28.004 280 2HD2 LEU 35 2HD2 LEU 35 -9.111 -24.999 -29.311 281 3HD2 LEU 35 3HD2 LEU 35 -8.464 -23.401 -28.928 282 H HIS 36 H HIS 36 -3.239 -24.427 -30.138 283 HA HIS 36 HA HIS 36 -1.631 -22.528 -28.644 284 1HB HIS 36 1HB HIS 36 0.463 -23.708 -29.293 285 2HB HIS 36 2HB HIS 36 -0.574 -24.636 -28.222 286 HD2 HIS 36 HD2 HIS 36 0.846 -24.763 -31.846 287 HE1 HIS 36 HE1 HIS 36 -1.094 -28.424 -31.011 288 HE2 HIS 36 HE2 HIS 36 0.096 -27.067 -32.766 289 H LEU 37 H LEU 37 -1.086 -20.860 -29.659 290 HA LEU 37 HA LEU 37 -1.395 -20.778 -32.593 291 1HB LEU 37 1HB LEU 37 -1.912 -18.581 -30.602 292 2HB LEU 37 2HB LEU 37 -2.024 -18.398 -32.309 293 HG LEU 37 HG LEU 37 -3.968 -20.116 -32.240 294 1HD1 LEU 37 1HD1 LEU 37 -3.542 -21.092 -30.063 295 2HD1 LEU 37 2HD1 LEU 37 -5.157 -20.380 -30.115 296 3HD1 LEU 37 3HD1 LEU 37 -3.846 -19.541 -29.286 297 1HD2 LEU 37 1HD2 LEU 37 -4.278 -17.504 -30.813 298 2HD2 LEU 37 2HD2 LEU 37 -5.609 -18.478 -31.418 299 3HD2 LEU 37 3HD2 LEU 37 -4.443 -17.783 -32.547 300 H LYS 38 H LYS 38 0.037 -19.245 -33.629 301 HA LYS 38 HA LYS 38 2.215 -18.499 -31.873 302 1HB LYS 38 1HB LYS 38 3.862 -19.246 -33.425 303 2HB LYS 38 2HB LYS 38 2.767 -20.550 -32.943 304 1HG LYS 38 1HG LYS 38 1.663 -20.507 -35.042 305 2HG LYS 38 2HG LYS 38 2.533 -19.047 -35.530 306 1HD LYS 38 1HD LYS 38 4.621 -20.231 -35.409 307 2HD LYS 38 2HD LYS 38 3.788 -21.713 -34.927 308 1HE LYS 38 1HE LYS 38 2.561 -21.683 -37.062 309 2HE LYS 38 2HE LYS 38 3.449 -20.231 -37.530 310 1HZ LYS 38 1HZ LYS 38 4.435 -22.208 -38.483 311 2HZ LYS 38 2HZ LYS 38 4.640 -22.873 -36.945 312 3HZ LYS 38 3HZ LYS 38 5.499 -21.500 -37.378 313 H GLN 39 H GLN 39 3.541 -16.953 -32.647 314 HA GLN 39 HA GLN 39 2.063 -14.816 -33.979 315 1HB GLN 39 1HB GLN 39 3.291 -14.403 -31.959 316 2HB GLN 39 2HB GLN 39 4.805 -14.859 -32.774 317 1HG GLN 39 1HG GLN 39 4.444 -12.934 -34.304 318 2HG GLN 39 2HG GLN 39 3.038 -12.479 -33.340 319 1HE2 GLN 39 1HE2 GLN 39 3.365 -11.729 -31.225 320 2HE2 GLN 39 2HE2 GLN 39 4.890 -11.130 -30.701 321 H GLY 40 H GLY 40 2.041 -14.976 -35.998 322 1HA GLY 40 1HA GLY 40 4.570 -15.446 -37.462 323 2HA GLY 40 2HA GLY 40 3.025 -16.075 -38.040 324 H ILE 41 H ILE 41 1.378 -14.535 -38.532 325 HA ILE 41 HA ILE 41 2.485 -12.219 -39.907 326 HB ILE 41 HB ILE 41 -0.370 -13.221 -39.853 327 1HG1 ILE 41 1HG1 ILE 41 1.668 -13.695 -42.028 328 2HG1 ILE 41 2HG1 ILE 41 1.372 -14.867 -40.748 329 1HG2 ILE 41 1HG2 ILE 41 -0.021 -10.877 -40.487 330 2HG2 ILE 41 2HG2 ILE 41 -0.611 -11.822 -41.864 331 3HG2 ILE 41 3HG2 ILE 41 1.098 -11.375 -41.749 332 1HD1 ILE 41 1HD1 ILE 41 -0.645 -13.868 -42.742 333 2HD1 ILE 41 2HD1 ILE 41 -0.928 -15.037 -41.439 334 3HD1 ILE 41 3HD1 ILE 41 0.170 -15.441 -42.760 335 H SER 42 H SER 42 2.624 -10.466 -38.660 336 HA SER 42 HA SER 42 0.618 -10.110 -36.594 337 1HB SER 42 1HB SER 42 3.396 -9.093 -36.887 338 2HB SER 42 2HB SER 42 2.321 -8.668 -35.536 339 HG SER 42 HG SER 42 3.563 -11.083 -36.190 340 H ALA 43 H ALA 43 0.846 -7.509 -35.998 341 HA ALA 43 HA ALA 43 0.685 -5.723 -38.013 342 1HB ALA 43 1HB ALA 43 -1.799 -5.268 -37.739 343 2HB ALA 43 2HB ALA 43 -1.922 -6.784 -36.854 344 3HB ALA 43 3HB ALA 43 -1.468 -6.795 -38.559 345 H SER 44 H SER 44 -0.716 -3.780 -36.584 346 HA SER 44 HA SER 44 0.876 -3.117 -34.450 347 1HB SER 44 1HB SER 44 -2.022 -2.354 -34.813 348 2HB SER 44 2HB SER 44 -0.808 -1.459 -33.890 349 HG SER 44 HG SER 44 0.390 -1.475 -35.972 350 H GLY 45 H GLY 45 1.272 -4.598 -32.967 351 1HA GLY 45 1HA GLY 45 0.313 -5.063 -30.638 352 2HA GLY 45 2HA GLY 45 -0.919 -5.933 -31.559 353 H ALA 46 H ALA 46 -0.586 -8.010 -32.008 354 HA ALA 46 HA ALA 46 1.821 -9.130 -32.780 355 1HB ALA 46 1HB ALA 46 0.868 -9.409 -29.957 356 2HB ALA 46 2HB ALA 46 2.474 -8.891 -30.475 357 3HB ALA 46 3HB ALA 46 1.966 -10.583 -30.696 358 H ARG 47 H ARG 47 1.029 -10.967 -33.884 359 HA ARG 47 HA ARG 47 -1.620 -11.527 -33.017 360 1HB ARG 47 1HB ARG 47 -0.666 -11.616 -35.875 361 2HB ARG 47 2HB ARG 47 -2.220 -12.228 -35.354 362 1HG ARG 47 1HG ARG 47 -2.871 -9.994 -34.622 363 2HG ARG 47 2HG ARG 47 -1.301 -9.368 -35.125 364 1HD ARG 47 1HD ARG 47 -2.909 -8.902 -36.857 365 2HD ARG 47 2HD ARG 47 -1.788 -10.127 -37.438 366 HE ARG 47 HE ARG 47 -4.553 -10.601 -36.557 367 1HH1 ARG 47 1HH1 ARG 47 -1.699 -11.790 -38.318 368 2HH1 ARG 47 2HH1 ARG 47 -2.604 -12.868 -39.283 369 1HH2 ARG 47 1HH2 ARG 47 -5.730 -12.147 -37.859 370 2HH2 ARG 47 2HH2 ARG 47 -4.902 -13.132 -38.979 371 H TYR 48 H TYR 48 -1.700 -13.529 -32.203 372 HA TYR 48 HA TYR 48 0.111 -15.695 -33.095 373 1HB TYR 48 1HB TYR 48 -1.644 -15.526 -30.638 374 2HB TYR 48 2HB TYR 48 -0.364 -16.679 -30.993 375 HD1 TYR 48 HD1 TYR 48 -1.118 -13.284 -29.879 376 HD2 TYR 48 HD2 TYR 48 1.975 -16.098 -30.622 377 HE1 TYR 48 HE1 TYR 48 0.453 -11.858 -28.654 378 HE2 TYR 48 HE2 TYR 48 3.567 -14.670 -29.388 379 HH TYR 48 HH TYR 48 2.503 -11.991 -27.505 380 H THR 49 H THR 49 -0.729 -17.022 -34.375 381 HA THR 49 HA THR 49 -3.601 -17.478 -34.277 382 HB THR 49 HB THR 49 -1.969 -16.566 -36.574 383 HG1 THR 49 HG1 THR 49 -3.201 -15.210 -34.865 384 1HG2 THR 49 1HG2 THR 49 -3.495 -18.257 -37.446 385 2HG2 THR 49 2HG2 THR 49 -4.040 -16.672 -37.992 386 3HG2 THR 49 3HG2 THR 49 -4.858 -17.475 -36.651 387 H ASP 50 H ASP 50 -4.054 -19.631 -34.929 388 HA ASP 50 HA ASP 50 -1.641 -21.093 -35.565 389 1HB ASP 50 1HB ASP 50 -2.611 -23.047 -34.579 390 2HB ASP 50 2HB ASP 50 -2.927 -21.723 -33.471 391 H GLY 51 H GLY 51 -4.830 -20.299 -36.520 392 1HA GLY 51 1HA GLY 51 -4.950 -20.380 -39.067 393 2HA GLY 51 2HA GLY 51 -4.706 -22.109 -38.808 394 H ILE 52 H ILE 52 -6.234 -21.989 -36.244 395 HA ILE 52 HA ILE 52 -8.875 -22.036 -37.405 396 HB ILE 52 HB ILE 52 -7.739 -22.947 -34.742 397 1HG1 ILE 52 1HG1 ILE 52 -8.795 -25.159 -35.399 398 2HG1 ILE 52 2HG1 ILE 52 -9.156 -24.425 -36.957 399 1HG2 ILE 52 1HG2 ILE 52 -9.990 -23.647 -34.022 400 2HG2 ILE 52 2HG2 ILE 52 -10.675 -22.901 -35.460 401 3HG2 ILE 52 3HG2 ILE 52 -9.887 -21.899 -34.239 402 1HD1 ILE 52 1HD1 ILE 52 -6.430 -24.890 -35.798 403 2HD1 ILE 52 2HD1 ILE 52 -6.776 -24.153 -37.362 404 3HD1 ILE 52 3HD1 ILE 52 -7.204 -25.840 -37.066 405 H TYR 53 H TYR 53 -7.193 -20.739 -34.592 406 HA TYR 53 HA TYR 53 -9.181 -18.506 -34.439 407 1HB TYR 53 1HB TYR 53 -7.945 -20.132 -32.434 408 2HB TYR 53 2HB TYR 53 -7.299 -18.438 -32.580 409 HD1 TYR 53 HD1 TYR 53 -10.578 -20.152 -32.414 410 HD2 TYR 53 HD2 TYR 53 -8.217 -16.699 -31.897 411 HE1 TYR 53 HE1 TYR 53 -12.547 -18.876 -31.676 412 HE2 TYR 53 HE2 TYR 53 -10.128 -15.481 -31.189 413 HH TYR 53 HH TYR 53 -12.990 -16.900 -30.486 414 H VAL 54 H VAL 54 -8.174 -16.578 -33.736 415 HA VAL 54 HA VAL 54 -5.460 -15.967 -34.614 416 HB VAL 54 HB VAL 54 -8.059 -14.808 -35.038 417 1HG1 VAL 54 1HG1 VAL 54 -6.839 -12.773 -36.187 418 2HG1 VAL 54 2HG1 VAL 54 -5.327 -13.484 -35.624 419 3HG1 VAL 54 3HG1 VAL 54 -6.514 -12.903 -34.458 420 1HG2 VAL 54 1HG2 VAL 54 -7.555 -16.311 -36.783 421 2HG2 VAL 54 2HG2 VAL 54 -5.976 -15.573 -37.068 422 3HG2 VAL 54 3HG2 VAL 54 -7.448 -14.703 -37.500 423 H PHE 55 H PHE 55 -4.555 -15.005 -32.871 424 HA PHE 55 HA PHE 55 -6.279 -13.757 -30.828 425 1HB PHE 55 1HB PHE 55 -5.041 -15.792 -30.073 426 2HB PHE 55 2HB PHE 55 -3.530 -15.003 -30.497 427 HD1 PHE 55 HD1 PHE 55 -2.955 -12.834 -29.175 428 HD2 PHE 55 HD2 PHE 55 -5.953 -15.592 -27.985 429 HE1 PHE 55 HE1 PHE 55 -2.849 -11.965 -26.866 430 HE2 PHE 55 HE2 PHE 55 -5.853 -14.717 -25.702 431 HZ PHE 55 HZ PHE 55 -4.297 -12.900 -25.144 432 H TRP 56 H TRP 56 -6.101 -11.575 -30.910 433 HA TRP 56 HA TRP 56 -3.653 -10.471 -31.964 434 1HB TRP 56 1HB TRP 56 -5.959 -9.884 -32.948 435 2HB TRP 56 2HB TRP 56 -6.226 -9.050 -31.409 436 HD1 TRP 56 HD1 TRP 56 -3.590 -7.500 -30.985 437 HE1 TRP 56 HE1 TRP 56 -2.848 -5.639 -32.578 438 HE3 TRP 56 HE3 TRP 56 -6.356 -8.805 -35.071 439 HZ2 TRP 56 HZ2 TRP 56 -3.392 -4.803 -35.213 440 HZ3 TRP 56 HZ3 TRP 56 -6.201 -7.406 -37.089 441 HH2 TRP 56 HH2 TRP 56 -4.747 -5.448 -37.157 442 H SER 57 H SER 57 -2.453 -9.804 -30.586 443 HA SER 57 HA SER 57 -3.321 -9.204 -27.839 444 1HB SER 57 1HB SER 57 -1.661 -11.116 -28.193 445 2HB SER 57 2HB SER 57 -0.547 -9.901 -28.789 446 HG SER 57 HG SER 57 -0.058 -10.065 -26.663 447 H LYS 58 H LYS 58 -3.649 -6.994 -27.886 448 HA LYS 58 HA LYS 58 -1.826 -5.390 -29.409 449 1HB LYS 58 1HB LYS 58 -4.175 -4.888 -29.457 450 2HB LYS 58 2HB LYS 58 -4.242 -4.838 -27.711 451 1HG LYS 58 1HG LYS 58 -3.147 -2.760 -27.639 452 2HG LYS 58 2HG LYS 58 -2.655 -2.886 -29.336 453 1HD LYS 58 1HD LYS 58 -4.806 -2.602 -30.117 454 2HD LYS 58 2HD LYS 58 -5.518 -2.992 -28.553 455 1HE LYS 58 1HE LYS 58 -3.809 -0.562 -28.986 456 2HE LYS 58 2HE LYS 58 -5.555 -0.522 -29.248 457 1HZ LYS 58 1HZ LYS 58 -5.887 -1.163 -26.977 458 2HZ LYS 58 2HZ LYS 58 -4.961 0.242 -27.008 459 3HZ LYS 58 3HZ LYS 58 -4.246 -1.263 -26.650 460 H GLY 59 H GLY 59 -2.028 -6.744 -26.378 461 1HA GLY 59 1HA GLY 59 -0.050 -6.763 -25.038 462 2HA GLY 59 2HA GLY 59 0.210 -5.076 -25.462 463 H ASP 60 H ASP 60 -2.296 -4.064 -25.049 464 HA ASP 60 HA ASP 60 -2.517 -4.288 -22.157 465 1HB ASP 60 1HB ASP 60 -3.648 -2.164 -22.248 466 2HB ASP 60 2HB ASP 60 -2.116 -2.044 -23.106 467 H GLU 61 H GLU 61 -4.098 -4.990 -25.098 468 HA GLU 61 HA GLU 61 -6.343 -6.144 -23.656 469 1HB GLU 61 1HB GLU 61 -7.872 -5.364 -25.355 470 2HB GLU 61 2HB GLU 61 -7.150 -3.993 -24.501 471 1HG GLU 61 1HG GLU 61 -5.596 -3.769 -26.381 472 2HG GLU 61 2HG GLU 61 -6.490 -5.042 -27.219 473 H ALA 62 H ALA 62 -7.441 -7.672 -24.967 474 HA ALA 62 HA ALA 62 -5.804 -8.792 -27.047 475 1HB ALA 62 1HB ALA 62 -6.922 -10.306 -24.686 476 2HB ALA 62 2HB ALA 62 -5.214 -10.000 -25.006 477 3HB ALA 62 3HB ALA 62 -6.144 -11.047 -26.083 478 H THR 63 H THR 63 -7.039 -9.320 -28.656 479 HA THR 63 HA THR 63 -9.905 -9.812 -28.271 480 HB THR 63 HB THR 63 -8.665 -8.302 -30.592 481 HG1 THR 63 HG1 THR 63 -9.506 -7.508 -28.101 482 1HG2 THR 63 1HG2 THR 63 -11.555 -8.686 -29.755 483 2HG2 THR 63 2HG2 THR 63 -10.768 -9.474 -31.123 484 3HG2 THR 63 3HG2 THR 63 -11.007 -7.728 -31.131 485 H VAL 64 H VAL 64 -10.459 -11.849 -29.188 486 HA VAL 64 HA VAL 64 -8.415 -12.957 -30.899 487 HB VAL 64 HB VAL 64 -8.945 -15.051 -29.839 488 1HG1 VAL 64 1HG1 VAL 64 -8.401 -14.682 -27.526 489 2HG1 VAL 64 2HG1 VAL 64 -8.742 -12.963 -27.726 490 3HG1 VAL 64 3HG1 VAL 64 -7.411 -13.707 -28.611 491 1HG2 VAL 64 1HG2 VAL 64 -11.348 -14.757 -29.677 492 2HG2 VAL 64 2HG2 VAL 64 -11.117 -13.611 -28.356 493 3HG2 VAL 64 3HG2 VAL 64 -10.656 -15.309 -28.152 494 H TYR 65 H TYR 65 -9.279 -13.962 -32.730 495 HA TYR 65 HA TYR 65 -12.145 -13.811 -33.217 496 1HB TYR 65 1HB TYR 65 -11.755 -11.609 -33.599 497 2HB TYR 65 2HB TYR 65 -10.164 -11.884 -34.307 498 HD1 TYR 65 HD1 TYR 65 -13.815 -12.424 -35.006 499 HD2 TYR 65 HD2 TYR 65 -9.957 -11.688 -36.628 500 HE1 TYR 65 HE1 TYR 65 -14.808 -12.115 -37.222 501 HE2 TYR 65 HE2 TYR 65 -10.943 -11.390 -38.855 502 HH TYR 65 HH TYR 65 -12.881 -11.843 -40.090 503 H LYS 66 H LYS 66 -12.211 -15.946 -33.855 504 HA LYS 66 HA LYS 66 -10.760 -16.686 -36.182 505 1HB LYS 66 1HB LYS 66 -11.685 -18.313 -34.461 506 2HB LYS 66 2HB LYS 66 -13.291 -17.784 -34.935 507 1HG LYS 66 1HG LYS 66 -12.751 -18.548 -37.245 508 2HG LYS 66 2HG LYS 66 -11.288 -19.291 -36.581 509 1HD LYS 66 1HD LYS 66 -12.940 -20.298 -34.855 510 2HD LYS 66 2HD LYS 66 -14.104 -19.810 -36.111 511 1HE LYS 66 1HE LYS 66 -11.746 -21.567 -36.728 512 2HE LYS 66 2HE LYS 66 -13.276 -22.248 -36.196 513 1HZ LYS 66 1HZ LYS 66 -12.917 -20.563 -38.628 514 2HZ LYS 66 2HZ LYS 66 -14.332 -21.392 -38.156 515 3HZ LYS 66 3HZ LYS 66 -12.961 -22.234 -38.573 516 H ARG 67 H ARG 67 -12.035 -16.834 -38.003 517 HA ARG 67 HA ARG 67 -13.344 -14.297 -38.533 518 1HB ARG 67 1HB ARG 67 -11.947 -15.350 -40.216 519 2HB ARG 67 2HB ARG 67 -13.072 -16.693 -40.325 520 1HG ARG 67 1HG ARG 67 -14.786 -15.155 -41.158 521 2HG ARG 67 2HG ARG 67 -13.602 -13.839 -41.096 522 1HD ARG 67 1HD ARG 67 -12.146 -15.088 -42.534 523 2HD ARG 67 2HD ARG 67 -13.340 -16.384 -42.589 524 HE ARG 67 HE ARG 67 -14.817 -14.441 -43.489 525 1HH1 ARG 67 1HH1 ARG 67 -11.399 -15.031 -44.301 526 2HH1 ARG 67 2HH1 ARG 67 -11.510 -14.455 -45.888 527 1HH2 ARG 67 1HH2 ARG 67 -14.987 -13.660 -45.704 528 2HH2 ARG 67 2HH2 ARG 67 -13.608 -13.622 -46.706 529 H ASP 68 H ASP 68 -14.321 -17.436 -37.910 530 HA ASP 68 HA ASP 68 -17.097 -16.820 -38.471 531 1HB ASP 68 1HB ASP 68 -16.386 -18.891 -39.465 532 2HB ASP 68 2HB ASP 68 -15.696 -19.440 -37.944 533 H ARG 69 H ARG 69 -14.902 -16.726 -35.873 534 HA ARG 69 HA ARG 69 -17.075 -16.529 -34.165 535 1HB ARG 69 1HB ARG 69 -17.038 -18.934 -34.359 536 2HB ARG 69 2HB ARG 69 -15.392 -18.980 -33.763 537 1HG ARG 69 1HG ARG 69 -17.027 -19.614 -32.018 538 2HG ARG 69 2HG ARG 69 -16.093 -18.163 -31.618 539 1HD ARG 69 1HD ARG 69 -18.635 -18.128 -31.166 540 2HD ARG 69 2HD ARG 69 -17.884 -16.734 -31.934 541 HE ARG 69 HE ARG 69 -18.968 -18.717 -33.730 542 1HH1 ARG 69 1HH1 ARG 69 -19.742 -15.836 -31.838 543 2HH1 ARG 69 2HH1 ARG 69 -20.768 -15.138 -32.986 544 1HH2 ARG 69 1HH2 ARG 69 -20.406 -17.762 -35.370 545 2HH2 ARG 69 2HH2 ARG 69 -21.182 -16.291 -35.076 546 H ILE 70 H ILE 70 -16.229 -14.692 -33.269 547 HA ILE 70 HA ILE 70 -13.744 -14.585 -31.780 548 HB ILE 70 HB ILE 70 -16.288 -12.997 -31.459 549 1HG1 ILE 70 1HG1 ILE 70 -13.822 -12.233 -32.970 550 2HG1 ILE 70 2HG1 ILE 70 -15.348 -12.720 -33.717 551 1HG2 ILE 70 1HG2 ILE 70 -14.878 -12.848 -29.498 552 2HG2 ILE 70 2HG2 ILE 70 -14.958 -11.311 -30.361 553 3HG2 ILE 70 3HG2 ILE 70 -13.517 -12.318 -30.501 554 1HD1 ILE 70 1HD1 ILE 70 -15.097 -10.309 -33.791 555 2HD1 ILE 70 2HD1 ILE 70 -14.838 -10.258 -32.049 556 3HD1 ILE 70 3HD1 ILE 70 -16.410 -10.731 -32.691 557 H VAL 71 H VAL 71 -13.486 -14.952 -29.829 558 HA VAL 71 HA VAL 71 -15.729 -16.155 -28.335 559 HB VAL 71 HB VAL 71 -14.305 -17.832 -27.239 560 1HG1 VAL 71 1HG1 VAL 71 -13.833 -19.310 -29.170 561 2HG1 VAL 71 2HG1 VAL 71 -14.140 -17.969 -30.253 562 3HG1 VAL 71 3HG1 VAL 71 -15.425 -18.563 -29.213 563 1HG2 VAL 71 1HG2 VAL 71 -12.113 -16.671 -27.294 564 2HG2 VAL 71 2HG2 VAL 71 -12.033 -16.939 -29.045 565 3HG2 VAL 71 3HG2 VAL 71 -12.004 -18.299 -27.959 566 H LEU 72 H LEU 72 -13.191 -13.991 -28.325 567 HA LEU 72 HA LEU 72 -13.942 -13.084 -25.698 568 1HB LEU 72 1HB LEU 72 -11.293 -14.220 -26.341 569 2HB LEU 72 2HB LEU 72 -11.276 -12.729 -25.404 570 HG LEU 72 HG LEU 72 -12.709 -15.258 -24.627 571 1HD1 LEU 72 1HD1 LEU 72 -10.892 -15.499 -22.984 572 2HD1 LEU 72 2HD1 LEU 72 -10.085 -14.100 -23.686 573 3HD1 LEU 72 3HD1 LEU 72 -10.295 -15.567 -24.640 574 1HD2 LEU 72 1HD2 LEU 72 -12.886 -14.128 -22.452 575 2HD2 LEU 72 2HD2 LEU 72 -13.706 -13.232 -23.728 576 3HD2 LEU 72 3HD2 LEU 72 -12.131 -12.695 -23.148 577 H ASN 73 H ASN 73 -14.397 -11.022 -26.068 578 HA ASN 73 HA ASN 73 -12.547 -9.479 -27.753 579 1HB ASN 73 1HB ASN 73 -14.271 -8.260 -28.906 580 2HB ASN 73 2HB ASN 73 -14.532 -9.973 -29.110 581 1HD2 ASN 73 1HD2 ASN 73 -16.017 -10.398 -26.510 582 2HD2 ASN 73 2HD2 ASN 73 -17.455 -9.502 -26.733 583 H ASN 74 H ASN 74 -12.888 -9.667 -24.866 584 HA ASN 74 HA ASN 74 -12.383 -6.939 -24.427 585 1HB ASN 74 1HB ASN 74 -14.904 -6.951 -24.105 586 2HB ASN 74 2HB ASN 74 -14.651 -8.060 -22.754 587 1HD2 ASN 74 1HD2 ASN 74 -15.392 -6.606 -21.179 588 2HD2 ASN 74 2HD2 ASN 74 -14.519 -5.191 -20.752 589 H CYS 75 H CYS 75 -10.469 -7.806 -24.051 590 HA CYS 75 HA CYS 75 -10.141 -8.991 -21.441 591 1HB CYS 75 1HB CYS 75 -9.178 -9.936 -24.083 592 2HB CYS 75 2HB CYS 75 -8.132 -10.155 -22.687 593 H GLN 76 H GLN 76 -8.448 -8.056 -20.296 594 HA GLN 76 HA GLN 76 -6.856 -6.161 -21.699 595 1HB GLN 76 1HB GLN 76 -8.728 -5.559 -19.406 596 2HB GLN 76 2HB GLN 76 -7.412 -4.501 -19.906 597 1HG GLN 76 1HG GLN 76 -8.345 -4.155 -22.006 598 2HG GLN 76 2HG GLN 76 -9.564 -5.402 -21.785 599 1HE2 GLN 76 1HE2 GLN 76 -11.318 -4.967 -20.451 600 2HE2 GLN 76 2HE2 GLN 76 -11.764 -3.382 -19.979 601 H LEU 77 H LEU 77 -4.991 -6.406 -21.044 602 HA LEU 77 HA LEU 77 -4.708 -8.426 -19.072 603 1HB LEU 77 1HB LEU 77 -3.520 -8.850 -21.098 604 2HB LEU 77 2HB LEU 77 -2.707 -7.305 -21.018 605 HG LEU 77 HG LEU 77 -1.345 -8.142 -19.087 606 1HD1 LEU 77 1HD1 LEU 77 -2.906 -10.643 -19.462 607 2HD1 LEU 77 2HD1 LEU 77 -2.828 -9.594 -18.048 608 3HD1 LEU 77 3HD1 LEU 77 -1.402 -10.494 -18.555 609 1HD2 LEU 77 1HD2 LEU 77 -0.032 -9.769 -20.359 610 2HD2 LEU 77 2HD2 LEU 77 -0.485 -8.383 -21.348 611 3HD2 LEU 77 3HD2 LEU 77 -1.344 -9.909 -21.533 612 H GLN 78 H GLN 78 -3.780 -8.001 -16.951 613 HA GLN 78 HA GLN 78 -2.755 -5.277 -16.721 614 1HB GLN 78 1HB GLN 78 -4.013 -6.951 -14.555 615 2HB GLN 78 2HB GLN 78 -3.414 -5.311 -14.381 616 1HG GLN 78 1HG GLN 78 -5.793 -6.226 -15.986 617 2HG GLN 78 2HG GLN 78 -5.811 -5.291 -14.497 618 1HE2 GLN 78 1HE2 GLN 78 -7.007 -4.662 -16.995 619 2HE2 GLN 78 2HE2 GLN 78 -6.358 -3.163 -17.529 620 H ASN 79 H ASN 79 -2.032 -8.744 -16.142 621 HA ASN 79 HA ASN 79 0.622 -8.041 -15.742 622 1HB ASN 79 1HB ASN 79 0.934 -8.859 -13.446 623 2HB ASN 79 2HB ASN 79 -0.145 -7.483 -13.475 624 1HD2 ASN 79 1HD2 ASN 79 -2.565 -9.185 -14.222 625 2HD2 ASN 79 2HD2 ASN 79 -2.920 -10.064 -12.813 626 HA PRO 80 HA PRO 80 0.028 -12.034 -17.345 627 1HB PRO 80 1HB PRO 80 2.353 -12.311 -18.776 628 2HB PRO 80 2HB PRO 80 0.906 -11.503 -19.389 629 1HG PRO 80 1HG PRO 80 3.321 -10.294 -18.069 630 2HG PRO 80 2HG PRO 80 2.470 -9.750 -19.529 631 1HD PRO 80 1HD PRO 80 2.011 -8.560 -17.162 632 2HD PRO 80 2HD PRO 80 0.723 -8.882 -18.367 633 H GLN 81 H GLN 81 2.083 -10.847 -15.129 634 HA GLN 81 HA GLN 81 3.284 -13.375 -14.563 635 1HB GLN 81 1HB GLN 81 5.048 -12.113 -13.266 636 2HB GLN 81 2HB GLN 81 5.093 -11.894 -15.010 637 1HG GLN 81 1HG GLN 81 3.874 -9.816 -14.754 638 2HG GLN 81 2HG GLN 81 3.916 -10.051 -13.007 639 1HE2 GLN 81 1HE2 GLN 81 5.827 -9.283 -15.821 640 2HE2 GLN 81 2HE2 GLN 81 7.235 -8.770 -14.961 641 H ARG 82 H ARG 82 1.504 -13.882 -13.713 642 HA ARG 82 HA ARG 82 0.917 -12.880 -11.027 643 1HB ARG 82 1HB ARG 82 -1.524 -13.666 -11.515 644 2HB ARG 82 2HB ARG 82 -0.966 -12.118 -12.106 645 1HG ARG 82 1HG ARG 82 -2.194 -12.981 -13.893 646 2HG ARG 82 2HG ARG 82 -0.537 -13.322 -14.338 647 1HD ARG 82 1HD ARG 82 -2.340 -15.372 -13.043 648 2HD ARG 82 2HD ARG 82 -2.286 -15.124 -14.776 649 HE ARG 82 HE ARG 82 0.296 -15.605 -14.105 650 1HH1 ARG 82 1HH1 ARG 82 -2.721 -17.324 -13.465 651 2HH1 ARG 82 2HH1 ARG 82 -2.029 -18.882 -13.509 652 1HH2 ARG 82 1HH2 ARG 82 1.254 -17.748 -14.185 653 2HH2 ARG 82 2HH2 ARG 82 0.259 -19.124 -13.933 Start of MODEL 11 1 H MET 1 H MET 1 9.115 -22.051 -12.746 2 HA MET 1 HA MET 1 7.660 -20.187 -12.259 3 1HB MET 1 1HB MET 1 8.632 -20.219 -15.145 4 2HB MET 1 2HB MET 1 8.203 -18.785 -14.247 5 1HG MET 1 1HG MET 1 10.581 -18.938 -14.363 6 2HG MET 1 2HG MET 1 10.094 -19.255 -12.701 7 1HE MET 1 1HE MET 1 12.992 -19.909 -13.978 8 2HE MET 1 2HE MET 1 13.310 -21.473 -13.229 9 3HE MET 1 3HE MET 1 12.574 -20.174 -12.286 10 H GLN 2 H GLN 2 5.959 -18.746 -13.309 11 HA GLN 2 HA GLN 2 4.020 -20.419 -14.691 12 1HB GLN 2 1HB GLN 2 3.789 -17.595 -13.586 13 2HB GLN 2 2HB GLN 2 2.525 -18.419 -14.463 14 1HG GLN 2 1HG GLN 2 2.315 -20.060 -12.712 15 2HG GLN 2 2HG GLN 2 3.671 -19.345 -11.841 16 1HE2 GLN 2 1HE2 GLN 2 0.867 -19.706 -11.051 17 2HE2 GLN 2 2HE2 GLN 2 0.287 -18.140 -10.626 18 H THR 3 H THR 3 4.002 -20.354 -16.853 19 HA THR 3 HA THR 3 5.567 -18.539 -18.442 20 HB THR 3 HB THR 3 3.113 -20.025 -19.317 21 HG1 THR 3 HG1 THR 3 5.677 -21.076 -18.607 22 1HG2 THR 3 1HG2 THR 3 4.440 -18.724 -20.925 23 2HG2 THR 3 2HG2 THR 3 4.486 -20.449 -21.305 24 3HG2 THR 3 3HG2 THR 3 5.864 -19.678 -20.516 25 H ASP 4 H ASP 4 5.180 -16.657 -19.008 26 HA ASP 4 HA ASP 4 3.875 -15.023 -17.298 27 1HB ASP 4 1HB ASP 4 5.651 -14.523 -18.791 28 2HB ASP 4 2HB ASP 4 4.570 -14.459 -20.170 29 H THR 5 H THR 5 1.984 -14.407 -16.952 30 HA THR 5 HA THR 5 -0.143 -15.356 -18.801 31 HB THR 5 HB THR 5 -0.151 -15.735 -15.795 32 HG1 THR 5 HG1 THR 5 0.906 -17.194 -17.652 33 1HG2 THR 5 1HG2 THR 5 -2.234 -16.570 -17.813 34 2HG2 THR 5 2HG2 THR 5 -2.426 -15.294 -16.614 35 3HG2 THR 5 3HG2 THR 5 -2.240 -16.972 -16.095 36 H LEU 6 H LEU 6 -1.976 -14.146 -19.118 37 HA LEU 6 HA LEU 6 -1.947 -11.541 -18.182 38 1HB LEU 6 1HB LEU 6 -3.647 -13.134 -20.009 39 2HB LEU 6 2HB LEU 6 -4.315 -11.626 -19.414 40 HG LEU 6 HG LEU 6 -2.178 -10.580 -20.088 41 1HD1 LEU 6 1HD1 LEU 6 -1.687 -13.007 -21.702 42 2HD1 LEU 6 2HD1 LEU 6 -0.733 -12.331 -20.362 43 3HD1 LEU 6 3HD1 LEU 6 -0.867 -11.447 -21.870 44 1HD2 LEU 6 1HD2 LEU 6 -2.823 -10.248 -22.434 45 2HD2 LEU 6 2HD2 LEU 6 -4.173 -10.111 -21.310 46 3HD2 LEU 6 3HD2 LEU 6 -3.972 -11.579 -22.278 47 H GLU 7 H GLU 7 -4.930 -11.175 -17.792 48 HA GLU 7 HA GLU 7 -4.589 -11.008 -15.031 49 1HB GLU 7 1HB GLU 7 -5.880 -9.374 -16.389 50 2HB GLU 7 2HB GLU 7 -7.133 -10.594 -16.622 51 1HG GLU 7 1HG GLU 7 -7.489 -10.715 -14.254 52 2HG GLU 7 2HG GLU 7 -6.201 -9.543 -13.987 53 H TYR 8 H TYR 8 -5.758 -13.247 -17.222 54 HA TYR 8 HA TYR 8 -6.870 -14.917 -17.414 55 1HB TYR 8 1HB TYR 8 -6.356 -16.862 -16.001 56 2HB TYR 8 2HB TYR 8 -4.970 -15.891 -16.444 57 HD1 TYR 8 HD1 TYR 8 -3.653 -14.762 -14.720 58 HD2 TYR 8 HD2 TYR 8 -7.106 -17.006 -13.678 59 HE1 TYR 8 HE1 TYR 8 -2.946 -14.751 -12.369 60 HE2 TYR 8 HE2 TYR 8 -6.415 -16.989 -11.325 61 HH TYR 8 HH TYR 8 -4.140 -14.952 -10.118 62 H GLN 9 H GLN 9 -8.396 -12.868 -15.971 63 HA GLN 9 HA GLN 9 -10.645 -14.466 -15.195 64 1HB GLN 9 1HB GLN 9 -9.270 -12.488 -13.389 65 2HB GLN 9 2HB GLN 9 -10.953 -12.955 -13.174 66 1HG GLN 9 1HG GLN 9 -10.327 -15.202 -12.880 67 2HG GLN 9 2HG GLN 9 -8.636 -14.834 -13.196 68 1HE2 GLN 9 1HE2 GLN 9 -7.438 -13.733 -11.646 69 2HE2 GLN 9 2HE2 GLN 9 -7.954 -13.568 -10.014 70 H CYS 10 H CYS 10 -11.828 -13.726 -16.701 71 HA CYS 10 HA CYS 10 -12.144 -10.841 -16.911 72 1HB CYS 10 1HB CYS 10 -11.740 -12.655 -19.307 73 2HB CYS 10 2HB CYS 10 -12.024 -10.918 -19.372 74 H ASP 11 H ASP 11 -14.111 -10.279 -17.993 75 HA ASP 11 HA ASP 11 -16.320 -11.633 -16.936 76 1HB ASP 11 1HB ASP 11 -16.188 -9.555 -19.104 77 2HB ASP 11 2HB ASP 11 -17.672 -10.075 -18.323 78 H GLU 12 H GLU 12 -14.904 -11.697 -20.152 79 HA GLU 12 HA GLU 12 -17.140 -13.140 -21.125 80 1HB GLU 12 1HB GLU 12 -16.228 -11.404 -22.534 81 2HB GLU 12 2HB GLU 12 -14.633 -12.112 -22.460 82 1HG GLU 12 1HG GLU 12 -15.277 -13.901 -23.885 83 2HG GLU 12 2HG GLU 12 -16.982 -13.502 -23.721 84 H LYS 13 H LYS 13 -13.780 -13.819 -20.268 85 HA LYS 13 HA LYS 13 -14.296 -16.681 -20.104 86 1HB LYS 13 1HB LYS 13 -11.935 -15.808 -21.739 87 2HB LYS 13 2HB LYS 13 -12.668 -17.393 -21.653 88 1HG LYS 13 1HG LYS 13 -13.908 -15.037 -22.870 89 2HG LYS 13 2HG LYS 13 -12.860 -16.088 -23.814 90 1HD LYS 13 1HD LYS 13 -15.499 -16.867 -22.490 91 2HD LYS 13 2HD LYS 13 -15.281 -16.558 -24.202 92 1HE LYS 13 1HE LYS 13 -15.326 -18.895 -24.051 93 2HE LYS 13 2HE LYS 13 -13.615 -18.520 -24.137 94 1HZ LYS 13 1HZ LYS 13 -13.338 -19.075 -21.854 95 2HZ LYS 13 2HZ LYS 13 -14.492 -20.204 -22.426 96 3HZ LYS 13 3HZ LYS 13 -14.989 -18.911 -21.555 97 HA PRO 14 HA PRO 14 -10.808 -15.659 -17.449 98 1HB PRO 14 1HB PRO 14 -9.605 -18.144 -17.201 99 2HB PRO 14 2HB PRO 14 -10.997 -17.638 -16.236 100 1HG PRO 14 1HG PRO 14 -10.901 -19.374 -18.662 101 2HG PRO 14 2HG PRO 14 -11.929 -19.511 -17.227 102 1HD PRO 14 1HD PRO 14 -12.792 -18.481 -19.607 103 2HD PRO 14 2HD PRO 14 -13.465 -18.007 -18.033 104 H LEU 15 H LEU 15 -8.945 -14.644 -18.371 105 HA LEU 15 HA LEU 15 -8.245 -15.523 -21.046 106 1HB LEU 15 1HB LEU 15 -8.908 -13.147 -20.625 107 2HB LEU 15 2HB LEU 15 -7.527 -13.031 -19.551 108 HG LEU 15 HG LEU 15 -6.022 -13.456 -21.479 109 1HD1 LEU 15 1HD1 LEU 15 -6.859 -13.404 -23.711 110 2HD1 LEU 15 2HD1 LEU 15 -8.481 -13.068 -23.142 111 3HD1 LEU 15 3HD1 LEU 15 -7.766 -14.648 -22.834 112 1HD2 LEU 15 1HD2 LEU 15 -7.916 -11.154 -21.830 113 2HD2 LEU 15 2HD2 LEU 15 -6.278 -11.255 -22.476 114 3HD2 LEU 15 3HD2 LEU 15 -6.540 -11.179 -20.730 115 H THR 16 H THR 16 -7.011 -17.244 -20.373 116 HA THR 16 HA THR 16 -4.863 -16.435 -18.694 117 HB THR 16 HB THR 16 -5.628 -19.321 -19.209 118 HG1 THR 16 HG1 THR 16 -7.439 -18.137 -18.436 119 1HG2 THR 16 1HG2 THR 16 -4.268 -17.871 -16.940 120 2HG2 THR 16 2HG2 THR 16 -3.457 -18.896 -18.118 121 3HG2 THR 16 3HG2 THR 16 -4.599 -19.604 -16.966 122 H VAL 17 H VAL 17 -3.075 -16.038 -19.929 123 HA VAL 17 HA VAL 17 -2.585 -17.591 -22.385 124 HB VAL 17 HB VAL 17 -1.449 -14.915 -21.593 125 1HG1 VAL 17 1HG1 VAL 17 -1.359 -16.361 -24.239 126 2HG1 VAL 17 2HG1 VAL 17 0.006 -16.147 -23.156 127 3HG1 VAL 17 3HG1 VAL 17 -0.715 -14.755 -23.947 128 1HG2 VAL 17 1HG2 VAL 17 -3.837 -14.665 -21.973 129 2HG2 VAL 17 2HG2 VAL 17 -3.693 -15.476 -23.533 130 3HG2 VAL 17 3HG2 VAL 17 -2.935 -13.907 -23.284 131 H LYS 18 H LYS 18 -0.614 -18.636 -22.549 132 HA LYS 18 HA LYS 18 1.111 -18.268 -20.258 133 1HB LYS 18 1HB LYS 18 0.697 -20.532 -22.180 134 2HB LYS 18 2HB LYS 18 2.192 -20.394 -21.300 135 1HG LYS 18 1HG LYS 18 0.658 -22.009 -20.304 136 2HG LYS 18 2HG LYS 18 1.047 -20.695 -19.193 137 1HD LYS 18 1HD LYS 18 -1.136 -19.714 -19.585 138 2HD LYS 18 2HD LYS 18 -1.477 -20.919 -20.826 139 1HE LYS 18 1HE LYS 18 -2.556 -21.402 -18.615 140 2HE LYS 18 2HE LYS 18 -1.519 -22.693 -19.208 141 1HZ LYS 18 1HZ LYS 18 -0.725 -20.687 -17.135 142 2HZ LYS 18 2HZ LYS 18 0.196 -22.012 -17.664 143 3HZ LYS 18 3HZ LYS 18 -1.243 -22.258 -16.848 144 H LEU 19 H LEU 19 1.951 -16.410 -21.117 145 HA LEU 19 HA LEU 19 3.004 -16.227 -23.742 146 1HB LEU 19 1HB LEU 19 3.096 -14.722 -21.239 147 2HB LEU 19 2HB LEU 19 4.178 -14.219 -22.534 148 HG LEU 19 HG LEU 19 1.124 -14.287 -22.692 149 1HD1 LEU 19 1HD1 LEU 19 1.243 -11.854 -22.528 150 2HD1 LEU 19 2HD1 LEU 19 2.989 -11.947 -22.294 151 3HD1 LEU 19 3HD1 LEU 19 1.899 -12.610 -21.078 152 1HD2 LEU 19 1HD2 LEU 19 1.407 -12.981 -24.705 153 2HD2 LEU 19 2HD2 LEU 19 2.329 -14.480 -24.860 154 3HD2 LEU 19 3HD2 LEU 19 3.150 -12.979 -24.485 155 H ASN 20 H ASN 20 4.512 -17.515 -24.152 156 HA ASN 20 HA ASN 20 6.433 -18.381 -22.206 157 1HB ASN 20 1HB ASN 20 5.943 -19.795 -24.165 158 2HB ASN 20 2HB ASN 20 6.551 -18.525 -25.225 159 1HD2 ASN 20 1HD2 ASN 20 7.998 -20.021 -26.110 160 2HD2 ASN 20 2HD2 ASN 20 9.428 -20.490 -25.285 161 H ASN 21 H ASN 21 8.414 -17.600 -21.808 162 HA ASN 21 HA ASN 21 8.573 -14.984 -21.425 163 1HB ASN 21 1HB ASN 21 10.919 -16.820 -21.652 164 2HB ASN 21 2HB ASN 21 10.957 -15.226 -20.901 165 1HD2 ASN 21 1HD2 ASN 21 9.755 -14.901 -18.975 166 2HD2 ASN 21 2HD2 ASN 21 9.247 -16.222 -17.998 167 HA PRO 22 HA PRO 22 11.446 -13.792 -25.180 168 1HB PRO 22 1HB PRO 22 10.963 -15.331 -27.430 169 2HB PRO 22 2HB PRO 22 12.379 -15.496 -26.384 170 1HG PRO 22 1HG PRO 22 9.818 -17.005 -26.379 171 2HG PRO 22 2HG PRO 22 11.490 -17.624 -26.221 172 1HD PRO 22 1HD PRO 22 9.918 -17.397 -24.092 173 2HD PRO 22 2HD PRO 22 11.629 -16.926 -23.997 174 H ARG 23 H ARG 23 8.348 -15.174 -25.302 175 HA ARG 23 HA ARG 23 6.447 -14.816 -26.068 176 1HB ARG 23 1HB ARG 23 7.154 -11.924 -25.701 177 2HB ARG 23 2HB ARG 23 5.525 -12.502 -26.090 178 1HG ARG 23 1HG ARG 23 5.567 -13.959 -24.111 179 2HG ARG 23 2HG ARG 23 7.150 -13.345 -23.697 180 1HD ARG 23 1HD ARG 23 4.681 -11.620 -23.882 181 2HD ARG 23 2HD ARG 23 5.249 -12.358 -22.391 182 HE ARG 23 HE ARG 23 7.129 -10.693 -23.803 183 1HH1 ARG 23 1HH1 ARG 23 4.812 -11.003 -21.031 184 2HH1 ARG 23 2HH1 ARG 23 5.281 -9.548 -20.354 185 1HH2 ARG 23 1HH2 ARG 23 7.761 -8.670 -22.733 186 2HH2 ARG 23 2HH2 ARG 23 6.962 -8.208 -21.297 187 H GLN 24 H GLN 24 7.072 -15.926 -27.686 188 HA GLN 24 HA GLN 24 6.307 -14.674 -30.149 189 1HB GLN 24 1HB GLN 24 8.381 -16.858 -29.818 190 2HB GLN 24 2HB GLN 24 7.774 -16.297 -31.363 191 1HG GLN 24 1HG GLN 24 8.748 -14.107 -30.972 192 2HG GLN 24 2HG GLN 24 9.306 -14.621 -29.381 193 1HE2 GLN 24 1HE2 GLN 24 11.047 -16.058 -29.248 194 2HE2 GLN 24 2HE2 GLN 24 12.086 -16.340 -30.590 195 H GLU 25 H GLU 25 5.481 -16.756 -27.738 196 HA GLU 25 HA GLU 25 3.775 -18.432 -29.340 197 1HB GLU 25 1HB GLU 25 6.019 -19.583 -29.266 198 2HB GLU 25 2HB GLU 25 5.855 -19.619 -27.515 199 1HG GLU 25 1HG GLU 25 3.863 -21.022 -27.743 200 2HG GLU 25 2HG GLU 25 4.059 -21.002 -29.496 201 H VAL 26 H VAL 26 2.080 -19.071 -28.160 202 HA VAL 26 HA VAL 26 1.934 -18.604 -25.201 203 HB VAL 26 HB VAL 26 -0.196 -17.576 -25.419 204 1HG1 VAL 26 1HG1 VAL 26 1.800 -16.117 -27.127 205 2HG1 VAL 26 2HG1 VAL 26 1.747 -16.181 -25.369 206 3HG1 VAL 26 3HG1 VAL 26 0.438 -15.386 -26.256 207 1HG2 VAL 26 1HG2 VAL 26 -0.989 -18.535 -27.498 208 2HG2 VAL 26 2HG2 VAL 26 0.206 -17.602 -28.400 209 3HG2 VAL 26 3HG2 VAL 26 -1.109 -16.775 -27.561 210 H SER 27 H SER 27 0.830 -20.008 -24.118 211 HA SER 27 HA SER 27 -0.753 -21.904 -25.689 212 1HB SER 27 1HB SER 27 -0.217 -22.087 -22.701 213 2HB SER 27 2HB SER 27 -0.774 -23.325 -23.809 214 HG SER 27 HG SER 27 1.651 -22.218 -24.483 215 H PHE 28 H PHE 28 -2.831 -21.445 -25.743 216 HA PHE 28 HA PHE 28 -3.800 -19.619 -23.729 217 1HB PHE 28 1HB PHE 28 -3.211 -18.300 -25.646 218 2HB PHE 28 2HB PHE 28 -4.205 -19.326 -26.707 219 HD1 PHE 28 HD1 PHE 28 -4.557 -17.423 -23.553 220 HD2 PHE 28 HD2 PHE 28 -6.185 -18.381 -27.342 221 HE1 PHE 28 HE1 PHE 28 -6.424 -15.967 -23.094 222 HE2 PHE 28 HE2 PHE 28 -8.096 -16.912 -26.906 223 HZ PHE 28 HZ PHE 28 -8.235 -15.693 -24.777 224 H VAL 29 H VAL 29 -6.076 -19.489 -23.775 225 HA VAL 29 HA VAL 29 -7.132 -22.165 -23.769 226 HB VAL 29 HB VAL 29 -6.677 -21.120 -21.638 227 1HG1 VAL 29 1HG1 VAL 29 -7.877 -19.159 -20.802 228 2HG1 VAL 29 2HG1 VAL 29 -8.574 -18.926 -22.409 229 3HG1 VAL 29 3HG1 VAL 29 -6.848 -18.804 -22.192 230 1HG2 VAL 29 1HG2 VAL 29 -9.610 -21.479 -22.212 231 2HG2 VAL 29 2HG2 VAL 29 -8.896 -21.399 -20.593 232 3HG2 VAL 29 3HG2 VAL 29 -8.434 -22.698 -21.696 233 H TYR 30 H TYR 30 -8.373 -22.445 -25.365 234 HA TYR 30 HA TYR 30 -9.922 -20.486 -26.817 235 1HB TYR 30 1HB TYR 30 -9.240 -22.573 -27.906 236 2HB TYR 30 2HB TYR 30 -10.161 -23.509 -26.737 237 HD1 TYR 30 HD1 TYR 30 -10.473 -21.071 -29.516 238 HD2 TYR 30 HD2 TYR 30 -12.442 -23.952 -27.086 239 HE1 TYR 30 HE1 TYR 30 -12.448 -20.958 -30.984 240 HE2 TYR 30 HE2 TYR 30 -14.406 -23.847 -28.535 241 HH TYR 30 HH TYR 30 -15.403 -22.319 -30.032 242 H ASP 31 H ASP 31 -10.620 -22.675 -24.296 243 HA ASP 31 HA ASP 31 -12.636 -21.043 -23.233 244 1HB ASP 31 1HB ASP 31 -13.979 -22.039 -25.028 245 2HB ASP 31 2HB ASP 31 -13.570 -23.653 -24.462 246 H ASN 32 H ASN 32 -12.042 -24.532 -23.406 247 HA ASN 32 HA ASN 32 -10.723 -24.386 -20.834 248 1HB ASN 32 1HB ASN 32 -13.204 -24.817 -20.406 249 2HB ASN 32 2HB ASN 32 -13.013 -26.330 -21.282 250 1HD2 ASN 32 1HD2 ASN 32 -13.564 -27.540 -19.447 251 2HD2 ASN 32 2HD2 ASN 32 -12.480 -27.729 -18.114 252 H GLN 33 H GLN 33 -9.865 -24.748 -23.512 253 HA GLN 33 HA GLN 33 -8.437 -27.207 -23.213 254 1HB GLN 33 1HB GLN 33 -8.781 -27.923 -25.471 255 2HB GLN 33 2HB GLN 33 -10.402 -27.638 -24.862 256 1HG GLN 33 1HG GLN 33 -10.456 -25.502 -25.987 257 2HG GLN 33 2HG GLN 33 -8.786 -25.744 -26.503 258 1HE2 GLN 33 1HE2 GLN 33 -8.356 -27.296 -28.119 259 2HE2 GLN 33 2HE2 GLN 33 -9.554 -27.870 -29.193 260 H LEU 34 H LEU 34 -6.459 -26.981 -24.234 261 HA LEU 34 HA LEU 34 -5.874 -24.163 -24.442 262 1HB LEU 34 1HB LEU 34 -4.229 -26.405 -23.325 263 2HB LEU 34 2HB LEU 34 -3.534 -24.820 -23.636 264 HG LEU 34 HG LEU 34 -3.945 -24.878 -21.305 265 1HD1 LEU 34 1HD1 LEU 34 -5.596 -23.275 -20.815 266 2HD1 LEU 34 2HD1 LEU 34 -6.287 -23.472 -22.418 267 3HD1 LEU 34 3HD1 LEU 34 -4.649 -22.832 -22.237 268 1HD2 LEU 34 1HD2 LEU 34 -6.036 -25.593 -20.255 269 2HD2 LEU 34 2HD2 LEU 34 -5.313 -26.896 -21.193 270 3HD2 LEU 34 3HD2 LEU 34 -6.690 -26.007 -21.840 271 H LEU 35 H LEU 35 -4.823 -23.480 -26.173 272 HA LEU 35 HA LEU 35 -3.694 -25.429 -28.091 273 1HB LEU 35 1HB LEU 35 -5.150 -22.830 -28.640 274 2HB LEU 35 2HB LEU 35 -4.168 -23.629 -29.835 275 HG LEU 35 HG LEU 35 -5.773 -25.536 -29.827 276 1HD1 LEU 35 1HD1 LEU 35 -6.686 -25.269 -27.567 277 2HD1 LEU 35 2HD1 LEU 35 -7.961 -25.247 -28.788 278 3HD1 LEU 35 3HD1 LEU 35 -7.415 -23.741 -28.049 279 1HD2 LEU 35 1HD2 LEU 35 -6.971 -22.853 -30.342 280 2HD2 LEU 35 2HD2 LEU 35 -7.505 -24.397 -31.005 281 3HD2 LEU 35 3HD2 LEU 35 -5.916 -23.758 -31.426 282 H HIS 36 H HIS 36 -1.783 -24.685 -29.150 283 HA HIS 36 HA HIS 36 -0.643 -22.384 -27.810 284 1HB HIS 36 1HB HIS 36 1.647 -23.337 -28.415 285 2HB HIS 36 2HB HIS 36 0.748 -24.158 -27.153 286 HD2 HIS 36 HD2 HIS 36 1.820 -24.750 -30.881 287 HE1 HIS 36 HE1 HIS 36 0.818 -28.424 -29.048 288 HE2 HIS 36 HE2 HIS 36 2.041 -27.335 -30.959 289 H LEU 37 H LEU 37 -0.466 -20.706 -28.816 290 HA LEU 37 HA LEU 37 -0.744 -20.714 -31.740 291 1HB LEU 37 1HB LEU 37 -1.135 -18.441 -29.804 292 2HB LEU 37 2HB LEU 37 -1.364 -18.357 -31.511 293 HG LEU 37 HG LEU 37 -3.302 -20.015 -31.253 294 1HD1 LEU 37 1HD1 LEU 37 -2.721 -21.005 -29.130 295 2HD1 LEU 37 2HD1 LEU 37 -4.306 -20.227 -29.013 296 3HD1 LEU 37 3HD1 LEU 37 -2.883 -19.443 -28.334 297 1HD2 LEU 37 1HD2 LEU 37 -4.881 -18.378 -30.421 298 2HD2 LEU 37 2HD2 LEU 37 -3.691 -17.611 -31.476 299 3HD2 LEU 37 3HD2 LEU 37 -3.560 -17.441 -29.727 300 H LYS 38 H LYS 38 0.590 -19.384 -32.931 301 HA LYS 38 HA LYS 38 3.019 -18.683 -31.477 302 1HB LYS 38 1HB LYS 38 4.300 -19.262 -33.383 303 2HB LYS 38 2HB LYS 38 3.197 -20.589 -32.963 304 1HG LYS 38 1HG LYS 38 1.859 -20.259 -34.817 305 2HG LYS 38 2HG LYS 38 2.447 -18.615 -35.072 306 1HD LYS 38 1HD LYS 38 4.619 -19.499 -35.654 307 2HD LYS 38 2HD LYS 38 4.012 -21.155 -35.492 308 1HE LYS 38 1HE LYS 38 2.345 -20.700 -37.246 309 2HE LYS 38 2HE LYS 38 2.966 -19.062 -37.404 310 1HZ LYS 38 1HZ LYS 38 4.499 -21.541 -37.969 311 2HZ LYS 38 2HZ LYS 38 5.086 -19.983 -38.134 312 3HZ LYS 38 3HZ LYS 38 3.821 -20.514 -39.120 313 H GLN 39 H GLN 39 4.010 -16.891 -32.146 314 HA GLN 39 HA GLN 39 2.316 -14.842 -33.195 315 1HB GLN 39 1HB GLN 39 3.751 -14.240 -31.522 316 2HB GLN 39 2HB GLN 39 5.194 -14.888 -32.334 317 1HG GLN 39 1HG GLN 39 4.861 -13.101 -34.044 318 2HG GLN 39 2HG GLN 39 3.538 -12.471 -33.058 319 1HE2 GLN 39 1HE2 GLN 39 3.994 -11.515 -31.098 320 2HE2 GLN 39 2HE2 GLN 39 5.586 -10.995 -30.695 321 H GLY 40 H GLY 40 1.870 -14.772 -35.074 322 1HA GLY 40 1HA GLY 40 3.729 -14.526 -37.209 323 2HA GLY 40 2HA GLY 40 2.834 -16.054 -37.274 324 H ILE 41 H ILE 41 2.454 -14.196 -39.269 325 HA ILE 41 HA ILE 41 0.811 -13.173 -40.436 326 HB ILE 41 HB ILE 41 -0.704 -14.387 -38.184 327 1HG1 ILE 41 1HG1 ILE 41 -1.957 -15.626 -40.059 328 2HG1 ILE 41 2HG1 ILE 41 -0.742 -14.955 -41.134 329 1HG2 ILE 41 1HG2 ILE 41 -1.965 -12.418 -38.477 330 2HG2 ILE 41 2HG2 ILE 41 -2.930 -13.775 -39.079 331 3HG2 ILE 41 3HG2 ILE 41 -2.118 -12.684 -40.214 332 1HD1 ILE 41 1HD1 ILE 41 -0.247 -16.781 -38.788 333 2HD1 ILE 41 2HD1 ILE 41 0.999 -16.100 -39.830 334 3HD1 ILE 41 3HD1 ILE 41 -0.185 -17.226 -40.494 335 H SER 42 H SER 42 2.168 -12.122 -37.864 336 HA SER 42 HA SER 42 0.534 -10.009 -36.943 337 1HB SER 42 1HB SER 42 2.575 -9.615 -35.522 338 2HB SER 42 2HB SER 42 1.768 -11.186 -35.422 339 HG SER 42 HG SER 42 4.237 -10.922 -35.753 340 H ALA 43 H ALA 43 1.287 -7.764 -36.808 341 HA ALA 43 HA ALA 43 3.024 -6.748 -38.657 342 1HB ALA 43 1HB ALA 43 1.367 -5.590 -40.103 343 2HB ALA 43 2HB ALA 43 0.082 -6.503 -39.313 344 3HB ALA 43 3HB ALA 43 1.294 -7.345 -40.281 345 H SER 44 H SER 44 -0.098 -6.097 -37.095 346 HA SER 44 HA SER 44 1.150 -3.844 -35.708 347 1HB SER 44 1HB SER 44 -0.863 -3.364 -37.224 348 2HB SER 44 2HB SER 44 -1.815 -4.367 -36.133 349 HG SER 44 HG SER 44 -2.089 -2.519 -35.141 350 H GLY 45 H GLY 45 0.752 -3.815 -33.403 351 1HA GLY 45 1HA GLY 45 0.526 -4.803 -31.323 352 2HA GLY 45 2HA GLY 45 -0.696 -5.847 -32.036 353 H ALA 46 H ALA 46 -0.263 -7.927 -31.799 354 HA ALA 46 HA ALA 46 2.164 -9.083 -32.597 355 1HB ALA 46 1HB ALA 46 2.442 -10.228 -30.381 356 2HB ALA 46 2HB ALA 46 1.257 -9.096 -29.709 357 3HB ALA 46 3HB ALA 46 2.798 -8.500 -30.314 358 H ARG 47 H ARG 47 1.415 -10.977 -33.522 359 HA ARG 47 HA ARG 47 -1.244 -11.506 -32.664 360 1HB ARG 47 1HB ARG 47 -0.248 -11.703 -35.514 361 2HB ARG 47 2HB ARG 47 -1.791 -12.358 -34.998 362 1HG ARG 47 1HG ARG 47 -2.547 -10.192 -34.324 363 2HG ARG 47 2HG ARG 47 -0.981 -9.475 -34.725 364 1HD ARG 47 1HD ARG 47 -2.574 -8.990 -36.454 365 2HD ARG 47 2HD ARG 47 -1.394 -10.122 -37.099 366 HE ARG 47 HE ARG 47 -3.381 -11.722 -36.250 367 1HH1 ARG 47 1HH1 ARG 47 -3.356 -8.822 -38.304 368 2HH1 ARG 47 2HH1 ARG 47 -4.627 -9.354 -39.301 369 1HH2 ARG 47 1HH2 ARG 47 -5.191 -12.438 -37.683 370 2HH2 ARG 47 2HH2 ARG 47 -5.669 -11.433 -38.946 371 H TYR 48 H TYR 48 -1.301 -13.441 -31.683 372 HA TYR 48 HA TYR 48 0.482 -15.616 -32.486 373 1HB TYR 48 1HB TYR 48 -1.205 -15.233 -29.983 374 2HB TYR 48 2HB TYR 48 -0.055 -16.530 -30.303 375 HD1 TYR 48 HD1 TYR 48 2.292 -16.215 -29.962 376 HD2 TYR 48 HD2 TYR 48 -0.371 -12.933 -29.504 377 HE1 TYR 48 HE1 TYR 48 4.084 -14.902 -28.909 378 HE2 TYR 48 HE2 TYR 48 1.414 -11.620 -28.453 379 HH TYR 48 HH TYR 48 3.487 -12.009 -27.260 380 H THR 49 H THR 49 -0.442 -17.078 -33.695 381 HA THR 49 HA THR 49 -3.307 -17.487 -33.424 382 HB THR 49 HB THR 49 -1.894 -16.833 -35.980 383 HG1 THR 49 HG1 THR 49 -2.778 -15.254 -34.237 384 1HG2 THR 49 1HG2 THR 49 -3.648 -18.487 -36.405 385 2HG2 THR 49 2HG2 THR 49 -4.131 -16.925 -37.072 386 3HG2 THR 49 3HG2 THR 49 -4.821 -17.489 -35.549 387 H ASP 50 H ASP 50 -3.931 -19.573 -33.896 388 HA ASP 50 HA ASP 50 -1.751 -21.298 -34.758 389 1HB ASP 50 1HB ASP 50 -2.381 -21.734 -32.418 390 2HB ASP 50 2HB ASP 50 -4.051 -21.978 -32.899 391 H GLY 51 H GLY 51 -4.884 -20.167 -35.382 392 1HA GLY 51 1HA GLY 51 -5.573 -20.545 -37.744 393 2HA GLY 51 2HA GLY 51 -5.336 -22.260 -37.410 394 H ILE 52 H ILE 52 -6.374 -22.338 -34.866 395 HA ILE 52 HA ILE 52 -9.156 -22.581 -35.400 396 HB ILE 52 HB ILE 52 -7.586 -22.815 -32.819 397 1HG1 ILE 52 1HG1 ILE 52 -8.151 -25.304 -33.049 398 2HG1 ILE 52 2HG1 ILE 52 -8.755 -24.945 -34.652 399 1HG2 ILE 52 1HG2 ILE 52 -9.583 -23.904 -31.809 400 2HG2 ILE 52 2HG2 ILE 52 -10.502 -23.519 -33.262 401 3HG2 ILE 52 3HG2 ILE 52 -9.880 -22.219 -32.244 402 1HD1 ILE 52 1HD1 ILE 52 -6.527 -25.914 -34.713 403 2HD1 ILE 52 2HD1 ILE 52 -5.909 -24.597 -33.717 404 3HD1 ILE 52 3HD1 ILE 52 -6.513 -24.268 -35.341 405 H TYR 53 H TYR 53 -7.142 -20.226 -33.924 406 HA TYR 53 HA TYR 53 -9.107 -18.321 -34.243 407 1HB TYR 53 1HB TYR 53 -8.943 -17.350 -31.946 408 2HB TYR 53 2HB TYR 53 -10.026 -18.715 -32.146 409 HD1 TYR 53 HD1 TYR 53 -9.667 -18.264 -29.518 410 HD2 TYR 53 HD2 TYR 53 -6.784 -20.085 -32.040 411 HE1 TYR 53 HE1 TYR 53 -8.649 -19.340 -27.580 412 HE2 TYR 53 HE2 TYR 53 -5.772 -21.172 -30.110 413 HH TYR 53 HH TYR 53 -5.644 -20.867 -27.673 414 H VAL 54 H VAL 54 -8.306 -16.154 -33.603 415 HA VAL 54 HA VAL 54 -5.443 -15.888 -34.226 416 HB VAL 54 HB VAL 54 -7.902 -14.344 -34.824 417 1HG1 VAL 54 1HG1 VAL 54 -4.998 -13.686 -35.584 418 2HG1 VAL 54 2HG1 VAL 54 -5.997 -12.766 -34.462 419 3HG1 VAL 54 3HG1 VAL 54 -6.393 -12.785 -36.181 420 1HG2 VAL 54 1HG2 VAL 54 -7.681 -16.225 -36.280 421 2HG2 VAL 54 2HG2 VAL 54 -6.020 -15.789 -36.688 422 3HG2 VAL 54 3HG2 VAL 54 -7.355 -14.771 -37.223 423 H PHE 55 H PHE 55 -4.393 -15.032 -32.435 424 HA PHE 55 HA PHE 55 -5.985 -13.474 -30.515 425 1HB PHE 55 1HB PHE 55 -4.856 -15.526 -29.660 426 2HB PHE 55 2HB PHE 55 -3.313 -14.864 -30.164 427 HD1 PHE 55 HD1 PHE 55 -2.284 -13.042 -28.878 428 HD2 PHE 55 HD2 PHE 55 -5.964 -14.797 -27.680 429 HE1 PHE 55 HE1 PHE 55 -2.020 -12.064 -26.628 430 HE2 PHE 55 HE2 PHE 55 -5.716 -13.812 -25.452 431 HZ PHE 55 HZ PHE 55 -3.740 -12.445 -24.921 432 H TRP 56 H TRP 56 -5.766 -11.321 -30.756 433 HA TRP 56 HA TRP 56 -3.258 -10.335 -31.790 434 1HB TRP 56 1HB TRP 56 -5.186 -9.889 -33.217 435 2HB TRP 56 2HB TRP 56 -5.983 -9.076 -31.857 436 HD1 TRP 56 HD1 TRP 56 -2.361 -8.636 -33.128 437 HE1 TRP 56 HE1 TRP 56 -1.984 -6.208 -33.713 438 HE3 TRP 56 HE3 TRP 56 -7.080 -6.892 -32.246 439 HZ2 TRP 56 HZ2 TRP 56 -3.486 -3.803 -33.797 440 HZ3 TRP 56 HZ3 TRP 56 -7.526 -4.502 -32.604 441 HH2 TRP 56 HH2 TRP 56 -5.768 -2.987 -33.364 442 H SER 57 H SER 57 -2.166 -9.526 -30.475 443 HA SER 57 HA SER 57 -3.153 -8.564 -27.876 444 1HB SER 57 1HB SER 57 -1.623 -10.548 -27.908 445 2HB SER 57 2HB SER 57 -0.402 -9.521 -28.651 446 HG SER 57 HG SER 57 0.065 -8.783 -26.764 447 H LYS 58 H LYS 58 -3.113 -6.380 -27.784 448 HA LYS 58 HA LYS 58 -1.156 -4.987 -29.435 449 1HB LYS 58 1HB LYS 58 -3.408 -3.981 -27.712 450 2HB LYS 58 2HB LYS 58 -2.270 -2.925 -28.546 451 1HG LYS 58 1HG LYS 58 -2.990 -3.726 -30.684 452 2HG LYS 58 2HG LYS 58 -3.992 -4.966 -29.935 453 1HD LYS 58 1HD LYS 58 -5.323 -3.058 -30.714 454 2HD LYS 58 2HD LYS 58 -5.415 -3.255 -28.967 455 1HE LYS 58 1HE LYS 58 -3.712 -1.487 -28.717 456 2HE LYS 58 2HE LYS 58 -3.728 -1.254 -30.466 457 1HZ LYS 58 1HZ LYS 58 -5.998 -0.602 -30.355 458 2HZ LYS 58 2HZ LYS 58 -5.142 0.321 -29.205 459 3HZ LYS 58 3HZ LYS 58 -6.089 -1.005 -28.718 460 H GLY 59 H GLY 59 -1.628 -6.044 -26.271 461 1HA GLY 59 1HA GLY 59 0.843 -5.823 -25.290 462 2HA GLY 59 2HA GLY 59 0.203 -4.198 -25.040 463 H ASP 60 H ASP 60 -1.717 -3.958 -23.837 464 HA ASP 60 HA ASP 60 -2.037 -6.109 -21.891 465 1HB ASP 60 1HB ASP 60 -2.780 -4.437 -20.258 466 2HB ASP 60 2HB ASP 60 -1.190 -4.033 -20.884 467 H GLU 61 H GLU 61 -3.527 -4.812 -24.510 468 HA GLU 61 HA GLU 61 -6.074 -5.825 -23.539 469 1HB GLU 61 1HB GLU 61 -7.158 -4.470 -25.336 470 2HB GLU 61 2HB GLU 61 -6.413 -3.478 -24.091 471 1HG GLU 61 1HG GLU 61 -4.500 -3.161 -25.575 472 2HG GLU 61 2HG GLU 61 -5.348 -4.089 -26.811 473 H ALA 62 H ALA 62 -6.984 -7.421 -24.679 474 HA ALA 62 HA ALA 62 -5.355 -8.387 -26.823 475 1HB ALA 62 1HB ALA 62 -4.696 -9.578 -24.820 476 2HB ALA 62 2HB ALA 62 -5.569 -10.666 -25.903 477 3HB ALA 62 3HB ALA 62 -6.378 -9.988 -24.490 478 H THR 63 H THR 63 -6.535 -9.072 -28.403 479 HA THR 63 HA THR 63 -9.417 -9.583 -28.060 480 HB THR 63 HB THR 63 -8.178 -8.308 -30.513 481 HG1 THR 63 HG1 THR 63 -9.470 -6.988 -28.316 482 1HG2 THR 63 1HG2 THR 63 -10.419 -9.354 -30.740 483 2HG2 THR 63 2HG2 THR 63 -10.478 -7.599 -30.941 484 3HG2 THR 63 3HG2 THR 63 -10.993 -8.329 -29.420 485 H VAL 64 H VAL 64 -9.858 -11.670 -28.688 486 HA VAL 64 HA VAL 64 -8.143 -12.785 -30.712 487 HB VAL 64 HB VAL 64 -7.322 -13.744 -28.712 488 1HG1 VAL 64 1HG1 VAL 64 -10.126 -14.284 -27.893 489 2HG1 VAL 64 2HG1 VAL 64 -8.972 -13.145 -27.198 490 3HG1 VAL 64 3HG1 VAL 64 -8.689 -14.881 -27.056 491 1HG2 VAL 64 1HG2 VAL 64 -7.846 -16.147 -28.920 492 2HG2 VAL 64 2HG2 VAL 64 -7.566 -15.375 -30.478 493 3HG2 VAL 64 3HG2 VAL 64 -9.210 -15.735 -29.960 494 H TYR 65 H TYR 65 -9.102 -13.304 -32.362 495 HA TYR 65 HA TYR 65 -11.963 -13.943 -32.444 496 1HB TYR 65 1HB TYR 65 -12.062 -11.654 -32.645 497 2HB TYR 65 2HB TYR 65 -10.536 -11.546 -33.501 498 HD1 TYR 65 HD1 TYR 65 -10.575 -11.135 -35.786 499 HD2 TYR 65 HD2 TYR 65 -14.074 -12.714 -33.974 500 HE1 TYR 65 HE1 TYR 65 -11.801 -10.810 -37.882 501 HE2 TYR 65 HE2 TYR 65 -15.311 -12.394 -36.070 502 HH TYR 65 HH TYR 65 -15.182 -11.023 -38.093 503 H LYS 66 H LYS 66 -11.950 -15.840 -33.418 504 HA LYS 66 HA LYS 66 -10.393 -16.520 -35.700 505 1HB LYS 66 1HB LYS 66 -11.220 -18.173 -33.993 506 2HB LYS 66 2HB LYS 66 -12.855 -17.665 -34.342 507 1HG LYS 66 1HG LYS 66 -12.379 -18.463 -36.732 508 2HG LYS 66 2HG LYS 66 -11.004 -19.326 -36.013 509 1HD LYS 66 1HD LYS 66 -12.663 -20.265 -34.347 510 2HD LYS 66 2HD LYS 66 -13.896 -19.517 -35.376 511 1HE LYS 66 1HE LYS 66 -13.106 -20.899 -37.276 512 2HE LYS 66 2HE LYS 66 -11.956 -21.679 -36.196 513 1HZ LYS 66 1HZ LYS 66 -13.942 -23.048 -36.450 514 2HZ LYS 66 2HZ LYS 66 -14.924 -21.790 -35.924 515 3HZ LYS 66 3HZ LYS 66 -13.854 -22.498 -34.859 516 H ARG 67 H ARG 67 -11.744 -16.932 -37.528 517 HA ARG 67 HA ARG 67 -13.370 -14.566 -38.129 518 1HB ARG 67 1HB ARG 67 -11.628 -15.452 -39.730 519 2HB ARG 67 2HB ARG 67 -12.676 -16.826 -40.018 520 1HG ARG 67 1HG ARG 67 -12.863 -15.209 -41.801 521 2HG ARG 67 2HG ARG 67 -14.380 -15.363 -40.912 522 1HD ARG 67 1HD ARG 67 -13.971 -13.344 -39.715 523 2HD ARG 67 2HD ARG 67 -12.349 -13.200 -40.387 524 HE ARG 67 HE ARG 67 -14.305 -13.315 -42.426 525 1HH1 ARG 67 1HH1 ARG 67 -13.224 -11.048 -39.969 526 2HH1 ARG 67 2HH1 ARG 67 -13.329 -9.658 -40.935 527 1HH2 ARG 67 1HH2 ARG 67 -14.522 -11.403 -43.810 528 2HH2 ARG 67 2HH2 ARG 67 -14.120 -9.874 -43.202 529 H ASP 68 H ASP 68 -13.968 -17.168 -36.749 530 HA ASP 68 HA ASP 68 -16.788 -17.375 -37.496 531 1HB ASP 68 1HB ASP 68 -15.838 -19.244 -38.608 532 2HB ASP 68 2HB ASP 68 -14.799 -19.632 -37.256 533 H ARG 69 H ARG 69 -14.583 -16.694 -35.084 534 HA ARG 69 HA ARG 69 -16.472 -17.039 -32.983 535 1HB ARG 69 1HB ARG 69 -15.850 -19.383 -33.227 536 2HB ARG 69 2HB ARG 69 -14.162 -18.978 -32.965 537 1HG ARG 69 1HG ARG 69 -14.779 -19.744 -30.882 538 2HG ARG 69 2HG ARG 69 -15.018 -18.010 -30.706 539 1HD ARG 69 1HD ARG 69 -17.119 -20.125 -31.162 540 2HD ARG 69 2HD ARG 69 -16.872 -19.158 -29.718 541 HE ARG 69 HE ARG 69 -17.930 -18.190 -32.285 542 1HH1 ARG 69 1HH1 ARG 69 -17.539 -17.711 -28.802 543 2HH1 ARG 69 2HH1 ARG 69 -18.854 -16.655 -28.639 544 1HH2 ARG 69 1HH2 ARG 69 -19.748 -16.731 -32.072 545 2HH2 ARG 69 2HH2 ARG 69 -20.129 -16.069 -30.546 546 H ILE 70 H ILE 70 -15.969 -15.056 -32.196 547 HA ILE 70 HA ILE 70 -13.342 -14.321 -31.162 548 HB ILE 70 HB ILE 70 -16.069 -13.415 -30.333 549 1HG1 ILE 70 1HG1 ILE 70 -14.184 -12.009 -32.151 550 2HG1 ILE 70 2HG1 ILE 70 -15.609 -12.906 -32.728 551 1HG2 ILE 70 1HG2 ILE 70 -13.410 -12.097 -29.870 552 2HG2 ILE 70 2HG2 ILE 70 -14.360 -13.001 -28.691 553 3HG2 ILE 70 3HG2 ILE 70 -14.994 -11.492 -29.345 554 1HD1 ILE 70 1HD1 ILE 70 -15.565 -10.411 -31.018 555 2HD1 ILE 70 2HD1 ILE 70 -17.018 -11.305 -31.465 556 3HD1 ILE 70 3HD1 ILE 70 -16.051 -10.517 -32.712 557 H VAL 71 H VAL 71 -12.653 -14.852 -29.341 558 HA VAL 71 HA VAL 71 -14.527 -16.300 -27.645 559 HB VAL 71 HB VAL 71 -12.793 -17.670 -26.637 560 1HG1 VAL 71 1HG1 VAL 71 -12.127 -19.038 -28.559 561 2HG1 VAL 71 2HG1 VAL 71 -12.579 -17.715 -29.634 562 3HG1 VAL 71 3HG1 VAL 71 -13.810 -18.508 -28.663 563 1HG2 VAL 71 1HG2 VAL 71 -10.920 -16.113 -26.714 564 2HG2 VAL 71 2HG2 VAL 71 -10.840 -16.309 -28.474 565 3HG2 VAL 71 3HG2 VAL 71 -10.482 -17.672 -27.415 566 H LEU 72 H LEU 72 -12.219 -13.804 -27.857 567 HA LEU 72 HA LEU 72 -13.242 -12.667 -25.396 568 1HB LEU 72 1HB LEU 72 -11.115 -14.115 -24.807 569 2HB LEU 72 2HB LEU 72 -10.289 -12.855 -25.716 570 HG LEU 72 HG LEU 72 -10.365 -12.776 -23.194 571 1HD1 LEU 72 1HD1 LEU 72 -9.314 -11.076 -24.557 572 2HD1 LEU 72 2HD1 LEU 72 -10.283 -10.265 -23.317 573 3HD1 LEU 72 3HD1 LEU 72 -10.883 -10.394 -24.967 574 1HD2 LEU 72 1HD2 LEU 72 -12.127 -11.383 -22.266 575 2HD2 LEU 72 2HD2 LEU 72 -12.747 -12.909 -22.900 576 3HD2 LEU 72 3HD2 LEU 72 -12.964 -11.413 -23.816 577 H ASN 73 H ASN 73 -13.677 -10.680 -26.070 578 HA ASN 73 HA ASN 73 -11.716 -9.552 -27.932 579 1HB ASN 73 1HB ASN 73 -13.337 -8.330 -29.236 580 2HB ASN 73 2HB ASN 73 -13.706 -10.032 -29.275 581 1HD2 ASN 73 1HD2 ASN 73 -15.187 -10.049 -26.622 582 2HD2 ASN 73 2HD2 ASN 73 -16.573 -9.096 -26.939 583 H ASN 74 H ASN 74 -12.394 -9.256 -25.050 584 HA ASN 74 HA ASN 74 -11.435 -6.661 -24.843 585 1HB ASN 74 1HB ASN 74 -13.649 -5.935 -25.542 586 2HB ASN 74 2HB ASN 74 -14.397 -6.844 -24.242 587 1HD2 ASN 74 1HD2 ASN 74 -14.489 -5.933 -22.255 588 2HD2 ASN 74 2HD2 ASN 74 -13.942 -4.353 -21.864 589 H CYS 75 H CYS 75 -10.051 -7.813 -23.553 590 HA CYS 75 HA CYS 75 -10.903 -7.394 -20.836 591 1HB CYS 75 1HB CYS 75 -10.950 -9.912 -21.136 592 2HB CYS 75 2HB CYS 75 -9.255 -9.825 -21.618 593 H GLN 76 H GLN 76 -8.818 -6.991 -19.454 594 HA GLN 76 HA GLN 76 -6.859 -5.889 -21.136 595 1HB GLN 76 1HB GLN 76 -8.719 -4.175 -19.466 596 2HB GLN 76 2HB GLN 76 -7.205 -3.603 -20.167 597 1HG GLN 76 1HG GLN 76 -7.996 -4.054 -22.375 598 2HG GLN 76 2HG GLN 76 -9.489 -4.736 -21.798 599 1HE2 GLN 76 1HE2 GLN 76 -11.016 -3.288 -20.861 600 2HE2 GLN 76 2HE2 GLN 76 -10.992 -1.596 -21.209 601 H LEU 77 H LEU 77 -5.198 -6.106 -20.249 602 HA LEU 77 HA LEU 77 -5.136 -7.852 -18.150 603 1HB LEU 77 1HB LEU 77 -3.815 -8.291 -19.943 604 2HB LEU 77 2HB LEU 77 -3.199 -6.672 -20.030 605 HG LEU 77 HG LEU 77 -1.673 -7.203 -18.104 606 1HD1 LEU 77 1HD1 LEU 77 -2.929 -8.806 -16.967 607 2HD1 LEU 77 2HD1 LEU 77 -1.410 -9.539 -17.498 608 3HD1 LEU 77 3HD1 LEU 77 -2.926 -9.872 -18.355 609 1HD2 LEU 77 1HD2 LEU 77 -0.329 -8.855 -19.475 610 2HD2 LEU 77 2HD2 LEU 77 -0.780 -7.347 -20.244 611 3HD2 LEU 77 3HD2 LEU 77 -1.657 -8.811 -20.644 612 H GLN 78 H GLN 78 -4.064 -7.645 -16.046 613 HA GLN 78 HA GLN 78 -3.662 -4.973 -15.057 614 1HB GLN 78 1HB GLN 78 -3.173 -7.645 -13.727 615 2HB GLN 78 2HB GLN 78 -3.141 -6.084 -12.922 616 1HG GLN 78 1HG GLN 78 -5.520 -7.320 -14.270 617 2HG GLN 78 2HG GLN 78 -5.226 -7.257 -12.534 618 1HE2 GLN 78 1HE2 GLN 78 -7.311 -6.171 -14.245 619 2HE2 GLN 78 2HE2 GLN 78 -7.423 -4.479 -13.854 620 H ASN 79 H ASN 79 -1.558 -7.894 -15.153 621 HA ASN 79 HA ASN 79 0.675 -6.571 -16.208 622 1HB ASN 79 1HB ASN 79 0.711 -5.507 -13.976 623 2HB ASN 79 2HB ASN 79 0.655 -7.090 -13.211 624 1HD2 ASN 79 1HD2 ASN 79 2.602 -4.764 -14.880 625 2HD2 ASN 79 2HD2 ASN 79 4.114 -5.524 -14.546 626 HA PRO 80 HA PRO 80 0.444 -10.887 -16.705 627 1HB PRO 80 1HB PRO 80 2.306 -11.260 -18.652 628 2HB PRO 80 2HB PRO 80 0.700 -10.587 -18.953 629 1HG PRO 80 1HG PRO 80 3.305 -9.164 -18.546 630 2HG PRO 80 2HG PRO 80 2.048 -8.853 -19.759 631 1HD PRO 80 1HD PRO 80 2.261 -7.366 -17.501 632 2HD PRO 80 2HD PRO 80 0.704 -7.753 -18.286 633 H GLN 81 H GLN 81 3.413 -9.239 -16.005 634 HA GLN 81 HA GLN 81 4.884 -11.613 -15.603 635 1HB GLN 81 1HB GLN 81 6.778 -10.111 -14.940 636 2HB GLN 81 2HB GLN 81 6.121 -9.820 -16.545 637 1HG GLN 81 1HG GLN 81 4.764 -8.019 -15.587 638 2HG GLN 81 2HG GLN 81 5.607 -8.280 -14.068 639 1HE2 GLN 81 1HE2 GLN 81 7.791 -7.697 -13.909 640 2HE2 GLN 81 2HE2 GLN 81 8.568 -6.674 -15.051 641 H ARG 82 H ARG 82 3.628 -12.440 -14.204 642 HA ARG 82 HA ARG 82 3.375 -11.574 -11.463 643 1HB ARG 82 1HB ARG 82 2.799 -14.256 -12.734 644 2HB ARG 82 2HB ARG 82 2.453 -13.866 -11.057 645 1HG ARG 82 1HG ARG 82 0.916 -12.105 -11.779 646 2HG ARG 82 2HG ARG 82 1.260 -12.500 -13.465 647 1HD ARG 82 1HD ARG 82 -0.851 -13.493 -12.629 648 2HD ARG 82 2HD ARG 82 0.310 -14.696 -13.186 649 HE ARG 82 HE ARG 82 0.762 -15.290 -10.978 650 1HH1 ARG 82 1HH1 ARG 82 -1.908 -12.916 -11.151 651 2HH1 ARG 82 2HH1 ARG 82 -2.564 -13.334 -9.649 652 1HH2 ARG 82 1HH2 ARG 82 -0.161 -15.854 -8.892 653 2HH2 ARG 82 2HH2 ARG 82 -1.561 -15.067 -8.336 Start of MODEL 12 1 H MET 1 H MET 1 9.716 -19.389 -13.633 2 HA MET 1 HA MET 1 7.668 -21.297 -14.555 3 1HB MET 1 1HB MET 1 6.815 -19.606 -12.931 4 2HB MET 1 2HB MET 1 7.485 -18.330 -13.931 5 1HG MET 1 1HG MET 1 5.098 -18.518 -14.245 6 2HG MET 1 2HG MET 1 5.956 -18.921 -15.730 7 1HE MET 1 1HE MET 1 2.881 -19.568 -15.268 8 2HE MET 1 2HE MET 1 2.795 -21.200 -15.932 9 3HE MET 1 3HE MET 1 3.767 -19.971 -16.737 10 H GLN 2 H GLN 2 8.044 -21.701 -16.645 11 HA GLN 2 HA GLN 2 9.794 -19.941 -18.170 12 1HB GLN 2 1HB GLN 2 8.562 -22.573 -18.994 13 2HB GLN 2 2HB GLN 2 9.864 -21.714 -19.800 14 1HG GLN 2 1HG GLN 2 11.301 -22.097 -17.852 15 2HG GLN 2 2HG GLN 2 9.989 -23.001 -17.090 16 1HE2 GLN 2 1HE2 GLN 2 11.147 -24.899 -17.031 17 2HE2 GLN 2 2HE2 GLN 2 11.464 -25.845 -18.443 18 H THR 3 H THR 3 6.634 -19.874 -17.608 19 HA THR 3 HA THR 3 6.042 -18.909 -20.297 20 HB THR 3 HB THR 3 3.621 -19.825 -19.028 21 HG1 THR 3 HG1 THR 3 4.789 -22.161 -19.455 22 1HG2 THR 3 1HG2 THR 3 3.492 -21.161 -21.064 23 2HG2 THR 3 2HG2 THR 3 5.201 -20.836 -21.396 24 3HG2 THR 3 3HG2 THR 3 4.026 -19.514 -21.408 25 H ASP 4 H ASP 4 5.029 -17.000 -20.394 26 HA ASP 4 HA ASP 4 4.506 -15.667 -17.872 27 1HB ASP 4 1HB ASP 4 4.375 -14.541 -20.715 28 2HB ASP 4 2HB ASP 4 4.222 -13.608 -19.237 29 H THR 5 H THR 5 2.303 -14.718 -17.572 30 HA THR 5 HA THR 5 0.325 -15.861 -19.307 31 HB THR 5 HB THR 5 0.414 -16.624 -16.368 32 HG1 THR 5 HG1 THR 5 1.321 -17.718 -18.591 33 1HG2 THR 5 1HG2 THR 5 -1.693 -17.283 -18.438 34 2HG2 THR 5 2HG2 THR 5 -1.914 -16.182 -17.080 35 3HG2 THR 5 3HG2 THR 5 -1.644 -17.901 -16.787 36 H LEU 6 H LEU 6 -1.583 -14.805 -19.401 37 HA LEU 6 HA LEU 6 -1.407 -12.176 -18.516 38 1HB LEU 6 1HB LEU 6 -3.025 -13.708 -20.459 39 2HB LEU 6 2HB LEU 6 -3.675 -12.164 -19.984 40 HG LEU 6 HG LEU 6 -1.381 -11.266 -20.465 41 1HD1 LEU 6 1HD1 LEU 6 -0.002 -12.226 -22.059 42 2HD1 LEU 6 2HD1 LEU 6 -1.031 -13.632 -22.214 43 3HD1 LEU 6 3HD1 LEU 6 -0.172 -13.318 -20.687 44 1HD2 LEU 6 1HD2 LEU 6 -3.155 -12.124 -22.736 45 2HD2 LEU 6 2HD2 LEU 6 -1.888 -10.892 -22.836 46 3HD2 LEU 6 3HD2 LEU 6 -3.275 -10.641 -21.782 47 H GLU 7 H GLU 7 -4.369 -11.769 -18.423 48 HA GLU 7 HA GLU 7 -4.388 -11.167 -15.698 49 1HB GLU 7 1HB GLU 7 -5.692 -10.528 -18.068 50 2HB GLU 7 2HB GLU 7 -6.941 -11.130 -16.982 51 1HG GLU 7 1HG GLU 7 -4.916 -9.203 -16.183 52 2HG GLU 7 2HG GLU 7 -6.381 -8.679 -17.038 53 H TYR 8 H TYR 8 -5.380 -13.620 -17.617 54 HA TYR 8 HA TYR 8 -6.681 -15.251 -17.653 55 1HB TYR 8 1HB TYR 8 -6.617 -16.930 -15.705 56 2HB TYR 8 2HB TYR 8 -5.086 -16.428 -16.374 57 HD1 TYR 8 HD1 TYR 8 -3.445 -15.353 -14.995 58 HD2 TYR 8 HD2 TYR 8 -7.322 -16.139 -13.442 59 HE1 TYR 8 HE1 TYR 8 -2.625 -14.880 -12.730 60 HE2 TYR 8 HE2 TYR 8 -6.506 -15.659 -11.167 61 HH TYR 8 HH TYR 8 -3.527 -14.184 -10.527 62 H GLN 9 H GLN 9 -8.156 -12.900 -17.247 63 HA GLN 9 HA GLN 9 -10.513 -13.794 -16.080 64 1HB GLN 9 1HB GLN 9 -9.565 -13.160 -14.064 65 2HB GLN 9 2HB GLN 9 -8.650 -11.847 -14.796 66 1HG GLN 9 1HG GLN 9 -10.669 -10.675 -15.189 67 2HG GLN 9 2HG GLN 9 -11.609 -11.931 -14.369 68 1HE2 GLN 9 1HE2 GLN 9 -9.251 -9.369 -13.957 69 2HE2 GLN 9 2HE2 GLN 9 -9.397 -9.231 -12.261 70 H CYS 10 H CYS 10 -11.767 -13.116 -17.638 71 HA CYS 10 HA CYS 10 -11.727 -10.341 -18.416 72 1HB CYS 10 1HB CYS 10 -11.751 -12.752 -20.244 73 2HB CYS 10 2HB CYS 10 -12.251 -11.131 -20.820 74 H ASP 11 H ASP 11 -14.132 -10.192 -19.737 75 HA ASP 11 HA ASP 11 -15.880 -10.873 -17.559 76 1HB ASP 11 1HB ASP 11 -16.624 -9.868 -20.299 77 2HB ASP 11 2HB ASP 11 -17.705 -9.967 -18.925 78 H GLU 12 H GLU 12 -15.651 -11.833 -20.905 79 HA GLU 12 HA GLU 12 -17.832 -13.633 -20.746 80 1HB GLU 12 1HB GLU 12 -15.742 -13.718 -22.882 81 2HB GLU 12 2HB GLU 12 -17.453 -14.089 -23.000 82 1HG GLU 12 1HG GLU 12 -17.593 -12.021 -23.902 83 2HG GLU 12 2HG GLU 12 -17.533 -11.616 -22.167 84 H LYS 13 H LYS 13 -14.377 -13.987 -20.674 85 HA LYS 13 HA LYS 13 -14.644 -16.810 -19.934 86 1HB LYS 13 1HB LYS 13 -12.661 -16.102 -22.080 87 2HB LYS 13 2HB LYS 13 -13.351 -17.660 -21.707 88 1HG LYS 13 1HG LYS 13 -15.521 -16.179 -22.551 89 2HG LYS 13 2HG LYS 13 -14.219 -15.592 -23.565 90 1HD LYS 13 1HD LYS 13 -15.333 -17.483 -24.668 91 2HD LYS 13 2HD LYS 13 -13.694 -17.949 -24.214 92 1HE LYS 13 1HE LYS 13 -14.498 -19.133 -22.279 93 2HE LYS 13 2HE LYS 13 -16.142 -18.544 -22.551 94 1HZ LYS 13 1HZ LYS 13 -14.622 -20.349 -24.346 95 2HZ LYS 13 2HZ LYS 13 -16.256 -19.872 -24.513 96 3HZ LYS 13 3HZ LYS 13 -15.799 -20.847 -23.225 97 HA PRO 14 HA PRO 14 -11.000 -15.366 -17.963 98 1HB PRO 14 1HB PRO 14 -9.486 -17.591 -17.505 99 2HB PRO 14 2HB PRO 14 -10.971 -17.257 -16.608 100 1HG PRO 14 1HG PRO 14 -10.518 -19.129 -18.883 101 2HG PRO 14 2HG PRO 14 -11.581 -19.308 -17.479 102 1HD PRO 14 1HD PRO 14 -12.391 -18.527 -20.023 103 2HD PRO 14 2HD PRO 14 -13.308 -18.253 -18.531 104 H LEU 15 H LEU 15 -8.549 -15.155 -18.317 105 HA LEU 15 HA LEU 15 -7.924 -15.574 -21.155 106 1HB LEU 15 1HB LEU 15 -8.448 -13.224 -20.629 107 2HB LEU 15 2HB LEU 15 -7.163 -13.236 -19.437 108 HG LEU 15 HG LEU 15 -5.548 -13.700 -21.255 109 1HD1 LEU 15 1HD1 LEU 15 -7.900 -13.179 -23.052 110 2HD1 LEU 15 2HD1 LEU 15 -7.007 -14.693 -22.852 111 3HD1 LEU 15 3HD1 LEU 15 -6.209 -13.290 -23.564 112 1HD2 LEU 15 1HD2 LEU 15 -5.694 -11.493 -20.444 113 2HD2 LEU 15 2HD2 LEU 15 -7.208 -11.236 -21.270 114 3HD2 LEU 15 3HD2 LEU 15 -5.707 -11.346 -22.213 115 H THR 16 H THR 16 -7.093 -17.531 -19.839 116 HA THR 16 HA THR 16 -4.567 -16.920 -18.653 117 HB THR 16 HB THR 16 -5.609 -19.723 -19.093 118 HG1 THR 16 HG1 THR 16 -6.877 -19.375 -17.148 119 1HG2 THR 16 1HG2 THR 16 -4.509 -20.041 -16.893 120 2HG2 THR 16 2HG2 THR 16 -4.131 -18.306 -16.880 121 3HG2 THR 16 3HG2 THR 16 -3.387 -19.352 -18.078 122 H VAL 17 H VAL 17 -3.103 -16.499 -20.061 123 HA VAL 17 HA VAL 17 -2.989 -17.907 -22.646 124 HB VAL 17 HB VAL 17 -1.981 -15.205 -21.806 125 1HG1 VAL 17 1HG1 VAL 17 -1.272 -14.886 -24.149 126 2HG1 VAL 17 2HG1 VAL 17 -1.906 -16.472 -24.528 127 3HG1 VAL 17 3HG1 VAL 17 -0.468 -16.341 -23.527 128 1HG2 VAL 17 1HG2 VAL 17 -4.136 -15.965 -23.754 129 2HG2 VAL 17 2HG2 VAL 17 -3.601 -14.320 -23.399 130 3HG2 VAL 17 3HG2 VAL 17 -4.381 -15.291 -22.146 131 H LYS 18 H LYS 18 -1.175 -18.964 -23.106 132 HA LYS 18 HA LYS 18 0.901 -18.903 -21.059 133 1HB LYS 18 1HB LYS 18 0.300 -20.820 -23.307 134 2HB LYS 18 2HB LYS 18 1.843 -20.824 -22.503 135 1HG LYS 18 1HG LYS 18 0.289 -22.605 -21.740 136 2HG LYS 18 2HG LYS 18 0.862 -21.558 -20.447 137 1HD LYS 18 1HD LYS 18 -1.154 -20.509 -20.245 138 2HD LYS 18 2HD LYS 18 -1.760 -21.056 -21.817 139 1HE LYS 18 1HE LYS 18 -2.844 -22.270 -19.960 140 2HE LYS 18 2HE LYS 18 -1.881 -23.342 -20.968 141 1HZ LYS 18 1HZ LYS 18 -1.586 -23.787 -18.622 142 2HZ LYS 18 2HZ LYS 18 -1.040 -22.228 -18.345 143 3HZ LYS 18 3HZ LYS 18 -0.134 -23.276 -19.299 144 H LEU 19 H LEU 19 1.679 -16.905 -21.679 145 HA LEU 19 HA LEU 19 2.611 -16.455 -24.330 146 1HB LEU 19 1HB LEU 19 2.844 -15.112 -21.728 147 2HB LEU 19 2HB LEU 19 4.182 -14.839 -22.845 148 HG LEU 19 HG LEU 19 1.268 -14.157 -23.327 149 1HD1 LEU 19 1HD1 LEU 19 2.053 -11.849 -23.068 150 2HD1 LEU 19 2HD1 LEU 19 3.678 -12.440 -22.719 151 3HD1 LEU 19 3HD1 LEU 19 2.360 -12.786 -21.602 152 1HD2 LEU 19 1HD2 LEU 19 2.085 -12.999 -25.290 153 2HD2 LEU 19 2HD2 LEU 19 2.584 -14.690 -25.394 154 3HD2 LEU 19 3HD2 LEU 19 3.738 -13.455 -24.910 155 H ASN 20 H ASN 20 3.899 -17.820 -25.001 156 HA ASN 20 HA ASN 20 5.822 -19.202 -23.344 157 1HB ASN 20 1HB ASN 20 4.941 -20.033 -25.640 158 2HB ASN 20 2HB ASN 20 6.076 -18.861 -26.326 159 1HD2 ASN 20 1HD2 ASN 20 7.278 -20.591 -27.322 160 2HD2 ASN 20 2HD2 ASN 20 8.289 -21.595 -26.351 161 H ASN 21 H ASN 21 7.885 -18.540 -22.863 162 HA ASN 21 HA ASN 21 8.268 -15.841 -22.694 163 1HB ASN 21 1HB ASN 21 9.455 -17.651 -21.371 164 2HB ASN 21 2HB ASN 21 10.638 -17.657 -22.685 165 1HD2 ASN 21 1HD2 ASN 21 8.855 -14.894 -21.226 166 2HD2 ASN 21 2HD2 ASN 21 10.254 -14.058 -20.747 167 HA PRO 22 HA PRO 22 11.301 -15.689 -26.612 168 1HB PRO 22 1HB PRO 22 9.806 -17.646 -28.283 169 2HB PRO 22 2HB PRO 22 11.540 -17.330 -28.232 170 1HG PRO 22 1HG PRO 22 10.559 -19.537 -27.133 171 2HG PRO 22 2HG PRO 22 11.859 -18.632 -26.339 172 1HD PRO 22 1HD PRO 22 8.952 -18.729 -25.685 173 2HD PRO 22 2HD PRO 22 10.355 -18.688 -24.598 174 H ARG 23 H ARG 23 7.969 -16.242 -26.337 175 HA ARG 23 HA ARG 23 6.099 -15.420 -27.030 176 1HB ARG 23 1HB ARG 23 7.699 -12.904 -27.209 177 2HB ARG 23 2HB ARG 23 5.927 -12.990 -27.239 178 1HG ARG 23 1HG ARG 23 5.865 -14.017 -25.100 179 2HG ARG 23 2HG ARG 23 7.601 -14.165 -25.049 180 1HD ARG 23 1HD ARG 23 7.767 -11.663 -25.076 181 2HD ARG 23 2HD ARG 23 6.008 -11.598 -24.932 182 HE ARG 23 HE ARG 23 6.748 -13.182 -22.854 183 1HH1 ARG 23 1HH1 ARG 23 7.824 -9.939 -23.813 184 2HH1 ARG 23 2HH1 ARG 23 8.137 -9.437 -22.227 185 1HH2 ARG 23 1HH2 ARG 23 7.240 -12.549 -20.770 186 2HH2 ARG 23 2HH2 ARG 23 7.818 -10.978 -20.415 187 H GLN 24 H GLN 24 6.672 -16.850 -28.723 188 HA GLN 24 HA GLN 24 6.039 -15.522 -31.179 189 1HB GLN 24 1HB GLN 24 7.461 -18.174 -30.844 190 2HB GLN 24 2HB GLN 24 7.085 -17.416 -32.379 191 1HG GLN 24 1HG GLN 24 8.604 -15.591 -31.887 192 2HG GLN 24 2HG GLN 24 8.918 -16.263 -30.289 193 1HE2 GLN 24 1HE2 GLN 24 10.118 -18.160 -30.127 194 2HE2 GLN 24 2HE2 GLN 24 11.149 -18.690 -31.395 195 H GLU 25 H GLU 25 4.929 -17.269 -28.633 196 HA GLU 25 HA GLU 25 2.726 -18.486 -30.057 197 1HB GLU 25 1HB GLU 25 4.707 -20.022 -28.445 198 2HB GLU 25 2HB GLU 25 3.031 -20.518 -28.524 199 1HG GLU 25 1HG GLU 25 3.169 -20.793 -30.846 200 2HG GLU 25 2HG GLU 25 4.856 -20.219 -30.897 201 H VAL 26 H VAL 26 1.017 -18.646 -28.910 202 HA VAL 26 HA VAL 26 1.057 -18.443 -25.948 203 HB VAL 26 HB VAL 26 -0.943 -17.198 -25.931 204 1HG1 VAL 26 1HG1 VAL 26 1.137 -15.771 -27.548 205 2HG1 VAL 26 2HG1 VAL 26 1.005 -15.866 -25.789 206 3HG1 VAL 26 3HG1 VAL 26 -0.201 -14.976 -26.718 207 1HG2 VAL 26 1HG2 VAL 26 -2.018 -17.835 -27.981 208 2HG2 VAL 26 2HG2 VAL 26 -0.783 -17.002 -28.920 209 3HG2 VAL 26 3HG2 VAL 26 -1.908 -16.071 -27.928 210 H SER 27 H SER 27 0.155 -20.031 -25.069 211 HA SER 27 HA SER 27 -1.829 -21.454 -26.661 212 1HB SER 27 1HB SER 27 -0.700 -22.324 -23.966 213 2HB SER 27 2HB SER 27 -1.723 -23.228 -25.077 214 HG SER 27 HG SER 27 0.516 -22.315 -26.309 215 H PHE 28 H PHE 28 -3.741 -20.853 -26.409 216 HA PHE 28 HA PHE 28 -4.402 -19.323 -24.054 217 1HB PHE 28 1HB PHE 28 -4.307 -17.743 -25.573 218 2HB PHE 28 2HB PHE 28 -4.754 -18.756 -26.953 219 HD1 PHE 28 HD1 PHE 28 -7.020 -18.807 -27.677 220 HD2 PHE 28 HD2 PHE 28 -6.012 -16.831 -24.045 221 HE1 PHE 28 HE1 PHE 28 -9.268 -17.840 -27.588 222 HE2 PHE 28 HE2 PHE 28 -8.258 -15.862 -23.953 223 HZ PHE 28 HZ PHE 28 -9.895 -16.367 -25.726 224 H VAL 29 H VAL 29 -6.602 -19.249 -23.634 225 HA VAL 29 HA VAL 29 -7.608 -21.942 -23.618 226 HB VAL 29 HB VAL 29 -6.904 -20.943 -21.525 227 1HG1 VAL 29 1HG1 VAL 29 -8.078 -19.097 -20.457 228 2HG1 VAL 29 2HG1 VAL 29 -9.011 -18.854 -21.939 229 3HG1 VAL 29 3HG1 VAL 29 -7.278 -18.615 -21.960 230 1HG2 VAL 29 1HG2 VAL 29 -9.864 -21.466 -21.732 231 2HG2 VAL 29 2HG2 VAL 29 -8.953 -21.384 -20.217 232 3HG2 VAL 29 3HG2 VAL 29 -8.554 -22.616 -21.416 233 H TYR 30 H TYR 30 -9.024 -22.269 -24.980 234 HA TYR 30 HA TYR 30 -10.830 -20.317 -26.107 235 1HB TYR 30 1HB TYR 30 -10.312 -22.212 -27.505 236 2HB TYR 30 2HB TYR 30 -10.839 -23.343 -26.266 237 HD1 TYR 30 HD1 TYR 30 -12.107 -20.647 -28.506 238 HD2 TYR 30 HD2 TYR 30 -13.047 -24.148 -26.283 239 HE1 TYR 30 HE1 TYR 30 -14.360 -20.671 -29.493 240 HE2 TYR 30 HE2 TYR 30 -15.300 -24.177 -27.270 241 HH TYR 30 HH TYR 30 -16.866 -22.487 -28.290 242 H ASP 31 H ASP 31 -10.969 -22.647 -23.588 243 HA ASP 31 HA ASP 31 -13.188 -21.403 -22.365 244 1HB ASP 31 1HB ASP 31 -14.328 -22.667 -24.181 245 2HB ASP 31 2HB ASP 31 -13.667 -24.158 -23.529 246 H ASN 32 H ASN 32 -12.091 -24.788 -22.606 247 HA ASN 32 HA ASN 32 -10.696 -24.499 -20.066 248 1HB ASN 32 1HB ASN 32 -13.079 -25.420 -19.733 249 2HB ASN 32 2HB ASN 32 -12.565 -26.827 -20.646 250 1HD2 ASN 32 1HD2 ASN 32 -11.216 -28.324 -19.652 251 2HD2 ASN 32 2HD2 ASN 32 -10.806 -28.280 -17.979 252 H GLN 33 H GLN 33 -10.071 -24.692 -22.995 253 HA GLN 33 HA GLN 33 -8.309 -26.971 -22.917 254 1HB GLN 33 1HB GLN 33 -8.858 -27.534 -25.208 255 2HB GLN 33 2HB GLN 33 -10.347 -27.607 -24.275 256 1HG GLN 33 1HG GLN 33 -10.900 -25.347 -25.066 257 2HG GLN 33 2HG GLN 33 -9.412 -25.392 -26.018 258 1HE2 GLN 33 1HE2 GLN 33 -9.328 -26.635 -27.845 259 2HE2 GLN 33 2HE2 GLN 33 -10.712 -27.320 -28.600 260 H LEU 34 H LEU 34 -6.557 -26.555 -24.316 261 HA LEU 34 HA LEU 34 -6.299 -23.712 -24.518 262 1HB LEU 34 1HB LEU 34 -4.280 -25.761 -23.664 263 2HB LEU 34 2HB LEU 34 -3.779 -24.153 -24.154 264 HG LEU 34 HG LEU 34 -3.774 -24.261 -21.734 265 1HD1 LEU 34 1HD1 LEU 34 -6.131 -22.714 -22.585 266 2HD1 LEU 34 2HD1 LEU 34 -4.443 -22.200 -22.617 267 3HD1 LEU 34 3HD1 LEU 34 -5.235 -22.538 -21.077 268 1HD2 LEU 34 1HD2 LEU 34 -6.645 -25.166 -21.854 269 2HD2 LEU 34 2HD2 LEU 34 -5.734 -24.795 -20.389 270 3HD2 LEU 34 3HD2 LEU 34 -5.270 -26.169 -21.395 271 H LEU 35 H LEU 35 -5.628 -22.974 -26.477 272 HA LEU 35 HA LEU 35 -4.551 -24.908 -28.380 273 1HB LEU 35 1HB LEU 35 -5.700 -23.885 -30.246 274 2HB LEU 35 2HB LEU 35 -6.875 -24.345 -29.043 275 HG LEU 35 HG LEU 35 -5.933 -21.495 -29.532 276 1HD1 LEU 35 1HD1 LEU 35 -7.099 -22.394 -31.437 277 2HD1 LEU 35 2HD1 LEU 35 -8.024 -21.156 -30.594 278 3HD1 LEU 35 3HD1 LEU 35 -8.452 -22.861 -30.397 279 1HD2 LEU 35 1HD2 LEU 35 -8.243 -22.587 -27.924 280 2HD2 LEU 35 2HD2 LEU 35 -7.927 -20.885 -28.239 281 3HD2 LEU 35 3HD2 LEU 35 -6.799 -21.821 -27.260 282 H HIS 36 H HIS 36 -2.826 -24.233 -29.608 283 HA HIS 36 HA HIS 36 -1.710 -21.778 -28.621 284 1HB HIS 36 1HB HIS 36 0.503 -22.697 -29.537 285 2HB HIS 36 2HB HIS 36 -0.169 -23.412 -28.083 286 HD2 HIS 36 HD2 HIS 36 -0.747 -24.436 -31.883 287 HE1 HIS 36 HE1 HIS 36 0.521 -27.775 -29.628 288 HE2 HIS 36 HE2 HIS 36 -0.441 -27.013 -31.814 289 H LEU 37 H LEU 37 -1.136 -20.232 -29.673 290 HA LEU 37 HA LEU 37 -1.636 -20.147 -32.577 291 1HB LEU 37 1HB LEU 37 -2.116 -17.960 -30.573 292 2HB LEU 37 2HB LEU 37 -2.271 -17.808 -32.299 293 HG LEU 37 HG LEU 37 -4.382 -17.875 -31.567 294 1HD1 LEU 37 1HD1 LEU 37 -5.435 -19.975 -32.269 295 2HD1 LEU 37 2HD1 LEU 37 -3.839 -20.723 -32.301 296 3HD1 LEU 37 3HD1 LEU 37 -4.205 -19.380 -33.387 297 1HD2 LEU 37 1HD2 LEU 37 -4.052 -18.429 -29.240 298 2HD2 LEU 37 2HD2 LEU 37 -3.731 -20.108 -29.641 299 3HD2 LEU 37 3HD2 LEU 37 -5.347 -19.434 -29.889 300 H LYS 38 H LYS 38 -0.455 -18.290 -33.575 301 HA LYS 38 HA LYS 38 2.163 -18.016 -32.229 302 1HB LYS 38 1HB LYS 38 1.758 -18.812 -35.043 303 2HB LYS 38 2HB LYS 38 3.316 -18.490 -34.270 304 1HG LYS 38 1HG LYS 38 2.594 -20.122 -32.596 305 2HG LYS 38 2HG LYS 38 1.313 -20.508 -33.750 306 1HD LYS 38 1HD LYS 38 4.165 -20.453 -34.577 307 2HD LYS 38 2HD LYS 38 3.570 -21.948 -33.848 308 1HE LYS 38 1HE LYS 38 3.431 -22.254 -36.238 309 2HE LYS 38 2HE LYS 38 1.793 -21.965 -35.681 310 1HZ LYS 38 1HZ LYS 38 2.315 -20.773 -37.722 311 2HZ LYS 38 2HZ LYS 38 3.564 -19.961 -36.972 312 3HZ LYS 38 3HZ LYS 38 1.981 -19.663 -36.505 313 H GLN 39 H GLN 39 3.353 -16.488 -32.714 314 HA GLN 39 HA GLN 39 2.108 -14.096 -33.895 315 1HB GLN 39 1HB GLN 39 3.284 -13.999 -31.764 316 2HB GLN 39 2HB GLN 39 4.783 -14.420 -32.623 317 1HG GLN 39 1HG GLN 39 4.464 -12.322 -33.957 318 2HG GLN 39 2HG GLN 39 3.139 -11.902 -32.869 319 1HE2 GLN 39 1HE2 GLN 39 3.627 -11.440 -30.679 320 2HE2 GLN 39 2HE2 GLN 39 5.215 -11.005 -30.210 321 H GLY 40 H GLY 40 2.150 -15.220 -35.785 322 1HA GLY 40 1HA GLY 40 4.684 -15.411 -37.265 323 2HA GLY 40 2HA GLY 40 3.130 -16.009 -37.843 324 H ILE 41 H ILE 41 1.503 -14.364 -38.327 325 HA ILE 41 HA ILE 41 2.758 -12.127 -39.705 326 HB ILE 41 HB ILE 41 -0.068 -13.244 -39.965 327 1HG1 ILE 41 1HG1 ILE 41 0.681 -13.673 -42.384 328 2HG1 ILE 41 2HG1 ILE 41 2.319 -13.390 -41.821 329 1HG2 ILE 41 1HG2 ILE 41 -0.139 -10.858 -40.297 330 2HG2 ILE 41 2HG2 ILE 41 -0.381 -11.678 -41.840 331 3HG2 ILE 41 3HG2 ILE 41 1.181 -10.948 -41.461 332 1HD1 ILE 41 1HD1 ILE 41 0.467 -15.574 -40.885 333 2HD1 ILE 41 2HD1 ILE 41 2.107 -15.301 -40.297 334 3HD1 ILE 41 3HD1 ILE 41 1.837 -15.762 -41.978 335 H SER 42 H SER 42 2.901 -10.365 -38.497 336 HA SER 42 HA SER 42 0.588 -9.464 -37.060 337 1HB SER 42 1HB SER 42 1.856 -10.922 -35.477 338 2HB SER 42 2HB SER 42 3.273 -9.905 -35.712 339 HG SER 42 HG SER 42 2.487 -8.527 -34.397 340 H ALA 43 H ALA 43 1.018 -7.228 -36.276 341 HA ALA 43 HA ALA 43 3.051 -5.601 -36.933 342 1HB ALA 43 1HB ALA 43 2.283 -4.418 -38.938 343 2HB ALA 43 2HB ALA 43 0.934 -5.536 -39.083 344 3HB ALA 43 3HB ALA 43 2.586 -6.116 -39.313 345 H SER 44 H SER 44 -0.455 -5.887 -37.165 346 HA SER 44 HA SER 44 -0.976 -3.289 -36.065 347 1HB SER 44 1HB SER 44 -2.850 -5.614 -36.535 348 2HB SER 44 2HB SER 44 -3.294 -3.917 -36.350 349 HG SER 44 HG SER 44 -3.192 -4.674 -38.538 350 H GLY 45 H GLY 45 0.553 -5.230 -34.398 351 1HA GLY 45 1HA GLY 45 -0.007 -4.854 -31.875 352 2HA GLY 45 2HA GLY 45 -1.261 -6.037 -32.265 353 H ALA 46 H ALA 46 -0.616 -7.830 -31.356 354 HA ALA 46 HA ALA 46 1.815 -9.000 -32.331 355 1HB ALA 46 1HB ALA 46 2.034 -10.034 -30.089 356 2HB ALA 46 2HB ALA 46 0.812 -8.874 -29.495 357 3HB ALA 46 3HB ALA 46 2.372 -8.296 -30.096 358 H ARG 47 H ARG 47 0.860 -10.318 -33.565 359 HA ARG 47 HA ARG 47 -1.692 -11.214 -32.706 360 1HB ARG 47 1HB ARG 47 -0.559 -11.112 -35.470 361 2HB ARG 47 2HB ARG 47 -2.088 -11.883 -35.095 362 1HG ARG 47 1HG ARG 47 -2.951 -9.763 -34.261 363 2HG ARG 47 2HG ARG 47 -1.405 -8.993 -34.646 364 1HD ARG 47 1HD ARG 47 -3.054 -8.623 -36.401 365 2HD ARG 47 2HD ARG 47 -1.679 -9.559 -36.978 366 HE ARG 47 HE ARG 47 -3.794 -11.227 -36.066 367 1HH1 ARG 47 1HH1 ARG 47 -2.754 -9.291 -38.805 368 2HH1 ARG 47 2HH1 ARG 47 -3.544 -10.229 -39.991 369 1HH2 ARG 47 1HH2 ARG 47 -4.906 -12.570 -37.686 370 2HH2 ARG 47 2HH2 ARG 47 -4.794 -12.143 -39.324 371 H TYR 48 H TYR 48 -1.714 -13.175 -31.931 372 HA TYR 48 HA TYR 48 0.047 -15.376 -32.896 373 1HB TYR 48 1HB TYR 48 -1.652 -15.059 -30.410 374 2HB TYR 48 2HB TYR 48 -0.570 -16.390 -30.821 375 HD1 TYR 48 HD1 TYR 48 1.797 -16.216 -30.468 376 HD2 TYR 48 HD2 TYR 48 -0.718 -12.876 -29.709 377 HE1 TYR 48 HE1 TYR 48 3.638 -15.102 -29.280 378 HE2 TYR 48 HE2 TYR 48 1.110 -11.757 -28.521 379 HH TYR 48 HH TYR 48 3.153 -12.229 -27.431 380 H THR 49 H THR 49 -0.856 -16.389 -34.395 381 HA THR 49 HA THR 49 -3.627 -17.099 -34.107 382 HB THR 49 HB THR 49 -2.536 -15.667 -36.548 383 HG1 THR 49 HG1 THR 49 -3.444 -14.683 -34.366 384 1HG2 THR 49 1HG2 THR 49 -4.191 -17.389 -37.181 385 2HG2 THR 49 2HG2 THR 49 -4.830 -15.770 -37.453 386 3HG2 THR 49 3HG2 THR 49 -5.347 -16.698 -36.044 387 H ASP 50 H ASP 50 -4.054 -18.964 -35.420 388 HA ASP 50 HA ASP 50 -1.721 -20.170 -36.704 389 1HB ASP 50 1HB ASP 50 -2.103 -21.351 -34.594 390 2HB ASP 50 2HB ASP 50 -3.806 -21.547 -34.965 391 H GLY 51 H GLY 51 -4.999 -21.274 -36.352 392 1HA GLY 51 1HA GLY 51 -5.950 -20.088 -38.783 393 2HA GLY 51 2HA GLY 51 -5.658 -21.822 -38.922 394 H ILE 52 H ILE 52 -6.550 -20.590 -35.839 395 HA ILE 52 HA ILE 52 -9.154 -21.889 -36.190 396 HB ILE 52 HB ILE 52 -7.673 -21.626 -33.522 397 1HG1 ILE 52 1HG1 ILE 52 -7.843 -24.046 -35.347 398 2HG1 ILE 52 2HG1 ILE 52 -6.415 -23.032 -35.200 399 1HG2 ILE 52 1HG2 ILE 52 -10.119 -21.913 -33.419 400 2HG2 ILE 52 2HG2 ILE 52 -9.279 -23.348 -32.826 401 3HG2 ILE 52 3HG2 ILE 52 -9.991 -23.346 -34.440 402 1HD1 ILE 52 1HD1 ILE 52 -6.246 -25.092 -33.891 403 2HD1 ILE 52 2HD1 ILE 52 -7.667 -24.613 -32.959 404 3HD1 ILE 52 3HD1 ILE 52 -6.187 -23.653 -32.877 405 H TYR 53 H TYR 53 -7.611 -19.485 -34.018 406 HA TYR 53 HA TYR 53 -9.670 -17.484 -34.697 407 1HB TYR 53 1HB TYR 53 -8.692 -17.994 -31.874 408 2HB TYR 53 2HB TYR 53 -9.802 -16.755 -32.475 409 HD1 TYR 53 HD1 TYR 53 -12.127 -17.390 -33.152 410 HD2 TYR 53 HD2 TYR 53 -9.469 -20.238 -31.488 411 HE1 TYR 53 HE1 TYR 53 -14.000 -18.963 -32.848 412 HE2 TYR 53 HE2 TYR 53 -11.325 -21.808 -31.174 413 HH TYR 53 HH TYR 53 -13.666 -21.859 -31.037 414 H VAL 54 H VAL 54 -8.896 -15.416 -34.038 415 HA VAL 54 HA VAL 54 -6.036 -15.200 -34.601 416 HB VAL 54 HB VAL 54 -8.371 -13.414 -34.888 417 1HG1 VAL 54 1HG1 VAL 54 -5.459 -12.930 -35.702 418 2HG1 VAL 54 2HG1 VAL 54 -6.349 -12.041 -34.463 419 3HG1 VAL 54 3HG1 VAL 54 -6.780 -11.858 -36.162 420 1HG2 VAL 54 1HG2 VAL 54 -6.745 -14.798 -37.013 421 2HG2 VAL 54 2HG2 VAL 54 -7.982 -13.593 -37.360 422 3HG2 VAL 54 3HG2 VAL 54 -8.422 -15.109 -36.570 423 H PHE 55 H PHE 55 -4.999 -14.927 -32.641 424 HA PHE 55 HA PHE 55 -6.412 -13.450 -30.566 425 1HB PHE 55 1HB PHE 55 -5.358 -15.619 -29.938 426 2HB PHE 55 2HB PHE 55 -3.794 -14.985 -30.423 427 HD1 PHE 55 HD1 PHE 55 -6.447 -14.863 -27.905 428 HD2 PHE 55 HD2 PHE 55 -2.598 -13.426 -28.999 429 HE1 PHE 55 HE1 PHE 55 -6.123 -14.014 -25.627 430 HE2 PHE 55 HE2 PHE 55 -2.262 -12.577 -26.713 431 HZ PHE 55 HZ PHE 55 -4.026 -12.868 -25.027 432 H TRP 56 H TRP 56 -6.177 -11.296 -30.682 433 HA TRP 56 HA TRP 56 -3.653 -10.319 -31.600 434 1HB TRP 56 1HB TRP 56 -5.227 -9.495 -33.069 435 2HB TRP 56 2HB TRP 56 -6.447 -9.255 -31.811 436 HD1 TRP 56 HD1 TRP 56 -2.852 -7.817 -32.311 437 HE1 TRP 56 HE1 TRP 56 -2.984 -5.274 -31.958 438 HE3 TRP 56 HE3 TRP 56 -7.860 -7.366 -31.504 439 HZ2 TRP 56 HZ2 TRP 56 -4.943 -3.331 -31.438 440 HZ3 TRP 56 HZ3 TRP 56 -8.795 -5.124 -31.098 441 HH2 TRP 56 HH2 TRP 56 -7.363 -3.152 -31.075 442 H SER 57 H SER 57 -2.517 -9.593 -30.273 443 HA SER 57 HA SER 57 -3.468 -8.713 -27.644 444 1HB SER 57 1HB SER 57 -1.913 -10.656 -27.641 445 2HB SER 57 2HB SER 57 -0.724 -9.693 -28.499 446 HG SER 57 HG SER 57 -0.246 -9.629 -26.330 447 H LYS 58 H LYS 58 -3.476 -6.525 -27.492 448 HA LYS 58 HA LYS 58 -1.838 -5.038 -29.349 449 1HB LYS 58 1HB LYS 58 -4.169 -4.462 -29.051 450 2HB LYS 58 2HB LYS 58 -3.912 -4.256 -27.331 451 1HG LYS 58 1HG LYS 58 -2.539 -2.312 -27.745 452 2HG LYS 58 2HG LYS 58 -2.706 -2.551 -29.491 453 1HD LYS 58 1HD LYS 58 -5.014 -2.227 -29.411 454 2HD LYS 58 2HD LYS 58 -5.032 -2.293 -27.654 455 1HE LYS 58 1HE LYS 58 -3.661 -0.208 -27.633 456 2HE LYS 58 2HE LYS 58 -3.849 -0.121 -29.384 457 1HZ LYS 58 1HZ LYS 58 -6.059 -0.131 -27.412 458 2HZ LYS 58 2HZ LYS 58 -6.242 0.071 -29.092 459 3HZ LYS 58 3HZ LYS 58 -5.470 1.251 -28.176 460 H GLY 59 H GLY 59 -1.866 -6.079 -26.084 461 1HA GLY 59 1HA GLY 59 0.530 -5.890 -25.203 462 2HA GLY 59 2HA GLY 59 0.247 -4.160 -25.365 463 H ASP 60 H ASP 60 -2.058 -3.625 -24.362 464 HA ASP 60 HA ASP 60 -2.058 -4.845 -21.686 465 1HB ASP 60 1HB ASP 60 -2.765 -2.013 -22.470 466 2HB ASP 60 2HB ASP 60 -3.096 -2.690 -20.878 467 H GLU 61 H GLU 61 -3.679 -4.835 -24.451 468 HA GLU 61 HA GLU 61 -6.078 -5.837 -23.213 469 1HB GLU 61 1HB GLU 61 -7.452 -4.645 -24.842 470 2HB GLU 61 2HB GLU 61 -6.653 -3.532 -23.721 471 1HG GLU 61 1HG GLU 61 -5.028 -3.026 -25.429 472 2HG GLU 61 2HG GLU 61 -5.835 -4.162 -26.519 473 H ALA 62 H ALA 62 -7.231 -7.158 -24.707 474 HA ALA 62 HA ALA 62 -5.671 -8.155 -26.903 475 1HB ALA 62 1HB ALA 62 -4.796 -9.369 -24.976 476 2HB ALA 62 2HB ALA 62 -5.779 -10.442 -25.988 477 3HB ALA 62 3HB ALA 62 -6.449 -9.769 -24.499 478 H THR 63 H THR 63 -7.001 -8.974 -28.359 479 HA THR 63 HA THR 63 -9.702 -9.740 -27.639 480 HB THR 63 HB THR 63 -9.019 -7.784 -29.854 481 HG1 THR 63 HG1 THR 63 -9.417 -6.485 -28.246 482 1HG2 THR 63 1HG2 THR 63 -10.718 -9.370 -30.655 483 2HG2 THR 63 2HG2 THR 63 -11.436 -7.782 -30.393 484 3HG2 THR 63 3HG2 THR 63 -11.687 -9.070 -29.212 485 H VAL 64 H VAL 64 -10.165 -11.605 -28.494 486 HA VAL 64 HA VAL 64 -8.460 -12.535 -30.651 487 HB VAL 64 HB VAL 64 -7.941 -13.852 -28.750 488 1HG1 VAL 64 1HG1 VAL 64 -9.575 -15.045 -27.409 489 2HG1 VAL 64 2HG1 VAL 64 -10.868 -14.253 -28.318 490 3HG1 VAL 64 3HG1 VAL 64 -9.753 -13.291 -27.343 491 1HG2 VAL 64 1HG2 VAL 64 -9.868 -15.445 -30.438 492 2HG2 VAL 64 2HG2 VAL 64 -8.655 -16.131 -29.361 493 3HG2 VAL 64 3HG2 VAL 64 -8.156 -15.188 -30.767 494 H TYR 65 H TYR 65 -9.385 -12.386 -32.398 495 HA TYR 65 HA TYR 65 -12.254 -12.871 -32.645 496 1HB TYR 65 1HB TYR 65 -12.274 -10.625 -32.399 497 2HB TYR 65 2HB TYR 65 -10.709 -10.398 -33.157 498 HD1 TYR 65 HD1 TYR 65 -10.776 -9.160 -35.098 499 HD2 TYR 65 HD2 TYR 65 -14.132 -11.598 -34.208 500 HE1 TYR 65 HE1 TYR 65 -11.892 -8.360 -37.129 501 HE2 TYR 65 HE2 TYR 65 -15.252 -10.800 -36.228 502 HH TYR 65 HH TYR 65 -15.193 -8.938 -37.744 503 H LYS 66 H LYS 66 -12.240 -14.665 -33.873 504 HA LYS 66 HA LYS 66 -10.727 -14.759 -36.293 505 1HB LYS 66 1HB LYS 66 -11.410 -16.804 -34.943 506 2HB LYS 66 2HB LYS 66 -13.074 -16.392 -35.291 507 1HG LYS 66 1HG LYS 66 -12.545 -16.578 -37.715 508 2HG LYS 66 2HG LYS 66 -10.964 -17.236 -37.256 509 1HD LYS 66 1HD LYS 66 -12.159 -18.985 -36.000 510 2HD LYS 66 2HD LYS 66 -13.666 -18.265 -36.599 511 1HE LYS 66 1HE LYS 66 -13.067 -18.759 -38.877 512 2HE LYS 66 2HE LYS 66 -11.477 -19.326 -38.377 513 1HZ LYS 66 1HZ LYS 66 -13.002 -21.121 -38.866 514 2HZ LYS 66 2HZ LYS 66 -14.048 -20.648 -37.639 515 3HZ LYS 66 3HZ LYS 66 -12.489 -21.187 -37.276 516 H ARG 67 H ARG 67 -12.106 -14.881 -38.131 517 HA ARG 67 HA ARG 67 -13.819 -12.524 -38.133 518 1HB ARG 67 1HB ARG 67 -13.256 -14.337 -40.483 519 2HB ARG 67 2HB ARG 67 -14.006 -12.755 -40.565 520 1HG ARG 67 1HG ARG 67 -11.146 -13.391 -39.858 521 2HG ARG 67 2HG ARG 67 -11.740 -12.533 -41.277 522 1HD ARG 67 1HD ARG 67 -12.567 -10.745 -39.759 523 2HD ARG 67 2HD ARG 67 -11.830 -11.613 -38.411 524 HE ARG 67 HE ARG 67 -10.346 -10.512 -40.700 525 1HH1 ARG 67 1HH1 ARG 67 -10.385 -11.365 -37.215 526 2HH1 ARG 67 2HH1 ARG 67 -8.938 -10.535 -36.900 527 1HH2 ARG 67 1HH2 ARG 67 -8.320 -9.419 -40.167 528 2HH2 ARG 67 2HH2 ARG 67 -7.775 -9.434 -38.552 529 H ASP 68 H ASP 68 -14.286 -15.650 -37.542 530 HA ASP 68 HA ASP 68 -17.146 -15.621 -38.201 531 1HB ASP 68 1HB ASP 68 -16.127 -17.552 -39.167 532 2HB ASP 68 2HB ASP 68 -15.248 -17.919 -37.694 533 H ARG 69 H ARG 69 -14.924 -15.387 -35.653 534 HA ARG 69 HA ARG 69 -16.960 -15.355 -33.754 535 1HB ARG 69 1HB ARG 69 -17.033 -17.726 -33.990 536 2HB ARG 69 2HB ARG 69 -15.301 -17.862 -33.752 537 1HG ARG 69 1HG ARG 69 -16.411 -18.529 -31.715 538 2HG ARG 69 2HG ARG 69 -15.616 -16.981 -31.440 539 1HD ARG 69 1HD ARG 69 -17.828 -15.884 -31.934 540 2HD ARG 69 2HD ARG 69 -18.557 -17.485 -31.890 541 HE ARG 69 HE ARG 69 -17.166 -16.165 -29.677 542 1HH1 ARG 69 1HH1 ARG 69 -19.543 -18.582 -30.776 543 2HH1 ARG 69 2HH1 ARG 69 -20.295 -18.713 -29.255 544 1HH2 ARG 69 1HH2 ARG 69 -18.229 -16.403 -27.547 545 2HH2 ARG 69 2HH2 ARG 69 -19.527 -17.470 -27.388 546 H ILE 70 H ILE 70 -16.247 -13.772 -32.641 547 HA ILE 70 HA ILE 70 -13.605 -13.484 -31.427 548 HB ILE 70 HB ILE 70 -16.213 -12.379 -30.511 549 1HG1 ILE 70 1HG1 ILE 70 -14.301 -11.041 -32.339 550 2HG1 ILE 70 2HG1 ILE 70 -15.821 -11.771 -32.896 551 1HG2 ILE 70 1HG2 ILE 70 -14.386 -12.159 -28.925 552 2HG2 ILE 70 2HG2 ILE 70 -14.873 -10.582 -29.537 553 3HG2 ILE 70 3HG2 ILE 70 -13.396 -11.344 -30.147 554 1HD1 ILE 70 1HD1 ILE 70 -17.025 -10.127 -31.484 555 2HD1 ILE 70 2HD1 ILE 70 -16.034 -9.354 -32.720 556 3HD1 ILE 70 3HD1 ILE 70 -15.477 -9.405 -31.045 557 H VAL 71 H VAL 71 -13.102 -14.419 -29.667 558 HA VAL 71 HA VAL 71 -15.285 -15.710 -28.187 559 HB VAL 71 HB VAL 71 -13.765 -17.415 -27.220 560 1HG1 VAL 71 1HG1 VAL 71 -13.453 -18.730 -29.261 561 2HG1 VAL 71 2HG1 VAL 71 -13.751 -17.284 -30.222 562 3HG1 VAL 71 3HG1 VAL 71 -15.032 -17.945 -29.198 563 1HG2 VAL 71 1HG2 VAL 71 -11.660 -16.199 -27.349 564 2HG2 VAL 71 2HG2 VAL 71 -11.710 -16.299 -29.120 565 3HG2 VAL 71 3HG2 VAL 71 -11.549 -17.763 -28.156 566 H LEU 72 H LEU 72 -13.015 -13.351 -27.987 567 HA LEU 72 HA LEU 72 -13.826 -12.691 -25.338 568 1HB LEU 72 1HB LEU 72 -11.095 -13.713 -25.861 569 2HB LEU 72 2HB LEU 72 -11.198 -12.291 -24.835 570 HG LEU 72 HG LEU 72 -12.536 -14.941 -24.326 571 1HD1 LEU 72 1HD1 LEU 72 -10.135 -13.643 -23.039 572 2HD1 LEU 72 2HD1 LEU 72 -10.092 -15.018 -24.137 573 3HD1 LEU 72 3HD1 LEU 72 -10.861 -15.177 -22.558 574 1HD2 LEU 72 1HD2 LEU 72 -12.979 -13.975 -22.114 575 2HD2 LEU 72 2HD2 LEU 72 -13.781 -13.065 -23.387 576 3HD2 LEU 72 3HD2 LEU 72 -12.301 -12.444 -22.654 577 H ASN 73 H ASN 73 -14.010 -10.455 -25.373 578 HA ASN 73 HA ASN 73 -12.102 -8.989 -27.016 579 1HB ASN 73 1HB ASN 73 -13.805 -7.546 -28.057 580 2HB ASN 73 2HB ASN 73 -13.923 -9.226 -28.548 581 1HD2 ASN 73 1HD2 ASN 73 -15.909 -7.139 -28.704 582 2HD2 ASN 73 2HD2 ASN 73 -17.271 -7.673 -27.788 583 H ASN 74 H ASN 74 -12.786 -9.230 -24.139 584 HA ASN 74 HA ASN 74 -12.121 -6.461 -23.692 585 1HB ASN 74 1HB ASN 74 -14.594 -6.541 -23.201 586 2HB ASN 74 2HB ASN 74 -14.224 -7.704 -21.920 587 1HD2 ASN 74 1HD2 ASN 74 -14.886 -6.404 -20.239 588 2HD2 ASN 74 2HD2 ASN 74 -14.038 -4.979 -19.765 589 H CYS 75 H CYS 75 -10.194 -7.527 -23.602 590 HA CYS 75 HA CYS 75 -9.724 -8.776 -21.051 591 1HB CYS 75 1HB CYS 75 -8.747 -9.424 -23.792 592 2HB CYS 75 2HB CYS 75 -7.819 -9.886 -22.374 593 H GLN 76 H GLN 76 -8.371 -7.656 -19.856 594 HA GLN 76 HA GLN 76 -6.651 -5.812 -21.165 595 1HB GLN 76 1HB GLN 76 -8.715 -5.074 -19.080 596 2HB GLN 76 2HB GLN 76 -7.327 -4.063 -19.475 597 1HG GLN 76 1HG GLN 76 -8.062 -3.891 -21.761 598 2HG GLN 76 2HG GLN 76 -9.444 -4.926 -21.444 599 1HE2 GLN 76 1HE2 GLN 76 -11.181 -4.080 -20.290 600 2HE2 GLN 76 2HE2 GLN 76 -11.360 -2.393 -19.994 601 H LEU 77 H LEU 77 -4.880 -5.956 -20.361 602 HA LEU 77 HA LEU 77 -4.670 -8.070 -18.518 603 1HB LEU 77 1HB LEU 77 -3.488 -8.373 -20.505 604 2HB LEU 77 2HB LEU 77 -2.748 -6.796 -20.416 605 HG LEU 77 HG LEU 77 -1.305 -7.576 -18.593 606 1HD1 LEU 77 1HD1 LEU 77 -2.757 -9.237 -17.611 607 2HD1 LEU 77 2HD1 LEU 77 -1.206 -9.951 -18.055 608 3HD1 LEU 77 3HD1 LEU 77 -2.632 -10.231 -19.060 609 1HD2 LEU 77 1HD2 LEU 77 -0.497 -7.724 -20.863 610 2HD2 LEU 77 2HD2 LEU 77 -1.311 -9.262 -21.083 611 3HD2 LEU 77 3HD2 LEU 77 0.043 -9.141 -19.955 612 H GLN 78 H GLN 78 -3.554 -7.908 -16.502 613 HA GLN 78 HA GLN 78 -3.018 -5.299 -15.434 614 1HB GLN 78 1HB GLN 78 -2.236 -8.000 -14.291 615 2HB GLN 78 2HB GLN 78 -2.264 -6.478 -13.420 616 1HG GLN 78 1HG GLN 78 -4.651 -7.951 -14.525 617 2HG GLN 78 2HG GLN 78 -4.173 -7.850 -12.837 618 1HE2 GLN 78 1HE2 GLN 78 -6.659 -7.061 -14.183 619 2HE2 GLN 78 2HE2 GLN 78 -6.888 -5.395 -13.808 620 H ASN 79 H ASN 79 -0.954 -8.191 -16.117 621 HA ASN 79 HA ASN 79 1.034 -7.002 -17.498 622 1HB ASN 79 1HB ASN 79 2.874 -6.968 -15.792 623 2HB ASN 79 2HB ASN 79 1.640 -5.803 -15.373 624 1HD2 ASN 79 1HD2 ASN 79 3.349 -8.583 -14.367 625 2HD2 ASN 79 2HD2 ASN 79 2.533 -8.785 -12.849 626 HA PRO 80 HA PRO 80 0.751 -11.224 -18.021 627 1HB PRO 80 1HB PRO 80 2.851 -11.891 -19.570 628 2HB PRO 80 2HB PRO 80 1.476 -10.944 -20.144 629 1HG PRO 80 1HG PRO 80 4.142 -9.970 -19.158 630 2HG PRO 80 2HG PRO 80 3.246 -9.462 -20.602 631 1HD PRO 80 1HD PRO 80 3.182 -7.995 -18.327 632 2HD PRO 80 2HD PRO 80 1.773 -8.182 -19.411 633 H GLN 81 H GLN 81 3.147 -10.263 -15.927 634 HA GLN 81 HA GLN 81 3.783 -13.038 -15.499 635 1HB GLN 81 1HB GLN 81 5.169 -10.639 -14.300 636 2HB GLN 81 2HB GLN 81 5.610 -12.317 -14.021 637 1HG GLN 81 1HG GLN 81 5.982 -12.564 -16.444 638 2HG GLN 81 2HG GLN 81 5.668 -10.841 -16.599 639 1HE2 GLN 81 1HE2 GLN 81 7.176 -9.378 -15.831 640 2HE2 GLN 81 2HE2 GLN 81 8.787 -9.834 -15.414 641 H ARG 82 H ARG 82 1.704 -10.840 -14.724 642 HA ARG 82 HA ARG 82 0.458 -10.157 -13.061 643 1HB ARG 82 1HB ARG 82 -0.718 -12.174 -11.803 644 2HB ARG 82 2HB ARG 82 -1.041 -11.836 -13.488 645 1HG ARG 82 1HG ARG 82 -0.590 -13.990 -13.882 646 2HG ARG 82 2HG ARG 82 1.093 -13.615 -13.538 647 1HD ARG 82 1HD ARG 82 -0.946 -14.541 -11.512 648 2HD ARG 82 2HD ARG 82 0.265 -15.562 -12.281 649 HE ARG 82 HE ARG 82 1.246 -13.255 -10.844 650 1HH1 ARG 82 1HH1 ARG 82 0.692 -16.757 -10.842 651 2HH1 ARG 82 2HH1 ARG 82 1.553 -17.036 -9.411 652 1HH2 ARG 82 1HH2 ARG 82 2.448 -13.646 -8.903 653 2HH2 ARG 82 2HH2 ARG 82 2.568 -15.226 -8.266 Start of MODEL 13 1 H MET 1 H MET 1 8.305 -14.179 -14.293 2 HA MET 1 HA MET 1 9.744 -15.925 -13.511 3 1HB MET 1 1HB MET 1 8.275 -16.996 -11.929 4 2HB MET 1 2HB MET 1 7.684 -15.367 -12.163 5 1HG MET 1 1HG MET 1 6.503 -17.924 -13.253 6 2HG MET 1 2HG MET 1 5.828 -16.879 -12.011 7 1HE MET 1 1HE MET 1 4.251 -17.979 -14.639 8 2HE MET 1 2HE MET 1 3.354 -16.533 -15.102 9 3HE MET 1 3HE MET 1 3.475 -16.989 -13.404 10 H GLN 2 H GLN 2 7.155 -17.116 -15.612 11 HA GLN 2 HA GLN 2 8.767 -19.337 -16.511 12 1HB GLN 2 1HB GLN 2 5.930 -19.596 -15.397 13 2HB GLN 2 2HB GLN 2 6.760 -20.846 -16.299 14 1HG GLN 2 1HG GLN 2 8.411 -21.025 -14.502 15 2HG GLN 2 2HG GLN 2 7.515 -19.819 -13.579 16 1HE2 GLN 2 1HE2 GLN 2 5.499 -20.378 -12.698 17 2HE2 GLN 2 2HE2 GLN 2 4.989 -22.013 -12.595 18 H THR 3 H THR 3 6.156 -20.255 -17.904 19 HA THR 3 HA THR 3 6.107 -18.667 -20.134 20 HB THR 3 HB THR 3 3.602 -19.949 -19.176 21 HG1 THR 3 HG1 THR 3 5.909 -21.458 -19.911 22 1HG2 THR 3 1HG2 THR 3 3.706 -20.941 -21.412 23 2HG2 THR 3 2HG2 THR 3 5.297 -20.230 -21.659 24 3HG2 THR 3 3HG2 THR 3 3.881 -19.187 -21.486 25 H ASP 4 H ASP 4 5.122 -16.728 -20.460 26 HA ASP 4 HA ASP 4 4.176 -15.301 -18.126 27 1HB ASP 4 1HB ASP 4 5.630 -14.492 -20.170 28 2HB ASP 4 2HB ASP 4 4.053 -14.290 -20.922 29 H THR 5 H THR 5 2.035 -14.725 -17.798 30 HA THR 5 HA THR 5 0.193 -16.032 -19.651 31 HB THR 5 HB THR 5 0.234 -16.425 -16.657 32 HG1 THR 5 HG1 THR 5 1.760 -17.623 -17.892 33 1HG2 THR 5 1HG2 THR 5 -1.671 -17.560 -18.704 34 2HG2 THR 5 2HG2 THR 5 -2.077 -16.345 -17.492 35 3HG2 THR 5 3HG2 THR 5 -1.637 -17.979 -16.990 36 H LEU 6 H LEU 6 -1.810 -15.092 -19.876 37 HA LEU 6 HA LEU 6 -1.753 -12.348 -19.145 38 1HB LEU 6 1HB LEU 6 -3.763 -13.893 -20.759 39 2HB LEU 6 2HB LEU 6 -3.973 -12.194 -20.428 40 HG LEU 6 HG LEU 6 -1.758 -13.462 -21.979 41 1HD1 LEU 6 1HD1 LEU 6 -3.880 -13.258 -23.172 42 2HD1 LEU 6 2HD1 LEU 6 -2.671 -12.153 -23.834 43 3HD1 LEU 6 3HD1 LEU 6 -3.940 -11.538 -22.778 44 1HD2 LEU 6 1HD2 LEU 6 -0.953 -11.160 -22.409 45 2HD2 LEU 6 2HD2 LEU 6 -0.817 -11.575 -20.708 46 3HD2 LEU 6 3HD2 LEU 6 -2.131 -10.550 -21.258 47 H GLU 7 H GLU 7 -4.486 -11.697 -18.802 48 HA GLU 7 HA GLU 7 -4.274 -11.476 -16.055 49 1HB GLU 7 1HB GLU 7 -5.105 -9.864 -17.726 50 2HB GLU 7 2HB GLU 7 -6.562 -10.833 -17.881 51 1HG GLU 7 1HG GLU 7 -6.806 -8.914 -16.390 52 2HG GLU 7 2HG GLU 7 -7.111 -10.479 -15.612 53 H TYR 8 H TYR 8 -5.823 -13.572 -18.323 54 HA TYR 8 HA TYR 8 -7.440 -14.747 -18.512 55 1HB TYR 8 1HB TYR 8 -7.591 -16.790 -17.028 56 2HB TYR 8 2HB TYR 8 -6.014 -16.405 -17.673 57 HD1 TYR 8 HD1 TYR 8 -8.107 -16.336 -14.652 58 HD2 TYR 8 HD2 TYR 8 -4.168 -16.054 -16.205 59 HE1 TYR 8 HE1 TYR 8 -7.209 -16.547 -12.392 60 HE2 TYR 8 HE2 TYR 8 -3.253 -16.258 -13.932 61 HH TYR 8 HH TYR 8 -3.909 -15.962 -11.686 62 H GLN 9 H GLN 9 -8.216 -12.395 -17.022 63 HA GLN 9 HA GLN 9 -10.753 -13.281 -15.960 64 1HB GLN 9 1HB GLN 9 -8.898 -11.266 -14.677 65 2HB GLN 9 2HB GLN 9 -10.575 -11.529 -14.198 66 1HG GLN 9 1HG GLN 9 -10.145 -13.730 -13.590 67 2HG GLN 9 2HG GLN 9 -8.528 -13.675 -14.265 68 1HE2 GLN 9 1HE2 GLN 9 -7.498 -14.176 -12.391 69 2HE2 GLN 9 2HE2 GLN 9 -7.392 -13.132 -11.024 70 H CYS 10 H CYS 10 -11.495 -12.809 -17.791 71 HA CYS 10 HA CYS 10 -11.306 -10.018 -18.645 72 1HB CYS 10 1HB CYS 10 -11.629 -12.506 -20.261 73 2HB CYS 10 2HB CYS 10 -11.634 -10.871 -20.928 74 H ASP 11 H ASP 11 -13.145 -9.467 -20.096 75 HA ASP 11 HA ASP 11 -15.488 -9.580 -18.560 76 1HB ASP 11 1HB ASP 11 -15.083 -7.591 -19.723 77 2HB ASP 11 2HB ASP 11 -14.798 -8.438 -21.236 78 H GLU 12 H GLU 12 -14.552 -11.263 -21.463 79 HA GLU 12 HA GLU 12 -17.247 -12.407 -21.605 80 1HB GLU 12 1HB GLU 12 -15.005 -12.657 -23.553 81 2HB GLU 12 2HB GLU 12 -16.678 -13.136 -23.787 82 1HG GLU 12 1HG GLU 12 -17.372 -10.834 -23.574 83 2HG GLU 12 2HG GLU 12 -15.670 -10.404 -23.295 84 H LYS 13 H LYS 13 -13.921 -13.343 -21.063 85 HA LYS 13 HA LYS 13 -14.829 -16.066 -20.519 86 1HB LYS 13 1HB LYS 13 -12.439 -15.729 -22.273 87 2HB LYS 13 2HB LYS 13 -13.402 -17.149 -22.005 88 1HG LYS 13 1HG LYS 13 -15.192 -15.823 -23.374 89 2HG LYS 13 2HG LYS 13 -13.802 -14.879 -23.887 90 1HD LYS 13 1HD LYS 13 -14.257 -17.846 -24.301 91 2HD LYS 13 2HD LYS 13 -14.101 -16.596 -25.517 92 1HE LYS 13 1HE LYS 13 -12.043 -17.694 -25.621 93 2HE LYS 13 2HE LYS 13 -11.689 -16.303 -24.604 94 1HZ LYS 13 1HZ LYS 13 -11.730 -17.747 -22.631 95 2HZ LYS 13 2HZ LYS 13 -10.786 -18.540 -23.804 96 3HZ LYS 13 3HZ LYS 13 -12.367 -18.990 -23.564 97 HA PRO 14 HA PRO 14 -11.012 -15.487 -18.342 98 1HB PRO 14 1HB PRO 14 -10.201 -18.093 -17.914 99 2HB PRO 14 2HB PRO 14 -11.402 -17.294 -16.896 100 1HG PRO 14 1HG PRO 14 -11.789 -19.268 -19.085 101 2HG PRO 14 2HG PRO 14 -12.728 -19.035 -17.601 102 1HD PRO 14 1HD PRO 14 -13.477 -18.151 -20.114 103 2HD PRO 14 2HD PRO 14 -14.100 -17.499 -18.590 104 H LEU 15 H LEU 15 -8.918 -15.310 -19.261 105 HA LEU 15 HA LEU 15 -8.467 -16.880 -21.644 106 1HB LEU 15 1HB LEU 15 -9.173 -14.731 -22.457 107 2HB LEU 15 2HB LEU 15 -8.024 -13.913 -21.414 108 HG LEU 15 HG LEU 15 -6.195 -14.923 -22.617 109 1HD1 LEU 15 1HD1 LEU 15 -7.271 -16.933 -23.463 110 2HD1 LEU 15 2HD1 LEU 15 -6.627 -16.016 -24.823 111 3HD1 LEU 15 3HD1 LEU 15 -8.356 -15.972 -24.467 112 1HD2 LEU 15 1HD2 LEU 15 -6.949 -12.713 -23.271 113 2HD2 LEU 15 2HD2 LEU 15 -8.092 -13.414 -24.416 114 3HD2 LEU 15 3HD2 LEU 15 -6.357 -13.589 -24.676 115 H THR 16 H THR 16 -7.253 -18.153 -20.375 116 HA THR 16 HA THR 16 -4.895 -17.023 -19.266 117 HB THR 16 HB THR 16 -5.404 -19.980 -19.539 118 HG1 THR 16 HG1 THR 16 -6.583 -19.414 -17.360 119 1HG2 THR 16 1HG2 THR 16 -4.371 -18.168 -17.376 120 2HG2 THR 16 2HG2 THR 16 -3.371 -19.146 -18.452 121 3HG2 THR 16 3HG2 THR 16 -4.422 -19.932 -17.261 122 H VAL 17 H VAL 17 -3.115 -16.842 -20.449 123 HA VAL 17 HA VAL 17 -2.898 -18.295 -22.992 124 HB VAL 17 HB VAL 17 -2.221 -15.415 -22.370 125 1HG1 VAL 17 1HG1 VAL 17 -0.294 -16.319 -23.623 126 2HG1 VAL 17 2HG1 VAL 17 -1.252 -15.336 -24.726 127 3HG1 VAL 17 3HG1 VAL 17 -1.399 -17.094 -24.716 128 1HG2 VAL 17 1HG2 VAL 17 -3.905 -16.713 -24.487 129 2HG2 VAL 17 2HG2 VAL 17 -3.631 -14.980 -24.315 130 3HG2 VAL 17 3HG2 VAL 17 -4.492 -15.874 -23.055 131 H LYS 18 H LYS 18 -1.042 -19.247 -23.330 132 HA LYS 18 HA LYS 18 0.993 -18.770 -21.330 133 1HB LYS 18 1HB LYS 18 0.443 -21.087 -23.120 134 2HB LYS 18 2HB LYS 18 2.097 -20.814 -22.613 135 1HG LYS 18 1HG LYS 18 1.164 -22.364 -21.110 136 2HG LYS 18 2HG LYS 18 1.263 -20.813 -20.265 137 1HD LYS 18 1HD LYS 18 -1.105 -20.455 -20.901 138 2HD LYS 18 2HD LYS 18 -1.157 -22.134 -21.435 139 1HE LYS 18 1HE LYS 18 -0.565 -21.129 -18.636 140 2HE LYS 18 2HE LYS 18 -1.987 -22.025 -19.148 141 1HZ LYS 18 1HZ LYS 18 -0.585 -23.970 -19.531 142 2HZ LYS 18 2HZ LYS 18 -0.377 -23.407 -17.961 143 3HZ LYS 18 3HZ LYS 18 0.796 -23.096 -19.102 144 H LEU 19 H LEU 19 1.716 -16.886 -22.087 145 HA LEU 19 HA LEU 19 2.724 -16.574 -24.733 146 1HB LEU 19 1HB LEU 19 2.887 -15.085 -22.170 147 2HB LEU 19 2HB LEU 19 3.976 -14.650 -23.479 148 HG LEU 19 HG LEU 19 0.955 -14.626 -23.755 149 1HD1 LEU 19 1HD1 LEU 19 1.621 -13.090 -21.952 150 2HD1 LEU 19 2HD1 LEU 19 1.091 -12.211 -23.386 151 3HD1 LEU 19 3HD1 LEU 19 2.812 -12.362 -23.026 152 1HD2 LEU 19 1HD2 LEU 19 1.429 -13.193 -25.650 153 2HD2 LEU 19 2HD2 LEU 19 2.333 -14.704 -25.821 154 3HD2 LEU 19 3HD2 LEU 19 3.150 -13.244 -25.286 155 H ASN 20 H ASN 20 4.175 -17.810 -25.221 156 HA ASN 20 HA ASN 20 5.935 -19.086 -23.335 157 1HB ASN 20 1HB ASN 20 5.199 -20.019 -25.649 158 2HB ASN 20 2HB ASN 20 6.423 -18.944 -26.310 159 1HD2 ASN 20 1HD2 ASN 20 6.291 -21.880 -26.480 160 2HD2 ASN 20 2HD2 ASN 20 7.741 -22.429 -25.735 161 H ASN 21 H ASN 21 8.249 -18.745 -23.175 162 HA ASN 21 HA ASN 21 8.726 -16.060 -22.737 163 1HB ASN 21 1HB ASN 21 10.716 -18.312 -22.697 164 2HB ASN 21 2HB ASN 21 11.131 -16.659 -22.255 165 1HD2 ASN 21 1HD2 ASN 21 10.107 -15.733 -20.403 166 2HD2 ASN 21 2HD2 ASN 21 9.451 -16.725 -19.162 167 HA PRO 22 HA PRO 22 11.481 -15.539 -26.684 168 1HB PRO 22 1HB PRO 22 10.228 -17.457 -28.556 169 2HB PRO 22 2HB PRO 22 11.937 -17.099 -28.314 170 1HG PRO 22 1HG PRO 22 10.880 -19.410 -27.493 171 2HG PRO 22 2HG PRO 22 12.139 -18.582 -26.560 172 1HD PRO 22 1HD PRO 22 9.181 -18.673 -26.086 173 2HD PRO 22 2HD PRO 22 10.505 -18.799 -24.914 174 H ARG 23 H ARG 23 8.211 -16.253 -26.352 175 HA ARG 23 HA ARG 23 6.279 -15.560 -27.059 176 1HB ARG 23 1HB ARG 23 7.652 -12.915 -27.358 177 2HB ARG 23 2HB ARG 23 5.901 -13.185 -27.309 178 1HG ARG 23 1HG ARG 23 6.136 -14.248 -25.173 179 2HG ARG 23 2HG ARG 23 7.850 -13.885 -25.146 180 1HD ARG 23 1HD ARG 23 7.132 -11.402 -25.423 181 2HD ARG 23 2HD ARG 23 5.530 -11.958 -24.925 182 HE ARG 23 HE ARG 23 7.963 -12.310 -23.327 183 1HH1 ARG 23 1HH1 ARG 23 4.498 -11.437 -23.401 184 2HH1 ARG 23 2HH1 ARG 23 4.386 -11.429 -21.692 185 1HH2 ARG 23 1HH2 ARG 23 7.727 -12.115 -20.988 186 2HH2 ARG 23 2HH2 ARG 23 6.198 -11.713 -20.363 187 H GLN 24 H GLN 24 7.068 -16.958 -28.786 188 HA GLN 24 HA GLN 24 6.307 -15.614 -31.181 189 1HB GLN 24 1HB GLN 24 7.839 -18.210 -30.900 190 2HB GLN 24 2HB GLN 24 7.266 -17.553 -32.417 191 1HG GLN 24 1HG GLN 24 9.207 -16.151 -30.600 192 2HG GLN 24 2HG GLN 24 9.667 -17.161 -31.968 193 1HE2 GLN 24 1HE2 GLN 24 8.279 -14.124 -30.988 194 2HE2 GLN 24 2HE2 GLN 24 8.381 -13.390 -32.545 195 H GLU 25 H GLU 25 5.243 -17.537 -28.676 196 HA GLU 25 HA GLU 25 2.959 -18.454 -30.228 197 1HB GLU 25 1HB GLU 25 4.549 -20.373 -28.538 198 2HB GLU 25 2HB GLU 25 2.913 -20.667 -29.076 199 1HG GLU 25 1HG GLU 25 3.852 -21.727 -30.732 200 2HG GLU 25 2HG GLU 25 4.185 -20.141 -31.405 201 H VAL 26 H VAL 26 1.196 -18.717 -29.203 202 HA VAL 26 HA VAL 26 1.004 -18.402 -26.224 203 HB VAL 26 HB VAL 26 -1.142 -17.316 -26.524 204 1HG1 VAL 26 1HG1 VAL 26 0.726 -15.859 -26.299 205 2HG1 VAL 26 2HG1 VAL 26 -0.449 -15.135 -27.404 206 3HG1 VAL 26 3HG1 VAL 26 1.014 -15.886 -28.038 207 1HG2 VAL 26 1HG2 VAL 26 -1.922 -16.485 -28.712 208 2HG2 VAL 26 2HG2 VAL 26 -1.860 -18.247 -28.624 209 3HG2 VAL 26 3HG2 VAL 26 -0.598 -17.367 -29.480 210 H SER 27 H SER 27 -0.016 -19.965 -25.215 211 HA SER 27 HA SER 27 -1.788 -21.578 -26.874 212 1HB SER 27 1HB SER 27 -0.570 -22.375 -24.211 213 2HB SER 27 2HB SER 27 -1.509 -23.360 -25.333 214 HG SER 27 HG SER 27 0.810 -22.126 -26.263 215 H PHE 28 H PHE 28 -3.790 -21.118 -26.507 216 HA PHE 28 HA PHE 28 -4.387 -19.801 -23.961 217 1HB PHE 28 1HB PHE 28 -5.510 -18.077 -24.918 218 2HB PHE 28 2HB PHE 28 -4.246 -18.364 -26.098 219 HD1 PHE 28 HD1 PHE 28 -4.989 -20.061 -28.073 220 HD2 PHE 28 HD2 PHE 28 -7.689 -17.829 -25.672 221 HE1 PHE 28 HE1 PHE 28 -6.753 -20.316 -29.793 222 HE2 PHE 28 HE2 PHE 28 -9.430 -18.074 -27.374 223 HZ PHE 28 HZ PHE 28 -8.967 -19.322 -29.439 224 H VAL 29 H VAL 29 -6.517 -19.884 -23.371 225 HA VAL 29 HA VAL 29 -7.643 -22.459 -23.942 226 HB VAL 29 HB VAL 29 -7.161 -21.858 -21.584 227 1HG1 VAL 29 1HG1 VAL 29 -7.679 -19.549 -21.520 228 2HG1 VAL 29 2HG1 VAL 29 -8.629 -20.410 -20.308 229 3HG1 VAL 29 3HG1 VAL 29 -9.389 -19.874 -21.807 230 1HG2 VAL 29 1HG2 VAL 29 -10.033 -22.508 -22.220 231 2HG2 VAL 29 2HG2 VAL 29 -9.281 -22.697 -20.634 232 3HG2 VAL 29 3HG2 VAL 29 -8.676 -23.626 -22.007 233 H TYR 30 H TYR 30 -8.913 -22.592 -25.331 234 HA TYR 30 HA TYR 30 -10.641 -20.757 -26.695 235 1HB TYR 30 1HB TYR 30 -10.003 -23.041 -27.500 236 2HB TYR 30 2HB TYR 30 -10.954 -23.743 -26.219 237 HD1 TYR 30 HD1 TYR 30 -13.515 -23.402 -26.323 238 HD2 TYR 30 HD2 TYR 30 -10.915 -22.563 -29.569 239 HE1 TYR 30 HE1 TYR 30 -15.412 -23.579 -27.878 240 HE2 TYR 30 HE2 TYR 30 -12.817 -22.729 -31.126 241 HH TYR 30 HH TYR 30 -14.941 -23.665 -31.276 242 H ASP 31 H ASP 31 -11.539 -23.298 -24.432 243 HA ASP 31 HA ASP 31 -13.045 -21.477 -22.830 244 1HB ASP 31 1HB ASP 31 -14.633 -21.981 -24.652 245 2HB ASP 31 2HB ASP 31 -14.502 -23.694 -24.277 246 H ASN 32 H ASN 32 -12.387 -24.882 -23.600 247 HA ASN 32 HA ASN 32 -11.709 -25.282 -20.770 248 1HB ASN 32 1HB ASN 32 -14.076 -26.081 -21.224 249 2HB ASN 32 2HB ASN 32 -13.405 -27.209 -22.383 250 1HD2 ASN 32 1HD2 ASN 32 -11.873 -26.492 -19.275 251 2HD2 ASN 32 2HD2 ASN 32 -12.165 -28.035 -18.582 252 H GLN 33 H GLN 33 -10.264 -25.052 -23.560 253 HA GLN 33 HA GLN 33 -8.540 -27.252 -23.224 254 1HB GLN 33 1HB GLN 33 -8.700 -28.021 -25.530 255 2HB GLN 33 2HB GLN 33 -10.243 -28.255 -24.727 256 1HG GLN 33 1HG GLN 33 -9.660 -25.839 -26.245 257 2HG GLN 33 2HG GLN 33 -10.157 -27.294 -27.130 258 1HE2 GLN 33 1HE2 GLN 33 -12.271 -28.078 -26.741 259 2HE2 GLN 33 2HE2 GLN 33 -13.528 -27.091 -26.086 260 H LEU 34 H LEU 34 -6.739 -26.942 -24.517 261 HA LEU 34 HA LEU 34 -6.355 -24.095 -24.764 262 1HB LEU 34 1HB LEU 34 -4.459 -26.275 -23.950 263 2HB LEU 34 2HB LEU 34 -3.872 -24.698 -24.431 264 HG LEU 34 HG LEU 34 -3.853 -24.954 -22.001 265 1HD1 LEU 34 1HD1 LEU 34 -5.904 -22.993 -22.866 266 2HD1 LEU 34 2HD1 LEU 34 -4.158 -22.766 -22.801 267 3HD1 LEU 34 3HD1 LEU 34 -5.074 -23.007 -21.312 268 1HD2 LEU 34 1HD2 LEU 34 -6.833 -25.361 -22.165 269 2HD2 LEU 34 2HD2 LEU 34 -5.903 -25.155 -20.680 270 3HD2 LEU 34 3HD2 LEU 34 -5.640 -26.573 -21.697 271 H LEU 35 H LEU 35 -5.655 -23.367 -26.749 272 HA LEU 35 HA LEU 35 -4.586 -25.315 -28.689 273 1HB LEU 35 1HB LEU 35 -6.027 -22.730 -29.261 274 2HB LEU 35 2HB LEU 35 -5.257 -23.733 -30.463 275 HG LEU 35 HG LEU 35 -7.424 -24.108 -30.709 276 1HD1 LEU 35 1HD1 LEU 35 -6.491 -26.376 -28.982 277 2HD1 LEU 35 2HD1 LEU 35 -6.347 -26.202 -30.736 278 3HD1 LEU 35 3HD1 LEU 35 -7.928 -26.426 -30.001 279 1HD2 LEU 35 1HD2 LEU 35 -7.822 -24.334 -27.739 280 2HD2 LEU 35 2HD2 LEU 35 -9.081 -24.628 -28.939 281 3HD2 LEU 35 3HD2 LEU 35 -8.349 -23.026 -28.798 282 H HIS 36 H HIS 36 -3.166 -24.117 -30.315 283 HA HIS 36 HA HIS 36 -1.734 -22.019 -28.929 284 1HB HIS 36 1HB HIS 36 0.495 -22.956 -29.252 285 2HB HIS 36 2HB HIS 36 -0.497 -24.028 -28.290 286 HD2 HIS 36 HD2 HIS 36 -1.560 -26.237 -30.003 287 HE1 HIS 36 HE1 HIS 36 2.034 -26.183 -32.229 288 HE2 HIS 36 HE2 HIS 36 -0.178 -27.338 -31.898 289 H LEU 37 H LEU 37 -0.776 -20.566 -30.027 290 HA LEU 37 HA LEU 37 -1.036 -20.581 -32.996 291 1HB LEU 37 1HB LEU 37 -1.773 -18.240 -31.270 292 2HB LEU 37 2HB LEU 37 -1.872 -18.331 -32.986 293 HG LEU 37 HG LEU 37 -3.620 -20.235 -32.590 294 1HD1 LEU 37 1HD1 LEU 37 -3.229 -20.579 -30.243 295 2HD1 LEU 37 2HD1 LEU 37 -4.897 -20.097 -30.542 296 3HD1 LEU 37 3HD1 LEU 37 -3.746 -18.928 -29.891 297 1HD2 LEU 37 1HD2 LEU 37 -4.394 -18.241 -33.532 298 2HD2 LEU 37 2HD2 LEU 37 -4.212 -17.356 -32.019 299 3HD2 LEU 37 3HD2 LEU 37 -5.474 -18.579 -32.180 300 H LYS 38 H LYS 38 0.339 -19.200 -34.039 301 HA LYS 38 HA LYS 38 2.581 -18.422 -32.338 302 1HB LYS 38 1HB LYS 38 4.057 -18.979 -34.089 303 2HB LYS 38 2HB LYS 38 2.942 -20.321 -33.754 304 1HG LYS 38 1HG LYS 38 1.707 -19.910 -35.741 305 2HG LYS 38 2HG LYS 38 2.573 -18.402 -36.030 306 1HD LYS 38 1HD LYS 38 4.607 -19.549 -36.330 307 2HD LYS 38 2HD LYS 38 3.866 -21.108 -35.960 308 1HE LYS 38 1HE LYS 38 3.229 -19.333 -38.340 309 2HE LYS 38 2HE LYS 38 4.118 -20.851 -38.390 310 1HZ LYS 38 1HZ LYS 38 2.083 -21.953 -37.546 311 2HZ LYS 38 2HZ LYS 38 1.871 -21.259 -39.062 312 3HZ LYS 38 3HZ LYS 38 1.244 -20.502 -37.713 313 H GLN 39 H GLN 39 3.710 -16.704 -32.980 314 HA GLN 39 HA GLN 39 2.102 -14.597 -34.163 315 1HB GLN 39 1HB GLN 39 3.344 -13.985 -32.234 316 2HB GLN 39 2HB GLN 39 4.868 -14.478 -32.996 317 1HG GLN 39 1HG GLN 39 4.757 -12.657 -34.528 318 2HG GLN 39 2HG GLN 39 3.116 -12.260 -34.041 319 1HE2 GLN 39 1HE2 GLN 39 5.564 -13.072 -31.663 320 2HE2 GLN 39 2HE2 GLN 39 5.729 -11.483 -31.045 321 H GLY 40 H GLY 40 1.876 -14.595 -36.079 322 1HA GLY 40 1HA GLY 40 3.972 -14.111 -37.970 323 2HA GLY 40 2HA GLY 40 3.196 -15.690 -38.184 324 H ILE 41 H ILE 41 3.002 -13.452 -40.047 325 HA ILE 41 HA ILE 41 1.437 -12.323 -41.256 326 HB ILE 41 HB ILE 41 -0.203 -14.321 -39.723 327 1HG1 ILE 41 1HG1 ILE 41 -0.740 -15.244 -42.067 328 2HG1 ILE 41 2HG1 ILE 41 0.500 -14.142 -42.636 329 1HG2 ILE 41 1HG2 ILE 41 -1.730 -12.542 -39.946 330 2HG2 ILE 41 2HG2 ILE 41 -2.268 -13.870 -40.991 331 3HG2 ILE 41 3HG2 ILE 41 -1.483 -12.434 -41.687 332 1HD1 ILE 41 1HD1 ILE 41 1.362 -16.400 -42.360 333 2HD1 ILE 41 2HD1 ILE 41 0.890 -16.385 -40.661 334 3HD1 ILE 41 3HD1 ILE 41 2.146 -15.286 -41.239 335 H SER 42 H SER 42 2.469 -11.460 -38.754 336 HA SER 42 HA SER 42 0.303 -10.169 -37.380 337 1HB SER 42 1HB SER 42 1.964 -10.044 -35.551 338 2HB SER 42 2HB SER 42 1.480 -11.652 -36.149 339 HG SER 42 HG SER 42 3.788 -10.315 -37.046 340 H ALA 43 H ALA 43 -0.058 -8.292 -38.521 341 HA ALA 43 HA ALA 43 2.089 -6.480 -38.473 342 1HB ALA 43 1HB ALA 43 0.782 -5.179 -40.113 343 2HB ALA 43 2HB ALA 43 -0.463 -6.424 -40.064 344 3HB ALA 43 3HB ALA 43 1.147 -6.810 -40.677 345 H SER 44 H SER 44 1.819 -4.590 -37.246 346 HA SER 44 HA SER 44 1.105 -3.216 -35.639 347 1HB SER 44 1HB SER 44 -1.651 -3.716 -36.796 348 2HB SER 44 2HB SER 44 -1.182 -2.350 -35.783 349 HG SER 44 HG SER 44 -0.519 -2.939 -38.437 350 H GLY 45 H GLY 45 1.695 -4.568 -33.908 351 1HA GLY 45 1HA GLY 45 0.681 -5.085 -31.683 352 2HA GLY 45 2HA GLY 45 -0.568 -5.962 -32.546 353 H ALA 46 H ALA 46 -0.298 -7.998 -31.982 354 HA ALA 46 HA ALA 46 2.032 -9.319 -32.921 355 1HB ALA 46 1HB ALA 46 2.133 -10.559 -30.760 356 2HB ALA 46 2HB ALA 46 1.069 -9.315 -30.066 357 3HB ALA 46 3HB ALA 46 2.676 -8.883 -30.637 358 H ARG 47 H ARG 47 1.041 -10.754 -34.145 359 HA ARG 47 HA ARG 47 -1.601 -11.338 -33.265 360 1HB ARG 47 1HB ARG 47 -0.649 -11.556 -36.148 361 2HB ARG 47 2HB ARG 47 -2.277 -11.869 -35.593 362 1HG ARG 47 1HG ARG 47 -2.539 -9.529 -34.964 363 2HG ARG 47 2HG ARG 47 -0.885 -9.198 -35.475 364 1HD ARG 47 1HD ARG 47 -2.176 -8.514 -37.313 365 2HD ARG 47 2HD ARG 47 -1.615 -10.111 -37.765 366 HE ARG 47 HE ARG 47 -4.241 -9.892 -36.542 367 1HH1 ARG 47 1HH1 ARG 47 -2.327 -10.569 -39.478 368 2HH1 ARG 47 2HH1 ARG 47 -3.693 -10.908 -40.432 369 1HH2 ARG 47 1HH2 ARG 47 -6.101 -10.357 -37.929 370 2HH2 ARG 47 2HH2 ARG 47 -5.839 -10.805 -39.552 371 H TYR 48 H TYR 48 -1.568 -13.320 -32.402 372 HA TYR 48 HA TYR 48 0.224 -15.435 -33.404 373 1HB TYR 48 1HB TYR 48 -1.465 -15.228 -30.899 374 2HB TYR 48 2HB TYR 48 -0.385 -16.544 -31.340 375 HD1 TYR 48 HD1 TYR 48 -0.483 -12.990 -30.264 376 HD2 TYR 48 HD2 TYR 48 1.941 -16.431 -30.871 377 HE1 TYR 48 HE1 TYR 48 1.332 -11.920 -29.012 378 HE2 TYR 48 HE2 TYR 48 3.772 -15.361 -29.624 379 HH TYR 48 HH TYR 48 3.311 -12.558 -27.752 380 H THR 49 H THR 49 -0.601 -16.686 -34.784 381 HA THR 49 HA THR 49 -3.425 -17.156 -34.684 382 HB THR 49 HB THR 49 -2.103 -15.819 -37.035 383 HG1 THR 49 HG1 THR 49 -3.042 -14.750 -34.940 384 1HG2 THR 49 1HG2 THR 49 -3.808 -17.439 -37.788 385 2HG2 THR 49 2HG2 THR 49 -4.331 -15.786 -38.092 386 3HG2 THR 49 3HG2 THR 49 -4.991 -16.682 -36.724 387 H ASP 50 H ASP 50 -3.882 -19.076 -35.548 388 HA ASP 50 HA ASP 50 -1.744 -20.422 -37.022 389 1HB ASP 50 1HB ASP 50 -2.020 -21.549 -34.887 390 2HB ASP 50 2HB ASP 50 -3.758 -21.682 -35.133 391 H GLY 51 H GLY 51 -4.965 -19.393 -36.950 392 1HA GLY 51 1HA GLY 51 -6.123 -19.387 -39.125 393 2HA GLY 51 2HA GLY 51 -5.694 -21.095 -39.235 394 H ILE 52 H ILE 52 -6.030 -21.252 -36.316 395 HA ILE 52 HA ILE 52 -8.661 -22.276 -36.131 396 HB ILE 52 HB ILE 52 -6.840 -21.391 -33.860 397 1HG1 ILE 52 1HG1 ILE 52 -6.964 -24.107 -35.190 398 2HG1 ILE 52 2HG1 ILE 52 -5.692 -22.925 -35.467 399 1HG2 ILE 52 1HG2 ILE 52 -8.017 -23.080 -32.544 400 2HG2 ILE 52 2HG2 ILE 52 -8.993 -23.497 -33.948 401 3HG2 ILE 52 3HG2 ILE 52 -9.161 -21.905 -33.207 402 1HD1 ILE 52 1HD1 ILE 52 -6.323 -24.280 -32.852 403 2HD1 ILE 52 2HD1 ILE 52 -5.068 -23.067 -33.099 404 3HD1 ILE 52 3HD1 ILE 52 -4.959 -24.626 -33.918 405 H TYR 53 H TYR 53 -7.055 -19.474 -34.776 406 HA TYR 53 HA TYR 53 -9.297 -17.719 -35.154 407 1HB TYR 53 1HB TYR 53 -8.067 -18.199 -32.426 408 2HB TYR 53 2HB TYR 53 -9.029 -16.798 -32.918 409 HD1 TYR 53 HD1 TYR 53 -9.158 -20.243 -31.795 410 HD2 TYR 53 HD2 TYR 53 -11.389 -17.109 -33.559 411 HE1 TYR 53 HE1 TYR 53 -11.234 -21.463 -31.342 412 HE2 TYR 53 HE2 TYR 53 -13.457 -18.305 -33.121 413 HH TYR 53 HH TYR 53 -14.177 -20.655 -32.771 414 H VAL 54 H VAL 54 -8.494 -15.551 -34.494 415 HA VAL 54 HA VAL 54 -5.652 -15.264 -35.117 416 HB VAL 54 HB VAL 54 -8.034 -13.511 -35.481 417 1HG1 VAL 54 1HG1 VAL 54 -5.109 -12.963 -36.183 418 2HG1 VAL 54 2HG1 VAL 54 -6.044 -12.125 -34.944 419 3HG1 VAL 54 3HG1 VAL 54 -6.438 -11.904 -36.649 420 1HG2 VAL 54 1HG2 VAL 54 -6.275 -14.837 -37.540 421 2HG2 VAL 54 2HG2 VAL 54 -7.534 -13.666 -37.921 422 3HG2 VAL 54 3HG2 VAL 54 -7.959 -15.206 -37.173 423 H PHE 55 H PHE 55 -4.677 -14.968 -33.196 424 HA PHE 55 HA PHE 55 -6.127 -13.625 -31.051 425 1HB PHE 55 1HB PHE 55 -5.024 -15.780 -30.523 426 2HB PHE 55 2HB PHE 55 -3.487 -15.127 -31.061 427 HD1 PHE 55 HD1 PHE 55 -5.881 -15.355 -28.369 428 HD2 PHE 55 HD2 PHE 55 -2.346 -13.411 -29.684 429 HE1 PHE 55 HE1 PHE 55 -5.426 -14.640 -26.077 430 HE2 PHE 55 HE2 PHE 55 -1.878 -12.686 -27.378 431 HZ PHE 55 HZ PHE 55 -3.422 -13.294 -25.576 432 H TRP 56 H TRP 56 -5.840 -11.502 -30.926 433 HA TRP 56 HA TRP 56 -3.433 -10.425 -32.093 434 1HB TRP 56 1HB TRP 56 -5.531 -9.886 -33.275 435 2HB TRP 56 2HB TRP 56 -6.131 -9.157 -31.779 436 HD1 TRP 56 HD1 TRP 56 -2.531 -8.566 -32.891 437 HE1 TRP 56 HE1 TRP 56 -2.279 -6.101 -33.586 438 HE3 TRP 56 HE3 TRP 56 -7.428 -7.124 -32.711 439 HZ2 TRP 56 HZ2 TRP 56 -3.891 -3.868 -34.004 440 HZ3 TRP 56 HZ3 TRP 56 -7.986 -4.797 -33.289 441 HH2 TRP 56 HH2 TRP 56 -6.246 -3.206 -33.920 442 H SER 57 H SER 57 -2.254 -9.592 -30.803 443 HA SER 57 HA SER 57 -3.167 -8.878 -28.118 444 1HB SER 57 1HB SER 57 -1.615 -10.821 -28.192 445 2HB SER 57 2HB SER 57 -0.414 -9.802 -28.971 446 HG SER 57 HG SER 57 -0.776 -10.108 -26.405 447 H LYS 58 H LYS 58 -3.112 -6.831 -27.775 448 HA LYS 58 HA LYS 58 -1.360 -5.166 -29.437 449 1HB LYS 58 1HB LYS 58 -3.733 -4.400 -27.731 450 2HB LYS 58 2HB LYS 58 -2.768 -3.314 -28.727 451 1HG LYS 58 1HG LYS 58 -3.496 -4.394 -30.741 452 2HG LYS 58 2HG LYS 58 -4.321 -5.645 -29.817 453 1HD LYS 58 1HD LYS 58 -5.890 -3.980 -30.689 454 2HD LYS 58 2HD LYS 58 -5.875 -4.004 -28.930 455 1HE LYS 58 1HE LYS 58 -5.937 -1.720 -29.685 456 2HE LYS 58 2HE LYS 58 -4.370 -2.026 -28.960 457 1HZ LYS 58 1HZ LYS 58 -4.127 -0.786 -30.963 458 2HZ LYS 58 2HZ LYS 58 -4.989 -1.888 -31.862 459 3HZ LYS 58 3HZ LYS 58 -3.467 -2.304 -31.242 460 H GLY 59 H GLY 59 -1.103 -6.771 -26.732 461 1HA GLY 59 1HA GLY 59 0.840 -6.430 -25.376 462 2HA GLY 59 2HA GLY 59 0.540 -4.699 -25.460 463 H ASP 60 H ASP 60 -1.585 -3.995 -24.496 464 HA ASP 60 HA ASP 60 -1.804 -5.311 -21.895 465 1HB ASP 60 1HB ASP 60 -2.467 -2.496 -22.770 466 2HB ASP 60 2HB ASP 60 -2.943 -3.141 -21.206 467 H GLU 61 H GLU 61 -3.325 -5.227 -24.766 468 HA GLU 61 HA GLU 61 -5.702 -6.351 -23.581 469 1HB GLU 61 1HB GLU 61 -7.161 -5.167 -25.102 470 2HB GLU 61 2HB GLU 61 -6.328 -4.046 -24.030 471 1HG GLU 61 1HG GLU 61 -4.805 -3.487 -25.813 472 2HG GLU 61 2HG GLU 61 -5.664 -4.616 -26.874 473 H ALA 62 H ALA 62 -6.664 -7.832 -24.779 474 HA ALA 62 HA ALA 62 -5.209 -8.687 -27.105 475 1HB ALA 62 1HB ALA 62 -4.300 -9.965 -25.230 476 2HB ALA 62 2HB ALA 62 -5.304 -11.001 -26.246 477 3HB ALA 62 3HB ALA 62 -5.933 -10.386 -24.717 478 H THR 63 H THR 63 -6.514 -9.596 -28.471 479 HA THR 63 HA THR 63 -9.281 -10.160 -27.775 480 HB THR 63 HB THR 63 -9.148 -7.791 -28.570 481 HG1 THR 63 HG1 THR 63 -10.890 -7.950 -29.747 482 1HG2 THR 63 1HG2 THR 63 -8.265 -9.074 -31.099 483 2HG2 THR 63 2HG2 THR 63 -7.268 -8.039 -30.053 484 3HG2 THR 63 3HG2 THR 63 -8.665 -7.358 -30.920 485 H VAL 64 H VAL 64 -10.325 -11.385 -29.600 486 HA VAL 64 HA VAL 64 -8.452 -12.941 -31.246 487 HB VAL 64 HB VAL 64 -10.444 -14.266 -29.394 488 1HG1 VAL 64 1HG1 VAL 64 -8.346 -15.422 -31.200 489 2HG1 VAL 64 2HG1 VAL 64 -10.115 -15.521 -31.344 490 3HG1 VAL 64 3HG1 VAL 64 -9.300 -16.332 -30.020 491 1HG2 VAL 64 1HG2 VAL 64 -8.652 -13.401 -28.011 492 2HG2 VAL 64 2HG2 VAL 64 -7.450 -14.154 -29.058 493 3HG2 VAL 64 3HG2 VAL 64 -8.552 -15.160 -28.111 494 H TYR 65 H TYR 65 -9.288 -12.526 -33.128 495 HA TYR 65 HA TYR 65 -12.245 -12.797 -33.547 496 1HB TYR 65 1HB TYR 65 -10.272 -11.130 -35.042 497 2HB TYR 65 2HB TYR 65 -11.996 -11.181 -35.354 498 HD1 TYR 65 HD1 TYR 65 -13.306 -10.288 -32.989 499 HD2 TYR 65 HD2 TYR 65 -9.424 -9.223 -34.338 500 HE1 TYR 65 HE1 TYR 65 -13.509 -8.129 -31.845 501 HE2 TYR 65 HE2 TYR 65 -9.604 -7.074 -33.179 502 HH TYR 65 HH TYR 65 -11.977 -6.329 -30.911 503 H LYS 66 H LYS 66 -12.102 -15.122 -34.563 504 HA LYS 66 HA LYS 66 -10.545 -15.130 -36.952 505 1HB LYS 66 1HB LYS 66 -11.098 -17.208 -35.437 506 2HB LYS 66 2HB LYS 66 -12.732 -17.023 -36.041 507 1HG LYS 66 1HG LYS 66 -11.693 -17.194 -38.365 508 2HG LYS 66 2HG LYS 66 -10.257 -17.792 -37.531 509 1HD LYS 66 1HD LYS 66 -11.683 -19.521 -36.456 510 2HD LYS 66 2HD LYS 66 -13.025 -18.935 -37.446 511 1HE LYS 66 1HE LYS 66 -11.644 -19.459 -39.476 512 2HE LYS 66 2HE LYS 66 -10.461 -20.194 -38.404 513 1HZ LYS 66 1HZ LYS 66 -12.176 -21.758 -37.667 514 2HZ LYS 66 2HZ LYS 66 -11.885 -21.850 -39.306 515 3HZ LYS 66 3HZ LYS 66 -13.271 -21.057 -38.767 516 H ARG 67 H ARG 67 -11.982 -15.468 -38.785 517 HA ARG 67 HA ARG 67 -13.915 -13.351 -38.889 518 1HB ARG 67 1HB ARG 67 -13.453 -15.454 -40.959 519 2HB ARG 67 2HB ARG 67 -14.325 -13.955 -41.162 520 1HG ARG 67 1HG ARG 67 -12.318 -12.687 -40.708 521 2HG ARG 67 2HG ARG 67 -11.421 -14.204 -40.505 522 1HD ARG 67 1HD ARG 67 -11.077 -13.475 -42.718 523 2HD ARG 67 2HD ARG 67 -12.208 -14.871 -42.616 524 HE ARG 67 HE ARG 67 -13.817 -12.708 -42.579 525 1HH1 ARG 67 1HH1 ARG 67 -11.426 -13.795 -44.980 526 2HH1 ARG 67 2HH1 ARG 67 -12.339 -13.189 -46.298 527 1HH2 ARG 67 1HH2 ARG 67 -14.986 -11.886 -44.387 528 2HH2 ARG 67 2HH2 ARG 67 -14.372 -12.092 -45.963 529 H ASP 68 H ASP 68 -13.988 -16.717 -38.531 530 HA ASP 68 HA ASP 68 -16.838 -16.974 -38.909 531 1HB ASP 68 1HB ASP 68 -14.932 -19.085 -37.850 532 2HB ASP 68 2HB ASP 68 -16.614 -19.336 -38.254 533 H ARG 69 H ARG 69 -14.647 -16.415 -36.332 534 HA ARG 69 HA ARG 69 -16.734 -15.884 -34.727 535 1HB ARG 69 1HB ARG 69 -17.011 -18.265 -34.423 536 2HB ARG 69 2HB ARG 69 -15.341 -18.432 -33.908 537 1HG ARG 69 1HG ARG 69 -15.886 -16.858 -32.004 538 2HG ARG 69 2HG ARG 69 -17.574 -17.030 -32.459 539 1HD ARG 69 1HD ARG 69 -17.459 -19.386 -32.091 540 2HD ARG 69 2HD ARG 69 -15.729 -19.252 -31.719 541 HE ARG 69 HE ARG 69 -17.283 -17.583 -30.034 542 1HH1 ARG 69 1HH1 ARG 69 -16.281 -20.968 -30.421 543 2HH1 ARG 69 2HH1 ARG 69 -16.538 -21.364 -28.780 544 1HH2 ARG 69 1HH2 ARG 69 -17.552 -18.161 -27.713 545 2HH2 ARG 69 2HH2 ARG 69 -17.259 -19.777 -27.262 546 H ILE 70 H ILE 70 -16.114 -14.509 -33.463 547 HA ILE 70 HA ILE 70 -13.433 -13.974 -32.413 548 HB ILE 70 HB ILE 70 -16.089 -12.808 -31.709 549 1HG1 ILE 70 1HG1 ILE 70 -14.148 -11.809 -33.750 550 2HG1 ILE 70 2HG1 ILE 70 -15.680 -12.582 -34.108 551 1HG2 ILE 70 1HG2 ILE 70 -13.321 -11.701 -31.302 552 2HG2 ILE 70 2HG2 ILE 70 -14.430 -12.286 -30.063 553 3HG2 ILE 70 3HG2 ILE 70 -14.811 -10.817 -30.965 554 1HD1 ILE 70 1HD1 ILE 70 -16.888 -10.736 -33.072 555 2HD1 ILE 70 2HD1 ILE 70 -15.837 -10.147 -34.365 556 3HD1 ILE 70 3HD1 ILE 70 -15.368 -9.940 -32.677 557 H VAL 71 H VAL 71 -12.941 -14.598 -30.477 558 HA VAL 71 HA VAL 71 -15.084 -15.858 -28.947 559 HB VAL 71 HB VAL 71 -13.547 -17.342 -27.720 560 1HG1 VAL 71 1HG1 VAL 71 -13.042 -18.874 -29.525 561 2HG1 VAL 71 2HG1 VAL 71 -13.328 -17.582 -30.691 562 3HG1 VAL 71 3HG1 VAL 71 -14.654 -18.167 -29.687 563 1HG2 VAL 71 1HG2 VAL 71 -11.268 -17.686 -28.425 564 2HG2 VAL 71 2HG2 VAL 71 -11.479 -16.003 -27.912 565 3HG2 VAL 71 3HG2 VAL 71 -11.425 -16.415 -29.634 566 H LEU 72 H LEU 72 -12.955 -13.373 -28.999 567 HA LEU 72 HA LEU 72 -13.675 -12.564 -26.351 568 1HB LEU 72 1HB LEU 72 -11.704 -14.211 -26.057 569 2HB LEU 72 2HB LEU 72 -10.788 -12.992 -26.935 570 HG LEU 72 HG LEU 72 -10.673 -13.145 -24.425 571 1HD1 LEU 72 1HD1 LEU 72 -9.483 -11.543 -25.754 572 2HD1 LEU 72 2HD1 LEU 72 -10.243 -10.662 -24.420 573 3HD1 LEU 72 3HD1 LEU 72 -10.948 -10.617 -26.037 574 1HD2 LEU 72 1HD2 LEU 72 -12.993 -12.971 -23.891 575 2HD2 LEU 72 2HD2 LEU 72 -13.138 -11.437 -24.746 576 3HD2 LEU 72 3HD2 LEU 72 -12.160 -11.545 -23.283 577 H ASN 73 H ASN 73 -13.765 -10.364 -26.542 578 HA ASN 73 HA ASN 73 -11.750 -9.062 -28.187 579 1HB ASN 73 1HB ASN 73 -13.362 -7.498 -29.163 580 2HB ASN 73 2HB ASN 73 -13.864 -9.138 -29.518 581 1HD2 ASN 73 1HD2 ASN 73 -15.723 -9.957 -28.464 582 2HD2 ASN 73 2HD2 ASN 73 -16.877 -8.927 -27.736 583 H ASN 74 H ASN 74 -12.456 -9.569 -25.341 584 HA ASN 74 HA ASN 74 -11.922 -6.883 -24.368 585 1HB ASN 74 1HB ASN 74 -14.189 -8.568 -23.278 586 2HB ASN 74 2HB ASN 74 -13.529 -7.160 -22.464 587 1HD2 ASN 74 1HD2 ASN 74 -16.238 -7.637 -23.281 588 2HD2 ASN 74 2HD2 ASN 74 -16.630 -6.406 -24.419 589 H CYS 75 H CYS 75 -9.775 -8.266 -24.275 590 HA CYS 75 HA CYS 75 -9.655 -9.035 -21.463 591 1HB CYS 75 1HB CYS 75 -8.192 -10.229 -23.794 592 2HB CYS 75 2HB CYS 75 -7.458 -10.208 -22.195 593 H GLN 76 H GLN 76 -8.200 -7.946 -20.242 594 HA GLN 76 HA GLN 76 -6.420 -6.234 -21.588 595 1HB GLN 76 1HB GLN 76 -8.619 -5.307 -19.716 596 2HB GLN 76 2HB GLN 76 -7.231 -4.318 -20.181 597 1HG GLN 76 1HG GLN 76 -7.862 -4.442 -22.477 598 2HG GLN 76 2HG GLN 76 -9.230 -5.474 -22.142 599 1HE2 GLN 76 1HE2 GLN 76 -11.012 -4.522 -21.075 600 2HE2 GLN 76 2HE2 GLN 76 -11.289 -2.822 -21.046 601 H LEU 77 H LEU 77 -4.732 -6.153 -20.525 602 HA LEU 77 HA LEU 77 -4.603 -8.226 -18.617 603 1HB LEU 77 1HB LEU 77 -3.152 -8.394 -20.458 604 2HB LEU 77 2HB LEU 77 -2.513 -6.792 -20.196 605 HG LEU 77 HG LEU 77 -1.391 -7.658 -18.116 606 1HD1 LEU 77 1HD1 LEU 77 -2.340 -10.306 -19.124 607 2HD1 LEU 77 2HD1 LEU 77 -2.839 -9.500 -17.638 608 3HD1 LEU 77 3HD1 LEU 77 -1.170 -10.032 -17.833 609 1HD2 LEU 77 1HD2 LEU 77 -0.742 -8.994 -20.738 610 2HD2 LEU 77 2HD2 LEU 77 0.353 -8.844 -19.374 611 3HD2 LEU 77 3HD2 LEU 77 -0.201 -7.401 -20.221 612 H GLN 78 H GLN 78 -3.779 -7.942 -16.398 613 HA GLN 78 HA GLN 78 -3.137 -5.155 -15.769 614 1HB GLN 78 1HB GLN 78 -4.105 -7.355 -13.938 615 2HB GLN 78 2HB GLN 78 -3.624 -5.753 -13.392 616 1HG GLN 78 1HG GLN 78 -5.403 -4.769 -14.763 617 2HG GLN 78 2HG GLN 78 -5.900 -6.384 -15.262 618 1HE2 GLN 78 1HE2 GLN 78 -7.929 -6.119 -14.398 619 2HE2 GLN 78 2HE2 GLN 78 -8.231 -6.117 -12.700 620 H ASN 79 H ASN 79 -2.018 -8.527 -15.226 621 HA ASN 79 HA ASN 79 0.652 -7.653 -15.238 622 1HB ASN 79 1HB ASN 79 0.147 -6.957 -12.942 623 2HB ASN 79 2HB ASN 79 -0.504 -8.550 -12.583 624 1HD2 ASN 79 1HD2 ASN 79 0.851 -10.110 -11.916 625 2HD2 ASN 79 2HD2 ASN 79 2.568 -9.909 -11.758 626 HA PRO 80 HA PRO 80 -0.073 -11.663 -16.718 627 1HB PRO 80 1HB PRO 80 2.019 -11.936 -18.386 628 2HB PRO 80 2HB PRO 80 0.633 -10.908 -18.745 629 1HG PRO 80 1HG PRO 80 3.272 -10.126 -17.536 630 2HG PRO 80 2HG PRO 80 2.411 -9.355 -18.884 631 1HD PRO 80 1HD PRO 80 2.257 -8.374 -16.380 632 2HD PRO 80 2HD PRO 80 0.873 -8.367 -17.512 633 H GLN 81 H GLN 81 2.151 -10.869 -14.508 634 HA GLN 81 HA GLN 81 3.807 -13.204 -14.712 635 1HB GLN 81 1HB GLN 81 3.933 -10.864 -12.844 636 2HB GLN 81 2HB GLN 81 5.112 -12.170 -12.887 637 1HG GLN 81 1HG GLN 81 5.801 -11.567 -15.075 638 2HG GLN 81 2HG GLN 81 4.487 -10.398 -15.226 639 1HE2 GLN 81 1HE2 GLN 81 7.525 -11.100 -13.765 640 2HE2 GLN 81 2HE2 GLN 81 7.867 -9.510 -13.202 641 H ARG 82 H ARG 82 1.451 -11.756 -12.853 642 HA ARG 82 HA ARG 82 0.705 -14.109 -11.382 643 1HB ARG 82 1HB ARG 82 1.525 -11.555 -9.945 644 2HB ARG 82 2HB ARG 82 0.696 -12.913 -9.203 645 1HG ARG 82 1HG ARG 82 2.601 -14.321 -9.570 646 2HG ARG 82 2HG ARG 82 3.412 -13.013 -10.442 647 1HD ARG 82 1HD ARG 82 4.262 -13.207 -8.170 648 2HD ARG 82 2HD ARG 82 3.416 -11.676 -8.387 649 HE ARG 82 HE ARG 82 1.489 -13.213 -7.368 650 1HH1 ARG 82 1HH1 ARG 82 4.826 -12.653 -6.370 651 2HH1 ARG 82 2HH1 ARG 82 4.541 -12.924 -4.721 652 1HH2 ARG 82 1HH2 ARG 82 1.075 -13.617 -5.027 653 2HH2 ARG 82 2HH2 ARG 82 2.396 -13.470 -3.955 Start of MODEL 14 1 H MET 1 H MET 1 1.610 -18.327 -13.527 2 HA MET 1 HA MET 1 3.413 -18.741 -11.901 3 1HB MET 1 1HB MET 1 1.947 -20.585 -12.644 4 2HB MET 1 2HB MET 1 2.990 -20.893 -14.016 5 1HG MET 1 1HG MET 1 4.817 -21.441 -12.394 6 2HG MET 1 2HG MET 1 3.635 -21.296 -11.100 7 1HE MET 1 1HE MET 1 1.152 -24.251 -11.991 8 2HE MET 1 2HE MET 1 1.014 -22.558 -12.461 9 3HE MET 1 3HE MET 1 1.521 -22.984 -10.825 10 H GLN 2 H GLN 2 4.691 -20.420 -14.745 11 HA GLN 2 HA GLN 2 7.242 -19.003 -14.399 12 1HB GLN 2 1HB GLN 2 6.631 -21.336 -16.237 13 2HB GLN 2 2HB GLN 2 8.216 -20.761 -15.760 14 1HG GLN 2 1HG GLN 2 7.805 -21.529 -13.466 15 2HG GLN 2 2HG GLN 2 6.215 -22.108 -13.952 16 1HE2 GLN 2 1HE2 GLN 2 7.274 -23.061 -16.575 17 2HE2 GLN 2 2HE2 GLN 2 8.141 -24.493 -16.196 18 H THR 3 H THR 3 4.824 -19.899 -16.505 19 HA THR 3 HA THR 3 5.497 -18.094 -18.697 20 HB THR 3 HB THR 3 2.836 -19.435 -18.513 21 HG1 THR 3 HG1 THR 3 5.080 -21.036 -19.133 22 1HG2 THR 3 1HG2 THR 3 5.045 -19.288 -20.550 23 2HG2 THR 3 2HG2 THR 3 3.558 -18.336 -20.551 24 3HG2 THR 3 3HG2 THR 3 3.508 -20.086 -20.805 25 H ASP 4 H ASP 4 4.271 -16.264 -19.161 26 HA ASP 4 HA ASP 4 2.971 -15.076 -16.865 27 1HB ASP 4 1HB ASP 4 3.423 -14.036 -19.686 28 2HB ASP 4 2HB ASP 4 2.628 -13.101 -18.415 29 H THR 5 H THR 5 0.743 -14.204 -17.049 30 HA THR 5 HA THR 5 -0.946 -15.657 -18.887 31 HB THR 5 HB THR 5 -1.180 -15.962 -15.887 32 HG1 THR 5 HG1 THR 5 0.078 -17.350 -17.811 33 1HG2 THR 5 1HG2 THR 5 -2.855 -17.170 -18.089 34 2HG2 THR 5 2HG2 THR 5 -3.384 -15.921 -16.964 35 3HG2 THR 5 3HG2 THR 5 -3.007 -17.539 -16.372 36 H LEU 6 H LEU 6 -2.924 -14.667 -19.236 37 HA LEU 6 HA LEU 6 -2.901 -11.904 -18.456 38 1HB LEU 6 1HB LEU 6 -4.822 -13.347 -20.295 39 2HB LEU 6 2HB LEU 6 -4.807 -11.620 -20.030 40 HG LEU 6 HG LEU 6 -2.694 -13.250 -21.348 41 1HD1 LEU 6 1HD1 LEU 6 -3.221 -11.837 -23.276 42 2HD1 LEU 6 2HD1 LEU 6 -4.477 -11.033 -22.338 43 3HD1 LEU 6 3HD1 LEU 6 -4.632 -12.746 -22.730 44 1HD2 LEU 6 1HD2 LEU 6 -1.486 -11.119 -21.716 45 2HD2 LEU 6 2HD2 LEU 6 -1.594 -11.522 -20.007 46 3HD2 LEU 6 3HD2 LEU 6 -2.661 -10.309 -20.690 47 H GLU 7 H GLU 7 -5.884 -11.548 -18.607 48 HA GLU 7 HA GLU 7 -6.098 -11.309 -15.816 49 1HB GLU 7 1HB GLU 7 -6.957 -9.616 -17.353 50 2HB GLU 7 2HB GLU 7 -8.077 -10.782 -18.047 51 1HG GLU 7 1HG GLU 7 -9.099 -11.017 -15.823 52 2HG GLU 7 2HG GLU 7 -8.069 -9.700 -15.257 53 H TYR 8 H TYR 8 -7.170 -13.377 -18.364 54 HA TYR 8 HA TYR 8 -8.509 -14.875 -18.742 55 1HB TYR 8 1HB TYR 8 -8.300 -16.964 -17.521 56 2HB TYR 8 2HB TYR 8 -6.780 -16.104 -17.573 57 HD1 TYR 8 HD1 TYR 8 -9.575 -17.114 -15.394 58 HD2 TYR 8 HD2 TYR 8 -5.635 -15.538 -15.548 59 HE1 TYR 8 HE1 TYR 8 -9.338 -17.512 -12.989 60 HE2 TYR 8 HE2 TYR 8 -5.392 -15.922 -13.128 61 HH TYR 8 HH TYR 8 -6.784 -16.190 -11.185 62 H GLN 9 H GLN 9 -9.900 -12.716 -17.166 63 HA GLN 9 HA GLN 9 -12.193 -14.248 -16.200 64 1HB GLN 9 1HB GLN 9 -10.889 -11.920 -14.800 65 2HB GLN 9 2HB GLN 9 -12.426 -12.649 -14.334 66 1HG GLN 9 1HG GLN 9 -11.300 -14.778 -14.112 67 2HG GLN 9 2HG GLN 9 -9.794 -13.977 -14.487 68 1HE2 GLN 9 1HE2 GLN 9 -10.645 -15.387 -12.028 69 2HE2 GLN 9 2HE2 GLN 9 -10.408 -14.269 -10.732 70 H CYS 10 H CYS 10 -11.930 -13.357 -18.515 71 HA CYS 10 HA CYS 10 -12.871 -10.695 -18.940 72 1HB CYS 10 1HB CYS 10 -12.835 -13.071 -20.805 73 2HB CYS 10 2HB CYS 10 -13.091 -11.393 -21.295 74 H ASP 11 H ASP 11 -14.989 -10.178 -19.758 75 HA ASP 11 HA ASP 11 -16.902 -10.719 -17.957 76 1HB ASP 11 1HB ASP 11 -17.017 -8.868 -19.560 77 2HB ASP 11 2HB ASP 11 -17.523 -10.003 -20.813 78 H GLU 12 H GLU 12 -16.584 -12.633 -20.967 79 HA GLU 12 HA GLU 12 -18.924 -14.136 -19.965 80 1HB GLU 12 1HB GLU 12 -17.893 -14.659 -22.661 81 2HB GLU 12 2HB GLU 12 -19.536 -14.609 -22.069 82 1HG GLU 12 1HG GLU 12 -19.376 -12.114 -22.083 83 2HG GLU 12 2HG GLU 12 -17.767 -12.366 -22.813 84 H LYS 13 H LYS 13 -15.472 -14.366 -20.440 85 HA LYS 13 HA LYS 13 -15.680 -17.187 -20.824 86 1HB LYS 13 1HB LYS 13 -15.857 -16.938 -23.057 87 2HB LYS 13 2HB LYS 13 -15.800 -15.204 -22.826 88 1HG LYS 13 1HG LYS 13 -14.162 -15.435 -24.258 89 2HG LYS 13 2HG LYS 13 -13.327 -15.551 -22.706 90 1HD LYS 13 1HD LYS 13 -13.451 -18.072 -22.852 91 2HD LYS 13 2HD LYS 13 -14.215 -17.855 -24.436 92 1HE LYS 13 1HE LYS 13 -12.231 -16.889 -25.334 93 2HE LYS 13 2HE LYS 13 -11.436 -16.957 -23.760 94 1HZ LYS 13 1HZ LYS 13 -12.371 -19.299 -25.328 95 2HZ LYS 13 2HZ LYS 13 -11.709 -19.368 -23.805 96 3HZ LYS 13 3HZ LYS 13 -10.748 -18.867 -25.077 97 HA PRO 14 HA PRO 14 -11.813 -16.361 -18.840 98 1HB PRO 14 1HB PRO 14 -10.812 -18.882 -18.738 99 2HB PRO 14 2HB PRO 14 -12.138 -18.351 -17.698 100 1HG PRO 14 1HG PRO 14 -12.227 -19.980 -20.197 101 2HG PRO 14 2HG PRO 14 -13.186 -20.151 -18.720 102 1HD PRO 14 1HD PRO 14 -14.083 -18.932 -21.026 103 2HD PRO 14 2HD PRO 14 -14.721 -18.605 -19.407 104 H LEU 15 H LEU 15 -9.982 -15.597 -19.746 105 HA LEU 15 HA LEU 15 -9.044 -16.928 -22.127 106 1HB LEU 15 1HB LEU 15 -10.001 -14.806 -22.801 107 2HB LEU 15 2HB LEU 15 -9.040 -13.958 -21.599 108 HG LEU 15 HG LEU 15 -7.021 -14.549 -22.740 109 1HD1 LEU 15 1HD1 LEU 15 -8.849 -15.804 -24.820 110 2HD1 LEU 15 2HD1 LEU 15 -7.717 -16.669 -23.782 111 3HD1 LEU 15 3HD1 LEU 15 -7.114 -15.577 -25.027 112 1HD2 LEU 15 1HD2 LEU 15 -7.309 -13.127 -24.752 113 2HD2 LEU 15 2HD2 LEU 15 -8.089 -12.467 -23.320 114 3HD2 LEU 15 3HD2 LEU 15 -9.054 -13.268 -24.557 115 H THR 16 H THR 16 -8.007 -18.111 -20.523 116 HA THR 16 HA THR 16 -5.862 -16.857 -19.156 117 HB THR 16 HB THR 16 -6.091 -19.835 -19.448 118 HG1 THR 16 HG1 THR 16 -7.851 -19.874 -18.073 119 1HG2 THR 16 1HG2 THR 16 -5.560 -19.662 -17.021 120 2HG2 THR 16 2HG2 THR 16 -5.611 -17.896 -17.207 121 3HG2 THR 16 3HG2 THR 16 -4.380 -18.830 -18.046 122 H VAL 17 H VAL 17 -3.992 -16.518 -20.112 123 HA VAL 17 HA VAL 17 -3.368 -17.990 -22.572 124 HB VAL 17 HB VAL 17 -2.766 -15.100 -21.928 125 1HG1 VAL 17 1HG1 VAL 17 -0.991 -16.189 -23.317 126 2HG1 VAL 17 2HG1 VAL 17 -1.882 -14.954 -24.198 127 3HG1 VAL 17 3HG1 VAL 17 -2.271 -16.658 -24.437 128 1HG2 VAL 17 1HG2 VAL 17 -4.672 -16.296 -23.926 129 2HG2 VAL 17 2HG2 VAL 17 -4.275 -14.586 -23.793 130 3HG2 VAL 17 3HG2 VAL 17 -5.099 -15.407 -22.462 131 H LYS 18 H LYS 18 -1.328 -18.751 -22.675 132 HA LYS 18 HA LYS 18 0.318 -18.139 -20.384 133 1HB LYS 18 1HB LYS 18 0.218 -20.532 -22.199 134 2HB LYS 18 2HB LYS 18 1.660 -20.187 -21.270 135 1HG LYS 18 1HG LYS 18 0.384 -21.801 -20.070 136 2HG LYS 18 2HG LYS 18 0.263 -20.268 -19.207 137 1HD LYS 18 1HD LYS 18 -1.900 -19.878 -20.285 138 2HD LYS 18 2HD LYS 18 -1.797 -21.469 -21.044 139 1HE LYS 18 1HE LYS 18 -1.897 -20.857 -18.093 140 2HE LYS 18 2HE LYS 18 -3.181 -21.588 -19.053 141 1HZ LYS 18 1HZ LYS 18 -1.701 -23.493 -19.446 142 2HZ LYS 18 2HZ LYS 18 -2.012 -23.270 -17.820 143 3HZ LYS 18 3HZ LYS 18 -0.529 -22.796 -18.459 144 H LEU 19 H LEU 19 1.242 -16.424 -20.917 145 HA LEU 19 HA LEU 19 2.231 -15.866 -23.530 146 1HB LEU 19 1HB LEU 19 2.109 -14.547 -20.937 147 2HB LEU 19 2HB LEU 19 3.409 -14.010 -21.999 148 HG LEU 19 HG LEU 19 0.445 -13.949 -22.672 149 1HD1 LEU 19 1HD1 LEU 19 0.643 -11.532 -22.256 150 2HD1 LEU 19 2HD1 LEU 19 2.318 -11.758 -21.753 151 3HD1 LEU 19 3HD1 LEU 19 1.010 -12.458 -20.801 152 1HD2 LEU 19 1HD2 LEU 19 2.831 -12.640 -23.981 153 2HD2 LEU 19 2HD2 LEU 19 1.154 -12.509 -24.508 154 3HD2 LEU 19 3HD2 LEU 19 1.998 -14.053 -24.614 155 H ASN 20 H ASN 20 3.586 -17.412 -23.952 156 HA ASN 20 HA ASN 20 5.886 -17.816 -22.262 157 1HB ASN 20 1HB ASN 20 5.306 -18.837 -25.069 158 2HB ASN 20 2HB ASN 20 6.849 -19.110 -24.267 159 1HD2 ASN 20 1HD2 ASN 20 6.968 -20.561 -22.601 160 2HD2 ASN 20 2HD2 ASN 20 5.715 -21.667 -22.224 161 H ASN 21 H ASN 21 6.618 -15.818 -22.037 162 HA ASN 21 HA ASN 21 6.862 -13.850 -23.927 163 1HB ASN 21 1HB ASN 21 7.032 -13.590 -21.421 164 2HB ASN 21 2HB ASN 21 8.722 -14.064 -21.576 165 1HD2 ASN 21 1HD2 ASN 21 9.468 -12.048 -20.850 166 2HD2 ASN 21 2HD2 ASN 21 9.349 -10.639 -21.835 167 HA PRO 22 HA PRO 22 11.482 -14.915 -24.901 168 1HB PRO 22 1HB PRO 22 11.827 -17.743 -24.213 169 2HB PRO 22 2HB PRO 22 12.842 -16.364 -23.782 170 1HG PRO 22 1HG PRO 22 11.355 -17.652 -21.956 171 2HG PRO 22 2HG PRO 22 11.634 -15.905 -21.871 172 1HD PRO 22 1HD PRO 22 9.252 -17.405 -22.879 173 2HD PRO 22 2HD PRO 22 9.310 -15.975 -21.826 174 H ARG 23 H ARG 23 8.760 -16.706 -25.479 175 HA ARG 23 HA ARG 23 9.838 -18.100 -27.854 176 1HB ARG 23 1HB ARG 23 7.414 -18.509 -26.176 177 2HB ARG 23 2HB ARG 23 7.549 -19.202 -27.779 178 1HG ARG 23 1HG ARG 23 9.513 -19.656 -25.582 179 2HG ARG 23 2HG ARG 23 8.145 -20.732 -25.928 180 1HD ARG 23 1HD ARG 23 9.020 -20.844 -28.292 181 2HD ARG 23 2HD ARG 23 10.485 -20.067 -27.695 182 HE ARG 23 HE ARG 23 10.836 -21.966 -26.305 183 1HH1 ARG 23 1HH1 ARG 23 8.211 -22.386 -28.717 184 2HH1 ARG 23 2HH1 ARG 23 8.500 -24.027 -28.956 185 1HH2 ARG 23 1HH2 ARG 23 11.193 -24.262 -26.616 186 2HH2 ARG 23 2HH2 ARG 23 10.225 -25.138 -27.718 187 H GLN 24 H GLN 24 7.528 -15.702 -26.812 188 HA GLN 24 HA GLN 24 5.940 -14.537 -27.769 189 1HB GLN 24 1HB GLN 24 7.698 -15.017 -30.117 190 2HB GLN 24 2HB GLN 24 6.233 -14.025 -30.288 191 1HG GLN 24 1HG GLN 24 8.675 -13.521 -28.592 192 2HG GLN 24 2HG GLN 24 8.124 -12.570 -29.970 193 1HE2 GLN 24 1HE2 GLN 24 6.319 -11.219 -29.706 194 2HE2 GLN 24 2HE2 GLN 24 5.724 -10.782 -28.154 195 H GLU 25 H GLU 25 5.433 -16.956 -27.166 196 HA GLU 25 HA GLU 25 3.442 -17.822 -29.102 197 1HB GLU 25 1HB GLU 25 5.328 -19.476 -27.449 198 2HB GLU 25 2HB GLU 25 3.756 -20.101 -27.908 199 1HG GLU 25 1HG GLU 25 4.250 -19.939 -30.169 200 2HG GLU 25 2HG GLU 25 5.801 -19.117 -29.879 201 H VAL 26 H VAL 26 1.599 -18.440 -28.208 202 HA VAL 26 HA VAL 26 1.203 -18.148 -25.267 203 HB VAL 26 HB VAL 26 -0.898 -17.124 -25.618 204 1HG1 VAL 26 1HG1 VAL 26 -0.236 -14.869 -26.409 205 2HG1 VAL 26 2HG1 VAL 26 1.276 -15.567 -27.002 206 3HG1 VAL 26 3HG1 VAL 26 0.898 -15.597 -25.274 207 1HG2 VAL 26 1HG2 VAL 26 -1.634 -16.219 -27.799 208 2HG2 VAL 26 2HG2 VAL 26 -1.513 -17.983 -27.764 209 3HG2 VAL 26 3HG2 VAL 26 -0.246 -17.026 -28.535 210 H SER 27 H SER 27 -0.118 -19.418 -24.431 211 HA SER 27 HA SER 27 -1.490 -21.288 -26.195 212 1HB SER 27 1HB SER 27 -0.405 -21.931 -23.437 213 2HB SER 27 2HB SER 27 -1.229 -23.012 -24.564 214 HG SER 27 HG SER 27 0.643 -22.112 -25.984 215 H PHE 28 H PHE 28 -3.533 -21.002 -26.018 216 HA PHE 28 HA PHE 28 -4.420 -19.780 -23.529 217 1HB PHE 28 1HB PHE 28 -5.741 -18.176 -24.512 218 2HB PHE 28 2HB PHE 28 -4.365 -18.225 -25.596 219 HD1 PHE 28 HD1 PHE 28 -7.911 -18.530 -25.263 220 HD2 PHE 28 HD2 PHE 28 -4.653 -19.514 -27.807 221 HE1 PHE 28 HE1 PHE 28 -9.480 -18.876 -27.112 222 HE2 PHE 28 HE2 PHE 28 -6.235 -19.863 -29.669 223 HZ PHE 28 HZ PHE 28 -8.640 -19.546 -29.319 224 H VAL 29 H VAL 29 -6.521 -20.061 -23.039 225 HA VAL 29 HA VAL 29 -7.291 -22.773 -23.534 226 HB VAL 29 HB VAL 29 -7.005 -21.925 -21.204 227 1HG1 VAL 29 1HG1 VAL 29 -7.883 -19.724 -21.424 228 2HG1 VAL 29 2HG1 VAL 29 -8.713 -20.597 -20.132 229 3HG1 VAL 29 3HG1 VAL 29 -9.504 -20.360 -21.695 230 1HG2 VAL 29 1HG2 VAL 29 -9.026 -23.002 -20.282 231 2HG2 VAL 29 2HG2 VAL 29 -8.232 -23.925 -21.553 232 3HG2 VAL 29 3HG2 VAL 29 -9.716 -23.031 -21.912 233 H TYR 30 H TYR 30 -8.516 -23.120 -24.960 234 HA TYR 30 HA TYR 30 -10.509 -21.378 -26.192 235 1HB TYR 30 1HB TYR 30 -9.595 -23.262 -27.480 236 2HB TYR 30 2HB TYR 30 -10.172 -24.398 -26.269 237 HD1 TYR 30 HD1 TYR 30 -11.847 -25.699 -27.152 238 HD2 TYR 30 HD2 TYR 30 -11.804 -21.553 -28.085 239 HE1 TYR 30 HE1 TYR 30 -13.961 -25.961 -28.373 240 HE2 TYR 30 HE2 TYR 30 -13.915 -21.805 -29.304 241 HH TYR 30 HH TYR 30 -15.829 -24.607 -29.087 242 H ASP 31 H ASP 31 -10.991 -24.298 -24.284 243 HA ASP 31 HA ASP 31 -13.078 -22.796 -22.948 244 1HB ASP 31 1HB ASP 31 -14.792 -24.418 -23.318 245 2HB ASP 31 2HB ASP 31 -13.941 -24.160 -24.849 246 H ASN 32 H ASN 32 -11.387 -25.906 -22.985 247 HA ASN 32 HA ASN 32 -10.560 -25.581 -20.224 248 1HB ASN 32 1HB ASN 32 -12.856 -26.739 -20.184 249 2HB ASN 32 2HB ASN 32 -12.131 -28.047 -21.104 250 1HD2 ASN 32 1HD2 ASN 32 -12.290 -26.462 -17.997 251 2HD2 ASN 32 2HD2 ASN 32 -11.552 -27.722 -17.102 252 H GLN 33 H GLN 33 -9.406 -25.546 -22.899 253 HA GLN 33 HA GLN 33 -7.598 -27.730 -22.710 254 1HB GLN 33 1HB GLN 33 -7.924 -28.413 -24.991 255 2HB GLN 33 2HB GLN 33 -9.490 -28.505 -24.195 256 1HG GLN 33 1HG GLN 33 -10.036 -26.300 -25.120 257 2HG GLN 33 2HG GLN 33 -8.488 -26.352 -25.975 258 1HE2 GLN 33 1HE2 GLN 33 -11.719 -27.570 -25.832 259 2HE2 GLN 33 2HE2 GLN 33 -11.684 -28.409 -27.343 260 H LEU 34 H LEU 34 -5.781 -27.172 -23.849 261 HA LEU 34 HA LEU 34 -5.654 -24.300 -24.198 262 1HB LEU 34 1HB LEU 34 -3.643 -26.223 -23.056 263 2HB LEU 34 2HB LEU 34 -3.180 -24.629 -23.615 264 HG LEU 34 HG LEU 34 -3.336 -24.676 -21.187 265 1HD1 LEU 34 1HD1 LEU 34 -5.535 -23.066 -22.366 266 2HD1 LEU 34 2HD1 LEU 34 -3.838 -22.617 -22.211 267 3HD1 LEU 34 3HD1 LEU 34 -4.825 -22.846 -20.767 268 1HD2 LEU 34 1HD2 LEU 34 -5.441 -25.031 -19.995 269 2HD2 LEU 34 2HD2 LEU 34 -4.945 -26.481 -20.869 270 3HD2 LEU 34 3HD2 LEU 34 -6.230 -25.460 -21.514 271 H LEU 35 H LEU 35 -4.928 -23.668 -26.128 272 HA LEU 35 HA LEU 35 -3.215 -25.513 -27.557 273 1HB LEU 35 1HB LEU 35 -4.122 -25.009 -29.745 274 2HB LEU 35 2HB LEU 35 -5.357 -25.662 -28.714 275 HG LEU 35 HG LEU 35 -6.259 -24.122 -30.145 276 1HD1 LEU 35 1HD1 LEU 35 -7.324 -24.073 -28.017 277 2HD1 LEU 35 2HD1 LEU 35 -7.330 -22.440 -28.681 278 3HD1 LEU 35 3HD1 LEU 35 -6.180 -22.872 -27.416 279 1HD2 LEU 35 1HD2 LEU 35 -4.323 -22.019 -29.218 280 2HD2 LEU 35 2HD2 LEU 35 -5.698 -21.731 -30.295 281 3HD2 LEU 35 3HD2 LEU 35 -4.388 -22.791 -30.801 282 H HIS 36 H HIS 36 -2.069 -24.268 -29.401 283 HA HIS 36 HA HIS 36 -1.220 -21.870 -28.038 284 1HB HIS 36 1HB HIS 36 1.137 -22.367 -28.387 285 2HB HIS 36 2HB HIS 36 0.339 -23.552 -27.372 286 HD2 HIS 36 HD2 HIS 36 1.824 -23.276 -30.988 287 HE1 HIS 36 HE1 HIS 36 1.667 -27.341 -29.848 288 HE2 HIS 36 HE2 HIS 36 2.643 -25.681 -31.479 289 H LEU 37 H LEU 37 -0.125 -20.411 -29.115 290 HA LEU 37 HA LEU 37 -0.495 -20.266 -32.049 291 1HB LEU 37 1HB LEU 37 -1.100 -18.100 -30.081 292 2HB LEU 37 2HB LEU 37 -1.332 -18.034 -31.799 293 HG LEU 37 HG LEU 37 -2.636 -20.078 -30.199 294 1HD1 LEU 37 1HD1 LEU 37 -4.630 -18.495 -29.973 295 2HD1 LEU 37 2HD1 LEU 37 -3.565 -17.216 -30.584 296 3HD1 LEU 37 3HD1 LEU 37 -3.202 -18.030 -29.057 297 1HD2 LEU 37 1HD2 LEU 37 -3.494 -18.688 -32.718 298 2HD2 LEU 37 2HD2 LEU 37 -4.408 -19.957 -31.903 299 3HD2 LEU 37 3HD2 LEU 37 -2.812 -20.307 -32.569 300 H LYS 38 H LYS 38 0.735 -18.621 -32.816 301 HA LYS 38 HA LYS 38 2.976 -17.795 -31.117 302 1HB LYS 38 1HB LYS 38 4.573 -18.373 -32.830 303 2HB LYS 38 2HB LYS 38 3.631 -19.767 -32.270 304 1HG LYS 38 1HG LYS 38 2.454 -19.947 -34.242 305 2HG LYS 38 2HG LYS 38 2.840 -18.296 -34.736 306 1HD LYS 38 1HD LYS 38 5.102 -18.872 -35.036 307 2HD LYS 38 2HD LYS 38 4.827 -20.532 -34.488 308 1HE LYS 38 1HE LYS 38 3.276 -20.904 -36.363 309 2HE LYS 38 2HE LYS 38 3.529 -19.253 -36.910 310 1HZ LYS 38 1HZ LYS 38 5.838 -19.806 -37.410 311 2HZ LYS 38 2HZ LYS 38 4.798 -20.859 -38.185 312 3HZ LYS 38 3HZ LYS 38 5.611 -21.374 -36.806 313 H GLN 39 H GLN 39 3.979 -15.995 -31.753 314 HA GLN 39 HA GLN 39 2.455 -14.222 -33.514 315 1HB GLN 39 1HB GLN 39 3.281 -13.275 -31.411 316 2HB GLN 39 2HB GLN 39 4.937 -13.670 -31.892 317 1HG GLN 39 1HG GLN 39 4.749 -12.156 -33.804 318 2HG GLN 39 2HG GLN 39 3.102 -11.757 -33.335 319 1HE2 GLN 39 1HE2 GLN 39 5.462 -10.083 -33.673 320 2HE2 GLN 39 2HE2 GLN 39 5.691 -9.255 -32.178 321 H GLY 40 H GLY 40 2.838 -14.346 -35.443 322 1HA GLY 40 1HA GLY 40 5.618 -14.549 -36.405 323 2HA GLY 40 2HA GLY 40 4.339 -15.512 -37.151 324 H ILE 41 H ILE 41 2.579 -14.416 -38.074 325 HA ILE 41 HA ILE 41 3.503 -12.069 -39.454 326 HB ILE 41 HB ILE 41 1.036 -13.786 -39.891 327 1HG1 ILE 41 1HG1 ILE 41 2.103 -14.179 -42.154 328 2HG1 ILE 41 2HG1 ILE 41 3.524 -13.342 -41.557 329 1HG2 ILE 41 1HG2 ILE 41 0.532 -12.423 -41.877 330 2HG2 ILE 41 2HG2 ILE 41 1.841 -11.324 -41.442 331 3HG2 ILE 41 3HG2 ILE 41 0.439 -11.479 -40.388 332 1HD1 ILE 41 1HD1 ILE 41 2.391 -15.929 -40.511 333 2HD1 ILE 41 2HD1 ILE 41 3.776 -15.086 -39.830 334 3HD1 ILE 41 3HD1 ILE 41 3.858 -15.732 -41.469 335 H SER 42 H SER 42 3.381 -10.397 -38.300 336 HA SER 42 HA SER 42 0.836 -9.544 -37.244 337 1HB SER 42 1HB SER 42 1.907 -10.759 -35.397 338 2HB SER 42 2HB SER 42 3.365 -9.809 -35.603 339 HG SER 42 HG SER 42 2.523 -8.313 -34.462 340 H ALA 43 H ALA 43 1.017 -7.222 -36.638 341 HA ALA 43 HA ALA 43 3.094 -5.605 -37.263 342 1HB ALA 43 1HB ALA 43 2.361 -4.546 -39.382 343 2HB ALA 43 2HB ALA 43 1.087 -5.755 -39.528 344 3HB ALA 43 3HB ALA 43 2.780 -6.245 -39.614 345 H SER 44 H SER 44 -0.389 -6.105 -37.241 346 HA SER 44 HA SER 44 -1.021 -3.414 -36.558 347 1HB SER 44 1HB SER 44 -3.288 -4.627 -36.395 348 2HB SER 44 2HB SER 44 -2.502 -4.528 -37.977 349 HG SER 44 HG SER 44 -3.300 -6.652 -37.265 350 H GLY 45 H GLY 45 0.446 -5.640 -34.759 351 1HA GLY 45 1HA GLY 45 -0.045 -4.740 -32.225 352 2HA GLY 45 2HA GLY 45 -1.289 -5.948 -32.494 353 H ALA 46 H ALA 46 -0.826 -7.848 -31.808 354 HA ALA 46 HA ALA 46 1.743 -8.967 -32.333 355 1HB ALA 46 1HB ALA 46 1.692 -9.899 -30.049 356 2HB ALA 46 2HB ALA 46 0.367 -8.767 -29.671 357 3HB ALA 46 3HB ALA 46 1.972 -8.152 -30.078 358 H ARG 47 H ARG 47 1.041 -10.455 -33.585 359 HA ARG 47 HA ARG 47 -1.573 -11.379 -33.018 360 1HB ARG 47 1HB ARG 47 -0.100 -11.290 -35.626 361 2HB ARG 47 2HB ARG 47 -1.501 -12.325 -35.422 362 1HG ARG 47 1HG ARG 47 -2.902 -10.443 -34.947 363 2HG ARG 47 2HG ARG 47 -1.511 -9.361 -34.934 364 1HD ARG 47 1HD ARG 47 -2.846 -9.303 -37.039 365 2HD ARG 47 2HD ARG 47 -1.147 -9.673 -37.278 366 HE ARG 47 HE ARG 47 -2.564 -12.077 -37.039 367 1HH1 ARG 47 1HH1 ARG 47 -2.233 -9.388 -39.323 368 2HH1 ARG 47 2HH1 ARG 47 -2.574 -10.317 -40.691 369 1HH2 ARG 47 1HH2 ARG 47 -2.997 -13.365 -38.917 370 2HH2 ARG 47 2HH2 ARG 47 -3.100 -12.648 -40.456 371 H TYR 48 H TYR 48 -1.365 -13.140 -31.802 372 HA TYR 48 HA TYR 48 0.613 -15.199 -32.416 373 1HB TYR 48 1HB TYR 48 -1.317 -14.884 -30.093 374 2HB TYR 48 2HB TYR 48 -0.068 -16.110 -30.274 375 HD1 TYR 48 HD1 TYR 48 2.205 -15.651 -29.676 376 HD2 TYR 48 HD2 TYR 48 -0.655 -12.500 -29.613 377 HE1 TYR 48 HE1 TYR 48 3.790 -14.226 -28.445 378 HE2 TYR 48 HE2 TYR 48 0.915 -11.086 -28.381 379 HH TYR 48 HH TYR 48 2.841 -11.292 -26.968 380 H THR 49 H THR 49 -0.080 -16.444 -33.935 381 HA THR 49 HA THR 49 -2.856 -17.251 -33.891 382 HB THR 49 HB THR 49 -1.569 -15.809 -36.174 383 HG1 THR 49 HG1 THR 49 -2.713 -14.843 -34.132 384 1HG2 THR 49 1HG2 THR 49 -3.035 -17.588 -37.012 385 2HG2 THR 49 2HG2 THR 49 -3.733 -16.008 -37.345 386 3HG2 THR 49 3HG2 THR 49 -4.354 -16.988 -36.009 387 H ASP 50 H ASP 50 -3.068 -19.227 -34.671 388 HA ASP 50 HA ASP 50 -0.892 -20.350 -36.272 389 1HB ASP 50 1HB ASP 50 -0.970 -21.555 -34.198 390 2HB ASP 50 2HB ASP 50 -2.718 -21.738 -34.304 391 H GLY 51 H GLY 51 -4.319 -19.878 -35.912 392 1HA GLY 51 1HA GLY 51 -5.421 -19.746 -38.180 393 2HA GLY 51 2HA GLY 51 -4.850 -21.405 -38.362 394 H ILE 52 H ILE 52 -5.211 -21.769 -35.450 395 HA ILE 52 HA ILE 52 -7.801 -22.900 -35.400 396 HB ILE 52 HB ILE 52 -6.187 -22.041 -32.972 397 1HG1 ILE 52 1HG1 ILE 52 -4.721 -23.376 -34.437 398 2HG1 ILE 52 2HG1 ILE 52 -5.128 -24.259 -32.972 399 1HG2 ILE 52 1HG2 ILE 52 -8.451 -22.729 -32.458 400 2HG2 ILE 52 2HG2 ILE 52 -7.312 -23.937 -31.864 401 3HG2 ILE 52 3HG2 ILE 52 -8.219 -24.235 -33.344 402 1HD1 ILE 52 1HD1 ILE 52 -6.351 -24.674 -35.691 403 2HD1 ILE 52 2HD1 ILE 52 -6.762 -25.565 -34.224 404 3HD1 ILE 52 3HD1 ILE 52 -5.144 -25.701 -34.916 405 H TYR 53 H TYR 53 -6.389 -20.045 -33.897 406 HA TYR 53 HA TYR 53 -8.685 -18.424 -34.425 407 1HB TYR 53 1HB TYR 53 -7.646 -18.758 -31.577 408 2HB TYR 53 2HB TYR 53 -8.654 -17.436 -32.204 409 HD1 TYR 53 HD1 TYR 53 -10.943 -17.846 -32.893 410 HD2 TYR 53 HD2 TYR 53 -8.657 -20.955 -31.136 411 HE1 TYR 53 HE1 TYR 53 -12.961 -19.211 -32.717 412 HE2 TYR 53 HE2 TYR 53 -10.686 -22.336 -30.933 413 HH TYR 53 HH TYR 53 -13.149 -22.055 -30.927 414 H VAL 54 H VAL 54 -8.092 -16.226 -34.090 415 HA VAL 54 HA VAL 54 -5.235 -15.755 -34.449 416 HB VAL 54 HB VAL 54 -7.738 -14.344 -35.079 417 1HG1 VAL 54 1HG1 VAL 54 -6.270 -12.600 -36.299 418 2HG1 VAL 54 2HG1 VAL 54 -4.851 -13.435 -35.669 419 3HG1 VAL 54 3HG1 VAL 54 -5.970 -12.637 -34.560 420 1HG2 VAL 54 1HG2 VAL 54 -7.341 -16.099 -36.637 421 2HG2 VAL 54 2HG2 VAL 54 -5.699 -15.540 -36.954 422 3HG2 VAL 54 3HG2 VAL 54 -7.075 -14.575 -37.479 423 H PHE 55 H PHE 55 -4.409 -15.198 -32.516 424 HA PHE 55 HA PHE 55 -6.072 -13.704 -30.651 425 1HB PHE 55 1HB PHE 55 -4.886 -15.707 -29.817 426 2HB PHE 55 2HB PHE 55 -3.358 -15.008 -30.317 427 HD1 PHE 55 HD1 PHE 55 -6.078 -14.904 -27.887 428 HD2 PHE 55 HD2 PHE 55 -2.304 -13.314 -28.985 429 HE1 PHE 55 HE1 PHE 55 -5.824 -13.955 -25.640 430 HE2 PHE 55 HE2 PHE 55 -2.041 -12.352 -26.738 431 HZ PHE 55 HZ PHE 55 -3.806 -12.673 -25.066 432 H TRP 56 H TRP 56 -6.037 -11.651 -31.200 433 HA TRP 56 HA TRP 56 -3.541 -10.521 -32.096 434 1HB TRP 56 1HB TRP 56 -5.259 -10.331 -33.732 435 2HB TRP 56 2HB TRP 56 -6.387 -9.665 -32.538 436 HD1 TRP 56 HD1 TRP 56 -2.771 -8.402 -32.876 437 HE1 TRP 56 HE1 TRP 56 -2.848 -5.948 -33.641 438 HE3 TRP 56 HE3 TRP 56 -7.767 -7.998 -33.828 439 HZ2 TRP 56 HZ2 TRP 56 -4.751 -4.105 -34.573 440 HZ3 TRP 56 HZ3 TRP 56 -8.636 -5.859 -34.673 441 HH2 TRP 56 HH2 TRP 56 -7.157 -3.954 -35.035 442 H SER 57 H SER 57 -2.641 -9.572 -30.753 443 HA SER 57 HA SER 57 -3.975 -8.603 -28.333 444 1HB SER 57 1HB SER 57 -2.464 -10.485 -27.953 445 2HB SER 57 2HB SER 57 -1.154 -9.610 -28.734 446 HG SER 57 HG SER 57 -0.818 -9.196 -26.653 447 H LYS 58 H LYS 58 -3.569 -6.630 -27.698 448 HA LYS 58 HA LYS 58 -1.523 -5.087 -29.172 449 1HB LYS 58 1HB LYS 58 -3.843 -3.940 -27.582 450 2HB LYS 58 2HB LYS 58 -2.577 -3.034 -28.375 451 1HG LYS 58 1HG LYS 58 -4.510 -2.816 -29.694 452 2HG LYS 58 2HG LYS 58 -3.432 -3.897 -30.569 453 1HD LYS 58 1HD LYS 58 -4.792 -5.758 -30.099 454 2HD LYS 58 2HD LYS 58 -5.645 -4.925 -28.804 455 1HE LYS 58 1HE LYS 58 -5.807 -4.274 -31.746 456 2HE LYS 58 2HE LYS 58 -7.052 -5.075 -30.788 457 1HZ LYS 58 1HZ LYS 58 -7.653 -2.775 -30.957 458 2HZ LYS 58 2HZ LYS 58 -6.132 -2.249 -30.526 459 3HZ LYS 58 3HZ LYS 58 -7.102 -2.989 -29.379 460 H GLY 59 H GLY 59 -1.652 -6.925 -26.672 461 1HA GLY 59 1HA GLY 59 0.061 -7.020 -25.069 462 2HA GLY 59 2HA GLY 59 0.211 -5.272 -25.153 463 H ASP 60 H ASP 60 -2.143 -4.284 -24.586 464 HA ASP 60 HA ASP 60 -2.531 -5.143 -21.794 465 1HB ASP 60 1HB ASP 60 -3.489 -2.614 -23.159 466 2HB ASP 60 2HB ASP 60 -3.573 -2.959 -21.439 467 H GLU 61 H GLU 61 -3.946 -5.282 -24.798 468 HA GLU 61 HA GLU 61 -6.446 -6.203 -23.703 469 1HB GLU 61 1HB GLU 61 -7.622 -4.952 -25.548 470 2HB GLU 61 2HB GLU 61 -6.938 -3.941 -24.276 471 1HG GLU 61 1HG GLU 61 -5.013 -3.480 -25.667 472 2HG GLU 61 2HG GLU 61 -5.702 -4.488 -26.936 473 H ALA 62 H ALA 62 -7.453 -7.736 -25.106 474 HA ALA 62 HA ALA 62 -5.790 -8.664 -27.264 475 1HB ALA 62 1HB ALA 62 -5.864 -10.955 -26.404 476 2HB ALA 62 2HB ALA 62 -6.689 -10.385 -24.955 477 3HB ALA 62 3HB ALA 62 -5.034 -9.873 -25.284 478 H THR 63 H THR 63 -6.896 -9.424 -28.807 479 HA THR 63 HA THR 63 -9.791 -9.968 -28.515 480 HB THR 63 HB THR 63 -8.306 -8.834 -30.907 481 HG1 THR 63 HG1 THR 63 -9.235 -7.725 -28.682 482 1HG2 THR 63 1HG2 THR 63 -10.311 -10.162 -31.527 483 2HG2 THR 63 2HG2 THR 63 -10.538 -8.446 -31.854 484 3HG2 THR 63 3HG2 THR 63 -11.289 -9.176 -30.437 485 H VAL 64 H VAL 64 -10.437 -12.052 -29.247 486 HA VAL 64 HA VAL 64 -8.409 -13.444 -30.764 487 HB VAL 64 HB VAL 64 -8.405 -14.251 -28.403 488 1HG1 VAL 64 1HG1 VAL 64 -11.236 -14.973 -28.757 489 2HG1 VAL 64 2HG1 VAL 64 -10.559 -13.716 -27.727 490 3HG1 VAL 64 3HG1 VAL 64 -10.188 -15.411 -27.403 491 1HG2 VAL 64 1HG2 VAL 64 -7.810 -15.842 -30.147 492 2HG2 VAL 64 2HG2 VAL 64 -9.509 -16.255 -30.358 493 3HG2 VAL 64 3HG2 VAL 64 -8.688 -16.654 -28.848 494 H TYR 65 H TYR 65 -9.113 -13.538 -32.711 495 HA TYR 65 HA TYR 65 -11.919 -14.238 -33.310 496 1HB TYR 65 1HB TYR 65 -11.918 -11.961 -33.736 497 2HB TYR 65 2HB TYR 65 -10.260 -11.966 -34.319 498 HD1 TYR 65 HD1 TYR 65 -9.794 -12.230 -36.672 499 HD2 TYR 65 HD2 TYR 65 -13.799 -12.780 -35.312 500 HE1 TYR 65 HE1 TYR 65 -10.597 -12.241 -38.994 501 HE2 TYR 65 HE2 TYR 65 -14.585 -12.791 -37.609 502 HH TYR 65 HH TYR 65 -13.904 -12.006 -39.748 503 H LYS 66 H LYS 66 -11.817 -16.217 -34.259 504 HA LYS 66 HA LYS 66 -9.838 -16.697 -36.289 505 1HB LYS 66 1HB LYS 66 -10.743 -18.554 -34.757 506 2HB LYS 66 2HB LYS 66 -12.298 -18.299 -35.531 507 1HG LYS 66 1HG LYS 66 -11.148 -18.792 -37.709 508 2HG LYS 66 2HG LYS 66 -9.763 -19.336 -36.747 509 1HD LYS 66 1HD LYS 66 -11.368 -20.871 -35.576 510 2HD LYS 66 2HD LYS 66 -12.551 -20.359 -36.792 511 1HE LYS 66 1HE LYS 66 -11.169 -21.226 -38.581 512 2HE LYS 66 2HE LYS 66 -9.908 -21.678 -37.436 513 1HZ LYS 66 1HZ LYS 66 -11.202 -23.587 -38.058 514 2HZ LYS 66 2HZ LYS 66 -12.640 -22.831 -37.593 515 3HZ LYS 66 3HZ LYS 66 -11.499 -23.252 -36.434 516 H ARG 67 H ARG 67 -10.757 -17.132 -38.256 517 HA ARG 67 HA ARG 67 -12.343 -15.105 -39.380 518 1HB ARG 67 1HB ARG 67 -10.776 -16.494 -40.694 519 2HB ARG 67 2HB ARG 67 -11.885 -17.854 -40.541 520 1HG ARG 67 1HG ARG 67 -12.136 -16.859 -42.714 521 2HG ARG 67 2HG ARG 67 -13.588 -16.549 -41.763 522 1HD ARG 67 1HD ARG 67 -12.996 -14.512 -42.856 523 2HD ARG 67 2HD ARG 67 -12.651 -14.396 -41.119 524 HE ARG 67 HE ARG 67 -10.406 -15.252 -42.693 525 1HH1 ARG 67 1HH1 ARG 67 -11.962 -12.437 -41.221 526 2HH1 ARG 67 2HH1 ARG 67 -10.653 -11.395 -41.510 527 1HH2 ARG 67 1HH2 ARG 67 -8.599 -13.867 -43.010 528 2HH2 ARG 67 2HH2 ARG 67 -8.654 -12.233 -42.539 529 H ASP 68 H ASP 68 -13.184 -18.022 -37.972 530 HA ASP 68 HA ASP 68 -15.899 -18.038 -39.028 531 1HB ASP 68 1HB ASP 68 -14.507 -20.178 -37.421 532 2HB ASP 68 2HB ASP 68 -16.150 -20.273 -38.024 533 H ARG 69 H ARG 69 -14.172 -17.364 -36.128 534 HA ARG 69 HA ARG 69 -16.432 -16.451 -34.958 535 1HB ARG 69 1HB ARG 69 -16.943 -18.892 -34.613 536 2HB ARG 69 2HB ARG 69 -15.518 -18.976 -33.574 537 1HG ARG 69 1HG ARG 69 -16.539 -17.113 -32.217 538 2HG ARG 69 2HG ARG 69 -18.007 -17.374 -33.145 539 1HD ARG 69 1HD ARG 69 -18.087 -19.686 -32.304 540 2HD ARG 69 2HD ARG 69 -16.634 -19.354 -31.343 541 HE ARG 69 HE ARG 69 -19.056 -17.734 -31.027 542 1HH1 ARG 69 1HH1 ARG 69 -16.736 -19.962 -29.509 543 2HH1 ARG 69 2HH1 ARG 69 -17.186 -19.525 -27.920 544 1HH2 ARG 69 1HH2 ARG 69 -19.664 -17.200 -28.841 545 2HH2 ARG 69 2HH2 ARG 69 -18.905 -17.971 -27.530 546 H ILE 70 H ILE 70 -15.898 -15.127 -33.613 547 HA ILE 70 HA ILE 70 -13.346 -14.713 -32.226 548 HB ILE 70 HB ILE 70 -16.016 -13.480 -31.708 549 1HG1 ILE 70 1HG1 ILE 70 -13.890 -12.411 -33.510 550 2HG1 ILE 70 2HG1 ILE 70 -15.403 -13.143 -34.087 551 1HG2 ILE 70 1HG2 ILE 70 -14.396 -13.103 -29.965 552 2HG2 ILE 70 2HG2 ILE 70 -14.808 -11.616 -30.801 553 3HG2 ILE 70 3HG2 ILE 70 -13.260 -12.409 -31.136 554 1HD1 ILE 70 1HD1 ILE 70 -15.064 -10.581 -32.526 555 2HD1 ILE 70 2HD1 ILE 70 -16.611 -11.291 -32.984 556 3HD1 ILE 70 3HD1 ILE 70 -15.501 -10.723 -34.232 557 H VAL 71 H VAL 71 -12.987 -15.314 -30.269 558 HA VAL 71 HA VAL 71 -15.226 -16.550 -28.802 559 HB VAL 71 HB VAL 71 -13.810 -18.120 -27.604 560 1HG1 VAL 71 1HG1 VAL 71 -14.967 -18.908 -29.528 561 2HG1 VAL 71 2HG1 VAL 71 -13.376 -19.681 -29.478 562 3HG1 VAL 71 3HG1 VAL 71 -13.678 -18.343 -30.587 563 1HG2 VAL 71 1HG2 VAL 71 -11.624 -16.980 -27.778 564 2HG2 VAL 71 2HG2 VAL 71 -11.544 -17.423 -29.496 565 3HG2 VAL 71 3HG2 VAL 71 -11.547 -18.672 -28.243 566 H LEU 72 H LEU 72 -13.348 -14.016 -28.798 567 HA LEU 72 HA LEU 72 -14.710 -12.952 -26.677 568 1HB LEU 72 1HB LEU 72 -12.750 -14.436 -25.590 569 2HB LEU 72 2HB LEU 72 -11.881 -12.944 -25.830 570 HG LEU 72 HG LEU 72 -13.051 -13.202 -23.524 571 1HD1 LEU 72 1HD1 LEU 72 -12.257 -11.037 -24.411 572 2HD1 LEU 72 2HD1 LEU 72 -13.734 -10.880 -23.451 573 3HD1 LEU 72 3HD1 LEU 72 -13.821 -10.872 -25.218 574 1HD2 LEU 72 1HD2 LEU 72 -15.272 -14.004 -24.567 575 2HD2 LEU 72 2HD2 LEU 72 -15.525 -12.310 -24.981 576 3HD2 LEU 72 3HD2 LEU 72 -15.331 -12.784 -23.310 577 H ASN 73 H ASN 73 -14.517 -10.596 -27.093 578 HA ASN 73 HA ASN 73 -12.147 -9.837 -28.664 579 1HB ASN 73 1HB ASN 73 -13.394 -8.385 -30.136 580 2HB ASN 73 2HB ASN 73 -14.088 -9.986 -30.213 581 1HD2 ASN 73 1HD2 ASN 73 -15.243 -7.522 -30.995 582 2HD2 ASN 73 2HD2 ASN 73 -16.676 -7.265 -30.076 583 H ASN 74 H ASN 74 -12.883 -9.467 -25.853 584 HA ASN 74 HA ASN 74 -11.899 -6.836 -25.617 585 1HB ASN 74 1HB ASN 74 -14.328 -6.313 -25.934 586 2HB ASN 74 2HB ASN 74 -14.688 -7.267 -24.498 587 1HD2 ASN 74 1HD2 ASN 74 -14.239 -6.392 -22.477 588 2HD2 ASN 74 2HD2 ASN 74 -13.725 -4.764 -22.249 589 H CYS 75 H CYS 75 -10.328 -8.088 -24.681 590 HA CYS 75 HA CYS 75 -10.866 -8.727 -21.895 591 1HB CYS 75 1HB CYS 75 -8.969 -10.076 -23.820 592 2HB CYS 75 2HB CYS 75 -8.731 -10.149 -22.078 593 H GLN 76 H GLN 76 -9.458 -7.789 -20.474 594 HA GLN 76 HA GLN 76 -7.608 -5.977 -21.659 595 1HB GLN 76 1HB GLN 76 -9.902 -5.281 -19.822 596 2HB GLN 76 2HB GLN 76 -8.564 -4.196 -20.204 597 1HG GLN 76 1HG GLN 76 -9.121 -4.132 -22.462 598 2HG GLN 76 2HG GLN 76 -10.321 -5.398 -22.333 599 1HE2 GLN 76 1HE2 GLN 76 -9.601 -2.059 -21.750 600 2HE2 GLN 76 2HE2 GLN 76 -11.201 -1.543 -21.368 601 H LEU 77 H LEU 77 -5.950 -6.041 -20.606 602 HA LEU 77 HA LEU 77 -5.920 -8.120 -18.737 603 1HB LEU 77 1HB LEU 77 -4.436 -8.348 -20.536 604 2HB LEU 77 2HB LEU 77 -3.802 -6.744 -20.338 605 HG LEU 77 HG LEU 77 -2.224 -8.627 -19.857 606 1HD1 LEU 77 1HD1 LEU 77 -1.322 -7.657 -17.830 607 2HD1 LEU 77 2HD1 LEU 77 -2.719 -6.583 -17.752 608 3HD1 LEU 77 3HD1 LEU 77 -1.612 -6.504 -19.131 609 1HD2 LEU 77 1HD2 LEU 77 -2.366 -9.819 -17.779 610 2HD2 LEU 77 2HD2 LEU 77 -3.892 -10.069 -18.642 611 3HD2 LEU 77 3HD2 LEU 77 -3.802 -8.930 -17.314 612 H GLN 78 H GLN 78 -5.172 -8.026 -16.542 613 HA GLN 78 HA GLN 78 -4.825 -5.393 -15.362 614 1HB GLN 78 1HB GLN 78 -4.992 -8.093 -14.019 615 2HB GLN 78 2HB GLN 78 -5.090 -6.524 -13.231 616 1HG GLN 78 1HG GLN 78 -7.056 -7.676 -15.186 617 2HG GLN 78 2HG GLN 78 -7.296 -7.458 -13.456 618 1HE2 GLN 78 1HE2 GLN 78 -8.718 -6.438 -15.774 619 2HE2 GLN 78 2HE2 GLN 78 -8.753 -4.716 -15.577 620 H ASN 79 H ASN 79 -3.033 -8.569 -15.205 621 HA ASN 79 HA ASN 79 -0.493 -7.277 -15.303 622 1HB ASN 79 1HB ASN 79 -1.128 -7.136 -12.842 623 2HB ASN 79 2HB ASN 79 -1.360 -8.877 -12.849 624 1HD2 ASN 79 1HD2 ASN 79 0.376 -7.475 -11.153 625 2HD2 ASN 79 2HD2 ASN 79 1.999 -7.959 -11.501 626 HA PRO 80 HA PRO 80 -0.742 -11.368 -16.831 627 1HB PRO 80 1HB PRO 80 1.220 -11.463 -18.627 628 2HB PRO 80 2HB PRO 80 -0.237 -10.516 -18.883 629 1HG PRO 80 1HG PRO 80 2.478 -9.559 -18.084 630 2HG PRO 80 2HG PRO 80 1.262 -8.754 -19.086 631 1HD PRO 80 1HD PRO 80 1.740 -8.315 -16.329 632 2HD PRO 80 2HD PRO 80 0.374 -7.715 -17.287 633 H GLN 81 H GLN 81 1.994 -10.080 -15.092 634 HA GLN 81 HA GLN 81 3.425 -12.502 -15.280 635 1HB GLN 81 1HB GLN 81 4.528 -10.353 -15.475 636 2HB GLN 81 2HB GLN 81 4.021 -9.996 -13.820 637 1HG GLN 81 1HG GLN 81 5.267 -11.817 -13.000 638 2HG GLN 81 2HG GLN 81 5.744 -12.273 -14.646 639 1HE2 GLN 81 1HE2 GLN 81 7.388 -11.546 -12.349 640 2HE2 GLN 81 2HE2 GLN 81 8.348 -10.202 -12.854 641 H ARG 82 H ARG 82 1.958 -13.630 -14.351 642 HA ARG 82 HA ARG 82 2.047 -13.724 -11.465 643 1HB ARG 82 1HB ARG 82 -0.417 -14.453 -11.505 644 2HB ARG 82 2HB ARG 82 -0.072 -12.740 -11.705 645 1HG ARG 82 1HG ARG 82 -1.099 -12.689 -13.694 646 2HG ARG 82 2HG ARG 82 -0.237 -14.123 -14.254 647 1HD ARG 82 1HD ARG 82 -2.621 -14.152 -12.419 648 2HD ARG 82 2HD ARG 82 -2.695 -14.429 -14.163 649 HE ARG 82 HE ARG 82 -0.843 -16.163 -13.420 650 1HH1 ARG 82 1HH1 ARG 82 -3.891 -15.587 -11.734 651 2HH1 ARG 82 2HH1 ARG 82 -4.211 -17.241 -11.453 652 1HH2 ARG 82 1HH2 ARG 82 -1.298 -18.417 -13.088 653 2HH2 ARG 82 2HH2 ARG 82 -2.720 -18.880 -12.255 Start of MODEL 15 1 H MET 1 H MET 1 11.323 -17.600 -12.648 2 HA MET 1 HA MET 1 10.931 -19.791 -13.563 3 1HB MET 1 1HB MET 1 10.890 -19.551 -11.116 4 2HB MET 1 2HB MET 1 9.195 -19.108 -11.172 5 1HG MET 1 1HG MET 1 8.652 -21.360 -11.989 6 2HG MET 1 2HG MET 1 10.354 -21.797 -11.890 7 1HE MET 1 1HE MET 1 8.729 -23.775 -8.912 8 2HE MET 1 2HE MET 1 9.689 -23.894 -10.390 9 3HE MET 1 3HE MET 1 7.991 -23.426 -10.475 10 H GLN 2 H GLN 2 8.242 -17.625 -13.617 11 HA GLN 2 HA GLN 2 6.420 -19.676 -14.501 12 1HB GLN 2 1HB GLN 2 5.931 -16.769 -13.827 13 2HB GLN 2 2HB GLN 2 4.711 -17.986 -14.134 14 1HG GLN 2 1HG GLN 2 4.641 -17.789 -11.829 15 2HG GLN 2 2HG GLN 2 5.709 -19.163 -12.039 16 1HE2 GLN 2 1HE2 GLN 2 5.428 -17.357 -9.806 17 2HE2 GLN 2 2HE2 GLN 2 6.985 -16.653 -9.531 18 H THR 3 H THR 3 5.192 -19.269 -16.387 19 HA THR 3 HA THR 3 6.373 -17.708 -18.603 20 HB THR 3 HB THR 3 3.693 -19.058 -18.446 21 HG1 THR 3 HG1 THR 3 6.135 -20.406 -19.042 22 1HG2 THR 3 1HG2 THR 3 4.280 -17.848 -20.471 23 2HG2 THR 3 2HG2 THR 3 4.224 -19.581 -20.811 24 3HG2 THR 3 3HG2 THR 3 5.772 -18.766 -20.619 25 H ASP 4 H ASP 4 5.431 -15.885 -19.419 26 HA ASP 4 HA ASP 4 4.134 -14.299 -17.452 27 1HB ASP 4 1HB ASP 4 4.373 -13.880 -20.453 28 2HB ASP 4 2HB ASP 4 3.757 -12.667 -19.326 29 H THR 5 H THR 5 1.914 -13.725 -17.377 30 HA THR 5 HA THR 5 0.173 -15.218 -19.121 31 HB THR 5 HB THR 5 0.133 -15.549 -16.081 32 HG1 THR 5 HG1 THR 5 1.298 -16.843 -18.018 33 1HG2 THR 5 1HG2 THR 5 -1.748 -16.739 -18.120 34 2HG2 THR 5 2HG2 THR 5 -2.160 -15.394 -17.068 35 3HG2 THR 5 3HG2 THR 5 -1.808 -16.979 -16.369 36 H LEU 6 H LEU 6 -1.853 -14.263 -19.340 37 HA LEU 6 HA LEU 6 -1.712 -11.476 -18.773 38 1HB LEU 6 1HB LEU 6 -3.872 -13.065 -20.103 39 2HB LEU 6 2HB LEU 6 -3.839 -11.310 -20.046 40 HG LEU 6 HG LEU 6 -2.090 -13.196 -21.556 41 1HD1 LEU 6 1HD1 LEU 6 -2.620 -11.768 -23.458 42 2HD1 LEU 6 2HD1 LEU 6 -3.625 -10.769 -22.411 43 3HD1 LEU 6 3HD1 LEU 6 -4.056 -12.460 -22.699 44 1HD2 LEU 6 1HD2 LEU 6 -1.438 -10.305 -21.009 45 2HD2 LEU 6 2HD2 LEU 6 -0.655 -11.297 -22.238 46 3HD2 LEU 6 3HD2 LEU 6 -0.500 -11.726 -20.534 47 H GLU 7 H GLU 7 -4.706 -11.188 -18.439 48 HA GLU 7 HA GLU 7 -4.253 -10.587 -15.697 49 1HB GLU 7 1HB GLU 7 -5.489 -9.033 -17.057 50 2HB GLU 7 2HB GLU 7 -6.698 -10.263 -17.424 51 1HG GLU 7 1HG GLU 7 -7.135 -10.441 -15.021 52 2HG GLU 7 2HG GLU 7 -6.103 -9.038 -14.764 53 H TYR 8 H TYR 8 -5.884 -12.931 -17.557 54 HA TYR 8 HA TYR 8 -7.281 -14.391 -17.332 55 1HB TYR 8 1HB TYR 8 -6.832 -16.238 -15.667 56 2HB TYR 8 2HB TYR 8 -5.477 -15.691 -16.622 57 HD1 TYR 8 HD1 TYR 8 -3.510 -14.886 -15.580 58 HD2 TYR 8 HD2 TYR 8 -6.978 -15.598 -13.232 59 HE1 TYR 8 HE1 TYR 8 -2.170 -14.641 -13.543 60 HE2 TYR 8 HE2 TYR 8 -5.644 -15.346 -11.184 61 HH TYR 8 HH TYR 8 -2.512 -14.060 -11.212 62 H GLN 9 H GLN 9 -8.234 -11.934 -15.820 63 HA GLN 9 HA GLN 9 -10.253 -13.179 -14.046 64 1HB GLN 9 1HB GLN 9 -8.872 -10.546 -13.553 65 2HB GLN 9 2HB GLN 9 -10.001 -11.374 -12.496 66 1HG GLN 9 1HG GLN 9 -7.566 -12.551 -13.414 67 2HG GLN 9 2HG GLN 9 -7.460 -11.474 -11.989 68 1HE2 GLN 9 1HE2 GLN 9 -7.031 -12.931 -10.405 69 2HE2 GLN 9 2HE2 GLN 9 -7.934 -14.352 -10.027 70 H CYS 10 H CYS 10 -10.295 -12.337 -16.751 71 HA CYS 10 HA CYS 10 -11.373 -9.707 -16.986 72 1HB CYS 10 1HB CYS 10 -11.711 -12.045 -18.858 73 2HB CYS 10 2HB CYS 10 -12.147 -10.385 -19.239 74 H ASP 11 H ASP 11 -13.447 -9.052 -17.103 75 HA ASP 11 HA ASP 11 -15.373 -10.299 -15.509 76 1HB ASP 11 1HB ASP 11 -15.378 -7.908 -15.860 77 2HB ASP 11 2HB ASP 11 -15.623 -8.117 -17.585 78 H GLU 12 H GLU 12 -14.574 -10.774 -18.797 79 HA GLU 12 HA GLU 12 -17.163 -11.886 -19.345 80 1HB GLU 12 1HB GLU 12 -16.325 -10.141 -20.806 81 2HB GLU 12 2HB GLU 12 -14.922 -11.125 -21.188 82 1HG GLU 12 1HG GLU 12 -16.330 -12.746 -22.261 83 2HG GLU 12 2HG GLU 12 -17.764 -11.848 -21.784 84 H LYS 13 H LYS 13 -13.737 -12.851 -19.156 85 HA LYS 13 HA LYS 13 -14.453 -15.644 -19.441 86 1HB LYS 13 1HB LYS 13 -12.544 -14.345 -21.413 87 2HB LYS 13 2HB LYS 13 -12.966 -16.038 -21.355 88 1HG LYS 13 1HG LYS 13 -14.901 -13.862 -21.931 89 2HG LYS 13 2HG LYS 13 -14.014 -14.648 -23.232 90 1HD LYS 13 1HD LYS 13 -15.936 -16.024 -21.321 91 2HD LYS 13 2HD LYS 13 -16.280 -15.544 -22.984 92 1HE LYS 13 1HE LYS 13 -14.592 -17.061 -23.819 93 2HE LYS 13 2HE LYS 13 -14.157 -17.525 -22.173 94 1HZ LYS 13 1HZ LYS 13 -16.352 -18.399 -21.865 95 2HZ LYS 13 2HZ LYS 13 -15.687 -19.163 -23.182 96 3HZ LYS 13 3HZ LYS 13 -16.829 -17.942 -23.404 97 HA PRO 14 HA PRO 14 -10.538 -15.392 -17.305 98 1HB PRO 14 1HB PRO 14 -9.754 -18.116 -17.874 99 2HB PRO 14 2HB PRO 14 -10.408 -17.483 -16.363 100 1HG PRO 14 1HG PRO 14 -11.736 -19.237 -18.054 101 2HG PRO 14 2HG PRO 14 -12.510 -18.213 -16.838 102 1HD PRO 14 1HD PRO 14 -12.294 -17.828 -19.785 103 2HD PRO 14 2HD PRO 14 -13.610 -17.381 -18.677 104 H LEU 15 H LEU 15 -8.753 -14.444 -18.248 105 HA LEU 15 HA LEU 15 -8.056 -15.272 -20.945 106 1HB LEU 15 1HB LEU 15 -8.647 -12.929 -20.781 107 2HB LEU 15 2HB LEU 15 -7.540 -12.714 -19.442 108 HG LEU 15 HG LEU 15 -5.642 -13.095 -20.955 109 1HD1 LEU 15 1HD1 LEU 15 -5.963 -13.168 -23.363 110 2HD1 LEU 15 2HD1 LEU 15 -7.708 -13.202 -23.119 111 3HD1 LEU 15 3HD1 LEU 15 -6.717 -14.545 -22.557 112 1HD2 LEU 15 1HD2 LEU 15 -7.550 -10.989 -21.906 113 2HD2 LEU 15 2HD2 LEU 15 -5.809 -11.003 -22.190 114 3HD2 LEU 15 3HD2 LEU 15 -6.436 -10.829 -20.547 115 H THR 16 H THR 16 -7.124 -17.062 -19.836 116 HA THR 16 HA THR 16 -4.753 -16.316 -18.468 117 HB THR 16 HB THR 16 -5.658 -19.182 -18.698 118 HG1 THR 16 HG1 THR 16 -6.845 -18.483 -16.625 119 1HG2 THR 16 1HG2 THR 16 -3.532 -18.629 -17.600 120 2HG2 THR 16 2HG2 THR 16 -4.708 -19.203 -16.404 121 3HG2 THR 16 3HG2 THR 16 -4.370 -17.476 -16.581 122 H VAL 17 H VAL 17 -2.828 -16.490 -19.566 123 HA VAL 17 HA VAL 17 -2.716 -18.028 -22.071 124 HB VAL 17 HB VAL 17 -1.689 -15.216 -21.646 125 1HG1 VAL 17 1HG1 VAL 17 -1.745 -16.941 -24.071 126 2HG1 VAL 17 2HG1 VAL 17 -0.290 -16.478 -23.180 127 3HG1 VAL 17 3HG1 VAL 17 -1.217 -15.262 -24.062 128 1HG2 VAL 17 1HG2 VAL 17 -4.114 -15.208 -21.833 129 2HG2 VAL 17 2HG2 VAL 17 -4.009 -16.148 -23.325 130 3HG2 VAL 17 3HG2 VAL 17 -3.370 -14.507 -23.269 131 H LYS 18 H LYS 18 -0.697 -19.055 -22.352 132 HA LYS 18 HA LYS 18 1.297 -18.459 -20.335 133 1HB LYS 18 1HB LYS 18 0.909 -20.766 -22.232 134 2HB LYS 18 2HB LYS 18 2.497 -20.427 -21.609 135 1HG LYS 18 1HG LYS 18 1.477 -22.172 -20.336 136 2HG LYS 18 2HG LYS 18 1.673 -20.733 -19.336 137 1HD LYS 18 1HD LYS 18 -0.666 -20.211 -19.634 138 2HD LYS 18 2HD LYS 18 -0.872 -21.641 -20.656 139 1HE LYS 18 1HE LYS 18 -0.152 -23.083 -18.808 140 2HE LYS 18 2HE LYS 18 0.086 -21.677 -17.785 141 1HZ LYS 18 1HZ LYS 18 -2.329 -21.267 -17.937 142 2HZ LYS 18 2HZ LYS 18 -1.932 -22.726 -17.244 143 3HZ LYS 18 3HZ LYS 18 -2.503 -22.696 -18.829 144 H LEU 19 H LEU 19 2.126 -16.608 -21.087 145 HA LEU 19 HA LEU 19 2.527 -16.188 -23.838 146 1HB LEU 19 1HB LEU 19 1.572 -14.546 -22.300 147 2HB LEU 19 2HB LEU 19 3.033 -14.798 -21.336 148 HG LEU 19 HG LEU 19 4.372 -13.792 -22.835 149 1HD1 LEU 19 1HD1 LEU 19 1.974 -13.493 -24.687 150 2HD1 LEU 19 2HD1 LEU 19 3.388 -14.510 -24.978 151 3HD1 LEU 19 3HD1 LEU 19 3.543 -12.754 -25.009 152 1HD2 LEU 19 1HD2 LEU 19 3.459 -11.452 -22.964 153 2HD2 LEU 19 2HD2 LEU 19 3.286 -12.235 -21.394 154 3HD2 LEU 19 3HD2 LEU 19 1.900 -12.118 -22.472 155 H ASN 20 H ASN 20 4.148 -17.522 -24.374 156 HA ASN 20 HA ASN 20 6.532 -17.436 -22.761 157 1HB ASN 20 1HB ASN 20 5.839 -19.629 -23.892 158 2HB ASN 20 2HB ASN 20 6.190 -18.876 -25.440 159 1HD2 ASN 20 1HD2 ASN 20 7.340 -21.236 -24.119 160 2HD2 ASN 20 2HD2 ASN 20 9.036 -20.944 -24.071 161 H ASN 21 H ASN 21 6.956 -15.350 -22.941 162 HA ASN 21 HA ASN 21 6.785 -13.636 -25.064 163 1HB ASN 21 1HB ASN 21 7.146 -13.049 -22.642 164 2HB ASN 21 2HB ASN 21 8.836 -13.469 -22.885 165 1HD2 ASN 21 1HD2 ASN 21 7.666 -10.956 -22.058 166 2HD2 ASN 21 2HD2 ASN 21 8.180 -9.764 -23.192 167 HA PRO 22 HA PRO 22 11.443 -14.149 -26.196 168 1HB PRO 22 1HB PRO 22 12.735 -16.408 -25.474 169 2HB PRO 22 2HB PRO 22 12.762 -14.921 -24.520 170 1HG PRO 22 1HG PRO 22 11.035 -17.322 -24.243 171 2HG PRO 22 2HG PRO 22 11.943 -16.455 -22.967 172 1HD PRO 22 1HD PRO 22 9.322 -16.069 -23.299 173 2HD PRO 22 2HD PRO 22 10.413 -14.710 -22.934 174 H ARG 23 H ARG 23 9.263 -16.843 -26.163 175 HA ARG 23 HA ARG 23 10.487 -17.697 -28.688 176 1HB ARG 23 1HB ARG 23 10.600 -19.402 -26.892 177 2HB ARG 23 2HB ARG 23 8.848 -19.489 -26.893 178 1HG ARG 23 1HG ARG 23 8.763 -20.421 -28.989 179 2HG ARG 23 2HG ARG 23 10.446 -20.021 -29.373 180 1HD ARG 23 1HD ARG 23 10.296 -22.381 -28.911 181 2HD ARG 23 2HD ARG 23 11.123 -21.601 -27.566 182 HE ARG 23 HE ARG 23 8.274 -21.995 -27.324 183 1HH1 ARG 23 1HH1 ARG 23 11.531 -23.080 -26.396 184 2HH1 ARG 23 2HH1 ARG 23 10.954 -24.068 -25.138 185 1HH2 ARG 23 1HH2 ARG 23 7.539 -23.389 -25.650 186 2HH2 ARG 23 2HH2 ARG 23 8.673 -24.297 -24.739 187 H GLN 24 H GLN 24 7.812 -16.083 -27.723 188 HA GLN 24 HA GLN 24 6.240 -15.059 -28.952 189 1HB GLN 24 1HB GLN 24 7.388 -16.738 -31.052 190 2HB GLN 24 2HB GLN 24 6.055 -15.624 -31.430 191 1HG GLN 24 1HG GLN 24 7.536 -13.771 -30.744 192 2HG GLN 24 2HG GLN 24 8.807 -14.942 -30.373 193 1HE2 GLN 24 1HE2 GLN 24 9.879 -15.972 -32.064 194 2HE2 GLN 24 2HE2 GLN 24 9.767 -15.420 -33.688 195 H GLU 25 H GLU 25 5.954 -18.095 -27.930 196 HA GLU 25 HA GLU 25 3.377 -18.529 -29.248 197 1HB GLU 25 1HB GLU 25 5.137 -20.348 -27.722 198 2HB GLU 25 2HB GLU 25 3.411 -20.636 -27.655 199 1HG GLU 25 1HG GLU 25 4.139 -22.026 -29.334 200 2HG GLU 25 2HG GLU 25 3.506 -20.632 -30.191 201 H VAL 26 H VAL 26 1.566 -18.843 -28.183 202 HA VAL 26 HA VAL 26 1.422 -18.350 -25.251 203 HB VAL 26 HB VAL 26 -0.663 -17.191 -25.590 204 1HG1 VAL 26 1HG1 VAL 26 0.215 -15.021 -26.456 205 2HG1 VAL 26 2HG1 VAL 26 1.664 -15.872 -26.995 206 3HG1 VAL 26 3HG1 VAL 26 1.267 -15.789 -25.279 207 1HG2 VAL 26 1HG2 VAL 26 -0.001 -17.209 -28.519 208 2HG2 VAL 26 2HG2 VAL 26 -1.272 -16.228 -27.786 209 3HG2 VAL 26 3HG2 VAL 26 -1.373 -17.991 -27.732 210 H SER 27 H SER 27 0.620 -19.962 -24.258 211 HA SER 27 HA SER 27 -1.192 -21.670 -25.756 212 1HB SER 27 1HB SER 27 -0.337 -22.050 -22.868 213 2HB SER 27 2HB SER 27 -1.034 -23.204 -23.993 214 HG SER 27 HG SER 27 0.866 -23.708 -24.603 215 H PHE 28 H PHE 28 -3.200 -21.158 -25.671 216 HA PHE 28 HA PHE 28 -4.146 -19.572 -23.461 217 1HB PHE 28 1HB PHE 28 -3.512 -17.915 -25.008 218 2HB PHE 28 2HB PHE 28 -4.188 -18.799 -26.374 219 HD1 PHE 28 HD1 PHE 28 -5.770 -17.554 -27.308 220 HD2 PHE 28 HD2 PHE 28 -5.575 -17.614 -23.098 221 HE1 PHE 28 HE1 PHE 28 -7.792 -16.160 -27.214 222 HE2 PHE 28 HE2 PHE 28 -7.594 -16.230 -22.973 223 HZ PHE 28 HZ PHE 28 -8.702 -15.492 -25.035 224 H VAL 29 H VAL 29 -6.384 -19.380 -23.481 225 HA VAL 29 HA VAL 29 -7.530 -21.960 -23.774 226 HB VAL 29 HB VAL 29 -7.265 -20.884 -21.596 227 1HG1 VAL 29 1HG1 VAL 29 -7.446 -18.570 -22.157 228 2HG1 VAL 29 2HG1 VAL 29 -8.595 -18.971 -20.888 229 3HG1 VAL 29 3HG1 VAL 29 -9.146 -18.756 -22.548 230 1HG2 VAL 29 1HG2 VAL 29 -9.578 -21.223 -20.780 231 2HG2 VAL 29 2HG2 VAL 29 -8.945 -22.510 -21.801 232 3HG2 VAL 29 3HG2 VAL 29 -10.107 -21.351 -22.470 233 H TYR 30 H TYR 30 -8.764 -22.260 -25.256 234 HA TYR 30 HA TYR 30 -10.097 -20.369 -26.977 235 1HB TYR 30 1HB TYR 30 -9.776 -22.638 -27.850 236 2HB TYR 30 2HB TYR 30 -10.671 -23.311 -26.501 237 HD1 TYR 30 HD1 TYR 30 -11.065 -21.282 -29.597 238 HD2 TYR 30 HD2 TYR 30 -13.021 -23.558 -26.591 239 HE1 TYR 30 HE1 TYR 30 -13.148 -21.169 -30.879 240 HE2 TYR 30 HE2 TYR 30 -15.110 -23.450 -27.869 241 HH TYR 30 HH TYR 30 -15.265 -22.494 -31.062 242 H ASP 31 H ASP 31 -11.116 -22.294 -24.288 243 HA ASP 31 HA ASP 31 -13.024 -20.405 -23.412 244 1HB ASP 31 1HB ASP 31 -14.348 -21.353 -25.232 245 2HB ASP 31 2HB ASP 31 -14.055 -22.976 -24.635 246 H ASN 32 H ASN 32 -12.468 -23.924 -23.433 247 HA ASN 32 HA ASN 32 -11.652 -23.798 -20.641 248 1HB ASN 32 1HB ASN 32 -14.201 -24.258 -20.845 249 2HB ASN 32 2HB ASN 32 -13.747 -25.804 -21.542 250 1HD2 ASN 32 1HD2 ASN 32 -12.931 -27.404 -20.190 251 2HD2 ASN 32 2HD2 ASN 32 -12.960 -27.283 -18.467 252 H GLN 33 H GLN 33 -10.310 -24.200 -23.231 253 HA GLN 33 HA GLN 33 -8.969 -26.691 -22.744 254 1HB GLN 33 1HB GLN 33 -9.145 -27.450 -25.033 255 2HB GLN 33 2HB GLN 33 -10.794 -27.220 -24.467 256 1HG GLN 33 1HG GLN 33 -10.867 -25.060 -25.552 257 2HG GLN 33 2HG GLN 33 -9.206 -25.283 -26.095 258 1HE2 GLN 33 1HE2 GLN 33 -12.507 -26.187 -26.555 259 2HE2 GLN 33 2HE2 GLN 33 -12.289 -27.014 -28.054 260 H LEU 34 H LEU 34 -6.932 -26.587 -23.816 261 HA LEU 34 HA LEU 34 -6.272 -23.793 -24.191 262 1HB LEU 34 1HB LEU 34 -4.741 -25.994 -22.861 263 2HB LEU 34 2HB LEU 34 -3.962 -24.489 -23.330 264 HG LEU 34 HG LEU 34 -4.365 -24.381 -20.984 265 1HD1 LEU 34 1HD1 LEU 34 -6.437 -22.769 -22.324 266 2HD1 LEU 34 2HD1 LEU 34 -4.750 -22.338 -22.018 267 3HD1 LEU 34 3HD1 LEU 34 -5.872 -22.561 -20.672 268 1HD2 LEU 34 1HD2 LEU 34 -7.230 -25.173 -21.482 269 2HD2 LEU 34 2HD2 LEU 34 -6.547 -24.706 -19.924 270 3HD2 LEU 34 3HD2 LEU 34 -5.989 -26.175 -20.726 271 H LEU 35 H LEU 35 -5.180 -23.328 -26.048 272 HA LEU 35 HA LEU 35 -3.571 -25.374 -27.293 273 1HB LEU 35 1HB LEU 35 -4.355 -24.900 -29.577 274 2HB LEU 35 2HB LEU 35 -5.592 -25.569 -28.548 275 HG LEU 35 HG LEU 35 -6.484 -24.039 -30.111 276 1HD1 LEU 35 1HD1 LEU 35 -7.683 -24.171 -28.064 277 2HD1 LEU 35 2HD1 LEU 35 -7.745 -22.508 -28.656 278 3HD1 LEU 35 3HD1 LEU 35 -6.665 -22.931 -27.330 279 1HD2 LEU 35 1HD2 LEU 35 -6.048 -21.603 -30.054 280 2HD2 LEU 35 2HD2 LEU 35 -4.656 -22.564 -30.555 281 3HD2 LEU 35 3HD2 LEU 35 -4.727 -21.903 -28.924 282 H HIS 36 H HIS 36 -2.369 -24.268 -29.242 283 HA HIS 36 HA HIS 36 -1.240 -21.924 -27.926 284 1HB HIS 36 1HB HIS 36 1.046 -22.621 -28.662 285 2HB HIS 36 2HB HIS 36 0.307 -23.690 -27.486 286 HD2 HIS 36 HD2 HIS 36 1.463 -23.689 -31.205 287 HE1 HIS 36 HE1 HIS 36 0.515 -27.649 -30.081 288 HE2 HIS 36 HE2 HIS 36 1.719 -26.188 -31.758 289 H LEU 37 H LEU 37 -0.913 -20.222 -28.919 290 HA LEU 37 HA LEU 37 -1.174 -20.094 -31.873 291 1HB LEU 37 1HB LEU 37 -1.758 -17.821 -29.981 292 2HB LEU 37 2HB LEU 37 -2.054 -17.844 -31.666 293 HG LEU 37 HG LEU 37 -3.587 -19.922 -30.979 294 1HD1 LEU 37 1HD1 LEU 37 -3.114 -19.834 -28.635 295 2HD1 LEU 37 2HD1 LEU 37 -4.812 -19.453 -28.920 296 3HD1 LEU 37 3HD1 LEU 37 -3.668 -18.161 -28.549 297 1HD2 LEU 37 1HD2 LEU 37 -4.339 -17.015 -30.918 298 2HD2 LEU 37 2HD2 LEU 37 -5.498 -18.341 -30.898 299 3HD2 LEU 37 3HD2 LEU 37 -4.429 -18.149 -32.276 300 H LYS 38 H LYS 38 0.031 -18.343 -32.791 301 HA LYS 38 HA LYS 38 2.328 -17.692 -31.147 302 1HB LYS 38 1HB LYS 38 3.762 -18.084 -33.026 303 2HB LYS 38 2HB LYS 38 2.921 -19.539 -32.431 304 1HG LYS 38 1HG LYS 38 1.544 -19.631 -34.337 305 2HG LYS 38 2HG LYS 38 1.958 -17.982 -34.808 306 1HD LYS 38 1HD LYS 38 4.193 -18.615 -35.268 307 2HD LYS 38 2HD LYS 38 3.912 -20.263 -34.717 308 1HE LYS 38 1HE LYS 38 2.448 -18.984 -37.036 309 2HE LYS 38 2HE LYS 38 3.874 -20.001 -37.223 310 1HZ LYS 38 1HZ LYS 38 2.659 -21.849 -36.279 311 2HZ LYS 38 2HZ LYS 38 1.794 -21.209 -37.572 312 3HZ LYS 38 3HZ LYS 38 1.277 -20.929 -36.020 313 H GLN 39 H GLN 39 3.376 -15.964 -31.737 314 HA GLN 39 HA GLN 39 1.910 -13.833 -32.961 315 1HB GLN 39 1HB GLN 39 3.284 -13.277 -31.218 316 2HB GLN 39 2HB GLN 39 4.712 -14.097 -31.881 317 1HG GLN 39 1HG GLN 39 5.198 -11.810 -32.167 318 2HG GLN 39 2HG GLN 39 4.492 -12.255 -33.718 319 1HE2 GLN 39 1HE2 GLN 39 4.065 -10.513 -30.787 320 2HE2 GLN 39 2HE2 GLN 39 2.752 -9.552 -31.312 321 H GLY 40 H GLY 40 1.639 -13.869 -34.929 322 1HA GLY 40 1HA GLY 40 3.828 -14.665 -36.763 323 2HA GLY 40 2HA GLY 40 2.183 -15.221 -37.031 324 H ILE 41 H ILE 41 1.253 -14.227 -38.612 325 HA ILE 41 HA ILE 41 2.274 -11.812 -39.709 326 HB ILE 41 HB ILE 41 -0.267 -13.338 -40.426 327 1HG1 ILE 41 1HG1 ILE 41 1.053 -13.928 -42.542 328 2HG1 ILE 41 2HG1 ILE 41 2.479 -13.330 -41.719 329 1HG2 ILE 41 1HG2 ILE 41 -0.330 -12.024 -42.488 330 2HG2 ILE 41 2HG2 ILE 41 1.056 -11.087 -41.918 331 3HG2 ILE 41 3HG2 ILE 41 -0.469 -11.005 -41.050 332 1HD1 ILE 41 1HD1 ILE 41 0.773 -15.657 -40.841 333 2HD1 ILE 41 2HD1 ILE 41 2.224 -15.075 -40.022 334 3HD1 ILE 41 3HD1 ILE 41 2.340 -15.759 -41.644 335 H SER 42 H SER 42 1.949 -9.962 -38.742 336 HA SER 42 HA SER 42 -0.559 -9.549 -37.320 337 1HB SER 42 1HB SER 42 1.567 -9.482 -36.039 338 2HB SER 42 2HB SER 42 2.088 -8.120 -37.028 339 HG SER 42 HG SER 42 1.165 -7.530 -35.001 340 H ALA 43 H ALA 43 -0.329 -6.818 -37.137 341 HA ALA 43 HA ALA 43 -0.161 -5.537 -39.558 342 1HB ALA 43 1HB ALA 43 -2.566 -4.937 -39.852 343 2HB ALA 43 2HB ALA 43 -2.974 -6.056 -38.549 344 3HB ALA 43 3HB ALA 43 -2.287 -6.668 -40.053 345 H SER 44 H SER 44 -1.603 -5.738 -36.364 346 HA SER 44 HA SER 44 -0.249 -3.429 -35.443 347 1HB SER 44 1HB SER 44 -3.295 -3.493 -35.493 348 2HB SER 44 2HB SER 44 -2.337 -2.328 -34.583 349 HG SER 44 HG SER 44 -1.518 -2.401 -37.126 350 H GLY 45 H GLY 45 -0.428 -3.411 -33.042 351 1HA GLY 45 1HA GLY 45 -0.945 -4.271 -30.957 352 2HA GLY 45 2HA GLY 45 -1.961 -5.476 -31.727 353 H ALA 46 H ALA 46 -1.332 -7.436 -31.722 354 HA ALA 46 HA ALA 46 1.263 -8.384 -31.987 355 1HB ALA 46 1HB ALA 46 1.516 -7.856 -29.636 356 2HB ALA 46 2HB ALA 46 1.139 -9.582 -29.715 357 3HB ALA 46 3HB ALA 46 -0.115 -8.406 -29.295 358 H ARG 47 H ARG 47 0.879 -10.387 -32.885 359 HA ARG 47 HA ARG 47 -1.944 -10.924 -32.966 360 1HB ARG 47 1HB ARG 47 -1.113 -9.930 -34.998 361 2HB ARG 47 2HB ARG 47 0.105 -11.183 -35.141 362 1HG ARG 47 1HG ARG 47 -1.556 -11.743 -36.672 363 2HG ARG 47 2HG ARG 47 -1.805 -12.825 -35.304 364 1HD ARG 47 1HD ARG 47 -3.598 -11.428 -34.490 365 2HD ARG 47 2HD ARG 47 -3.310 -10.262 -35.783 366 HE ARG 47 HE ARG 47 -4.540 -12.863 -35.966 367 1HH1 ARG 47 1HH1 ARG 47 -3.111 -10.178 -37.798 368 2HH1 ARG 47 2HH1 ARG 47 -4.089 -10.373 -39.171 369 1HH2 ARG 47 1HH2 ARG 47 -5.936 -13.132 -37.977 370 2HH2 ARG 47 2HH2 ARG 47 -5.711 -12.020 -39.228 371 H TYR 48 H TYR 48 -1.810 -12.743 -31.413 372 HA TYR 48 HA TYR 48 -0.123 -14.960 -32.179 373 1HB TYR 48 1HB TYR 48 -1.926 -14.515 -29.782 374 2HB TYR 48 2HB TYR 48 -0.782 -15.836 -30.029 375 HD1 TYR 48 HD1 TYR 48 1.668 -15.349 -30.030 376 HD2 TYR 48 HD2 TYR 48 -1.203 -12.448 -28.845 377 HE1 TYR 48 HE1 TYR 48 3.439 -14.065 -28.910 378 HE2 TYR 48 HE2 TYR 48 0.563 -11.152 -27.725 379 HH TYR 48 HH TYR 48 2.800 -11.610 -26.733 380 H THR 49 H THR 49 -1.031 -16.166 -33.640 381 HA THR 49 HA THR 49 -3.830 -16.723 -33.380 382 HB THR 49 HB THR 49 -2.778 -15.291 -35.834 383 HG1 THR 49 HG1 THR 49 -3.801 -14.416 -33.614 384 1HG2 THR 49 1HG2 THR 49 -5.542 -16.444 -35.360 385 2HG2 THR 49 2HG2 THR 49 -4.359 -17.047 -36.521 386 3HG2 THR 49 3HG2 THR 49 -5.069 -15.449 -36.739 387 H ASP 50 H ASP 50 -4.274 -18.763 -34.228 388 HA ASP 50 HA ASP 50 -2.475 -19.838 -36.176 389 1HB ASP 50 1HB ASP 50 -1.472 -20.198 -33.838 390 2HB ASP 50 2HB ASP 50 -2.728 -21.416 -33.625 391 H GLY 51 H GLY 51 -4.785 -19.452 -36.951 392 1HA GLY 51 1HA GLY 51 -6.246 -20.639 -38.305 393 2HA GLY 51 2HA GLY 51 -5.760 -22.109 -37.496 394 H ILE 52 H ILE 52 -6.479 -21.306 -34.885 395 HA ILE 52 HA ILE 52 -9.205 -22.148 -35.021 396 HB ILE 52 HB ILE 52 -7.665 -21.308 -32.537 397 1HG1 ILE 52 1HG1 ILE 52 -6.404 -23.049 -33.734 398 2HG1 ILE 52 2HG1 ILE 52 -7.083 -23.685 -32.243 399 1HG2 ILE 52 1HG2 ILE 52 -10.094 -21.515 -32.241 400 2HG2 ILE 52 2HG2 ILE 52 -9.225 -22.767 -31.351 401 3HG2 ILE 52 3HG2 ILE 52 -10.024 -23.162 -32.872 402 1HD1 ILE 52 1HD1 ILE 52 -8.149 -24.138 -35.028 403 2HD1 ILE 52 2HD1 ILE 52 -8.870 -24.757 -33.543 404 3HD1 ILE 52 3HD1 ILE 52 -7.268 -25.301 -34.034 405 H TYR 53 H TYR 53 -7.642 -19.348 -33.531 406 HA TYR 53 HA TYR 53 -9.837 -17.666 -34.349 407 1HB TYR 53 1HB TYR 53 -9.935 -16.676 -32.048 408 2HB TYR 53 2HB TYR 53 -10.805 -18.184 -32.303 409 HD1 TYR 53 HD1 TYR 53 -10.436 -19.955 -30.884 410 HD2 TYR 53 HD2 TYR 53 -7.614 -16.821 -30.931 411 HE1 TYR 53 HE1 TYR 53 -9.292 -20.950 -28.924 412 HE2 TYR 53 HE2 TYR 53 -6.483 -17.786 -29.015 413 HH TYR 53 HH TYR 53 -7.121 -19.312 -27.080 414 H VAL 54 H VAL 54 -9.329 -15.445 -33.893 415 HA VAL 54 HA VAL 54 -6.498 -14.898 -34.213 416 HB VAL 54 HB VAL 54 -9.051 -13.398 -34.554 417 1HG1 VAL 54 1HG1 VAL 54 -6.190 -12.390 -35.046 418 2HG1 VAL 54 2HG1 VAL 54 -7.281 -11.788 -33.796 419 3HG1 VAL 54 3HG1 VAL 54 -7.642 -11.496 -35.497 420 1HG2 VAL 54 1HG2 VAL 54 -6.983 -14.295 -36.556 421 2HG2 VAL 54 2HG2 VAL 54 -8.391 -13.310 -36.951 422 3HG2 VAL 54 3HG2 VAL 54 -8.604 -14.947 -36.328 423 H PHE 55 H PHE 55 -5.587 -14.830 -32.190 424 HA PHE 55 HA PHE 55 -6.959 -13.379 -30.091 425 1HB PHE 55 1HB PHE 55 -5.966 -15.499 -29.416 426 2HB PHE 55 2HB PHE 55 -4.428 -15.041 -30.121 427 HD1 PHE 55 HD1 PHE 55 -3.086 -15.361 -28.256 428 HD2 PHE 55 HD2 PHE 55 -6.496 -12.846 -27.932 429 HE1 PHE 55 HE1 PHE 55 -2.300 -14.579 -26.064 430 HE2 PHE 55 HE2 PHE 55 -5.722 -12.075 -25.738 431 HZ PHE 55 HZ PHE 55 -3.621 -12.937 -24.808 432 H TRP 56 H TRP 56 -6.804 -11.269 -30.350 433 HA TRP 56 HA TRP 56 -4.353 -10.215 -31.392 434 1HB TRP 56 1HB TRP 56 -6.425 -9.890 -32.716 435 2HB TRP 56 2HB TRP 56 -7.102 -9.017 -31.336 436 HD1 TRP 56 HD1 TRP 56 -3.667 -8.722 -33.079 437 HE1 TRP 56 HE1 TRP 56 -3.294 -6.285 -33.695 438 HE3 TRP 56 HE3 TRP 56 -8.132 -6.822 -31.484 439 HZ2 TRP 56 HZ2 TRP 56 -4.717 -3.843 -33.556 440 HZ3 TRP 56 HZ3 TRP 56 -8.551 -4.417 -31.775 441 HH2 TRP 56 HH2 TRP 56 -6.872 -2.961 -32.787 442 H SER 57 H SER 57 -3.296 -9.203 -30.162 443 HA SER 57 HA SER 57 -4.275 -8.324 -27.529 444 1HB SER 57 1HB SER 57 -1.550 -9.280 -28.402 445 2HB SER 57 2HB SER 57 -1.940 -8.749 -26.746 446 HG SER 57 HG SER 57 -3.578 -10.648 -27.881 447 H LYS 58 H LYS 58 -4.589 -6.163 -27.672 448 HA LYS 58 HA LYS 58 -3.135 -4.558 -29.564 449 1HB LYS 58 1HB LYS 58 -5.556 -4.257 -28.951 450 2HB LYS 58 2HB LYS 58 -5.018 -3.715 -27.374 451 1HG LYS 58 1HG LYS 58 -5.592 -1.821 -28.739 452 2HG LYS 58 2HG LYS 58 -3.853 -1.828 -28.440 453 1HD LYS 58 1HD LYS 58 -3.429 -2.741 -30.621 454 2HD LYS 58 2HD LYS 58 -5.155 -2.933 -30.918 455 1HE LYS 58 1HE LYS 58 -3.736 -0.312 -30.484 456 2HE LYS 58 2HE LYS 58 -4.204 -0.961 -32.052 457 1HZ LYS 58 1HZ LYS 58 -5.840 0.650 -31.283 458 2HZ LYS 58 2HZ LYS 58 -6.067 -0.210 -29.855 459 3HZ LYS 58 3HZ LYS 58 -6.533 -0.881 -31.305 460 H GLY 59 H GLY 59 -3.132 -5.194 -26.156 461 1HA GLY 59 1HA GLY 59 -0.619 -4.730 -25.442 462 2HA GLY 59 2HA GLY 59 -1.248 -3.085 -25.521 463 H ASP 60 H ASP 60 -3.272 -2.702 -24.332 464 HA ASP 60 HA ASP 60 -3.172 -4.086 -21.747 465 1HB ASP 60 1HB ASP 60 -4.171 -1.342 -22.500 466 2HB ASP 60 2HB ASP 60 -4.537 -2.086 -20.956 467 H GLU 61 H GLU 61 -4.747 -4.326 -24.501 468 HA GLU 61 HA GLU 61 -7.098 -5.357 -23.208 469 1HB GLU 61 1HB GLU 61 -8.513 -4.394 -25.023 470 2HB GLU 61 2HB GLU 61 -7.827 -3.195 -23.926 471 1HG GLU 61 1HG GLU 61 -6.044 -2.813 -25.581 472 2HG GLU 61 2HG GLU 61 -6.919 -3.878 -26.680 473 H ALA 62 H ALA 62 -8.188 -6.913 -24.572 474 HA ALA 62 HA ALA 62 -6.507 -8.028 -26.604 475 1HB ALA 62 1HB ALA 62 -5.797 -9.134 -24.558 476 2HB ALA 62 2HB ALA 62 -6.751 -10.259 -25.540 477 3HB ALA 62 3HB ALA 62 -7.482 -9.462 -24.147 478 H THR 63 H THR 63 -7.741 -9.006 -28.078 479 HA THR 63 HA THR 63 -10.560 -9.544 -27.565 480 HB THR 63 HB THR 63 -9.611 -7.988 -30.002 481 HG1 THR 63 HG1 THR 63 -10.237 -7.225 -27.441 482 1HG2 THR 63 1HG2 THR 63 -11.710 -9.301 -30.267 483 2HG2 THR 63 2HG2 THR 63 -12.005 -7.559 -30.317 484 3HG2 THR 63 3HG2 THR 63 -12.360 -8.472 -28.850 485 H VAL 64 H VAL 64 -11.227 -11.387 -28.586 486 HA VAL 64 HA VAL 64 -9.295 -12.710 -30.365 487 HB VAL 64 HB VAL 64 -11.126 -14.033 -28.369 488 1HG1 VAL 64 1HG1 VAL 64 -10.652 -15.363 -30.292 489 2HG1 VAL 64 2HG1 VAL 64 -9.819 -16.011 -28.885 490 3HG1 VAL 64 3HG1 VAL 64 -8.917 -15.095 -30.103 491 1HG2 VAL 64 1HG2 VAL 64 -9.205 -14.499 -27.021 492 2HG2 VAL 64 2HG2 VAL 64 -9.276 -12.747 -27.283 493 3HG2 VAL 64 3HG2 VAL 64 -8.151 -13.751 -28.210 494 H TYR 65 H TYR 65 -10.166 -12.992 -32.310 495 HA TYR 65 HA TYR 65 -13.060 -13.493 -32.586 496 1HB TYR 65 1HB TYR 65 -13.001 -11.195 -32.850 497 2HB TYR 65 2HB TYR 65 -11.494 -11.232 -33.764 498 HD1 TYR 65 HD1 TYR 65 -15.129 -12.109 -33.997 499 HD2 TYR 65 HD2 TYR 65 -11.577 -11.163 -36.137 500 HE1 TYR 65 HE1 TYR 65 -16.419 -11.969 -36.062 501 HE2 TYR 65 HE2 TYR 65 -12.874 -11.029 -38.219 502 HH TYR 65 HH TYR 65 -16.279 -10.941 -38.223 503 H LYS 66 H LYS 66 -12.965 -15.494 -33.452 504 HA LYS 66 HA LYS 66 -11.566 -15.956 -35.904 505 1HB LYS 66 1HB LYS 66 -12.129 -17.858 -34.267 506 2HB LYS 66 2HB LYS 66 -13.829 -17.488 -34.524 507 1HG LYS 66 1HG LYS 66 -13.322 -17.834 -37.002 508 2HG LYS 66 2HG LYS 66 -11.852 -18.635 -36.456 509 1HD LYS 66 1HD LYS 66 -14.697 -19.384 -35.821 510 2HD LYS 66 2HD LYS 66 -13.634 -20.220 -36.946 511 1HE LYS 66 1HE LYS 66 -12.105 -20.597 -34.916 512 2HE LYS 66 2HE LYS 66 -13.488 -20.106 -33.942 513 1HZ LYS 66 1HZ LYS 66 -14.761 -21.918 -34.958 514 2HZ LYS 66 2HZ LYS 66 -13.410 -22.487 -34.158 515 3HZ LYS 66 3HZ LYS 66 -13.399 -22.371 -35.841 516 H ARG 67 H ARG 67 -12.960 -16.122 -37.690 517 HA ARG 67 HA ARG 67 -14.731 -13.900 -37.875 518 1HB ARG 67 1HB ARG 67 -13.453 -14.449 -39.852 519 2HB ARG 67 2HB ARG 67 -14.106 -16.071 -39.892 520 1HG ARG 67 1HG ARG 67 -16.012 -13.832 -40.188 521 2HG ARG 67 2HG ARG 67 -14.924 -14.178 -41.541 522 1HD ARG 67 1HD ARG 67 -16.639 -16.219 -40.162 523 2HD ARG 67 2HD ARG 67 -17.134 -15.384 -41.650 524 HE ARG 67 HE ARG 67 -14.638 -16.502 -42.097 525 1HH1 ARG 67 1HH1 ARG 67 -17.850 -17.771 -41.363 526 2HH1 ARG 67 2HH1 ARG 67 -17.619 -19.215 -42.233 527 1HH2 ARG 67 1HH2 ARG 67 -14.339 -18.457 -43.278 528 2HH2 ARG 67 2HH2 ARG 67 -15.604 -19.591 -43.385 529 H ASP 68 H ASP 68 -15.259 -17.116 -37.044 530 HA ASP 68 HA ASP 68 -18.136 -16.787 -37.322 531 1HB ASP 68 1HB ASP 68 -16.509 -19.266 -36.824 532 2HB ASP 68 2HB ASP 68 -18.251 -19.225 -36.630 533 H ARG 69 H ARG 69 -15.668 -16.628 -35.000 534 HA ARG 69 HA ARG 69 -17.596 -16.277 -33.063 535 1HB ARG 69 1HB ARG 69 -17.621 -18.717 -32.992 536 2HB ARG 69 2HB ARG 69 -15.910 -18.723 -32.566 537 1HG ARG 69 1HG ARG 69 -16.450 -17.397 -30.537 538 2HG ARG 69 2HG ARG 69 -18.155 -17.539 -30.933 539 1HD ARG 69 1HD ARG 69 -17.931 -19.963 -30.820 540 2HD ARG 69 2HD ARG 69 -16.236 -19.724 -30.326 541 HE ARG 69 HE ARG 69 -18.037 -18.266 -28.681 542 1HH1 ARG 69 1HH1 ARG 69 -16.733 -21.571 -29.031 543 2HH1 ARG 69 2HH1 ARG 69 -17.013 -21.987 -27.411 544 1HH2 ARG 69 1HH2 ARG 69 -18.351 -18.846 -26.433 545 2HH2 ARG 69 2HH2 ARG 69 -17.937 -20.395 -25.886 546 H ILE 70 H ILE 70 -16.970 -14.878 -31.999 547 HA ILE 70 HA ILE 70 -14.272 -14.137 -31.081 548 HB ILE 70 HB ILE 70 -16.961 -13.143 -30.233 549 1HG1 ILE 70 1HG1 ILE 70 -15.061 -11.839 -32.107 550 2HG1 ILE 70 2HG1 ILE 70 -16.526 -12.698 -32.634 551 1HG2 ILE 70 1HG2 ILE 70 -15.778 -11.147 -29.359 552 2HG2 ILE 70 2HG2 ILE 70 -14.248 -11.925 -29.773 553 3HG2 ILE 70 3HG2 ILE 70 -15.307 -12.650 -28.563 554 1HD1 ILE 70 1HD1 ILE 70 -17.863 -11.009 -31.427 555 2HD1 ILE 70 2HD1 ILE 70 -16.850 -10.277 -32.678 556 3HD1 ILE 70 3HD1 ILE 70 -16.377 -10.171 -30.983 557 H VAL 71 H VAL 71 -13.592 -14.792 -29.335 558 HA VAL 71 HA VAL 71 -15.434 -16.140 -27.505 559 HB VAL 71 HB VAL 71 -13.588 -17.567 -26.585 560 1HG1 VAL 71 1HG1 VAL 71 -13.474 -19.119 -28.478 561 2HG1 VAL 71 2HG1 VAL 71 -14.021 -17.843 -29.554 562 3HG1 VAL 71 3HG1 VAL 71 -15.102 -18.457 -28.295 563 1HG2 VAL 71 1HG2 VAL 71 -12.025 -16.560 -28.951 564 2HG2 VAL 71 2HG2 VAL 71 -11.520 -17.825 -27.841 565 3HG2 VAL 71 3HG2 VAL 71 -11.683 -16.164 -27.270 566 H LEU 72 H LEU 72 -13.208 -13.640 -27.772 567 HA LEU 72 HA LEU 72 -13.861 -12.784 -25.063 568 1HB LEU 72 1HB LEU 72 -11.012 -13.149 -26.006 569 2HB LEU 72 2HB LEU 72 -11.421 -11.984 -24.777 570 HG LEU 72 HG LEU 72 -12.264 -13.947 -23.403 571 1HD1 LEU 72 1HD1 LEU 72 -10.700 -15.528 -25.437 572 2HD1 LEU 72 2HD1 LEU 72 -12.430 -15.650 -25.109 573 3HD1 LEU 72 3HD1 LEU 72 -11.263 -16.131 -23.879 574 1HD2 LEU 72 1HD2 LEU 72 -10.244 -12.800 -22.889 575 2HD2 LEU 72 2HD2 LEU 72 -9.377 -13.729 -24.108 576 3HD2 LEU 72 3HD2 LEU 72 -10.005 -14.538 -22.670 577 H ASN 73 H ASN 73 -14.403 -10.638 -25.158 578 HA ASN 73 HA ASN 73 -12.788 -8.949 -26.900 579 1HB ASN 73 1HB ASN 73 -14.722 -7.794 -27.911 580 2HB ASN 73 2HB ASN 73 -14.717 -9.498 -28.332 581 1HD2 ASN 73 1HD2 ASN 73 -16.306 -10.841 -27.455 582 2HD2 ASN 73 2HD2 ASN 73 -17.739 -10.204 -26.753 583 H ASN 74 H ASN 74 -13.211 -9.421 -24.051 584 HA ASN 74 HA ASN 74 -13.319 -6.678 -23.267 585 1HB ASN 74 1HB ASN 74 -15.687 -7.339 -22.989 586 2HB ASN 74 2HB ASN 74 -15.188 -8.694 -21.985 587 1HD2 ASN 74 1HD2 ASN 74 -16.419 -7.912 -20.229 588 2HD2 ASN 74 2HD2 ASN 74 -15.905 -6.550 -19.307 589 H CYS 75 H CYS 75 -11.133 -7.219 -23.107 590 HA CYS 75 HA CYS 75 -10.532 -8.242 -20.489 591 1HB CYS 75 1HB CYS 75 -9.439 -9.314 -23.047 592 2HB CYS 75 2HB CYS 75 -8.417 -9.236 -21.611 593 H GLN 76 H GLN 76 -8.909 -7.181 -19.504 594 HA GLN 76 HA GLN 76 -7.551 -5.158 -20.975 595 1HB GLN 76 1HB GLN 76 -9.403 -4.730 -18.632 596 2HB GLN 76 2HB GLN 76 -8.167 -3.573 -19.114 597 1HG GLN 76 1HG GLN 76 -9.145 -3.276 -21.221 598 2HG GLN 76 2HG GLN 76 -10.313 -4.563 -20.961 599 1HE2 GLN 76 1HE2 GLN 76 -12.021 -3.095 -21.311 600 2HE2 GLN 76 2HE2 GLN 76 -12.486 -1.904 -20.155 601 H LEU 77 H LEU 77 -5.680 -5.432 -20.496 602 HA LEU 77 HA LEU 77 -5.076 -7.473 -18.669 603 1HB LEU 77 1HB LEU 77 -3.960 -7.481 -20.771 604 2HB LEU 77 2HB LEU 77 -3.299 -5.890 -20.499 605 HG LEU 77 HG LEU 77 -1.805 -6.830 -18.739 606 1HD1 LEU 77 1HD1 LEU 77 -2.968 -9.460 -19.573 607 2HD1 LEU 77 2HD1 LEU 77 -3.187 -8.667 -18.016 608 3HD1 LEU 77 3HD1 LEU 77 -1.588 -9.219 -18.507 609 1HD2 LEU 77 1HD2 LEU 77 -0.996 -6.611 -21.008 610 2HD2 LEU 77 2HD2 LEU 77 -1.705 -8.164 -21.434 611 3HD2 LEU 77 3HD2 LEU 77 -0.368 -8.098 -20.290 612 H GLN 78 H GLN 78 -3.887 -7.314 -16.722 613 HA GLN 78 HA GLN 78 -3.597 -4.663 -15.602 614 1HB GLN 78 1HB GLN 78 -3.019 -7.380 -14.395 615 2HB GLN 78 2HB GLN 78 -3.021 -5.853 -13.520 616 1HG GLN 78 1HG GLN 78 -5.378 -7.123 -14.884 617 2HG GLN 78 2HG GLN 78 -5.094 -7.056 -13.141 618 1HE2 GLN 78 1HE2 GLN 78 -7.286 -6.020 -14.788 619 2HE2 GLN 78 2HE2 GLN 78 -7.367 -4.326 -14.425 620 H ASN 79 H ASN 79 -1.449 -7.520 -15.849 621 HA ASN 79 HA ASN 79 0.642 -6.210 -17.130 622 1HB ASN 79 1HB ASN 79 0.884 -5.247 -14.753 623 2HB ASN 79 2HB ASN 79 1.105 -6.899 -14.196 624 1HD2 ASN 79 1HD2 ASN 79 2.396 -5.389 -17.173 625 2HD2 ASN 79 2HD2 ASN 79 4.039 -5.588 -16.702 626 HA PRO 80 HA PRO 80 0.384 -10.507 -17.587 627 1HB PRO 80 1HB PRO 80 2.363 -11.011 -19.401 628 2HB PRO 80 2HB PRO 80 0.795 -10.316 -19.803 629 1HG PRO 80 1HG PRO 80 3.422 -8.967 -19.481 630 2HG PRO 80 2HG PRO 80 2.091 -8.582 -20.578 631 1HD PRO 80 1HD PRO 80 2.640 -7.241 -18.206 632 2HD PRO 80 2HD PRO 80 1.080 -7.221 -19.044 633 H GLN 81 H GLN 81 3.458 -9.108 -16.516 634 HA GLN 81 HA GLN 81 4.293 -11.710 -15.844 635 1HB GLN 81 1HB GLN 81 5.760 -9.893 -16.820 636 2HB GLN 81 2HB GLN 81 5.732 -9.211 -15.180 637 1HG GLN 81 1HG GLN 81 6.774 -11.045 -14.281 638 2HG GLN 81 2HG GLN 81 6.409 -12.020 -15.718 639 1HE2 GLN 81 1HE2 GLN 81 7.542 -11.677 -17.575 640 2HE2 GLN 81 2HE2 GLN 81 9.100 -10.947 -17.644 641 H ARG 82 H ARG 82 2.906 -12.203 -14.505 642 HA ARG 82 HA ARG 82 1.845 -11.023 -12.218 643 1HB ARG 82 1HB ARG 82 2.390 -13.897 -12.881 644 2HB ARG 82 2HB ARG 82 1.678 -13.427 -11.352 645 1HG ARG 82 1HG ARG 82 0.502 -12.778 -14.050 646 2HG ARG 82 2HG ARG 82 0.038 -14.167 -13.066 647 1HD ARG 82 1HD ARG 82 -0.279 -11.243 -12.375 648 2HD ARG 82 2HD ARG 82 -1.555 -12.418 -12.682 649 HE ARG 82 HE ARG 82 0.114 -13.252 -10.544 650 1HH1 ARG 82 1HH1 ARG 82 -2.683 -11.196 -11.248 651 2HH1 ARG 82 2HH1 ARG 82 -3.104 -10.980 -9.620 652 1HH2 ARG 82 1HH2 ARG 82 -0.471 -12.962 -8.304 653 2HH2 ARG 82 2HH2 ARG 82 -1.846 -12.038 -7.915 Start of MODEL 16 1 H MET 1 H MET 1 8.550 -20.476 -11.684 2 HA MET 1 HA MET 1 7.625 -18.507 -12.470 3 1HB MET 1 1HB MET 1 9.483 -18.918 -14.816 4 2HB MET 1 2HB MET 1 8.103 -17.846 -14.886 5 1HG MET 1 1HG MET 1 10.003 -16.503 -14.474 6 2HG MET 1 2HG MET 1 9.117 -16.595 -12.956 7 1HE MET 1 1HE MET 1 12.103 -15.563 -13.122 8 2HE MET 1 2HE MET 1 12.815 -16.395 -11.739 9 3HE MET 1 3HE MET 1 11.198 -15.702 -11.616 10 H GLN 2 H GLN 2 5.805 -18.538 -13.842 11 HA GLN 2 HA GLN 2 4.934 -21.259 -14.509 12 1HB GLN 2 1HB GLN 2 3.437 -18.647 -14.754 13 2HB GLN 2 2HB GLN 2 2.761 -20.262 -14.777 14 1HG GLN 2 1HG GLN 2 3.255 -20.519 -12.421 15 2HG GLN 2 2HG GLN 2 4.021 -18.926 -12.394 16 1HE2 GLN 2 1HE2 GLN 2 2.741 -17.090 -12.648 17 2HE2 GLN 2 2HE2 GLN 2 1.028 -17.098 -12.467 18 H THR 3 H THR 3 3.517 -21.203 -16.661 19 HA THR 3 HA THR 3 4.937 -19.810 -18.825 20 HB THR 3 HB THR 3 2.243 -21.115 -18.985 21 HG1 THR 3 HG1 THR 3 4.479 -22.316 -18.130 22 1HG2 THR 3 1HG2 THR 3 3.031 -21.711 -21.241 23 2HG2 THR 3 2HG2 THR 3 4.594 -20.982 -20.874 24 3HG2 THR 3 3HG2 THR 3 3.148 -19.975 -20.949 25 H ASP 4 H ASP 4 4.513 -17.912 -19.364 26 HA ASP 4 HA ASP 4 3.183 -16.191 -17.614 27 1HB ASP 4 1HB ASP 4 4.993 -15.931 -19.567 28 2HB ASP 4 2HB ASP 4 3.576 -15.368 -20.425 29 H THR 5 H THR 5 1.170 -15.008 -17.795 30 HA THR 5 HA THR 5 -0.587 -15.978 -19.849 31 HB THR 5 HB THR 5 -0.913 -17.758 -18.292 32 HG1 THR 5 HG1 THR 5 -3.052 -16.138 -17.583 33 1HG2 THR 5 1HG2 THR 5 -1.350 -15.649 -16.165 34 2HG2 THR 5 2HG2 THR 5 0.000 -16.787 -16.265 35 3HG2 THR 5 3HG2 THR 5 -1.627 -17.378 -15.946 36 H LEU 6 H LEU 6 -2.597 -14.851 -19.833 37 HA LEU 6 HA LEU 6 -2.078 -12.130 -19.041 38 1HB LEU 6 1HB LEU 6 -4.409 -13.280 -20.586 39 2HB LEU 6 2HB LEU 6 -4.147 -11.571 -20.285 40 HG LEU 6 HG LEU 6 -2.426 -13.378 -21.944 41 1HD1 LEU 6 1HD1 LEU 6 -4.472 -12.680 -23.026 42 2HD1 LEU 6 2HD1 LEU 6 -3.083 -11.872 -23.759 43 3HD1 LEU 6 3HD1 LEU 6 -4.126 -10.996 -22.640 44 1HD2 LEU 6 1HD2 LEU 6 -2.025 -10.455 -21.306 45 2HD2 LEU 6 2HD2 LEU 6 -1.065 -11.392 -22.443 46 3HD2 LEU 6 3HD2 LEU 6 -1.001 -11.764 -20.727 47 H GLU 7 H GLU 7 -5.066 -11.649 -18.727 48 HA GLU 7 HA GLU 7 -4.682 -11.220 -15.994 49 1HB GLU 7 1HB GLU 7 -5.621 -9.733 -17.661 50 2HB GLU 7 2HB GLU 7 -7.039 -10.760 -17.795 51 1HG GLU 7 1HG GLU 7 -7.382 -8.790 -16.414 52 2HG GLU 7 2HG GLU 7 -7.621 -10.310 -15.547 53 H TYR 8 H TYR 8 -6.118 -13.582 -17.966 54 HA TYR 8 HA TYR 8 -7.553 -15.029 -17.925 55 1HB TYR 8 1HB TYR 8 -7.299 -16.854 -16.111 56 2HB TYR 8 2HB TYR 8 -5.915 -16.405 -17.085 57 HD1 TYR 8 HD1 TYR 8 -3.912 -15.853 -16.050 58 HD2 TYR 8 HD2 TYR 8 -7.477 -15.775 -13.744 59 HE1 TYR 8 HE1 TYR 8 -2.579 -15.471 -14.031 60 HE2 TYR 8 HE2 TYR 8 -6.155 -15.390 -11.716 61 HH TYR 8 HH TYR 8 -2.753 -14.635 -11.843 62 H GLN 9 H GLN 9 -8.706 -12.670 -16.599 63 HA GLN 9 HA GLN 9 -10.998 -13.933 -15.360 64 1HB GLN 9 1HB GLN 9 -10.892 -12.463 -13.432 65 2HB GLN 9 2HB GLN 9 -9.507 -13.560 -13.512 66 1HG GLN 9 1HG GLN 9 -8.223 -11.714 -14.499 67 2HG GLN 9 2HG GLN 9 -9.559 -10.604 -14.140 68 1HE2 GLN 9 1HE2 GLN 9 -6.866 -12.330 -13.009 69 2HE2 GLN 9 2HE2 GLN 9 -6.829 -11.724 -11.388 70 H CYS 10 H CYS 10 -10.869 -12.912 -17.754 71 HA CYS 10 HA CYS 10 -11.421 -10.116 -17.925 72 1HB CYS 10 1HB CYS 10 -11.929 -12.305 -19.951 73 2HB CYS 10 2HB CYS 10 -11.889 -10.582 -20.289 74 H ASP 11 H ASP 11 -13.574 -9.362 -18.880 75 HA ASP 11 HA ASP 11 -15.548 -10.243 -17.029 76 1HB ASP 11 1HB ASP 11 -15.764 -8.183 -19.233 77 2HB ASP 11 2HB ASP 11 -16.955 -8.440 -17.963 78 H GLU 12 H GLU 12 -14.813 -11.132 -20.206 79 HA GLU 12 HA GLU 12 -17.455 -12.368 -20.351 80 1HB GLU 12 1HB GLU 12 -17.006 -10.869 -22.241 81 2HB GLU 12 2HB GLU 12 -15.588 -11.825 -22.655 82 1HG GLU 12 1HG GLU 12 -16.993 -13.764 -23.047 83 2HG GLU 12 2HG GLU 12 -18.425 -12.829 -22.638 84 H LYS 13 H LYS 13 -14.009 -13.144 -20.443 85 HA LYS 13 HA LYS 13 -14.729 -15.950 -20.660 86 1HB LYS 13 1HB LYS 13 -12.665 -14.545 -22.365 87 2HB LYS 13 2HB LYS 13 -12.929 -16.272 -22.322 88 1HG LYS 13 1HG LYS 13 -14.968 -14.261 -23.215 89 2HG LYS 13 2HG LYS 13 -13.869 -15.064 -24.321 90 1HD LYS 13 1HD LYS 13 -15.971 -16.426 -22.613 91 2HD LYS 13 2HD LYS 13 -16.037 -16.143 -24.357 92 1HE LYS 13 1HE LYS 13 -14.027 -17.548 -24.651 93 2HE LYS 13 2HE LYS 13 -14.030 -17.887 -22.924 94 1HZ LYS 13 1HZ LYS 13 -16.173 -18.962 -23.163 95 2HZ LYS 13 2HZ LYS 13 -15.043 -19.660 -24.213 96 3HZ LYS 13 3HZ LYS 13 -16.205 -18.575 -24.803 97 HA PRO 14 HA PRO 14 -11.283 -15.704 -17.879 98 1HB PRO 14 1HB PRO 14 -11.177 -18.623 -17.748 99 2HB PRO 14 2HB PRO 14 -11.662 -17.506 -16.475 100 1HG PRO 14 1HG PRO 14 -13.398 -19.190 -17.779 101 2HG PRO 14 2HG PRO 14 -13.881 -17.677 -16.999 102 1HD PRO 14 1HD PRO 14 -13.412 -18.251 -19.893 103 2HD PRO 14 2HD PRO 14 -14.622 -17.200 -19.117 104 H LEU 15 H LEU 15 -9.310 -15.306 -19.020 105 HA LEU 15 HA LEU 15 -8.744 -17.082 -21.234 106 1HB LEU 15 1HB LEU 15 -9.240 -14.830 -21.959 107 2HB LEU 15 2HB LEU 15 -8.073 -14.192 -20.817 108 HG LEU 15 HG LEU 15 -6.274 -15.372 -22.034 109 1HD1 LEU 15 1HD1 LEU 15 -7.559 -17.131 -23.061 110 2HD1 LEU 15 2HD1 LEU 15 -6.655 -16.228 -24.266 111 3HD1 LEU 15 3HD1 LEU 15 -8.389 -15.957 -24.082 112 1HD2 LEU 15 1HD2 LEU 15 -7.885 -13.420 -23.674 113 2HD2 LEU 15 2HD2 LEU 15 -6.192 -13.824 -23.943 114 3HD2 LEU 15 3HD2 LEU 15 -6.683 -13.018 -22.452 115 H THR 16 H THR 16 -7.543 -18.484 -20.041 116 HA THR 16 HA THR 16 -5.291 -17.214 -18.850 117 HB THR 16 HB THR 16 -5.630 -20.227 -18.796 118 HG1 THR 16 HG1 THR 16 -7.349 -18.349 -17.839 119 1HG2 THR 16 1HG2 THR 16 -3.597 -19.218 -17.879 120 2HG2 THR 16 2HG2 THR 16 -4.583 -19.867 -16.554 121 3HG2 THR 16 3HG2 THR 16 -4.586 -18.131 -16.916 122 H VAL 17 H VAL 17 -3.292 -17.443 -19.799 123 HA VAL 17 HA VAL 17 -3.329 -18.599 -22.498 124 HB VAL 17 HB VAL 17 -1.888 -16.135 -21.469 125 1HG1 VAL 17 1HG1 VAL 17 -0.528 -17.299 -23.161 126 2HG1 VAL 17 2HG1 VAL 17 -1.181 -15.792 -23.800 127 3HG1 VAL 17 3HG1 VAL 17 -1.932 -17.334 -24.214 128 1HG2 VAL 17 1HG2 VAL 17 -4.236 -15.733 -21.789 129 2HG2 VAL 17 2HG2 VAL 17 -4.171 -16.443 -23.403 130 3HG2 VAL 17 3HG2 VAL 17 -3.325 -14.933 -23.072 131 H LYS 18 H LYS 18 -1.630 -19.851 -23.040 132 HA LYS 18 HA LYS 18 0.492 -20.068 -21.060 133 1HB LYS 18 1HB LYS 18 -0.414 -21.936 -23.238 134 2HB LYS 18 2HB LYS 18 1.181 -22.086 -22.537 135 1HG LYS 18 1HG LYS 18 -0.352 -23.668 -21.525 136 2HG LYS 18 2HG LYS 18 0.198 -22.479 -20.342 137 1HD LYS 18 1HD LYS 18 -1.936 -21.278 -20.630 138 2HD LYS 18 2HD LYS 18 -2.456 -22.515 -21.769 139 1HE LYS 18 1HE LYS 18 -3.379 -22.884 -19.501 140 2HE LYS 18 2HE LYS 18 -2.354 -24.215 -20.025 141 1HZ LYS 18 1HZ LYS 18 -1.946 -23.564 -17.712 142 2HZ LYS 18 2HZ LYS 18 -1.449 -22.029 -18.183 143 3HZ LYS 18 3HZ LYS 18 -0.581 -23.390 -18.653 144 H LEU 19 H LEU 19 1.416 -18.093 -21.616 145 HA LEU 19 HA LEU 19 2.218 -17.638 -24.284 146 1HB LEU 19 1HB LEU 19 1.200 -15.920 -22.867 147 2HB LEU 19 2HB LEU 19 2.424 -16.341 -21.671 148 HG LEU 19 HG LEU 19 4.093 -15.392 -22.827 149 1HD1 LEU 19 1HD1 LEU 19 2.139 -14.835 -25.104 150 2HD1 LEU 19 2HD1 LEU 19 3.480 -15.976 -25.164 151 3HD1 LEU 19 3HD1 LEU 19 3.802 -14.244 -25.074 152 1HD2 LEU 19 1HD2 LEU 19 2.833 -13.816 -21.549 153 2HD2 LEU 19 2HD2 LEU 19 1.690 -13.592 -22.852 154 3HD2 LEU 19 3HD2 LEU 19 3.345 -12.992 -23.026 155 H ASN 20 H ASN 20 3.618 -19.223 -24.493 156 HA ASN 20 HA ASN 20 5.841 -19.303 -22.633 157 1HB ASN 20 1HB ASN 20 4.863 -21.477 -23.306 158 2HB ASN 20 2HB ASN 20 5.293 -21.135 -24.978 159 1HD2 ASN 20 1HD2 ASN 20 6.500 -23.045 -25.017 160 2HD2 ASN 20 2HD2 ASN 20 8.071 -23.130 -24.305 161 H ASN 21 H ASN 21 7.131 -17.693 -23.024 162 HA ASN 21 HA ASN 21 7.365 -16.243 -25.354 163 1HB ASN 21 1HB ASN 21 9.378 -16.375 -23.121 164 2HB ASN 21 2HB ASN 21 9.330 -15.145 -24.376 165 1HD2 ASN 21 1HD2 ASN 21 7.661 -13.597 -24.334 166 2HD2 ASN 21 2HD2 ASN 21 6.726 -13.327 -22.921 167 HA PRO 22 HA PRO 22 11.587 -18.549 -26.458 168 1HB PRO 22 1HB PRO 22 10.775 -21.252 -25.491 169 2HB PRO 22 2HB PRO 22 12.384 -20.519 -25.550 170 1HG PRO 22 1HG PRO 22 11.130 -20.730 -23.240 171 2HG PRO 22 2HG PRO 22 12.024 -19.252 -23.639 172 1HD PRO 22 1HD PRO 22 9.074 -19.745 -23.687 173 2HD PRO 22 2HD PRO 22 9.972 -18.312 -23.145 174 H ARG 23 H ARG 23 8.341 -19.695 -26.537 175 HA ARG 23 HA ARG 23 8.757 -20.876 -29.204 176 1HB ARG 23 1HB ARG 23 6.469 -21.149 -27.270 177 2HB ARG 23 2HB ARG 23 6.430 -21.763 -28.913 178 1HG ARG 23 1HG ARG 23 8.451 -22.556 -26.855 179 2HG ARG 23 2HG ARG 23 6.976 -23.464 -27.176 180 1HD ARG 23 1HD ARG 23 9.245 -22.947 -29.112 181 2HD ARG 23 2HD ARG 23 8.820 -24.478 -28.343 182 HE ARG 23 HE ARG 23 6.618 -23.443 -29.801 183 1HH1 ARG 23 1HH1 ARG 23 9.667 -25.191 -30.334 184 2HH1 ARG 23 2HH1 ARG 23 9.158 -25.794 -31.847 185 1HH2 ARG 23 1HH2 ARG 23 5.957 -24.304 -31.705 186 2HH2 ARG 23 2HH2 ARG 23 6.955 -25.309 -32.663 187 H GLN 24 H GLN 24 7.261 -18.242 -27.536 188 HA GLN 24 HA GLN 24 5.973 -16.499 -28.091 189 1HB GLN 24 1HB GLN 24 7.134 -17.208 -30.721 190 2HB GLN 24 2HB GLN 24 5.985 -15.858 -30.619 191 1HG GLN 24 1HG GLN 24 8.588 -16.139 -29.131 192 2HG GLN 24 2HG GLN 24 8.343 -15.123 -30.555 193 1HE2 GLN 24 1HE2 GLN 24 7.140 -13.232 -30.337 194 2HE2 GLN 24 2HE2 GLN 24 6.842 -12.543 -28.779 195 H GLU 25 H GLU 25 4.949 -19.109 -27.945 196 HA GLU 25 HA GLU 25 2.581 -18.890 -29.617 197 1HB GLU 25 1HB GLU 25 4.047 -21.300 -28.610 198 2HB GLU 25 2HB GLU 25 2.354 -21.385 -29.091 199 1HG GLU 25 1HG GLU 25 2.806 -20.763 -31.232 200 2HG GLU 25 2HG GLU 25 4.491 -20.304 -30.903 201 H VAL 26 H VAL 26 0.750 -18.959 -28.754 202 HA VAL 26 HA VAL 26 0.532 -19.102 -25.808 203 HB VAL 26 HB VAL 26 -1.454 -17.678 -26.023 204 1HG1 VAL 26 1HG1 VAL 26 0.690 -16.647 -25.419 205 2HG1 VAL 26 2HG1 VAL 26 -0.237 -15.530 -26.420 206 3HG1 VAL 26 3HG1 VAL 26 1.094 -16.448 -27.123 207 1HG2 VAL 26 1HG2 VAL 26 -2.042 -18.041 -28.331 208 2HG2 VAL 26 2HG2 VAL 26 -0.555 -17.253 -28.863 209 3HG2 VAL 26 3HG2 VAL 26 -1.808 -16.314 -28.049 210 H SER 27 H SER 27 -0.513 -20.704 -25.095 211 HA SER 27 HA SER 27 -2.481 -21.963 -26.836 212 1HB SER 27 1HB SER 27 -1.600 -23.078 -24.190 213 2HB SER 27 2HB SER 27 -2.212 -23.882 -25.627 214 HG SER 27 HG SER 27 -0.284 -23.925 -26.514 215 H PHE 28 H PHE 28 -4.434 -21.330 -26.408 216 HA PHE 28 HA PHE 28 -4.946 -20.275 -23.729 217 1HB PHE 28 1HB PHE 28 -6.066 -18.421 -24.487 218 2HB PHE 28 2HB PHE 28 -4.783 -18.590 -25.669 219 HD1 PHE 28 HD1 PHE 28 -5.463 -19.918 -27.873 220 HD2 PHE 28 HD2 PHE 28 -8.261 -18.153 -25.205 221 HE1 PHE 28 HE1 PHE 28 -7.173 -19.924 -29.647 222 HE2 PHE 28 HE2 PHE 28 -9.964 -18.162 -26.970 223 HZ PHE 28 HZ PHE 28 -9.419 -19.048 -29.196 224 H VAL 29 H VAL 29 -7.167 -20.234 -23.222 225 HA VAL 29 HA VAL 29 -8.356 -22.767 -23.964 226 HB VAL 29 HB VAL 29 -7.692 -22.513 -21.610 227 1HG1 VAL 29 1HG1 VAL 29 -7.977 -20.174 -21.229 228 2HG1 VAL 29 2HG1 VAL 29 -8.926 -21.088 -20.057 229 3HG1 VAL 29 3HG1 VAL 29 -9.723 -20.314 -21.423 230 1HG2 VAL 29 1HG2 VAL 29 -10.653 -22.790 -22.066 231 2HG2 VAL 29 2HG2 VAL 29 -9.793 -23.287 -20.599 232 3HG2 VAL 29 3HG2 VAL 29 -9.406 -24.042 -22.146 233 H TYR 30 H TYR 30 -9.766 -22.716 -25.219 234 HA TYR 30 HA TYR 30 -11.431 -20.539 -26.058 235 1HB TYR 30 1HB TYR 30 -10.995 -22.380 -27.572 236 2HB TYR 30 2HB TYR 30 -11.684 -23.530 -26.440 237 HD1 TYR 30 HD1 TYR 30 -12.550 -20.678 -28.664 238 HD2 TYR 30 HD2 TYR 30 -13.967 -24.101 -26.574 239 HE1 TYR 30 HE1 TYR 30 -14.715 -20.497 -29.830 240 HE2 TYR 30 HE2 TYR 30 -16.128 -23.925 -27.729 241 HH TYR 30 HH TYR 30 -17.455 -22.307 -28.866 242 H ASP 31 H ASP 31 -11.798 -23.213 -23.898 243 HA ASP 31 HA ASP 31 -13.521 -22.161 -22.041 244 1HB ASP 31 1HB ASP 31 -15.246 -22.084 -23.834 245 2HB ASP 31 2HB ASP 31 -15.047 -23.819 -24.081 246 H ASN 32 H ASN 32 -13.392 -25.120 -23.959 247 HA ASN 32 HA ASN 32 -12.579 -26.586 -21.540 248 1HB ASN 32 1HB ASN 32 -15.023 -26.878 -22.057 249 2HB ASN 32 2HB ASN 32 -14.583 -27.536 -23.618 250 1HD2 ASN 32 1HD2 ASN 32 -14.651 -28.102 -20.183 251 2HD2 ASN 32 2HD2 ASN 32 -14.426 -29.805 -20.239 252 H GLN 33 H GLN 33 -11.180 -25.497 -24.149 253 HA GLN 33 HA GLN 33 -9.605 -27.793 -24.640 254 1HB GLN 33 1HB GLN 33 -9.978 -27.962 -26.982 255 2HB GLN 33 2HB GLN 33 -11.576 -28.049 -26.256 256 1HG GLN 33 1HG GLN 33 -11.911 -25.701 -26.747 257 2HG GLN 33 2HG GLN 33 -10.321 -25.634 -27.490 258 1HE2 GLN 33 1HE2 GLN 33 -9.980 -26.813 -29.477 259 2HE2 GLN 33 2HE2 GLN 33 -11.308 -27.264 -30.465 260 H LEU 34 H LEU 34 -7.790 -27.192 -25.751 261 HA LEU 34 HA LEU 34 -7.321 -24.374 -25.331 262 1HB LEU 34 1HB LEU 34 -5.477 -26.732 -25.241 263 2HB LEU 34 2HB LEU 34 -4.881 -25.081 -25.138 264 HG LEU 34 HG LEU 34 -4.840 -25.915 -22.929 265 1HD1 LEU 34 1HD1 LEU 34 -7.382 -24.422 -23.108 266 2HD1 LEU 34 2HD1 LEU 34 -5.757 -23.748 -23.021 267 3HD1 LEU 34 3HD1 LEU 34 -6.400 -24.681 -21.665 268 1HD2 LEU 34 1HD2 LEU 34 -6.118 -27.960 -23.291 269 2HD2 LEU 34 2HD2 LEU 34 -7.614 -27.028 -23.325 270 3HD2 LEU 34 3HD2 LEU 34 -6.662 -27.116 -21.844 271 H LEU 35 H LEU 35 -6.584 -23.228 -27.072 272 HA LEU 35 HA LEU 35 -5.787 -24.723 -29.470 273 1HB LEU 35 1HB LEU 35 -7.022 -21.991 -29.232 274 2HB LEU 35 2HB LEU 35 -6.247 -22.556 -30.691 275 HG LEU 35 HG LEU 35 -8.482 -22.710 -31.028 276 1HD1 LEU 35 1HD1 LEU 35 -7.348 -24.629 -31.871 277 2HD1 LEU 35 2HD1 LEU 35 -8.966 -25.093 -31.352 278 3HD1 LEU 35 3HD1 LEU 35 -7.574 -25.485 -30.344 279 1HD2 LEU 35 1HD2 LEU 35 -8.817 -24.128 -28.395 280 2HD2 LEU 35 2HD2 LEU 35 -10.108 -23.885 -29.577 281 3HD2 LEU 35 3HD2 LEU 35 -9.342 -22.495 -28.804 282 H HIS 36 H HIS 36 -4.293 -23.243 -30.818 283 HA HIS 36 HA HIS 36 -2.503 -21.874 -29.011 284 1HB HIS 36 1HB HIS 36 -0.519 -23.046 -29.832 285 2HB HIS 36 2HB HIS 36 -1.645 -24.143 -29.051 286 HD2 HIS 36 HD2 HIS 36 -3.201 -25.699 -31.026 287 HE1 HIS 36 HE1 HIS 36 -0.044 -25.447 -33.829 288 HE2 HIS 36 HE2 HIS 36 -2.356 -26.329 -33.389 289 H LEU 37 H LEU 37 -1.461 -20.271 -29.809 290 HA LEU 37 HA LEU 37 -1.644 -19.634 -32.714 291 1HB LEU 37 1HB LEU 37 -1.973 -17.660 -30.478 292 2HB LEU 37 2HB LEU 37 -1.977 -17.308 -32.175 293 HG LEU 37 HG LEU 37 -4.109 -17.073 -31.541 294 1HD1 LEU 37 1HD1 LEU 37 -4.114 -18.341 -33.521 295 2HD1 LEU 37 2HD1 LEU 37 -5.462 -18.888 -32.524 296 3HD1 LEU 37 3HD1 LEU 37 -3.990 -19.856 -32.629 297 1HD2 LEU 37 1HD2 LEU 37 -4.046 -17.924 -29.309 298 2HD2 LEU 37 2HD2 LEU 37 -3.933 -19.577 -29.893 299 3HD2 LEU 37 3HD2 LEU 37 -5.419 -18.657 -30.140 300 H LYS 38 H LYS 38 -0.119 -17.974 -33.240 301 HA LYS 38 HA LYS 38 2.160 -17.929 -31.444 302 1HB LYS 38 1HB LYS 38 3.686 -18.608 -33.183 303 2HB LYS 38 2HB LYS 38 2.447 -19.828 -32.866 304 1HG LYS 38 1HG LYS 38 1.322 -19.401 -34.849 305 2HG LYS 38 2HG LYS 38 2.214 -17.899 -35.123 306 1HD LYS 38 1HD LYS 38 4.225 -19.090 -35.327 307 2HD LYS 38 2HD LYS 38 3.418 -20.632 -35.023 308 1HE LYS 38 1HE LYS 38 2.041 -20.321 -37.030 309 2HE LYS 38 2HE LYS 38 2.839 -18.781 -37.346 310 1HZ LYS 38 1HZ LYS 38 4.143 -21.450 -37.351 311 2HZ LYS 38 2HZ LYS 38 4.923 -19.988 -37.582 312 3HZ LYS 38 3HZ LYS 38 3.787 -20.507 -38.708 313 H GLN 39 H GLN 39 3.529 -16.319 -31.814 314 HA GLN 39 HA GLN 39 2.452 -14.028 -33.294 315 1HB GLN 39 1HB GLN 39 3.301 -13.869 -30.938 316 2HB GLN 39 2HB GLN 39 4.917 -14.213 -31.578 317 1HG GLN 39 1HG GLN 39 3.246 -11.849 -32.413 318 2HG GLN 39 2HG GLN 39 4.379 -11.796 -31.066 319 1HE2 GLN 39 1HE2 GLN 39 4.339 -10.268 -33.578 320 2HE2 GLN 39 2HE2 GLN 39 5.831 -10.577 -34.361 321 H GLY 40 H GLY 40 2.856 -14.205 -35.203 322 1HA GLY 40 1HA GLY 40 5.579 -14.038 -36.196 323 2HA GLY 40 2HA GLY 40 4.719 -15.481 -36.739 324 H ILE 41 H ILE 41 2.879 -12.697 -36.111 325 HA ILE 41 HA ILE 41 2.791 -11.686 -38.787 326 HB ILE 41 HB ILE 41 0.316 -12.829 -37.406 327 1HG1 ILE 41 1HG1 ILE 41 1.583 -13.823 -39.980 328 2HG1 ILE 41 2HG1 ILE 41 1.697 -14.642 -38.429 329 1HG2 ILE 41 1HG2 ILE 41 -0.154 -10.802 -38.642 330 2HG2 ILE 41 2HG2 ILE 41 -0.893 -12.184 -39.452 331 3HG2 ILE 41 3HG2 ILE 41 0.591 -11.476 -40.091 332 1HD1 ILE 41 1HD1 ILE 41 0.028 -15.677 -39.851 333 2HD1 ILE 41 2HD1 ILE 41 -0.824 -14.139 -39.995 334 3HD1 ILE 41 3HD1 ILE 41 -0.735 -14.954 -38.434 335 H SER 42 H SER 42 2.351 -9.493 -38.442 336 HA SER 42 HA SER 42 0.785 -8.821 -36.124 337 1HB SER 42 1HB SER 42 3.444 -7.475 -36.733 338 2HB SER 42 2HB SER 42 2.269 -7.043 -35.477 339 HG SER 42 HG SER 42 3.855 -9.357 -35.677 340 H ALA 43 H ALA 43 0.112 -6.499 -36.309 341 HA ALA 43 HA ALA 43 0.391 -5.281 -38.758 342 1HB ALA 43 1HB ALA 43 -1.367 -6.872 -39.421 343 2HB ALA 43 2HB ALA 43 -1.982 -5.220 -39.460 344 3HB ALA 43 3HB ALA 43 -2.394 -6.284 -38.116 345 H SER 44 H SER 44 -2.464 -5.068 -36.690 346 HA SER 44 HA SER 44 -1.600 -2.404 -35.878 347 1HB SER 44 1HB SER 44 -4.314 -3.758 -35.750 348 2HB SER 44 2HB SER 44 -3.980 -2.050 -35.454 349 HG SER 44 HG SER 44 -3.643 -1.709 -37.520 350 H GLY 45 H GLY 45 -0.383 -4.656 -34.758 351 1HA GLY 45 1HA GLY 45 -0.333 -4.289 -32.097 352 2HA GLY 45 2HA GLY 45 -1.652 -5.438 -32.304 353 H ALA 46 H ALA 46 -0.768 -7.262 -31.542 354 HA ALA 46 HA ALA 46 1.624 -8.247 -32.818 355 1HB ALA 46 1HB ALA 46 1.924 -9.397 -30.580 356 2HB ALA 46 2HB ALA 46 0.664 -8.302 -29.970 357 3HB ALA 46 3HB ALA 46 2.182 -7.646 -30.556 358 H ARG 47 H ARG 47 1.047 -10.255 -33.737 359 HA ARG 47 HA ARG 47 -1.593 -10.756 -32.959 360 1HB ARG 47 1HB ARG 47 -0.475 -10.944 -35.743 361 2HB ARG 47 2HB ARG 47 -2.041 -11.637 -35.321 362 1HG ARG 47 1HG ARG 47 -2.775 -9.360 -34.656 363 2HG ARG 47 2HG ARG 47 -1.195 -8.756 -35.178 364 1HD ARG 47 1HD ARG 47 -2.852 -8.423 -36.934 365 2HD ARG 47 2HD ARG 47 -1.619 -9.569 -37.437 366 HE ARG 47 HE ARG 47 -3.661 -11.087 -36.396 367 1HH1 ARG 47 1HH1 ARG 47 -3.304 -8.783 -39.075 368 2HH1 ARG 47 2HH1 ARG 47 -4.514 -9.465 -40.035 369 1HH2 ARG 47 1HH2 ARG 47 -5.392 -12.042 -37.753 370 2HH2 ARG 47 2HH2 ARG 47 -5.724 -11.358 -39.264 371 H TYR 48 H TYR 48 -1.522 -12.623 -31.842 372 HA TYR 48 HA TYR 48 0.280 -14.770 -32.572 373 1HB TYR 48 1HB TYR 48 -1.761 -14.489 -30.333 374 2HB TYR 48 2HB TYR 48 -0.614 -15.811 -30.520 375 HD1 TYR 48 HD1 TYR 48 1.615 -15.587 -29.672 376 HD2 TYR 48 HD2 TYR 48 -0.977 -12.213 -29.727 377 HE1 TYR 48 HE1 TYR 48 3.186 -14.351 -28.231 378 HE2 TYR 48 HE2 TYR 48 0.581 -10.977 -28.299 379 HH TYR 48 HH TYR 48 3.741 -12.007 -27.687 380 H THR 49 H THR 49 -0.461 -15.779 -34.273 381 HA THR 49 HA THR 49 -3.254 -16.435 -34.343 382 HB THR 49 HB THR 49 -1.909 -14.817 -36.472 383 HG1 THR 49 HG1 THR 49 -3.088 -14.051 -34.306 384 1HG2 THR 49 1HG2 THR 49 -3.469 -16.400 -37.479 385 2HG2 THR 49 2HG2 THR 49 -4.112 -14.766 -37.612 386 3HG2 THR 49 3HG2 THR 49 -4.748 -15.869 -36.390 387 H ASP 50 H ASP 50 -3.389 -18.403 -35.179 388 HA ASP 50 HA ASP 50 -1.169 -19.377 -36.784 389 1HB ASP 50 1HB ASP 50 -1.514 -20.770 -34.840 390 2HB ASP 50 2HB ASP 50 -3.240 -20.876 -35.160 391 H GLY 51 H GLY 51 -4.505 -18.637 -36.703 392 1HA GLY 51 1HA GLY 51 -5.420 -18.158 -38.951 393 2HA GLY 51 2HA GLY 51 -4.915 -19.786 -39.382 394 H ILE 52 H ILE 52 -5.628 -20.528 -36.520 395 HA ILE 52 HA ILE 52 -8.318 -21.373 -37.002 396 HB ILE 52 HB ILE 52 -6.792 -21.320 -34.362 397 1HG1 ILE 52 1HG1 ILE 52 -7.034 -23.578 -36.368 398 2HG1 ILE 52 2HG1 ILE 52 -5.598 -22.585 -36.147 399 1HG2 ILE 52 1HG2 ILE 52 -8.349 -23.125 -33.700 400 2HG2 ILE 52 2HG2 ILE 52 -9.204 -22.919 -35.234 401 3HG2 ILE 52 3HG2 ILE 52 -9.188 -21.613 -34.054 402 1HD1 ILE 52 1HD1 ILE 52 -5.396 -23.436 -33.850 403 2HD1 ILE 52 2HD1 ILE 52 -5.351 -24.726 -35.051 404 3HD1 ILE 52 3HD1 ILE 52 -6.820 -24.446 -34.116 405 H TYR 53 H TYR 53 -6.810 -19.177 -34.713 406 HA TYR 53 HA TYR 53 -9.039 -17.311 -34.963 407 1HB TYR 53 1HB TYR 53 -7.724 -18.032 -32.341 408 2HB TYR 53 2HB TYR 53 -8.890 -16.748 -32.677 409 HD1 TYR 53 HD1 TYR 53 -11.189 -17.479 -33.582 410 HD2 TYR 53 HD2 TYR 53 -8.506 -20.151 -31.651 411 HE1 TYR 53 HE1 TYR 53 -13.038 -19.024 -33.154 412 HE2 TYR 53 HE2 TYR 53 -10.367 -21.707 -31.221 413 HH TYR 53 HH TYR 53 -12.785 -21.656 -31.039 414 H VAL 54 H VAL 54 -8.368 -15.275 -34.138 415 HA VAL 54 HA VAL 54 -5.544 -14.745 -34.646 416 HB VAL 54 HB VAL 54 -8.043 -13.173 -34.949 417 1HG1 VAL 54 1HG1 VAL 54 -6.203 -11.677 -34.233 418 2HG1 VAL 54 2HG1 VAL 54 -6.542 -11.351 -35.934 419 3HG1 VAL 54 3HG1 VAL 54 -5.151 -12.335 -35.484 420 1HG2 VAL 54 1HG2 VAL 54 -7.773 -14.730 -36.747 421 2HG2 VAL 54 2HG2 VAL 54 -6.121 -14.190 -37.036 422 3HG2 VAL 54 3HG2 VAL 54 -7.469 -13.116 -37.386 423 H PHE 55 H PHE 55 -4.666 -14.575 -32.674 424 HA PHE 55 HA PHE 55 -6.218 -13.359 -30.534 425 1HB PHE 55 1HB PHE 55 -5.149 -15.562 -30.112 426 2HB PHE 55 2HB PHE 55 -3.585 -14.893 -30.499 427 HD1 PHE 55 HD1 PHE 55 -6.007 -15.555 -27.988 428 HD2 PHE 55 HD2 PHE 55 -2.685 -13.071 -28.909 429 HE1 PHE 55 HE1 PHE 55 -5.710 -15.074 -25.610 430 HE2 PHE 55 HE2 PHE 55 -2.383 -12.581 -26.522 431 HZ PHE 55 HZ PHE 55 -3.898 -13.589 -24.868 432 H TRP 56 H TRP 56 -6.080 -11.281 -30.837 433 HA TRP 56 HA TRP 56 -3.641 -10.111 -31.798 434 1HB TRP 56 1HB TRP 56 -5.504 -9.815 -33.230 435 2HB TRP 56 2HB TRP 56 -6.519 -9.280 -31.892 436 HD1 TRP 56 HD1 TRP 56 -3.016 -7.799 -32.392 437 HE1 TRP 56 HE1 TRP 56 -3.286 -5.331 -33.062 438 HE3 TRP 56 HE3 TRP 56 -8.068 -7.682 -33.073 439 HZ2 TRP 56 HZ2 TRP 56 -5.351 -3.581 -33.832 440 HZ3 TRP 56 HZ3 TRP 56 -9.115 -5.581 -33.788 441 HH2 TRP 56 HH2 TRP 56 -7.782 -3.568 -34.165 442 H SER 57 H SER 57 -2.619 -9.149 -30.549 443 HA SER 57 HA SER 57 -3.630 -8.193 -27.958 444 1HB SER 57 1HB SER 57 -1.778 -9.893 -27.926 445 2HB SER 57 2HB SER 57 -0.770 -8.738 -28.790 446 HG SER 57 HG SER 57 -1.545 -8.813 -26.141 447 H LYS 58 H LYS 58 -4.065 -6.074 -28.037 448 HA LYS 58 HA LYS 58 -2.163 -4.395 -29.443 449 1HB LYS 58 1HB LYS 58 -4.276 -2.814 -29.674 450 2HB LYS 58 2HB LYS 58 -3.927 -4.065 -30.857 451 1HG LYS 58 1HG LYS 58 -5.574 -5.488 -30.003 452 2HG LYS 58 2HG LYS 58 -5.778 -4.522 -28.540 453 1HD LYS 58 1HD LYS 58 -6.730 -2.731 -29.812 454 2HD LYS 58 2HD LYS 58 -6.357 -3.555 -31.330 455 1HE LYS 58 1HE LYS 58 -8.747 -3.725 -30.763 456 2HE LYS 58 2HE LYS 58 -7.975 -5.306 -30.785 457 1HZ LYS 58 1HZ LYS 58 -8.560 -3.733 -28.316 458 2HZ LYS 58 2HZ LYS 58 -8.001 -5.345 -28.396 459 3HZ LYS 58 3HZ LYS 58 -9.508 -4.964 -28.947 460 H GLY 59 H GLY 59 -1.238 -4.612 -27.276 461 1HA GLY 59 1HA GLY 59 -0.481 -3.043 -25.700 462 2HA GLY 59 2HA GLY 59 -2.074 -2.295 -25.722 463 H ASP 60 H ASP 60 -3.266 -2.659 -24.038 464 HA ASP 60 HA ASP 60 -2.635 -4.926 -22.282 465 1HB ASP 60 1HB ASP 60 -4.134 -2.350 -21.749 466 2HB ASP 60 2HB ASP 60 -3.975 -3.654 -20.584 467 H GLU 61 H GLU 61 -4.380 -4.652 -24.776 468 HA GLU 61 HA GLU 61 -6.733 -5.882 -23.610 469 1HB GLU 61 1HB GLU 61 -8.138 -4.716 -25.271 470 2HB GLU 61 2HB GLU 61 -7.379 -3.601 -24.147 471 1HG GLU 61 1HG GLU 61 -5.639 -3.191 -25.874 472 2HG GLU 61 2HG GLU 61 -6.611 -4.206 -26.937 473 H ALA 62 H ALA 62 -7.519 -7.587 -24.727 474 HA ALA 62 HA ALA 62 -5.861 -8.474 -26.907 475 1HB ALA 62 1HB ALA 62 -6.897 -10.047 -24.568 476 2HB ALA 62 2HB ALA 62 -5.211 -9.621 -24.865 477 3HB ALA 62 3HB ALA 62 -6.046 -10.749 -25.945 478 H THR 63 H THR 63 -6.973 -9.305 -28.461 479 HA THR 63 HA THR 63 -9.876 -9.754 -28.204 480 HB THR 63 HB THR 63 -8.526 -8.654 -30.684 481 HG1 THR 63 HG1 THR 63 -9.419 -7.402 -28.330 482 1HG2 THR 63 1HG2 THR 63 -10.798 -9.632 -30.913 483 2HG2 THR 63 2HG2 THR 63 -10.795 -7.889 -31.205 484 3HG2 THR 63 3HG2 THR 63 -11.369 -8.524 -29.663 485 H VAL 64 H VAL 64 -10.589 -11.664 -29.211 486 HA VAL 64 HA VAL 64 -8.668 -13.144 -30.852 487 HB VAL 64 HB VAL 64 -10.681 -14.346 -28.905 488 1HG1 VAL 64 1HG1 VAL 64 -10.442 -15.706 -30.843 489 2HG1 VAL 64 2HG1 VAL 64 -9.650 -16.483 -29.479 490 3HG1 VAL 64 3HG1 VAL 64 -8.676 -15.672 -30.720 491 1HG2 VAL 64 1HG2 VAL 64 -8.742 -15.171 -27.667 492 2HG2 VAL 64 2HG2 VAL 64 -8.758 -13.406 -27.730 493 3HG2 VAL 64 3HG2 VAL 64 -7.670 -14.316 -28.777 494 H TYR 65 H TYR 65 -9.432 -12.789 -32.788 495 HA TYR 65 HA TYR 65 -12.378 -12.899 -33.337 496 1HB TYR 65 1HB TYR 65 -11.285 -10.608 -32.838 497 2HB TYR 65 2HB TYR 65 -10.422 -10.898 -34.344 498 HD1 TYR 65 HD1 TYR 65 -12.127 -11.400 -36.435 499 HD2 TYR 65 HD2 TYR 65 -13.085 -9.253 -32.880 500 HE1 TYR 65 HE1 TYR 65 -13.962 -10.246 -37.618 501 HE2 TYR 65 HE2 TYR 65 -14.913 -8.117 -34.039 502 HH TYR 65 HH TYR 65 -15.628 -7.563 -36.211 503 H LYS 66 H LYS 66 -12.072 -14.853 -34.588 504 HA LYS 66 HA LYS 66 -10.508 -14.532 -36.958 505 1HB LYS 66 1HB LYS 66 -10.477 -16.714 -35.816 506 2HB LYS 66 2HB LYS 66 -12.220 -16.779 -35.842 507 1HG LYS 66 1HG LYS 66 -11.248 -18.264 -37.500 508 2HG LYS 66 2HG LYS 66 -12.196 -17.000 -38.270 509 1HD LYS 66 1HD LYS 66 -10.098 -15.771 -38.755 510 2HD LYS 66 2HD LYS 66 -9.184 -17.097 -38.031 511 1HE LYS 66 1HE LYS 66 -11.017 -17.347 -40.423 512 2HE LYS 66 2HE LYS 66 -9.265 -17.217 -40.512 513 1HZ LYS 66 1HZ LYS 66 -9.081 -19.281 -39.290 514 2HZ LYS 66 2HZ LYS 66 -9.968 -19.512 -40.681 515 3HZ LYS 66 3HZ LYS 66 -10.755 -19.445 -39.196 516 H ARG 67 H ARG 67 -11.535 -14.323 -38.734 517 HA ARG 67 HA ARG 67 -13.817 -12.909 -39.296 518 1HB ARG 67 1HB ARG 67 -12.154 -13.447 -40.951 519 2HB ARG 67 2HB ARG 67 -12.622 -15.140 -40.906 520 1HG ARG 67 1HG ARG 67 -14.850 -14.482 -41.764 521 2HG ARG 67 2HG ARG 67 -14.248 -12.830 -41.934 522 1HD ARG 67 1HD ARG 67 -12.514 -13.577 -43.381 523 2HD ARG 67 2HD ARG 67 -13.023 -15.254 -43.169 524 HE ARG 67 HE ARG 67 -14.979 -13.390 -44.214 525 1HH1 ARG 67 1HH1 ARG 67 -12.678 -15.971 -44.954 526 2HH1 ARG 67 2HH1 ARG 67 -13.300 -16.277 -46.504 527 1HH2 ARG 67 1HH2 ARG 67 -15.856 -13.837 -46.345 528 2HH2 ARG 67 2HH2 ARG 67 -15.149 -15.044 -47.315 529 H ASP 68 H ASP 68 -13.622 -16.279 -38.542 530 HA ASP 68 HA ASP 68 -16.408 -16.767 -39.252 531 1HB ASP 68 1HB ASP 68 -14.202 -18.722 -38.601 532 2HB ASP 68 2HB ASP 68 -15.845 -19.146 -39.045 533 H ARG 69 H ARG 69 -14.437 -16.074 -36.600 534 HA ARG 69 HA ARG 69 -16.458 -16.593 -34.819 535 1HB ARG 69 1HB ARG 69 -15.972 -18.926 -35.028 536 2HB ARG 69 2HB ARG 69 -14.262 -18.659 -34.724 537 1HG ARG 69 1HG ARG 69 -15.264 -19.575 -32.733 538 2HG ARG 69 2HG ARG 69 -14.859 -17.888 -32.425 539 1HD ARG 69 1HD ARG 69 -17.259 -17.340 -33.007 540 2HD ARG 69 2HD ARG 69 -17.566 -19.077 -32.978 541 HE ARG 69 HE ARG 69 -16.526 -17.555 -30.697 542 1HH1 ARG 69 1HH1 ARG 69 -18.717 -20.023 -31.989 543 2HH1 ARG 69 2HH1 ARG 69 -19.357 -20.441 -30.465 544 1HH2 ARG 69 1HH2 ARG 69 -17.451 -18.173 -28.552 545 2HH2 ARG 69 2HH2 ARG 69 -18.640 -19.379 -28.513 546 H ILE 70 H ILE 70 -16.164 -14.871 -33.650 547 HA ILE 70 HA ILE 70 -13.677 -14.134 -32.423 548 HB ILE 70 HB ILE 70 -16.451 -12.972 -32.092 549 1HG1 ILE 70 1HG1 ILE 70 -15.467 -11.001 -33.415 550 2HG1 ILE 70 2HG1 ILE 70 -14.243 -12.149 -33.916 551 1HG2 ILE 70 1HG2 ILE 70 -15.015 -12.474 -30.227 552 2HG2 ILE 70 2HG2 ILE 70 -15.330 -11.006 -31.149 553 3HG2 ILE 70 3HG2 ILE 70 -13.781 -11.834 -31.312 554 1HD1 ILE 70 1HD1 ILE 70 -17.186 -12.377 -34.476 555 2HD1 ILE 70 2HD1 ILE 70 -15.939 -13.504 -35.026 556 3HD1 ILE 70 3HD1 ILE 70 -15.961 -11.843 -35.624 557 H VAL 71 H VAL 71 -13.410 -14.539 -30.507 558 HA VAL 71 HA VAL 71 -15.524 -15.745 -28.935 559 HB VAL 71 HB VAL 71 -14.575 -17.688 -29.768 560 1HG1 VAL 71 1HG1 VAL 71 -12.194 -18.200 -29.884 561 2HG1 VAL 71 2HG1 VAL 71 -11.865 -16.555 -29.302 562 3HG1 VAL 71 3HG1 VAL 71 -12.728 -16.805 -30.823 563 1HG2 VAL 71 1HG2 VAL 71 -13.476 -18.876 -27.934 564 2HG2 VAL 71 2HG2 VAL 71 -14.823 -17.901 -27.348 565 3HG2 VAL 71 3HG2 VAL 71 -13.165 -17.350 -27.114 566 H LEU 72 H LEU 72 -13.002 -13.602 -29.050 567 HA LEU 72 HA LEU 72 -13.676 -12.823 -26.358 568 1HB LEU 72 1HB LEU 72 -10.814 -13.335 -27.168 569 2HB LEU 72 2HB LEU 72 -11.225 -12.180 -25.938 570 HG LEU 72 HG LEU 72 -12.275 -14.118 -24.665 571 1HD1 LEU 72 1HD1 LEU 72 -11.414 -16.345 -25.159 572 2HD1 LEU 72 2HD1 LEU 72 -10.572 -15.723 -26.578 573 3HD1 LEU 72 3HD1 LEU 72 -12.337 -15.716 -26.528 574 1HD2 LEU 72 1HD2 LEU 72 -10.235 -13.054 -24.053 575 2HD2 LEU 72 2HD2 LEU 72 -9.342 -14.072 -25.187 576 3HD2 LEU 72 3HD2 LEU 72 -10.148 -14.795 -23.791 577 H ASN 73 H ASN 73 -14.121 -10.771 -26.408 578 HA ASN 73 HA ASN 73 -12.397 -9.026 -27.975 579 1HB ASN 73 1HB ASN 73 -14.239 -7.763 -28.907 580 2HB ASN 73 2HB ASN 73 -14.491 -9.455 -29.301 581 1HD2 ASN 73 1HD2 ASN 73 -16.377 -7.268 -29.214 582 2HD2 ASN 73 2HD2 ASN 73 -17.611 -7.735 -28.100 583 H ASN 74 H ASN 74 -12.659 -9.866 -25.241 584 HA ASN 74 HA ASN 74 -12.783 -7.354 -23.977 585 1HB ASN 74 1HB ASN 74 -15.131 -7.868 -23.813 586 2HB ASN 74 2HB ASN 74 -14.787 -9.502 -23.259 587 1HD2 ASN 74 1HD2 ASN 74 -14.725 -6.132 -22.398 588 2HD2 ASN 74 2HD2 ASN 74 -14.648 -6.378 -20.695 589 H CYS 75 H CYS 75 -10.669 -7.890 -23.777 590 HA CYS 75 HA CYS 75 -10.218 -9.084 -21.226 591 1HB CYS 75 1HB CYS 75 -8.971 -10.131 -23.728 592 2HB CYS 75 2HB CYS 75 -7.965 -10.013 -22.288 593 H GLN 76 H GLN 76 -9.102 -7.725 -20.064 594 HA GLN 76 HA GLN 76 -7.325 -5.940 -21.385 595 1HB GLN 76 1HB GLN 76 -9.565 -5.139 -19.514 596 2HB GLN 76 2HB GLN 76 -8.160 -4.112 -19.804 597 1HG GLN 76 1HG GLN 76 -8.659 -4.105 -22.181 598 2HG GLN 76 2HG GLN 76 -10.089 -5.083 -21.902 599 1HE2 GLN 76 1HE2 GLN 76 -11.887 -4.106 -20.938 600 2HE2 GLN 76 2HE2 GLN 76 -12.093 -2.405 -20.844 601 H LEU 77 H LEU 77 -5.652 -6.396 -20.683 602 HA LEU 77 HA LEU 77 -5.464 -8.163 -18.572 603 1HB LEU 77 1HB LEU 77 -4.241 -8.797 -20.438 604 2HB LEU 77 2HB LEU 77 -3.612 -7.203 -20.703 605 HG LEU 77 HG LEU 77 -1.901 -8.972 -20.157 606 1HD1 LEU 77 1HD1 LEU 77 -1.413 -6.623 -19.924 607 2HD1 LEU 77 2HD1 LEU 77 -0.542 -7.647 -18.803 608 3HD1 LEU 77 3HD1 LEU 77 -1.922 -6.700 -18.233 609 1HD2 LEU 77 1HD2 LEU 77 -1.616 -9.656 -17.848 610 2HD2 LEU 77 2HD2 LEU 77 -3.168 -10.209 -18.481 611 3HD2 LEU 77 3HD2 LEU 77 -3.100 -8.813 -17.406 612 H GLN 78 H GLN 78 -4.338 -7.781 -16.465 613 HA GLN 78 HA GLN 78 -3.687 -4.953 -16.080 614 1HB GLN 78 1HB GLN 78 -4.226 -7.072 -13.985 615 2HB GLN 78 2HB GLN 78 -3.893 -5.379 -13.651 616 1HG GLN 78 1HG GLN 78 -6.273 -6.434 -15.178 617 2HG GLN 78 2HG GLN 78 -6.287 -5.903 -13.504 618 1HE2 GLN 78 1HE2 GLN 78 -6.122 -4.915 -16.812 619 2HE2 GLN 78 2HE2 GLN 78 -6.451 -3.247 -16.562 620 H ASN 79 H ASN 79 -2.260 -8.237 -15.510 621 HA ASN 79 HA ASN 79 0.301 -7.317 -16.107 622 1HB ASN 79 1HB ASN 79 0.127 -6.369 -13.775 623 2HB ASN 79 2HB ASN 79 -0.197 -7.981 -13.165 624 1HD2 ASN 79 1HD2 ASN 79 1.963 -6.058 -12.594 625 2HD2 ASN 79 2HD2 ASN 79 3.430 -6.910 -12.892 626 HA PRO 80 HA PRO 80 -0.442 -11.540 -16.843 627 1HB PRO 80 1HB PRO 80 1.462 -12.015 -18.666 628 2HB PRO 80 2HB PRO 80 0.075 -10.970 -18.984 629 1HG PRO 80 1HG PRO 80 2.893 -10.223 -18.364 630 2HG PRO 80 2HG PRO 80 1.733 -9.449 -19.443 631 1HD PRO 80 1HD PRO 80 2.338 -8.628 -16.852 632 2HD PRO 80 2HD PRO 80 0.941 -8.151 -17.840 633 H GLN 81 H GLN 81 2.120 -10.555 -14.924 634 HA GLN 81 HA GLN 81 3.842 -12.731 -15.289 635 1HB GLN 81 1HB GLN 81 4.714 -10.558 -14.865 636 2HB GLN 81 2HB GLN 81 3.778 -10.418 -13.396 637 1HG GLN 81 1HG GLN 81 5.054 -12.172 -12.417 638 2HG GLN 81 2HG GLN 81 6.037 -12.283 -13.894 639 1HE2 GLN 81 1HE2 GLN 81 5.172 -10.310 -11.181 640 2HE2 GLN 81 2HE2 GLN 81 6.511 -9.225 -11.262 641 H ARG 82 H ARG 82 1.141 -12.326 -13.380 642 HA ARG 82 HA ARG 82 1.975 -14.659 -11.817 643 1HB ARG 82 1HB ARG 82 0.570 -12.257 -10.630 644 2HB ARG 82 2HB ARG 82 0.830 -13.776 -9.789 645 1HG ARG 82 1HG ARG 82 3.213 -13.508 -9.903 646 2HG ARG 82 2HG ARG 82 3.046 -12.081 -10.918 647 1HD ARG 82 1HD ARG 82 1.894 -10.943 -9.059 648 2HD ARG 82 2HD ARG 82 2.130 -12.369 -8.058 649 HE ARG 82 HE ARG 82 4.574 -11.996 -8.446 650 1HH1 ARG 82 1HH1 ARG 82 2.326 -9.280 -8.571 651 2HH1 ARG 82 2HH1 ARG 82 3.415 -8.126 -7.965 652 1HH2 ARG 82 1HH2 ARG 82 6.127 -10.411 -7.638 653 2HH2 ARG 82 2HH2 ARG 82 5.643 -8.798 -7.423 Start of MODEL 17 1 H MET 1 H MET 1 10.658 -15.971 -13.221 2 HA MET 1 HA MET 1 10.760 -18.367 -12.994 3 1HB MET 1 1HB MET 1 10.065 -17.010 -11.057 4 2HB MET 1 2HB MET 1 8.396 -17.114 -11.585 5 1HG MET 1 1HG MET 1 8.451 -19.547 -11.267 6 2HG MET 1 2HG MET 1 10.116 -19.429 -10.705 7 1HE MET 1 1HE MET 1 7.754 -20.854 -9.065 8 2HE MET 1 2HE MET 1 8.107 -20.280 -7.437 9 3HE MET 1 3HE MET 1 9.424 -20.767 -8.505 10 H GLN 2 H GLN 2 7.379 -17.384 -13.472 11 HA GLN 2 HA GLN 2 6.773 -20.099 -14.333 12 1HB GLN 2 1HB GLN 2 4.920 -17.786 -13.793 13 2HB GLN 2 2HB GLN 2 4.477 -19.473 -13.971 14 1HG GLN 2 1HG GLN 2 6.100 -18.311 -11.716 15 2HG GLN 2 2HG GLN 2 4.385 -18.689 -11.655 16 1HE2 GLN 2 1HE2 GLN 2 4.662 -20.085 -9.974 17 2HE2 GLN 2 2HE2 GLN 2 5.423 -21.629 -10.148 18 H THR 3 H THR 3 5.101 -20.113 -16.137 19 HA THR 3 HA THR 3 5.918 -18.534 -18.375 20 HB THR 3 HB THR 3 3.380 -20.118 -18.110 21 HG1 THR 3 HG1 THR 3 4.788 -21.934 -18.749 22 1HG2 THR 3 1HG2 THR 3 5.389 -19.756 -20.329 23 2HG2 THR 3 2HG2 THR 3 3.836 -18.931 -20.196 24 3HG2 THR 3 3HG2 THR 3 3.894 -20.677 -20.439 25 H ASP 4 H ASP 4 4.887 -16.803 -19.148 26 HA ASP 4 HA ASP 4 3.495 -15.159 -17.297 27 1HB ASP 4 1HB ASP 4 4.053 -14.965 -20.233 28 2HB ASP 4 2HB ASP 4 3.278 -13.655 -19.336 29 H THR 5 H THR 5 1.264 -14.472 -17.418 30 HA THR 5 HA THR 5 -0.419 -15.898 -19.300 31 HB THR 5 HB THR 5 -0.390 -17.439 -17.368 32 HG1 THR 5 HG1 THR 5 -2.862 -16.284 -17.029 33 1HG2 THR 5 1HG2 THR 5 -1.313 -16.758 -15.204 34 2HG2 THR 5 2HG2 THR 5 -1.543 -15.120 -15.807 35 3HG2 THR 5 3HG2 THR 5 0.087 -15.754 -15.599 36 H LEU 6 H LEU 6 -2.535 -14.972 -19.526 37 HA LEU 6 HA LEU 6 -2.543 -12.360 -18.866 38 1HB LEU 6 1HB LEU 6 -4.332 -14.126 -20.386 39 2HB LEU 6 2HB LEU 6 -5.017 -12.615 -19.805 40 HG LEU 6 HG LEU 6 -3.081 -11.486 -20.747 41 1HD1 LEU 6 1HD1 LEU 6 -1.452 -13.019 -21.021 42 2HD1 LEU 6 2HD1 LEU 6 -1.842 -12.418 -22.622 43 3HD1 LEU 6 3HD1 LEU 6 -2.407 -14.025 -22.118 44 1HD2 LEU 6 1HD2 LEU 6 -5.188 -11.300 -21.847 45 2HD2 LEU 6 2HD2 LEU 6 -4.908 -12.811 -22.720 46 3HD2 LEU 6 3HD2 LEU 6 -3.910 -11.392 -23.056 47 H GLU 7 H GLU 7 -5.218 -11.731 -18.154 48 HA GLU 7 HA GLU 7 -4.595 -11.790 -15.422 49 1HB GLU 7 1HB GLU 7 -5.372 -9.778 -16.522 50 2HB GLU 7 2HB GLU 7 -6.911 -10.544 -16.885 51 1HG GLU 7 1HG GLU 7 -7.363 -10.818 -14.545 52 2HG GLU 7 2HG GLU 7 -5.820 -10.074 -14.140 53 H TYR 8 H TYR 8 -6.309 -13.763 -17.521 54 HA TYR 8 HA TYR 8 -8.062 -14.811 -17.720 55 1HB TYR 8 1HB TYR 8 -8.571 -16.620 -16.002 56 2HB TYR 8 2HB TYR 8 -6.943 -16.554 -16.632 57 HD1 TYR 8 HD1 TYR 8 -5.131 -16.456 -15.166 58 HD2 TYR 8 HD2 TYR 8 -9.030 -15.647 -13.681 59 HE1 TYR 8 HE1 TYR 8 -4.261 -16.504 -12.884 60 HE2 TYR 8 HE2 TYR 8 -8.168 -15.694 -11.380 61 HH TYR 8 HH TYR 8 -6.397 -16.362 -10.107 62 H GLN 9 H GLN 9 -8.759 -12.225 -16.708 63 HA GLN 9 HA GLN 9 -11.398 -12.872 -15.633 64 1HB GLN 9 1HB GLN 9 -9.740 -10.437 -15.053 65 2HB GLN 9 2HB GLN 9 -11.408 -10.667 -14.546 66 1HG GLN 9 1HG GLN 9 -10.784 -12.581 -13.334 67 2HG GLN 9 2HG GLN 9 -9.097 -12.367 -13.786 68 1HE2 GLN 9 1HE2 GLN 9 -9.342 -9.399 -13.626 69 2HE2 GLN 9 2HE2 GLN 9 -9.344 -9.001 -11.960 70 H CYS 10 H CYS 10 -12.148 -12.970 -17.568 71 HA CYS 10 HA CYS 10 -12.307 -10.417 -18.955 72 1HB CYS 10 1HB CYS 10 -11.644 -13.067 -20.265 73 2HB CYS 10 2HB CYS 10 -11.910 -11.570 -21.152 74 H ASP 11 H ASP 11 -14.185 -10.012 -20.092 75 HA ASP 11 HA ASP 11 -16.523 -10.746 -18.833 76 1HB ASP 11 1HB ASP 11 -16.173 -9.672 -21.622 77 2HB ASP 11 2HB ASP 11 -17.693 -9.701 -20.737 78 H GLU 12 H GLU 12 -15.066 -12.149 -21.594 79 HA GLU 12 HA GLU 12 -17.399 -13.750 -22.148 80 1HB GLU 12 1HB GLU 12 -14.695 -13.714 -23.421 81 2HB GLU 12 2HB GLU 12 -16.081 -14.624 -23.984 82 1HG GLU 12 1HG GLU 12 -16.022 -11.685 -23.666 83 2HG GLU 12 2HG GLU 12 -15.664 -12.495 -25.200 84 H LYS 13 H LYS 13 -14.097 -14.196 -20.998 85 HA LYS 13 HA LYS 13 -14.687 -16.978 -20.311 86 1HB LYS 13 1HB LYS 13 -12.326 -16.318 -22.065 87 2HB LYS 13 2HB LYS 13 -12.922 -17.897 -21.635 88 1HG LYS 13 1HG LYS 13 -14.172 -15.914 -23.507 89 2HG LYS 13 2HG LYS 13 -13.329 -17.377 -23.982 90 1HD LYS 13 1HD LYS 13 -15.937 -17.245 -22.431 91 2HD LYS 13 2HD LYS 13 -15.760 -17.748 -24.107 92 1HE LYS 13 1HE LYS 13 -14.586 -19.727 -23.458 93 2HE LYS 13 2HE LYS 13 -14.454 -19.172 -21.791 94 1HZ LYS 13 1HZ LYS 13 -16.828 -19.322 -21.572 95 2HZ LYS 13 2HZ LYS 13 -16.197 -20.809 -22.016 96 3HZ LYS 13 3HZ LYS 13 -17.005 -19.863 -23.162 97 HA PRO 14 HA PRO 14 -11.354 -15.637 -17.719 98 1HB PRO 14 1HB PRO 14 -10.760 -18.007 -16.441 99 2HB PRO 14 2HB PRO 14 -12.113 -16.980 -15.969 100 1HG PRO 14 1HG PRO 14 -12.122 -19.514 -17.501 101 2HG PRO 14 2HG PRO 14 -13.373 -18.836 -16.452 102 1HD PRO 14 1HD PRO 14 -13.334 -18.766 -19.265 103 2HD PRO 14 2HD PRO 14 -14.390 -17.812 -18.206 104 H LEU 15 H LEU 15 -9.331 -15.364 -18.791 105 HA LEU 15 HA LEU 15 -8.631 -17.482 -20.618 106 1HB LEU 15 1HB LEU 15 -9.216 -15.477 -21.779 107 2HB LEU 15 2HB LEU 15 -8.175 -14.518 -20.744 108 HG LEU 15 HG LEU 15 -6.242 -15.712 -21.594 109 1HD1 LEU 15 1HD1 LEU 15 -8.218 -16.933 -23.537 110 2HD1 LEU 15 2HD1 LEU 15 -7.268 -17.789 -22.321 111 3HD1 LEU 15 3HD1 LEU 15 -6.467 -17.032 -23.696 112 1HD2 LEU 15 1HD2 LEU 15 -6.124 -14.606 -23.746 113 2HD2 LEU 15 2HD2 LEU 15 -6.911 -13.567 -22.550 114 3HD2 LEU 15 3HD2 LEU 15 -7.871 -14.410 -23.765 115 H THR 16 H THR 16 -7.234 -18.636 -19.520 116 HA THR 16 HA THR 16 -5.208 -17.116 -18.309 117 HB THR 16 HB THR 16 -5.499 -20.151 -18.049 118 HG1 THR 16 HG1 THR 16 -7.362 -19.444 -17.167 119 1HG2 THR 16 1HG2 THR 16 -3.361 -19.228 -17.289 120 2HG2 THR 16 2HG2 THR 16 -4.335 -19.734 -15.892 121 3HG2 THR 16 3HG2 THR 16 -4.237 -18.024 -16.351 122 H VAL 17 H VAL 17 -2.934 -17.485 -19.221 123 HA VAL 17 HA VAL 17 -2.902 -18.960 -21.778 124 HB VAL 17 HB VAL 17 -1.798 -16.162 -21.335 125 1HG1 VAL 17 1HG1 VAL 17 -0.365 -17.393 -22.891 126 2HG1 VAL 17 2HG1 VAL 17 -1.280 -16.157 -23.746 127 3HG1 VAL 17 3HG1 VAL 17 -1.781 -17.842 -23.835 128 1HG2 VAL 17 1HG2 VAL 17 -4.182 -16.064 -21.547 129 2HG2 VAL 17 2HG2 VAL 17 -4.143 -17.094 -22.974 130 3HG2 VAL 17 3HG2 VAL 17 -3.467 -15.472 -23.051 131 H LYS 18 H LYS 18 -0.876 -19.884 -22.301 132 HA LYS 18 HA LYS 18 1.115 -19.470 -20.274 133 1HB LYS 18 1HB LYS 18 0.621 -21.803 -22.115 134 2HB LYS 18 2HB LYS 18 2.192 -21.561 -21.377 135 1HG LYS 18 1HG LYS 18 0.957 -23.144 -20.066 136 2HG LYS 18 2HG LYS 18 1.115 -21.650 -19.145 137 1HD LYS 18 1HD LYS 18 -1.162 -21.030 -19.876 138 2HD LYS 18 2HD LYS 18 -1.320 -22.607 -20.650 139 1HE LYS 18 1HE LYS 18 -0.869 -22.082 -17.703 140 2HE LYS 18 2HE LYS 18 -2.384 -22.596 -18.438 141 1HZ LYS 18 1HZ LYS 18 -1.247 -24.446 -17.447 142 2HZ LYS 18 2HZ LYS 18 0.139 -24.159 -18.358 143 3HZ LYS 18 3HZ LYS 18 -1.271 -24.664 -19.112 144 H LEU 19 H LEU 19 1.649 -17.558 -21.014 145 HA LEU 19 HA LEU 19 2.618 -17.118 -23.667 146 1HB LEU 19 1HB LEU 19 2.411 -15.582 -21.162 147 2HB LEU 19 2HB LEU 19 3.630 -15.078 -22.309 148 HG LEU 19 HG LEU 19 0.707 -15.296 -23.065 149 1HD1 LEU 19 1HD1 LEU 19 0.978 -13.737 -21.166 150 2HD1 LEU 19 2HD1 LEU 19 0.611 -12.882 -22.667 151 3HD1 LEU 19 3HD1 LEU 19 2.262 -12.910 -22.046 152 1HD2 LEU 19 1HD2 LEU 19 1.391 -13.779 -24.828 153 2HD2 LEU 19 2HD2 LEU 19 2.404 -15.225 -24.866 154 3HD2 LEU 19 3HD2 LEU 19 3.026 -13.729 -24.180 155 H ASN 20 H ASN 20 4.104 -18.580 -23.915 156 HA ASN 20 HA ASN 20 6.408 -18.609 -22.168 157 1HB ASN 20 1HB ASN 20 6.004 -19.938 -24.877 158 2HB ASN 20 2HB ASN 20 7.465 -20.112 -23.919 159 1HD2 ASN 20 1HD2 ASN 20 4.089 -20.948 -24.190 160 2HD2 ASN 20 2HD2 ASN 20 4.144 -22.215 -23.021 161 H ASN 21 H ASN 21 6.945 -16.511 -22.232 162 HA ASN 21 HA ASN 21 6.987 -14.742 -24.297 163 1HB ASN 21 1HB ASN 21 7.261 -14.253 -21.823 164 2HB ASN 21 2HB ASN 21 8.952 -14.693 -22.015 165 1HD2 ASN 21 1HD2 ASN 21 7.790 -12.160 -21.177 166 2HD2 ASN 21 2HD2 ASN 21 8.368 -10.977 -22.286 167 HA PRO 22 HA PRO 22 11.695 -15.539 -25.226 168 1HB PRO 22 1HB PRO 22 12.645 -18.024 -24.627 169 2HB PRO 22 2HB PRO 22 12.859 -16.606 -23.586 170 1HG PRO 22 1HG PRO 22 10.796 -18.745 -23.489 171 2HG PRO 22 2HG PRO 22 11.782 -18.085 -22.150 172 1HD PRO 22 1HD PRO 22 9.267 -17.314 -22.475 173 2HD PRO 22 2HD PRO 22 10.524 -16.118 -22.080 174 H ARG 23 H ARG 23 9.191 -17.838 -25.510 175 HA ARG 23 HA ARG 23 10.339 -18.900 -28.012 176 1HB ARG 23 1HB ARG 23 9.875 -20.613 -26.350 177 2HB ARG 23 2HB ARG 23 8.214 -20.064 -26.211 178 1HG ARG 23 1HG ARG 23 7.822 -20.761 -28.543 179 2HG ARG 23 2HG ARG 23 9.477 -21.327 -28.627 180 1HD ARG 23 1HD ARG 23 9.121 -23.022 -27.051 181 2HD ARG 23 2HD ARG 23 7.587 -22.328 -26.524 182 HE ARG 23 HE ARG 23 6.955 -22.823 -28.987 183 1HH1 ARG 23 1HH1 ARG 23 8.877 -24.927 -26.882 184 2HH1 ARG 23 2HH1 ARG 23 8.329 -26.360 -27.622 185 1HH2 ARG 23 1HH2 ARG 23 6.201 -24.772 -29.944 186 2HH2 ARG 23 2HH2 ARG 23 6.782 -26.275 -29.387 187 H GLN 24 H GLN 24 7.901 -16.820 -26.857 188 HA GLN 24 HA GLN 24 6.132 -15.763 -27.668 189 1HB GLN 24 1HB GLN 24 7.477 -16.531 -30.202 190 2HB GLN 24 2HB GLN 24 6.063 -15.454 -30.199 191 1HG GLN 24 1HG GLN 24 7.416 -13.933 -28.724 192 2HG GLN 24 2HG GLN 24 8.790 -15.005 -28.994 193 1HE2 GLN 24 1HE2 GLN 24 9.773 -15.021 -31.025 194 2HE2 GLN 24 2HE2 GLN 24 9.472 -13.807 -32.193 195 H GLU 25 H GLU 25 5.876 -18.475 -27.002 196 HA GLU 25 HA GLU 25 3.842 -19.569 -28.860 197 1HB GLU 25 1HB GLU 25 5.966 -20.851 -28.017 198 2HB GLU 25 2HB GLU 25 5.046 -20.962 -26.522 199 1HG GLU 25 1HG GLU 25 4.648 -22.980 -27.597 200 2HG GLU 25 2HG GLU 25 3.213 -22.017 -27.944 201 H VAL 26 H VAL 26 1.808 -19.720 -28.041 202 HA VAL 26 HA VAL 26 1.373 -19.438 -25.121 203 HB VAL 26 HB VAL 26 -0.691 -18.273 -25.518 204 1HG1 VAL 26 1HG1 VAL 26 0.188 -16.084 -26.236 205 2HG1 VAL 26 2HG1 VAL 26 1.672 -16.899 -26.745 206 3HG1 VAL 26 3HG1 VAL 26 1.180 -16.920 -25.048 207 1HG2 VAL 26 1HG2 VAL 26 -1.253 -17.261 -27.685 208 2HG2 VAL 26 2HG2 VAL 26 -1.263 -19.024 -27.732 209 3HG2 VAL 26 3HG2 VAL 26 0.097 -18.133 -28.417 210 H SER 27 H SER 27 0.167 -20.785 -24.245 211 HA SER 27 HA SER 27 -1.559 -22.382 -25.951 212 1HB SER 27 1HB SER 27 -0.164 -23.311 -23.425 213 2HB SER 27 2HB SER 27 -1.183 -24.258 -24.523 214 HG SER 27 HG SER 27 0.646 -23.167 -26.001 215 H PHE 28 H PHE 28 -3.565 -21.991 -25.400 216 HA PHE 28 HA PHE 28 -4.018 -21.224 -22.697 217 1HB PHE 28 1HB PHE 28 -5.268 -19.173 -23.146 218 2HB PHE 28 2HB PHE 28 -3.595 -19.071 -23.634 219 HD1 PHE 28 HD1 PHE 28 -3.057 -18.238 -25.706 220 HD2 PHE 28 HD2 PHE 28 -7.014 -19.616 -24.984 221 HE1 PHE 28 HE1 PHE 28 -3.783 -17.261 -27.832 222 HE2 PHE 28 HE2 PHE 28 -7.744 -18.656 -27.119 223 HZ PHE 28 HZ PHE 28 -6.131 -17.471 -28.543 224 H VAL 29 H VAL 29 -6.375 -20.577 -22.480 225 HA VAL 29 HA VAL 29 -7.628 -23.043 -23.216 226 HB VAL 29 HB VAL 29 -7.099 -22.623 -20.835 227 1HG1 VAL 29 1HG1 VAL 29 -9.161 -20.456 -20.941 228 2HG1 VAL 29 2HG1 VAL 29 -7.441 -20.288 -20.611 229 3HG1 VAL 29 3HG1 VAL 29 -8.473 -21.153 -19.475 230 1HG2 VAL 29 1HG2 VAL 29 -9.997 -23.003 -21.520 231 2HG2 VAL 29 2HG2 VAL 29 -9.268 -23.370 -19.953 232 3HG2 VAL 29 3HG2 VAL 29 -8.741 -24.240 -21.392 233 H TYR 30 H TYR 30 -9.060 -22.971 -24.487 234 HA TYR 30 HA TYR 30 -10.498 -20.760 -25.680 235 1HB TYR 30 1HB TYR 30 -10.173 -23.057 -26.705 236 2HB TYR 30 2HB TYR 30 -11.281 -23.696 -25.511 237 HD1 TYR 30 HD1 TYR 30 -13.666 -22.345 -25.533 238 HD2 TYR 30 HD2 TYR 30 -10.994 -22.738 -28.802 239 HE1 TYR 30 HE1 TYR 30 -15.521 -21.955 -27.077 240 HE2 TYR 30 HE2 TYR 30 -12.851 -22.331 -30.366 241 HH TYR 30 HH TYR 30 -15.285 -22.539 -30.375 242 H ASP 31 H ASP 31 -11.170 -23.132 -23.259 243 HA ASP 31 HA ASP 31 -12.998 -21.580 -21.783 244 1HB ASP 31 1HB ASP 31 -14.557 -22.090 -23.538 245 2HB ASP 31 2HB ASP 31 -14.089 -23.777 -23.559 246 H ASN 32 H ASN 32 -12.716 -25.015 -22.595 247 HA ASN 32 HA ASN 32 -11.384 -25.504 -20.050 248 1HB ASN 32 1HB ASN 32 -13.921 -26.825 -21.012 249 2HB ASN 32 2HB ASN 32 -12.819 -27.693 -19.953 250 1HD2 ASN 32 1HD2 ASN 32 -15.070 -25.011 -20.205 251 2HD2 ASN 32 2HD2 ASN 32 -15.204 -24.701 -18.520 252 H GLN 33 H GLN 33 -10.590 -25.361 -22.970 253 HA GLN 33 HA GLN 33 -9.202 -27.852 -23.051 254 1HB GLN 33 1HB GLN 33 -9.705 -28.237 -25.391 255 2HB GLN 33 2HB GLN 33 -11.223 -28.173 -24.517 256 1HG GLN 33 1HG GLN 33 -11.534 -25.864 -25.269 257 2HG GLN 33 2HG GLN 33 -9.983 -25.998 -26.096 258 1HE2 GLN 33 1HE2 GLN 33 -12.818 -25.594 -27.121 259 2HE2 GLN 33 2HE2 GLN 33 -12.970 -26.790 -28.353 260 H LEU 34 H LEU 34 -7.373 -27.610 -24.385 261 HA LEU 34 HA LEU 34 -6.580 -24.842 -24.148 262 1HB LEU 34 1HB LEU 34 -5.006 -27.353 -23.678 263 2HB LEU 34 2HB LEU 34 -4.229 -25.787 -23.815 264 HG LEU 34 HG LEU 34 -4.321 -26.355 -21.513 265 1HD1 LEU 34 1HD1 LEU 34 -6.478 -24.380 -22.013 266 2HD1 LEU 34 2HD1 LEU 34 -4.744 -24.072 -21.910 267 3HD1 LEU 34 3HD1 LEU 34 -5.631 -24.631 -20.489 268 1HD2 LEU 34 1HD2 LEU 34 -6.369 -26.922 -20.288 269 2HD2 LEU 34 2HD2 LEU 34 -6.007 -28.102 -21.545 270 3HD2 LEU 34 3HD2 LEU 34 -7.273 -26.902 -21.804 271 H LEU 35 H LEU 35 -5.734 -23.947 -25.961 272 HA LEU 35 HA LEU 35 -4.899 -25.702 -28.161 273 1HB LEU 35 1HB LEU 35 -6.202 -22.986 -28.270 274 2HB LEU 35 2HB LEU 35 -5.394 -23.713 -29.632 275 HG LEU 35 HG LEU 35 -7.641 -23.938 -29.947 276 1HD1 LEU 35 1HD1 LEU 35 -6.599 -26.609 -29.050 277 2HD1 LEU 35 2HD1 LEU 35 -6.432 -25.869 -30.645 278 3HD1 LEU 35 3HD1 LEU 35 -8.019 -26.372 -30.069 279 1HD2 LEU 35 1HD2 LEU 35 -7.937 -25.207 -27.229 280 2HD2 LEU 35 2HD2 LEU 35 -9.235 -25.048 -28.415 281 3HD2 LEU 35 3HD2 LEU 35 -8.497 -23.610 -27.706 282 H HIS 36 H HIS 36 -3.433 -24.348 -29.654 283 HA HIS 36 HA HIS 36 -1.664 -22.718 -28.020 284 1HB HIS 36 1HB HIS 36 0.371 -23.870 -28.757 285 2HB HIS 36 2HB HIS 36 -0.696 -24.937 -27.858 286 HD2 HIS 36 HD2 HIS 36 -1.928 -26.964 -29.418 287 HE1 HIS 36 HE1 HIS 36 0.648 -26.401 -32.724 288 HE2 HIS 36 HE2 HIS 36 -1.007 -27.967 -31.624 289 H LEU 37 H LEU 37 -0.740 -21.118 -28.946 290 HA LEU 37 HA LEU 37 -0.914 -20.759 -31.870 291 1HB LEU 37 1HB LEU 37 -1.735 -18.641 -29.861 292 2HB LEU 37 2HB LEU 37 -1.738 -18.432 -31.564 293 HG LEU 37 HG LEU 37 -3.479 -20.375 -31.577 294 1HD1 LEU 37 1HD1 LEU 37 -3.812 -19.484 -28.720 295 2HD1 LEU 37 2HD1 LEU 37 -3.219 -21.042 -29.260 296 3HD1 LEU 37 3HD1 LEU 37 -4.883 -20.575 -29.611 297 1HD2 LEU 37 1HD2 LEU 37 -4.105 -17.606 -30.616 298 2HD2 LEU 37 2HD2 LEU 37 -5.311 -18.800 -31.103 299 3HD2 LEU 37 3HD2 LEU 37 -4.112 -18.255 -32.269 300 H LYS 38 H LYS 38 0.482 -18.860 -32.493 301 HA LYS 38 HA LYS 38 2.464 -18.220 -30.471 302 1HB LYS 38 1HB LYS 38 4.273 -18.742 -31.898 303 2HB LYS 38 2HB LYS 38 3.204 -20.153 -31.703 304 1HG LYS 38 1HG LYS 38 2.332 -19.883 -33.903 305 2HG LYS 38 2HG LYS 38 3.170 -18.341 -34.104 306 1HD LYS 38 1HD LYS 38 4.392 -20.060 -35.278 307 2HD LYS 38 2HD LYS 38 5.289 -19.499 -33.855 308 1HE LYS 38 1HE LYS 38 4.606 -21.442 -32.591 309 2HE LYS 38 2HE LYS 38 3.575 -21.970 -33.921 310 1HZ LYS 38 1HZ LYS 38 5.523 -22.321 -35.260 311 2HZ LYS 38 2HZ LYS 38 5.678 -23.168 -33.800 312 3HZ LYS 38 3HZ LYS 38 6.522 -21.740 -34.032 313 H GLN 39 H GLN 39 3.749 -16.443 -31.106 314 HA GLN 39 HA GLN 39 2.189 -14.520 -32.621 315 1HB GLN 39 1HB GLN 39 3.302 -13.800 -30.573 316 2HB GLN 39 2HB GLN 39 4.865 -14.186 -31.315 317 1HG GLN 39 1HG GLN 39 4.502 -12.469 -33.003 318 2HG GLN 39 2HG GLN 39 2.928 -12.095 -32.306 319 1HE2 GLN 39 1HE2 GLN 39 5.267 -10.406 -32.707 320 2HE2 GLN 39 2HE2 GLN 39 5.672 -9.784 -31.146 321 H GLY 40 H GLY 40 2.215 -14.952 -34.519 322 1HA GLY 40 1HA GLY 40 4.723 -15.494 -35.964 323 2HA GLY 40 2HA GLY 40 3.112 -15.860 -36.582 324 H ILE 41 H ILE 41 2.557 -14.607 -38.174 325 HA ILE 41 HA ILE 41 3.911 -12.129 -38.589 326 HB ILE 41 HB ILE 41 1.525 -13.247 -40.105 327 1HG1 ILE 41 1HG1 ILE 41 3.305 -13.589 -41.949 328 2HG1 ILE 41 2HG1 ILE 41 4.492 -13.365 -40.680 329 1HG2 ILE 41 1HG2 ILE 41 1.658 -10.837 -40.267 330 2HG2 ILE 41 2HG2 ILE 41 2.062 -11.569 -41.828 331 3HG2 ILE 41 3HG2 ILE 41 3.337 -10.934 -40.781 332 1HD1 ILE 41 1HD1 ILE 41 2.412 -15.546 -40.772 333 2HD1 ILE 41 2HD1 ILE 41 3.627 -15.331 -39.514 334 3HD1 ILE 41 3HD1 ILE 41 4.121 -15.728 -41.159 335 H SER 42 H SER 42 3.421 -10.382 -37.583 336 HA SER 42 HA SER 42 0.645 -9.905 -36.778 337 1HB SER 42 1HB SER 42 3.201 -9.184 -35.399 338 2HB SER 42 2HB SER 42 1.566 -8.859 -34.783 339 HG SER 42 HG SER 42 2.697 -11.414 -35.317 340 H ALA 43 H ALA 43 -0.082 -8.138 -37.938 341 HA ALA 43 HA ALA 43 1.806 -6.493 -39.125 342 1HB ALA 43 1HB ALA 43 -0.097 -5.274 -40.104 343 2HB ALA 43 2HB ALA 43 -1.194 -6.168 -39.062 344 3HB ALA 43 3HB ALA 43 -0.267 -7.019 -40.298 345 H SER 44 H SER 44 -0.561 -6.262 -36.583 346 HA SER 44 HA SER 44 0.851 -4.030 -35.380 347 1HB SER 44 1HB SER 44 -1.171 -3.220 -36.685 348 2HB SER 44 2HB SER 44 -2.166 -4.244 -35.654 349 HG SER 44 HG SER 44 -0.603 -2.011 -34.951 350 H GLY 45 H GLY 45 0.548 -4.095 -33.056 351 1HA GLY 45 1HA GLY 45 0.114 -5.071 -31.001 352 2HA GLY 45 2HA GLY 45 -1.075 -6.100 -31.787 353 H ALA 46 H ALA 46 -0.663 -8.164 -31.561 354 HA ALA 46 HA ALA 46 1.782 -9.308 -32.293 355 1HB ALA 46 1HB ALA 46 2.410 -8.728 -30.023 356 2HB ALA 46 2HB ALA 46 2.056 -10.461 -30.118 357 3HB ALA 46 3HB ALA 46 0.874 -9.350 -29.413 358 H ARG 47 H ARG 47 0.902 -10.861 -33.483 359 HA ARG 47 HA ARG 47 -1.650 -11.664 -32.588 360 1HB ARG 47 1HB ARG 47 -0.426 -11.813 -35.321 361 2HB ARG 47 2HB ARG 47 -1.938 -12.636 -34.924 362 1HG ARG 47 1HG ARG 47 -2.803 -10.450 -34.208 363 2HG ARG 47 2HG ARG 47 -1.341 -9.698 -34.876 364 1HD ARG 47 1HD ARG 47 -3.406 -11.340 -36.279 365 2HD ARG 47 2HD ARG 47 -3.132 -9.598 -36.449 366 HE ARG 47 HE ARG 47 -0.910 -11.333 -37.162 367 1HH1 ARG 47 1HH1 ARG 47 -3.666 -9.494 -38.350 368 2HH1 ARG 47 2HH1 ARG 47 -3.174 -9.550 -39.982 369 1HH2 ARG 47 1HH2 ARG 47 -0.261 -11.420 -39.340 370 2HH2 ARG 47 2HH2 ARG 47 -1.167 -10.657 -40.568 371 H TYR 48 H TYR 48 -1.582 -13.467 -31.412 372 HA TYR 48 HA TYR 48 0.261 -15.635 -32.016 373 1HB TYR 48 1HB TYR 48 -1.781 -15.271 -29.799 374 2HB TYR 48 2HB TYR 48 -0.556 -16.524 -29.910 375 HD1 TYR 48 HD1 TYR 48 -1.116 -12.942 -29.208 376 HD2 TYR 48 HD2 TYR 48 1.723 -16.110 -29.226 377 HE1 TYR 48 HE1 TYR 48 0.404 -11.576 -27.874 378 HE2 TYR 48 HE2 TYR 48 3.264 -14.728 -27.889 379 HH TYR 48 HH TYR 48 2.196 -11.806 -26.408 380 H THR 49 H THR 49 -0.466 -16.857 -33.525 381 HA THR 49 HA THR 49 -3.317 -17.370 -33.668 382 HB THR 49 HB THR 49 -1.830 -15.941 -35.871 383 HG1 THR 49 HG1 THR 49 -3.014 -14.983 -33.813 384 1HG2 THR 49 1HG2 THR 49 -3.404 -17.572 -36.783 385 2HG2 THR 49 2HG2 THR 49 -3.971 -15.924 -37.069 386 3HG2 THR 49 3HG2 THR 49 -4.678 -16.893 -35.772 387 H ASP 50 H ASP 50 -3.720 -19.349 -34.545 388 HA ASP 50 HA ASP 50 -1.486 -20.514 -35.920 389 1HB ASP 50 1HB ASP 50 -1.473 -21.478 -33.720 390 2HB ASP 50 2HB ASP 50 -3.167 -21.931 -33.867 391 H GLY 51 H GLY 51 -4.995 -20.471 -35.548 392 1HA GLY 51 1HA GLY 51 -5.694 -20.578 -38.155 393 2HA GLY 51 2HA GLY 51 -5.396 -22.264 -37.789 394 H ILE 52 H ILE 52 -6.363 -21.708 -34.987 395 HA ILE 52 HA ILE 52 -9.101 -22.454 -35.449 396 HB ILE 52 HB ILE 52 -7.640 -21.847 -32.863 397 1HG1 ILE 52 1HG1 ILE 52 -6.505 -23.645 -34.056 398 2HG1 ILE 52 2HG1 ILE 52 -7.322 -24.289 -32.639 399 1HG2 ILE 52 1HG2 ILE 52 -9.362 -23.252 -31.781 400 2HG2 ILE 52 2HG2 ILE 52 -10.192 -23.390 -33.331 401 3HG2 ILE 52 3HG2 ILE 52 -10.049 -21.818 -32.545 402 1HD1 ILE 52 1HD1 ILE 52 -8.276 -24.484 -35.490 403 2HD1 ILE 52 2HD1 ILE 52 -9.133 -25.105 -34.081 404 3HD1 ILE 52 3HD1 ILE 52 -7.565 -25.782 -34.528 405 H TYR 53 H TYR 53 -7.346 -19.715 -34.182 406 HA TYR 53 HA TYR 53 -9.261 -17.790 -34.909 407 1HB TYR 53 1HB TYR 53 -9.358 -16.862 -32.530 408 2HB TYR 53 2HB TYR 53 -10.560 -18.020 -33.059 409 HD1 TYR 53 HD1 TYR 53 -7.158 -18.182 -31.479 410 HD2 TYR 53 HD2 TYR 53 -11.161 -19.555 -31.481 411 HE1 TYR 53 HE1 TYR 53 -6.670 -19.616 -29.528 412 HE2 TYR 53 HE2 TYR 53 -10.699 -20.967 -29.555 413 HH TYR 53 HH TYR 53 -8.787 -22.047 -28.502 414 H VAL 54 H VAL 54 -8.592 -15.661 -34.316 415 HA VAL 54 HA VAL 54 -5.683 -15.403 -34.557 416 HB VAL 54 HB VAL 54 -8.043 -13.658 -35.059 417 1HG1 VAL 54 1HG1 VAL 54 -6.046 -12.278 -34.465 418 2HG1 VAL 54 2HG1 VAL 54 -6.386 -12.080 -36.185 419 3HG1 VAL 54 3HG1 VAL 54 -5.078 -13.142 -35.662 420 1HG2 VAL 54 1HG2 VAL 54 -7.894 -15.387 -36.702 421 2HG2 VAL 54 2HG2 VAL 54 -6.194 -15.029 -37.012 422 3HG2 VAL 54 3HG2 VAL 54 -7.439 -13.867 -37.468 423 H PHE 55 H PHE 55 -4.878 -15.197 -32.440 424 HA PHE 55 HA PHE 55 -6.419 -13.587 -30.573 425 1HB PHE 55 1HB PHE 55 -5.577 -15.748 -29.746 426 2HB PHE 55 2HB PHE 55 -3.933 -15.265 -30.125 427 HD1 PHE 55 HD1 PHE 55 -2.689 -13.917 -28.620 428 HD2 PHE 55 HD2 PHE 55 -6.812 -14.626 -27.903 429 HE1 PHE 55 HE1 PHE 55 -2.450 -12.984 -26.361 430 HE2 PHE 55 HE2 PHE 55 -6.589 -13.687 -25.662 431 HZ PHE 55 HZ PHE 55 -4.404 -12.866 -24.878 432 H TRP 56 H TRP 56 -6.073 -11.513 -30.566 433 HA TRP 56 HA TRP 56 -3.514 -10.529 -31.449 434 1HB TRP 56 1HB TRP 56 -5.498 -9.939 -32.790 435 2HB TRP 56 2HB TRP 56 -6.195 -9.190 -31.347 436 HD1 TRP 56 HD1 TRP 56 -2.816 -8.837 -33.198 437 HE1 TRP 56 HE1 TRP 56 -2.306 -6.393 -33.480 438 HE3 TRP 56 HE3 TRP 56 -6.949 -6.932 -30.899 439 HZ2 TRP 56 HZ2 TRP 56 -3.498 -3.893 -32.813 440 HZ3 TRP 56 HZ3 TRP 56 -7.187 -4.489 -30.770 441 HH2 TRP 56 HH2 TRP 56 -5.499 -3.006 -31.699 442 H SER 57 H SER 57 -2.436 -9.761 -30.069 443 HA SER 57 HA SER 57 -3.446 -9.042 -27.396 444 1HB SER 57 1HB SER 57 -1.758 -10.881 -27.532 445 2HB SER 57 2HB SER 57 -0.635 -9.739 -28.263 446 HG SER 57 HG SER 57 -1.801 -9.464 -25.682 447 H LYS 58 H LYS 58 -3.695 -6.864 -27.206 448 HA LYS 58 HA LYS 58 -1.657 -5.248 -28.460 449 1HB LYS 58 1HB LYS 58 -3.938 -5.008 -29.468 450 2HB LYS 58 2HB LYS 58 -4.516 -4.443 -27.909 451 1HG LYS 58 1HG LYS 58 -4.102 -2.581 -29.402 452 2HG LYS 58 2HG LYS 58 -2.979 -2.543 -28.036 453 1HD LYS 58 1HD LYS 58 -1.283 -3.593 -29.381 454 2HD LYS 58 2HD LYS 58 -2.384 -3.689 -30.745 455 1HE LYS 58 1HE LYS 58 -0.906 -1.788 -31.059 456 2HE LYS 58 2HE LYS 58 -2.544 -1.222 -30.748 457 1HZ LYS 58 1HZ LYS 58 -0.920 0.056 -29.531 458 2HZ LYS 58 2HZ LYS 58 -0.362 -1.325 -28.740 459 3HZ LYS 58 3HZ LYS 58 -1.906 -0.767 -28.444 460 H GLY 59 H GLY 59 -0.592 -5.809 -26.424 461 1HA GLY 59 1HA GLY 59 0.343 -5.033 -24.499 462 2HA GLY 59 2HA GLY 59 -0.647 -3.596 -24.699 463 H ASP 60 H ASP 60 -2.783 -3.683 -23.935 464 HA ASP 60 HA ASP 60 -2.929 -5.235 -21.437 465 1HB ASP 60 1HB ASP 60 -4.146 -2.561 -22.118 466 2HB ASP 60 2HB ASP 60 -4.416 -3.427 -20.615 467 H GLU 61 H GLU 61 -4.349 -4.992 -24.496 468 HA GLU 61 HA GLU 61 -6.805 -6.139 -23.420 469 1HB GLU 61 1HB GLU 61 -8.029 -5.134 -25.265 470 2HB GLU 61 2HB GLU 61 -7.238 -3.886 -24.318 471 1HG GLU 61 1HG GLU 61 -5.431 -3.837 -25.974 472 2HG GLU 61 2HG GLU 61 -6.336 -5.005 -26.938 473 H ALA 62 H ALA 62 -7.661 -7.801 -24.600 474 HA ALA 62 HA ALA 62 -5.968 -8.754 -26.688 475 1HB ALA 62 1HB ALA 62 -5.299 -9.978 -24.715 476 2HB ALA 62 2HB ALA 62 -6.164 -11.066 -25.802 477 3HB ALA 62 3HB ALA 62 -6.968 -10.422 -24.375 478 H THR 63 H THR 63 -7.124 -9.350 -28.329 479 HA THR 63 HA THR 63 -9.970 -10.010 -28.053 480 HB THR 63 HB THR 63 -8.725 -8.190 -30.142 481 HG1 THR 63 HG1 THR 63 -9.674 -7.757 -27.729 482 1HG2 THR 63 1HG2 THR 63 -10.557 -9.565 -31.090 483 2HG2 THR 63 2HG2 THR 63 -11.023 -7.869 -30.979 484 3HG2 THR 63 3HG2 THR 63 -11.628 -9.028 -29.796 485 H VAL 64 H VAL 64 -10.573 -11.801 -29.236 486 HA VAL 64 HA VAL 64 -8.641 -12.728 -31.157 487 HB VAL 64 HB VAL 64 -7.972 -13.954 -29.274 488 1HG1 VAL 64 1HG1 VAL 64 -9.455 -15.292 -27.877 489 2HG1 VAL 64 2HG1 VAL 64 -10.835 -14.635 -28.772 490 3HG1 VAL 64 3HG1 VAL 64 -9.787 -13.559 -27.837 491 1HG2 VAL 64 1HG2 VAL 64 -8.118 -15.327 -31.243 492 2HG2 VAL 64 2HG2 VAL 64 -9.788 -15.743 -30.838 493 3HG2 VAL 64 3HG2 VAL 64 -8.469 -16.286 -29.803 494 H TYR 65 H TYR 65 -9.584 -12.534 -32.891 495 HA TYR 65 HA TYR 65 -12.467 -13.136 -33.217 496 1HB TYR 65 1HB TYR 65 -11.791 -10.776 -33.158 497 2HB TYR 65 2HB TYR 65 -10.677 -11.123 -34.476 498 HD1 TYR 65 HD1 TYR 65 -13.726 -9.672 -33.683 499 HD2 TYR 65 HD2 TYR 65 -11.976 -12.114 -36.687 500 HE1 TYR 65 HE1 TYR 65 -15.431 -8.928 -35.281 501 HE2 TYR 65 HE2 TYR 65 -13.685 -11.379 -38.289 502 HH TYR 65 HH TYR 65 -15.738 -8.738 -37.673 503 H LYS 66 H LYS 66 -12.202 -15.240 -34.216 504 HA LYS 66 HA LYS 66 -11.071 -15.135 -36.832 505 1HB LYS 66 1HB LYS 66 -10.855 -16.988 -34.969 506 2HB LYS 66 2HB LYS 66 -12.491 -17.345 -35.412 507 1HG LYS 66 1HG LYS 66 -10.956 -18.836 -36.561 508 2HG LYS 66 2HG LYS 66 -11.878 -17.826 -37.682 509 1HD LYS 66 1HD LYS 66 -9.988 -16.417 -38.090 510 2HD LYS 66 2HD LYS 66 -9.085 -17.133 -36.763 511 1HE LYS 66 1HE LYS 66 -8.297 -17.907 -38.950 512 2HE LYS 66 2HE LYS 66 -8.926 -19.228 -37.968 513 1HZ LYS 66 1HZ LYS 66 -9.611 -19.347 -40.268 514 2HZ LYS 66 2HZ LYS 66 -10.397 -17.866 -40.155 515 3HZ LYS 66 3HZ LYS 66 -10.935 -19.186 -39.254 516 H ARG 67 H ARG 67 -12.644 -15.402 -38.409 517 HA ARG 67 HA ARG 67 -15.318 -14.443 -37.936 518 1HB ARG 67 1HB ARG 67 -14.018 -15.696 -40.311 519 2HB ARG 67 2HB ARG 67 -15.748 -15.412 -40.277 520 1HG ARG 67 1HG ARG 67 -15.412 -13.078 -40.014 521 2HG ARG 67 2HG ARG 67 -13.661 -13.310 -39.875 522 1HD ARG 67 1HD ARG 67 -13.469 -14.052 -42.020 523 2HD ARG 67 2HD ARG 67 -15.196 -14.331 -42.189 524 HE ARG 67 HE ARG 67 -15.219 -11.738 -41.774 525 1HH1 ARG 67 1HH1 ARG 67 -12.936 -13.456 -43.856 526 2HH1 ARG 67 2HH1 ARG 67 -12.885 -12.251 -45.036 527 1HH2 ARG 67 1HH2 ARG 67 -15.178 -10.088 -43.382 528 2HH2 ARG 67 2HH2 ARG 67 -14.225 -10.247 -44.770 529 H ASP 68 H ASP 68 -13.856 -17.378 -38.040 530 HA ASP 68 HA ASP 68 -16.009 -19.176 -38.100 531 1HB ASP 68 1HB ASP 68 -13.668 -19.964 -38.180 532 2HB ASP 68 2HB ASP 68 -13.467 -19.499 -36.498 533 H ARG 69 H ARG 69 -14.601 -17.373 -35.480 534 HA ARG 69 HA ARG 69 -16.754 -16.482 -34.449 535 1HB ARG 69 1HB ARG 69 -17.488 -18.859 -33.835 536 2HB ARG 69 2HB ARG 69 -16.164 -18.879 -32.673 537 1HG ARG 69 1HG ARG 69 -17.128 -16.983 -31.500 538 2HG ARG 69 2HG ARG 69 -18.431 -16.896 -32.675 539 1HD ARG 69 1HD ARG 69 -19.252 -17.966 -30.715 540 2HD ARG 69 2HD ARG 69 -19.120 -19.178 -31.979 541 HE ARG 69 HE ARG 69 -17.142 -19.999 -30.899 542 1HH1 ARG 69 1HH1 ARG 69 -19.065 -17.727 -28.916 543 2HH1 ARG 69 2HH1 ARG 69 -18.626 -18.428 -27.447 544 1HH2 ARG 69 1HH2 ARG 69 -16.560 -20.954 -28.820 545 2HH2 ARG 69 2HH2 ARG 69 -17.215 -20.289 -27.376 546 H ILE 70 H ILE 70 -16.178 -14.988 -33.112 547 HA ILE 70 HA ILE 70 -13.574 -14.615 -31.929 548 HB ILE 70 HB ILE 70 -16.194 -13.478 -31.057 549 1HG1 ILE 70 1HG1 ILE 70 -14.368 -12.279 -33.090 550 2HG1 ILE 70 2HG1 ILE 70 -15.854 -13.133 -33.506 551 1HG2 ILE 70 1HG2 ILE 70 -14.392 -13.005 -29.521 552 2HG2 ILE 70 2HG2 ILE 70 -14.819 -11.518 -30.382 553 3HG2 ILE 70 3HG2 ILE 70 -13.378 -12.417 -30.843 554 1HD1 ILE 70 1HD1 ILE 70 -17.131 -11.444 -32.244 555 2HD1 ILE 70 2HD1 ILE 70 -16.182 -10.725 -33.548 556 3HD1 ILE 70 3HD1 ILE 70 -15.624 -10.604 -31.882 557 H VAL 71 H VAL 71 -13.010 -15.213 -30.002 558 HA VAL 71 HA VAL 71 -15.077 -16.635 -28.468 559 HB VAL 71 HB VAL 71 -13.521 -18.223 -27.545 560 1HG1 VAL 71 1HG1 VAL 71 -14.428 -18.793 -29.701 561 2HG1 VAL 71 2HG1 VAL 71 -12.771 -19.398 -29.585 562 3HG1 VAL 71 3HG1 VAL 71 -13.117 -17.941 -30.515 563 1HG2 VAL 71 1HG2 VAL 71 -11.301 -16.888 -29.101 564 2HG2 VAL 71 2HG2 VAL 71 -11.154 -18.297 -28.027 565 3HG2 VAL 71 3HG2 VAL 71 -11.546 -16.713 -27.363 566 H LEU 72 H LEU 72 -13.124 -14.049 -28.478 567 HA LEU 72 HA LEU 72 -13.826 -13.308 -25.802 568 1HB LEU 72 1HB LEU 72 -11.084 -14.159 -26.479 569 2HB LEU 72 2HB LEU 72 -11.206 -12.696 -25.516 570 HG LEU 72 HG LEU 72 -12.598 -15.217 -24.669 571 1HD1 LEU 72 1HD1 LEU 72 -10.216 -15.754 -25.109 572 2HD1 LEU 72 2HD1 LEU 72 -10.593 -15.757 -23.385 573 3HD1 LEU 72 3HD1 LEU 72 -9.766 -14.372 -24.109 574 1HD2 LEU 72 1HD2 LEU 72 -11.329 -12.995 -23.113 575 2HD2 LEU 72 2HD2 LEU 72 -12.500 -14.190 -22.529 576 3HD2 LEU 72 3HD2 LEU 72 -12.985 -12.928 -23.670 577 H ASN 73 H ASN 73 -14.479 -11.149 -26.324 578 HA ASN 73 HA ASN 73 -12.665 -9.720 -28.143 579 1HB ASN 73 1HB ASN 73 -14.451 -8.404 -29.027 580 2HB ASN 73 2HB ASN 73 -14.919 -10.096 -29.083 581 1HD2 ASN 73 1HD2 ASN 73 -16.631 -10.824 -27.768 582 2HD2 ASN 73 2HD2 ASN 73 -17.649 -9.741 -26.903 583 H ASN 74 H ASN 74 -13.077 -9.919 -25.167 584 HA ASN 74 HA ASN 74 -12.167 -7.335 -24.608 585 1HB ASN 74 1HB ASN 74 -14.717 -6.969 -24.669 586 2HB ASN 74 2HB ASN 74 -14.786 -7.962 -23.216 587 1HD2 ASN 74 1HD2 ASN 74 -14.190 -7.033 -21.234 588 2HD2 ASN 74 2HD2 ASN 74 -13.691 -5.388 -21.117 589 H CYS 75 H CYS 75 -10.574 -8.373 -23.963 590 HA CYS 75 HA CYS 75 -10.727 -9.727 -21.386 591 1HB CYS 75 1HB CYS 75 -10.276 -11.199 -23.534 592 2HB CYS 75 2HB CYS 75 -8.740 -10.332 -23.515 593 H GLN 76 H GLN 76 -8.860 -9.021 -20.082 594 HA GLN 76 HA GLN 76 -7.456 -6.807 -21.213 595 1HB GLN 76 1HB GLN 76 -9.325 -6.545 -18.861 596 2HB GLN 76 2HB GLN 76 -8.154 -5.336 -19.360 597 1HG GLN 76 1HG GLN 76 -9.219 -5.022 -21.419 598 2HG GLN 76 2HG GLN 76 -10.336 -6.352 -21.145 599 1HE2 GLN 76 1HE2 GLN 76 -11.891 -6.109 -19.535 600 2HE2 GLN 76 2HE2 GLN 76 -12.451 -4.559 -19.008 601 H LEU 77 H LEU 77 -5.674 -7.013 -20.633 602 HA LEU 77 HA LEU 77 -5.107 -9.010 -18.747 603 1HB LEU 77 1HB LEU 77 -4.050 -9.297 -20.765 604 2HB LEU 77 2HB LEU 77 -3.524 -7.633 -20.858 605 HG LEU 77 HG LEU 77 -1.734 -8.090 -19.245 606 1HD1 LEU 77 1HD1 LEU 77 -3.187 -10.622 -18.956 607 2HD1 LEU 77 2HD1 LEU 77 -2.550 -9.536 -17.717 608 3HD1 LEU 77 3HD1 LEU 77 -1.445 -10.551 -18.655 609 1HD2 LEU 77 1HD2 LEU 77 -0.519 -9.817 -20.601 610 2HD2 LEU 77 2HD2 LEU 77 -1.196 -8.488 -21.519 611 3HD2 LEU 77 3HD2 LEU 77 -2.004 -10.045 -21.531 612 H GLN 78 H GLN 78 -4.054 -8.469 -16.648 613 HA GLN 78 HA GLN 78 -3.582 -5.649 -16.306 614 1HB GLN 78 1HB GLN 78 -2.952 -6.204 -13.934 615 2HB GLN 78 2HB GLN 78 -4.587 -6.629 -14.396 616 1HG GLN 78 1HG GLN 78 -3.971 -8.928 -14.603 617 2HG GLN 78 2HG GLN 78 -2.282 -8.533 -14.270 618 1HE2 GLN 78 1HE2 GLN 78 -5.469 -8.690 -12.919 619 2HE2 GLN 78 2HE2 GLN 78 -4.961 -8.734 -11.261 620 H ASN 79 H ASN 79 -1.466 -8.548 -15.973 621 HA ASN 79 HA ASN 79 0.656 -7.306 -17.288 622 1HB ASN 79 1HB ASN 79 0.842 -6.142 -15.059 623 2HB ASN 79 2HB ASN 79 0.966 -7.723 -14.296 624 1HD2 ASN 79 1HD2 ASN 79 2.922 -8.875 -14.450 625 2HD2 ASN 79 2HD2 ASN 79 4.338 -8.131 -15.110 626 HA PRO 80 HA PRO 80 0.351 -11.656 -17.554 627 1HB PRO 80 1HB PRO 80 2.226 -12.082 -19.496 628 2HB PRO 80 2HB PRO 80 0.585 -11.517 -19.805 629 1HG PRO 80 1HG PRO 80 3.110 -9.945 -19.553 630 2HG PRO 80 2HG PRO 80 1.808 -9.790 -20.746 631 1HD PRO 80 1HD PRO 80 1.964 -8.107 -18.663 632 2HD PRO 80 2HD PRO 80 0.411 -8.724 -19.305 633 H GLN 81 H GLN 81 3.492 -10.121 -16.881 634 HA GLN 81 HA GLN 81 4.734 -12.561 -16.367 635 1HB GLN 81 1HB GLN 81 5.914 -10.514 -16.997 636 2HB GLN 81 2HB GLN 81 5.469 -9.837 -15.417 637 1HG GLN 81 1HG GLN 81 6.626 -11.622 -14.331 638 2HG GLN 81 2HG GLN 81 7.090 -12.279 -15.908 639 1HE2 GLN 81 1HE2 GLN 81 8.639 -11.206 -17.111 640 2HE2 GLN 81 2HE2 GLN 81 9.700 -10.015 -16.471 641 H ARG 82 H ARG 82 3.519 -13.549 -15.098 642 HA ARG 82 HA ARG 82 2.510 -13.140 -12.551 643 1HB ARG 82 1HB ARG 82 4.078 -15.594 -13.378 644 2HB ARG 82 2HB ARG 82 2.978 -15.502 -12.013 645 1HG ARG 82 1HG ARG 82 1.118 -15.130 -13.524 646 2HG ARG 82 2HG ARG 82 2.219 -15.162 -14.901 647 1HD ARG 82 1HD ARG 82 1.138 -17.314 -14.714 648 2HD ARG 82 2HD ARG 82 2.836 -17.484 -14.305 649 HE ARG 82 HE ARG 82 1.589 -17.111 -11.912 650 1HH1 ARG 82 1HH1 ARG 82 1.301 -19.473 -14.576 651 2HH1 ARG 82 2HH1 ARG 82 0.668 -20.694 -13.618 652 1HH2 ARG 82 1HH2 ARG 82 0.713 -18.901 -10.562 653 2HH2 ARG 82 2HH2 ARG 82 0.341 -20.382 -11.328 Start of MODEL 18 1 H MET 1 H MET 1 7.162 -19.595 -12.039 2 HA MET 1 HA MET 1 7.163 -21.557 -13.295 3 1HB MET 1 1HB MET 1 4.666 -20.376 -14.513 4 2HB MET 1 2HB MET 1 5.586 -21.618 -15.339 5 1HG MET 1 1HG MET 1 5.230 -23.112 -13.418 6 2HG MET 1 2HG MET 1 4.243 -21.885 -12.645 7 1HE MET 1 1HE MET 1 3.141 -24.197 -16.491 8 2HE MET 1 2HE MET 1 4.569 -24.503 -15.505 9 3HE MET 1 3HE MET 1 4.457 -23.025 -16.465 10 H GLN 2 H GLN 2 7.247 -21.375 -16.028 11 HA GLN 2 HA GLN 2 8.994 -19.062 -16.430 12 1HB GLN 2 1HB GLN 2 8.891 -21.735 -17.833 13 2HB GLN 2 2HB GLN 2 9.964 -20.415 -18.275 14 1HG GLN 2 1HG GLN 2 10.906 -20.521 -15.972 15 2HG GLN 2 2HG GLN 2 9.932 -21.964 -15.717 16 1HE2 GLN 2 1HE2 GLN 2 12.550 -20.591 -17.457 17 2HE2 GLN 2 2HE2 GLN 2 13.287 -22.067 -17.964 18 H THR 3 H THR 3 6.139 -18.974 -16.615 19 HA THR 3 HA THR 3 5.949 -18.007 -19.326 20 HB THR 3 HB THR 3 3.439 -19.043 -18.871 21 HG1 THR 3 HG1 THR 3 5.255 -21.165 -18.448 22 1HG2 THR 3 1HG2 THR 3 4.044 -20.561 -20.726 23 2HG2 THR 3 2HG2 THR 3 5.742 -20.069 -20.501 24 3HG2 THR 3 3HG2 THR 3 4.513 -18.869 -20.939 25 H ASP 4 H ASP 4 4.636 -16.297 -19.563 26 HA ASP 4 HA ASP 4 3.655 -15.193 -17.084 27 1HB ASP 4 1HB ASP 4 3.896 -13.912 -19.834 28 2HB ASP 4 2HB ASP 4 3.192 -13.097 -18.446 29 H THR 5 H THR 5 1.357 -13.992 -17.398 30 HA THR 5 HA THR 5 -0.327 -15.476 -19.201 31 HB THR 5 HB THR 5 -0.304 -17.041 -17.343 32 HG1 THR 5 HG1 THR 5 -2.707 -15.720 -16.863 33 1HG2 THR 5 1HG2 THR 5 0.415 -15.521 -15.541 34 2HG2 THR 5 2HG2 THR 5 -1.040 -16.398 -15.070 35 3HG2 THR 5 3HG2 THR 5 -1.153 -14.717 -15.590 36 H LEU 6 H LEU 6 -2.499 -14.538 -19.376 37 HA LEU 6 HA LEU 6 -2.451 -11.847 -18.834 38 1HB LEU 6 1HB LEU 6 -4.159 -13.755 -20.264 39 2HB LEU 6 2HB LEU 6 -4.964 -12.298 -19.716 40 HG LEU 6 HG LEU 6 -3.133 -11.054 -20.673 41 1HD1 LEU 6 1HD1 LEU 6 -1.873 -11.956 -22.596 42 2HD1 LEU 6 2HD1 LEU 6 -2.240 -13.570 -21.954 43 3HD1 LEU 6 3HD1 LEU 6 -1.375 -12.371 -20.972 44 1HD2 LEU 6 1HD2 LEU 6 -5.244 -11.013 -21.766 45 2HD2 LEU 6 2HD2 LEU 6 -4.894 -12.531 -22.601 46 3HD2 LEU 6 3HD2 LEU 6 -3.986 -11.068 -22.998 47 H GLU 7 H GLU 7 -5.313 -11.482 -18.157 48 HA GLU 7 HA GLU 7 -4.719 -11.137 -15.479 49 1HB GLU 7 1HB GLU 7 -6.048 -9.569 -16.798 50 2HB GLU 7 2HB GLU 7 -7.346 -10.759 -16.911 51 1HG GLU 7 1HG GLU 7 -7.559 -10.782 -14.523 52 2HG GLU 7 2HG GLU 7 -6.246 -9.616 -14.378 53 H TYR 8 H TYR 8 -5.997 -13.651 -17.409 54 HA TYR 8 HA TYR 8 -7.253 -15.173 -17.425 55 1HB TYR 8 1HB TYR 8 -7.115 -16.937 -15.600 56 2HB TYR 8 2HB TYR 8 -5.646 -16.406 -16.380 57 HD1 TYR 8 HD1 TYR 8 -7.630 -16.111 -13.253 58 HD2 TYR 8 HD2 TYR 8 -3.845 -15.531 -15.107 59 HE1 TYR 8 HE1 TYR 8 -6.613 -15.722 -11.053 60 HE2 TYR 8 HE2 TYR 8 -2.819 -15.135 -12.913 61 HH TYR 8 HH TYR 8 -3.469 -14.445 -10.659 62 H GLN 9 H GLN 9 -8.563 -12.907 -16.657 63 HA GLN 9 HA GLN 9 -11.042 -13.938 -15.838 64 1HB GLN 9 1HB GLN 9 -9.606 -11.759 -14.298 65 2HB GLN 9 2HB GLN 9 -11.343 -12.008 -14.243 66 1HG GLN 9 1HG GLN 9 -10.964 -14.247 -13.410 67 2HG GLN 9 2HG GLN 9 -9.227 -13.935 -13.354 68 1HE2 GLN 9 1HE2 GLN 9 -8.430 -12.435 -11.830 69 2HE2 GLN 9 2HE2 GLN 9 -9.364 -11.944 -10.468 70 H CYS 10 H CYS 10 -12.058 -13.255 -17.394 71 HA CYS 10 HA CYS 10 -11.564 -10.543 -18.394 72 1HB CYS 10 1HB CYS 10 -12.046 -13.079 -19.871 73 2HB CYS 10 2HB CYS 10 -12.208 -11.502 -20.678 74 H ASP 11 H ASP 11 -13.521 -9.754 -19.600 75 HA ASP 11 HA ASP 11 -15.762 -10.002 -17.875 76 1HB ASP 11 1HB ASP 11 -15.314 -7.908 -18.979 77 2HB ASP 11 2HB ASP 11 -15.421 -8.663 -20.558 78 H GLU 12 H GLU 12 -14.830 -11.558 -20.810 79 HA GLU 12 HA GLU 12 -17.517 -12.480 -21.245 80 1HB GLU 12 1HB GLU 12 -16.341 -11.463 -23.101 81 2HB GLU 12 2HB GLU 12 -15.043 -12.622 -22.940 82 1HG GLU 12 1HG GLU 12 -16.238 -14.297 -23.928 83 2HG GLU 12 2HG GLU 12 -17.796 -13.607 -23.477 84 H LYS 13 H LYS 13 -14.344 -13.772 -20.395 85 HA LYS 13 HA LYS 13 -15.453 -16.289 -19.548 86 1HB LYS 13 1HB LYS 13 -13.231 -16.485 -21.586 87 2HB LYS 13 2HB LYS 13 -14.325 -17.734 -21.039 88 1HG LYS 13 1HG LYS 13 -16.132 -16.467 -22.342 89 2HG LYS 13 2HG LYS 13 -14.797 -15.540 -23.006 90 1HD LYS 13 1HD LYS 13 -15.323 -17.332 -24.558 91 2HD LYS 13 2HD LYS 13 -13.757 -17.647 -23.820 92 1HE LYS 13 1HE LYS 13 -14.767 -19.261 -22.306 93 2HE LYS 13 2HE LYS 13 -16.365 -18.893 -22.955 94 1HZ LYS 13 1HZ LYS 13 -15.554 -19.719 -25.126 95 2HZ LYS 13 2HZ LYS 13 -15.579 -20.875 -23.923 96 3HZ LYS 13 3HZ LYS 13 -14.106 -20.199 -24.379 97 HA PRO 14 HA PRO 14 -11.503 -15.657 -17.474 98 1HB PRO 14 1HB PRO 14 -10.984 -18.523 -17.120 99 2HB PRO 14 2HB PRO 14 -11.412 -17.335 -15.887 100 1HG PRO 14 1HG PRO 14 -13.102 -19.326 -16.693 101 2HG PRO 14 2HG PRO 14 -13.662 -17.768 -16.065 102 1HD PRO 14 1HD PRO 14 -13.457 -18.707 -18.902 103 2HD PRO 14 2HD PRO 14 -14.735 -17.747 -18.121 104 H LEU 15 H LEU 15 -9.151 -15.766 -18.096 105 HA LEU 15 HA LEU 15 -8.634 -17.340 -20.488 106 1HB LEU 15 1HB LEU 15 -9.408 -15.166 -21.279 107 2HB LEU 15 2HB LEU 15 -8.196 -14.417 -20.243 108 HG LEU 15 HG LEU 15 -6.420 -15.462 -21.508 109 1HD1 LEU 15 1HD1 LEU 15 -7.547 -17.416 -22.381 110 2HD1 LEU 15 2HD1 LEU 15 -6.896 -16.473 -23.723 111 3HD1 LEU 15 3HD1 LEU 15 -8.618 -16.407 -23.351 112 1HD2 LEU 15 1HD2 LEU 15 -7.112 -13.209 -22.075 113 2HD2 LEU 15 2HD2 LEU 15 -8.278 -13.839 -23.240 114 3HD2 LEU 15 3HD2 LEU 15 -6.549 -14.068 -23.501 115 H THR 16 H THR 16 -7.164 -18.533 -19.281 116 HA THR 16 HA THR 16 -4.962 -17.038 -18.225 117 HB THR 16 HB THR 16 -5.086 -20.063 -18.320 118 HG1 THR 16 HG1 THR 16 -6.287 -19.891 -16.312 119 1HG2 THR 16 1HG2 THR 16 -4.079 -18.034 -16.340 120 2HG2 THR 16 2HG2 THR 16 -3.075 -18.964 -17.454 121 3HG2 THR 16 3HG2 THR 16 -3.935 -19.785 -16.137 122 H VAL 17 H VAL 17 -2.923 -17.103 -19.236 123 HA VAL 17 HA VAL 17 -2.841 -18.361 -21.895 124 HB VAL 17 HB VAL 17 -1.950 -15.530 -21.216 125 1HG1 VAL 17 1HG1 VAL 17 -0.379 -16.512 -22.851 126 2HG1 VAL 17 2HG1 VAL 17 -1.380 -15.293 -23.623 127 3HG1 VAL 17 3HG1 VAL 17 -1.743 -17.001 -23.849 128 1HG2 VAL 17 1HG2 VAL 17 -4.160 -16.513 -23.015 129 2HG2 VAL 17 2HG2 VAL 17 -3.647 -14.835 -22.874 130 3HG2 VAL 17 3HG2 VAL 17 -4.341 -15.669 -21.480 131 H LYS 18 H LYS 18 -0.798 -19.026 -22.508 132 HA LYS 18 HA LYS 18 1.201 -18.838 -20.431 133 1HB LYS 18 1HB LYS 18 0.828 -20.828 -22.667 134 2HB LYS 18 2HB LYS 18 2.344 -20.682 -21.822 135 1HG LYS 18 1HG LYS 18 1.075 -22.559 -20.932 136 2HG LYS 18 2HG LYS 18 1.244 -21.302 -19.711 137 1HD LYS 18 1HD LYS 18 -1.045 -20.567 -20.148 138 2HD LYS 18 2HD LYS 18 -1.204 -21.787 -21.410 139 1HE LYS 18 1HE LYS 18 -2.273 -22.513 -19.346 140 2HE LYS 18 2HE LYS 18 -0.914 -23.551 -19.760 141 1HZ LYS 18 1HZ LYS 18 0.427 -22.436 -18.099 142 2HZ LYS 18 2HZ LYS 18 -0.983 -23.021 -17.398 143 3HZ LYS 18 3HZ LYS 18 -0.829 -21.387 -17.687 144 H LEU 19 H LEU 19 1.735 -16.807 -20.931 145 HA LEU 19 HA LEU 19 2.620 -16.127 -23.565 146 1HB LEU 19 1HB LEU 19 2.476 -14.742 -20.963 147 2HB LEU 19 2HB LEU 19 3.670 -14.173 -22.118 148 HG LEU 19 HG LEU 19 0.702 -14.351 -22.699 149 1HD1 LEU 19 1HD1 LEU 19 1.200 -12.764 -20.895 150 2HD1 LEU 19 2HD1 LEU 19 0.716 -11.935 -22.377 151 3HD1 LEU 19 3HD1 LEU 19 2.419 -11.999 -21.913 152 1HD2 LEU 19 1HD2 LEU 19 2.242 -14.416 -24.656 153 2HD2 LEU 19 2HD2 LEU 19 2.952 -12.906 -24.100 154 3HD2 LEU 19 3HD2 LEU 19 1.262 -12.952 -24.593 155 H ASN 20 H ASN 20 4.172 -17.112 -24.186 156 HA ASN 20 HA ASN 20 6.221 -18.151 -22.502 157 1HB ASN 20 1HB ASN 20 5.378 -18.983 -24.833 158 2HB ASN 20 2HB ASN 20 6.486 -17.761 -25.457 159 1HD2 ASN 20 1HD2 ASN 20 6.496 -20.767 -25.681 160 2HD2 ASN 20 2HD2 ASN 20 8.047 -21.212 -25.087 161 H ASN 21 H ASN 21 8.437 -17.420 -22.390 162 HA ASN 21 HA ASN 21 8.737 -14.743 -21.930 163 1HB ASN 21 1HB ASN 21 10.919 -16.785 -22.376 164 2HB ASN 21 2HB ASN 21 11.221 -15.123 -21.892 165 1HD2 ASN 21 1HD2 ASN 21 12.089 -15.681 -19.948 166 2HD2 ASN 21 2HD2 ASN 21 11.150 -16.327 -18.646 167 HA PRO 22 HA PRO 22 11.032 -13.936 -26.150 168 1HB PRO 22 1HB PRO 22 9.836 -16.048 -27.854 169 2HB PRO 22 2HB PRO 22 11.497 -15.458 -27.819 170 1HG PRO 22 1HG PRO 22 10.912 -17.843 -26.845 171 2HG PRO 22 2HG PRO 22 12.074 -16.790 -26.014 172 1HD PRO 22 1HD PRO 22 9.203 -17.320 -25.362 173 2HD PRO 22 2HD PRO 22 10.607 -17.235 -24.280 174 H ARG 23 H ARG 23 7.854 -14.965 -25.547 175 HA ARG 23 HA ARG 23 5.806 -14.495 -26.241 176 1HB ARG 23 1HB ARG 23 7.127 -11.855 -26.547 177 2HB ARG 23 2HB ARG 23 5.420 -12.070 -26.921 178 1HG ARG 23 1HG ARG 23 5.134 -13.048 -24.682 179 2HG ARG 23 2HG ARG 23 6.789 -12.585 -24.319 180 1HD ARG 23 1HD ARG 23 5.163 -10.858 -23.534 181 2HD ARG 23 2HD ARG 23 6.288 -10.242 -24.750 182 HE ARG 23 HE ARG 23 3.956 -11.225 -25.992 183 1HH1 ARG 23 1HH1 ARG 23 5.047 -8.408 -24.106 184 2HH1 ARG 23 2HH1 ARG 23 3.941 -7.352 -24.868 185 1HH2 ARG 23 1HH2 ARG 23 2.486 -9.779 -26.964 186 2HH2 ARG 23 2HH2 ARG 23 2.416 -8.144 -26.477 187 H GLN 24 H GLN 24 7.112 -15.806 -27.989 188 HA GLN 24 HA GLN 24 6.070 -14.792 -30.441 189 1HB GLN 24 1HB GLN 24 8.145 -16.919 -29.948 190 2HB GLN 24 2HB GLN 24 7.493 -16.561 -31.542 191 1HG GLN 24 1HG GLN 24 8.350 -14.299 -31.419 192 2HG GLN 24 2HG GLN 24 8.946 -14.595 -29.787 193 1HE2 GLN 24 1HE2 GLN 24 9.354 -15.317 -33.133 194 2HE2 GLN 24 2HE2 GLN 24 10.958 -15.927 -33.030 195 H GLU 25 H GLU 25 5.097 -16.508 -27.940 196 HA GLU 25 HA GLU 25 3.300 -18.212 -29.404 197 1HB GLU 25 1HB GLU 25 5.245 -19.655 -29.184 198 2HB GLU 25 2HB GLU 25 5.317 -19.316 -27.455 199 1HG GLU 25 1HG GLU 25 3.079 -20.388 -27.235 200 2HG GLU 25 2HG GLU 25 3.196 -20.856 -28.930 201 H VAL 26 H VAL 26 1.515 -18.504 -28.334 202 HA VAL 26 HA VAL 26 1.240 -18.090 -25.387 203 HB VAL 26 HB VAL 26 -0.952 -17.158 -25.709 204 1HG1 VAL 26 1HG1 VAL 26 -0.403 -14.900 -26.552 205 2HG1 VAL 26 2HG1 VAL 26 1.128 -15.538 -27.162 206 3HG1 VAL 26 3HG1 VAL 26 0.786 -15.549 -25.429 207 1HG2 VAL 26 1HG2 VAL 26 -1.744 -16.327 -27.916 208 2HG2 VAL 26 2HG2 VAL 26 -1.601 -18.082 -27.810 209 3HG2 VAL 26 3HG2 VAL 26 -0.364 -17.153 -28.654 210 H SER 27 H SER 27 -0.124 -19.372 -24.454 211 HA SER 27 HA SER 27 -1.633 -21.208 -26.125 212 1HB SER 27 1HB SER 27 -0.296 -22.081 -23.542 213 2HB SER 27 2HB SER 27 -1.101 -23.046 -24.768 214 HG SER 27 HG SER 27 0.680 -21.870 -26.131 215 H PHE 28 H PHE 28 -3.698 -20.991 -25.589 216 HA PHE 28 HA PHE 28 -4.236 -20.020 -22.905 217 1HB PHE 28 1HB PHE 28 -5.797 -18.340 -23.608 218 2HB PHE 28 2HB PHE 28 -4.273 -18.070 -24.430 219 HD1 PHE 28 HD1 PHE 28 -4.144 -18.120 -26.809 220 HD2 PHE 28 HD2 PHE 28 -7.752 -19.226 -24.851 221 HE1 PHE 28 HE1 PHE 28 -5.355 -18.007 -28.946 222 HE2 PHE 28 HE2 PHE 28 -8.955 -19.123 -26.988 223 HZ PHE 28 HZ PHE 28 -7.750 -18.508 -29.038 224 H VAL 29 H VAL 29 -6.452 -20.125 -22.376 225 HA VAL 29 HA VAL 29 -7.428 -22.713 -23.163 226 HB VAL 29 HB VAL 29 -6.931 -22.383 -20.774 227 1HG1 VAL 29 1HG1 VAL 29 -8.360 -21.062 -19.311 228 2HG1 VAL 29 2HG1 VAL 29 -9.137 -20.356 -20.730 229 3HG1 VAL 29 3HG1 VAL 29 -7.416 -20.087 -20.435 230 1HG2 VAL 29 1HG2 VAL 29 -9.039 -23.293 -19.854 231 2HG2 VAL 29 2HG2 VAL 29 -8.471 -24.077 -21.321 232 3HG2 VAL 29 3HG2 VAL 29 -9.824 -22.936 -21.403 233 H TYR 30 H TYR 30 -8.739 -22.745 -24.546 234 HA TYR 30 HA TYR 30 -10.399 -20.667 -25.605 235 1HB TYR 30 1HB TYR 30 -9.816 -22.217 -27.185 236 2HB TYR 30 2HB TYR 30 -10.002 -23.577 -26.098 237 HD1 TYR 30 HD1 TYR 30 -11.753 -25.000 -26.470 238 HD2 TYR 30 HD2 TYR 30 -12.086 -21.010 -27.881 239 HE1 TYR 30 HE1 TYR 30 -13.845 -25.587 -27.582 240 HE2 TYR 30 HE2 TYR 30 -14.215 -21.607 -29.008 241 HH TYR 30 HH TYR 30 -15.889 -24.401 -28.366 242 H ASP 31 H ASP 31 -11.014 -23.413 -23.609 243 HA ASP 31 HA ASP 31 -13.215 -22.127 -22.410 244 1HB ASP 31 1HB ASP 31 -14.348 -22.906 -24.392 245 2HB ASP 31 2HB ASP 31 -13.740 -24.535 -24.156 246 H ASN 32 H ASN 32 -12.238 -25.501 -23.038 247 HA ASN 32 HA ASN 32 -11.109 -25.607 -20.367 248 1HB ASN 32 1HB ASN 32 -13.548 -26.398 -20.264 249 2HB ASN 32 2HB ASN 32 -13.069 -27.731 -21.308 250 1HD2 ASN 32 1HD2 ASN 32 -13.588 -29.272 -19.697 251 2HD2 ASN 32 2HD2 ASN 32 -12.593 -29.480 -18.310 252 H GLN 33 H GLN 33 -9.843 -25.409 -22.890 253 HA GLN 33 HA GLN 33 -8.198 -27.701 -22.845 254 1HB GLN 33 1HB GLN 33 -8.432 -28.282 -25.176 255 2HB GLN 33 2HB GLN 33 -10.039 -28.382 -24.470 256 1HG GLN 33 1HG GLN 33 -10.566 -26.206 -25.356 257 2HG GLN 33 2HG GLN 33 -8.937 -26.100 -26.027 258 1HE2 GLN 33 1HE2 GLN 33 -12.029 -27.614 -26.316 259 2HE2 GLN 33 2HE2 GLN 33 -11.797 -28.267 -27.898 260 H LEU 34 H LEU 34 -6.327 -27.202 -24.000 261 HA LEU 34 HA LEU 34 -6.006 -24.315 -24.065 262 1HB LEU 34 1HB LEU 34 -4.130 -26.522 -23.335 263 2HB LEU 34 2HB LEU 34 -3.515 -24.937 -23.774 264 HG LEU 34 HG LEU 34 -3.545 -25.253 -21.341 265 1HD1 LEU 34 1HD1 LEU 34 -5.536 -23.232 -22.219 266 2HD1 LEU 34 2HD1 LEU 34 -3.784 -23.047 -22.107 267 3HD1 LEU 34 3HD1 LEU 34 -4.738 -23.296 -20.647 268 1HD2 LEU 34 1HD2 LEU 34 -5.610 -25.446 -20.074 269 2HD2 LEU 34 2HD2 LEU 34 -5.391 -26.841 -21.130 270 3HD2 LEU 34 3HD2 LEU 34 -6.532 -25.571 -21.572 271 H LEU 35 H LEU 35 -5.392 -23.401 -25.888 272 HA LEU 35 HA LEU 35 -4.365 -25.081 -28.074 273 1HB LEU 35 1HB LEU 35 -5.904 -22.507 -28.149 274 2HB LEU 35 2HB LEU 35 -5.045 -23.113 -29.536 275 HG LEU 35 HG LEU 35 -7.228 -23.612 -29.878 276 1HD1 LEU 35 1HD1 LEU 35 -5.859 -25.497 -30.451 277 2HD1 LEU 35 2HD1 LEU 35 -7.432 -26.053 -29.889 278 3HD1 LEU 35 3HD1 LEU 35 -6.036 -26.158 -28.822 279 1HD2 LEU 35 1HD2 LEU 35 -8.731 -24.777 -28.305 280 2HD2 LEU 35 2HD2 LEU 35 -8.136 -23.231 -27.685 281 3HD2 LEU 35 3HD2 LEU 35 -7.439 -24.740 -27.105 282 H HIS 36 H HIS 36 -2.975 -23.671 -29.587 283 HA HIS 36 HA HIS 36 -1.476 -21.749 -28.071 284 1HB HIS 36 1HB HIS 36 0.726 -22.769 -28.347 285 2HB HIS 36 2HB HIS 36 -0.359 -23.801 -27.426 286 HD2 HIS 36 HD2 HIS 36 -1.332 -26.062 -28.946 287 HE1 HIS 36 HE1 HIS 36 2.035 -25.959 -31.486 288 HE2 HIS 36 HE2 HIS 36 -0.004 -27.260 -30.822 289 H LEU 37 H LEU 37 -0.825 -20.180 -29.111 290 HA LEU 37 HA LEU 37 -0.886 -20.228 -32.076 291 1HB LEU 37 1HB LEU 37 -1.859 -18.030 -30.269 292 2HB LEU 37 2HB LEU 37 -1.766 -17.935 -31.984 293 HG LEU 37 HG LEU 37 -3.506 -19.814 -32.130 294 1HD1 LEU 37 1HD1 LEU 37 -3.270 -20.853 -30.004 295 2HD1 LEU 37 2HD1 LEU 37 -4.925 -20.243 -30.137 296 3HD1 LEU 37 3HD1 LEU 37 -3.724 -19.382 -29.167 297 1HD2 LEU 37 1HD2 LEU 37 -4.315 -17.621 -32.482 298 2HD2 LEU 37 2HD2 LEU 37 -4.245 -17.271 -30.765 299 3HD2 LEU 37 3HD2 LEU 37 -5.441 -18.414 -31.379 300 H LYS 38 H LYS 38 0.453 -18.775 -33.099 301 HA LYS 38 HA LYS 38 2.575 -17.917 -31.316 302 1HB LYS 38 1HB LYS 38 4.196 -18.576 -32.900 303 2HB LYS 38 2HB LYS 38 3.082 -19.902 -32.504 304 1HG LYS 38 1HG LYS 38 2.017 -19.773 -34.606 305 2HG LYS 38 2HG LYS 38 2.828 -18.253 -35.002 306 1HD LYS 38 1HD LYS 38 4.966 -19.384 -34.933 307 2HD LYS 38 2HD LYS 38 4.161 -20.922 -34.605 308 1HE LYS 38 1HE LYS 38 2.990 -20.758 -36.752 309 2HE LYS 38 2HE LYS 38 3.789 -19.218 -37.074 310 1HZ LYS 38 1HZ LYS 38 5.913 -20.381 -36.989 311 2HZ LYS 38 2HZ LYS 38 4.939 -20.951 -38.214 312 3HZ LYS 38 3HZ LYS 38 5.120 -21.863 -36.791 313 H GLN 39 H GLN 39 3.815 -16.252 -32.045 314 HA GLN 39 HA GLN 39 2.199 -14.169 -33.246 315 1HB GLN 39 1HB GLN 39 3.521 -13.744 -31.209 316 2HB GLN 39 2HB GLN 39 4.994 -13.999 -32.153 317 1HG GLN 39 1HG GLN 39 4.445 -12.096 -33.550 318 2HG GLN 39 2HG GLN 39 2.940 -11.865 -32.669 319 1HE2 GLN 39 1HE2 GLN 39 6.367 -11.558 -32.579 320 2HE2 GLN 39 2HE2 GLN 39 6.448 -10.536 -31.200 321 H GLY 40 H GLY 40 2.155 -13.911 -35.151 322 1HA GLY 40 1HA GLY 40 4.475 -14.501 -36.890 323 2HA GLY 40 2HA GLY 40 2.803 -14.482 -37.453 324 H ILE 41 H ILE 41 2.499 -12.826 -38.773 325 HA ILE 41 HA ILE 41 4.040 -10.416 -38.411 326 HB ILE 41 HB ILE 41 1.869 -10.970 -40.483 327 1HG1 ILE 41 1HG1 ILE 41 3.852 -10.920 -42.116 328 2HG1 ILE 41 2HG1 ILE 41 4.892 -11.061 -40.711 329 1HG2 ILE 41 1HG2 ILE 41 3.792 -8.661 -40.269 330 2HG2 ILE 41 2HG2 ILE 41 2.057 -8.605 -40.004 331 3HG2 ILE 41 3HG2 ILE 41 2.692 -8.943 -41.621 332 1HD1 ILE 41 1HD1 ILE 41 2.826 -13.075 -41.580 333 2HD1 ILE 41 2HD1 ILE 41 3.898 -13.228 -40.188 334 3HD1 ILE 41 3HD1 ILE 41 4.568 -13.201 -41.820 335 H SER 42 H SER 42 3.427 -9.275 -36.752 336 HA SER 42 HA SER 42 0.660 -9.051 -36.070 337 1HB SER 42 1HB SER 42 3.042 -7.669 -34.872 338 2HB SER 42 2HB SER 42 1.403 -7.850 -34.194 339 HG SER 42 HG SER 42 3.441 -9.464 -33.911 340 H ALA 43 H ALA 43 -0.200 -8.048 -37.813 341 HA ALA 43 HA ALA 43 0.548 -5.900 -39.183 342 1HB ALA 43 1HB ALA 43 -1.396 -7.231 -39.705 343 2HB ALA 43 2HB ALA 43 -1.817 -5.515 -39.665 344 3HB ALA 43 3HB ALA 43 -2.241 -6.561 -38.311 345 H SER 44 H SER 44 -1.740 -5.668 -36.459 346 HA SER 44 HA SER 44 -0.849 -2.904 -36.074 347 1HB SER 44 1HB SER 44 -3.387 -4.223 -35.124 348 2HB SER 44 2HB SER 44 -3.025 -2.493 -35.078 349 HG SER 44 HG SER 44 -2.699 -2.899 -37.495 350 H GLY 45 H GLY 45 -1.999 -5.681 -34.131 351 1HA GLY 45 1HA GLY 45 -0.645 -4.548 -31.786 352 2HA GLY 45 2HA GLY 45 -1.837 -5.840 -31.762 353 H ALA 46 H ALA 46 -1.182 -7.842 -31.551 354 HA ALA 46 HA ALA 46 1.462 -8.630 -32.286 355 1HB ALA 46 1HB ALA 46 1.611 -9.793 -30.053 356 2HB ALA 46 2HB ALA 46 0.216 -8.822 -29.543 357 3HB ALA 46 3HB ALA 46 1.728 -8.034 -29.954 358 H ARG 47 H ARG 47 1.067 -10.340 -33.478 359 HA ARG 47 HA ARG 47 -1.622 -11.216 -33.275 360 1HB ARG 47 1HB ARG 47 0.253 -11.134 -35.580 361 2HB ARG 47 2HB ARG 47 -1.100 -12.242 -35.622 362 1HG ARG 47 1HG ARG 47 -1.301 -9.260 -35.267 363 2HG ARG 47 2HG ARG 47 -1.583 -10.141 -36.773 364 1HD ARG 47 1HD ARG 47 -3.264 -11.506 -35.308 365 2HD ARG 47 2HD ARG 47 -3.146 -10.079 -34.267 366 HE ARG 47 HE ARG 47 -4.124 -8.764 -35.951 367 1HH1 ARG 47 1HH1 ARG 47 -3.953 -12.207 -36.920 368 2HH1 ARG 47 2HH1 ARG 47 -5.150 -12.013 -38.114 369 1HH2 ARG 47 1HH2 ARG 47 -5.802 -8.615 -37.574 370 2HH2 ARG 47 2HH2 ARG 47 -6.225 -9.982 -38.475 371 H TYR 48 H TYR 48 -1.444 -12.968 -31.778 372 HA TYR 48 HA TYR 48 0.342 -15.176 -32.465 373 1HB TYR 48 1HB TYR 48 -1.530 -14.759 -30.110 374 2HB TYR 48 2HB TYR 48 -0.319 -16.027 -30.321 375 HD1 TYR 48 HD1 TYR 48 -0.870 -12.502 -29.448 376 HD2 TYR 48 HD2 TYR 48 2.032 -15.575 -29.929 377 HE1 TYR 48 HE1 TYR 48 0.764 -11.131 -28.247 378 HE2 TYR 48 HE2 TYR 48 3.677 -14.199 -28.726 379 HH TYR 48 HH TYR 48 3.992 -11.723 -28.369 380 H THR 49 H THR 49 -0.458 -16.376 -33.925 381 HA THR 49 HA THR 49 -3.285 -16.961 -33.837 382 HB THR 49 HB THR 49 -1.878 -15.721 -36.162 383 HG1 THR 49 HG1 THR 49 -3.067 -14.631 -34.182 384 1HG2 THR 49 1HG2 THR 49 -3.418 -17.419 -36.987 385 2HG2 THR 49 2HG2 THR 49 -4.060 -15.819 -37.355 386 3HG2 THR 49 3HG2 THR 49 -4.714 -16.751 -36.005 387 H ASP 50 H ASP 50 -3.609 -19.087 -34.599 388 HA ASP 50 HA ASP 50 -1.158 -20.241 -35.639 389 1HB ASP 50 1HB ASP 50 -1.537 -22.212 -34.481 390 2HB ASP 50 2HB ASP 50 -2.050 -20.963 -33.352 391 H GLY 51 H GLY 51 -4.394 -19.570 -36.281 392 1HA GLY 51 1HA GLY 51 -4.903 -19.828 -38.686 393 2HA GLY 51 2HA GLY 51 -4.385 -21.498 -38.494 394 H ILE 52 H ILE 52 -5.639 -21.627 -35.777 395 HA ILE 52 HA ILE 52 -8.308 -22.293 -36.705 396 HB ILE 52 HB ILE 52 -6.856 -22.805 -34.103 397 1HG1 ILE 52 1HG1 ILE 52 -7.160 -25.246 -34.691 398 2HG1 ILE 52 2HG1 ILE 52 -7.871 -24.747 -36.212 399 1HG2 ILE 52 1HG2 ILE 52 -9.212 -22.444 -33.578 400 2HG2 ILE 52 2HG2 ILE 52 -8.793 -24.139 -33.342 401 3HG2 ILE 52 3HG2 ILE 52 -9.683 -23.649 -34.780 402 1HD1 ILE 52 1HD1 ILE 52 -5.577 -25.503 -36.467 403 2HD1 ILE 52 2HD1 ILE 52 -5.038 -24.257 -35.337 404 3HD1 ILE 52 3HD1 ILE 52 -5.738 -23.798 -36.889 405 H TYR 53 H TYR 53 -6.702 -20.255 -34.354 406 HA TYR 53 HA TYR 53 -9.026 -18.414 -34.409 407 1HB TYR 53 1HB TYR 53 -7.388 -19.011 -31.931 408 2HB TYR 53 2HB TYR 53 -8.700 -17.853 -32.142 409 HD1 TYR 53 HD1 TYR 53 -7.876 -21.116 -31.040 410 HD2 TYR 53 HD2 TYR 53 -11.006 -18.899 -32.880 411 HE1 TYR 53 HE1 TYR 53 -9.480 -22.871 -30.420 412 HE2 TYR 53 HE2 TYR 53 -12.615 -20.648 -32.263 413 HH TYR 53 HH TYR 53 -12.551 -23.045 -31.772 414 H VAL 54 H VAL 54 -8.200 -16.365 -33.364 415 HA VAL 54 HA VAL 54 -5.473 -15.695 -34.220 416 HB VAL 54 HB VAL 54 -8.092 -14.350 -34.620 417 1HG1 VAL 54 1HG1 VAL 54 -6.424 -12.635 -33.940 418 2HG1 VAL 54 2HG1 VAL 54 -6.781 -12.415 -35.653 419 3HG1 VAL 54 3HG1 VAL 54 -5.295 -13.227 -35.158 420 1HG2 VAL 54 1HG2 VAL 54 -6.018 -15.192 -36.643 421 2HG2 VAL 54 2HG2 VAL 54 -7.486 -14.301 -37.035 422 3HG2 VAL 54 3HG2 VAL 54 -7.595 -15.926 -36.357 423 H PHE 55 H PHE 55 -4.536 -15.127 -32.310 424 HA PHE 55 HA PHE 55 -6.212 -13.856 -30.279 425 1HB PHE 55 1HB PHE 55 -4.975 -15.860 -29.531 426 2HB PHE 55 2HB PHE 55 -3.458 -15.142 -30.047 427 HD1 PHE 55 HD1 PHE 55 -2.569 -13.192 -28.730 428 HD2 PHE 55 HD2 PHE 55 -5.937 -15.436 -27.456 429 HE1 PHE 55 HE1 PHE 55 -2.275 -12.320 -26.443 430 HE2 PHE 55 HE2 PHE 55 -5.666 -14.572 -25.184 431 HZ PHE 55 HZ PHE 55 -3.830 -13.008 -24.667 432 H TRP 56 H TRP 56 -6.280 -11.828 -30.940 433 HA TRP 56 HA TRP 56 -3.812 -10.581 -31.698 434 1HB TRP 56 1HB TRP 56 -5.529 -10.400 -33.336 435 2HB TRP 56 2HB TRP 56 -6.681 -9.808 -32.135 436 HD1 TRP 56 HD1 TRP 56 -3.304 -8.147 -31.905 437 HE1 TRP 56 HE1 TRP 56 -3.468 -5.762 -32.829 438 HE3 TRP 56 HE3 TRP 56 -7.859 -8.491 -34.163 439 HZ2 TRP 56 HZ2 TRP 56 -5.277 -4.242 -34.395 440 HZ3 TRP 56 HZ3 TRP 56 -8.727 -6.537 -35.367 441 HH2 TRP 56 HH2 TRP 56 -7.458 -4.457 -35.476 442 H SER 57 H SER 57 -2.940 -9.647 -30.355 443 HA SER 57 HA SER 57 -4.214 -8.683 -27.905 444 1HB SER 57 1HB SER 57 -2.299 -10.282 -27.692 445 2HB SER 57 2HB SER 57 -1.285 -9.123 -28.529 446 HG SER 57 HG SER 57 -2.176 -9.130 -25.912 447 H LYS 58 H LYS 58 -4.792 -6.628 -28.078 448 HA LYS 58 HA LYS 58 -3.342 -4.843 -29.857 449 1HB LYS 58 1HB LYS 58 -5.971 -4.572 -28.400 450 2HB LYS 58 2HB LYS 58 -5.346 -3.445 -29.604 451 1HG LYS 58 1HG LYS 58 -5.411 -5.189 -31.304 452 2HG LYS 58 2HG LYS 58 -5.970 -6.345 -30.109 453 1HD LYS 58 1HD LYS 58 -7.448 -3.863 -30.908 454 2HD LYS 58 2HD LYS 58 -7.732 -5.480 -31.590 455 1HE LYS 58 1HE LYS 58 -8.279 -6.282 -29.334 456 2HE LYS 58 2HE LYS 58 -8.025 -4.649 -28.725 457 1HZ LYS 58 1HZ LYS 58 -9.863 -3.931 -30.224 458 2HZ LYS 58 2HZ LYS 58 -10.262 -4.925 -28.949 459 3HZ LYS 58 3HZ LYS 58 -10.207 -5.578 -30.507 460 H GLY 59 H GLY 59 -2.393 -5.771 -27.208 461 1HA GLY 59 1HA GLY 59 -0.831 -4.454 -25.958 462 2HA GLY 59 2HA GLY 59 -1.983 -3.123 -26.013 463 H ASP 60 H ASP 60 -3.704 -3.081 -24.611 464 HA ASP 60 HA ASP 60 -3.278 -4.714 -22.243 465 1HB ASP 60 1HB ASP 60 -4.997 -2.264 -22.680 466 2HB ASP 60 2HB ASP 60 -4.955 -3.172 -21.174 467 H GLU 61 H GLU 61 -5.063 -4.932 -24.992 468 HA GLU 61 HA GLU 61 -6.947 -6.493 -23.527 469 1HB GLU 61 1HB GLU 61 -8.802 -5.849 -24.970 470 2HB GLU 61 2HB GLU 61 -8.158 -4.472 -24.085 471 1HG GLU 61 1HG GLU 61 -7.039 -3.697 -26.034 472 2HG GLU 61 2HG GLU 61 -7.500 -5.166 -26.899 473 H ALA 62 H ALA 62 -7.877 -8.218 -24.763 474 HA ALA 62 HA ALA 62 -6.218 -8.938 -26.990 475 1HB ALA 62 1HB ALA 62 -6.174 -11.254 -26.125 476 2HB ALA 62 2HB ALA 62 -7.014 -10.697 -24.676 477 3HB ALA 62 3HB ALA 62 -5.387 -10.112 -25.030 478 H THR 63 H THR 63 -7.355 -9.762 -28.552 479 HA THR 63 HA THR 63 -10.156 -10.522 -28.127 480 HB THR 63 HB THR 63 -9.055 -9.036 -30.523 481 HG1 THR 63 HG1 THR 63 -10.076 -8.228 -28.072 482 1HG2 THR 63 1HG2 THR 63 -11.050 -10.424 -30.985 483 2HG2 THR 63 2HG2 THR 63 -11.437 -8.704 -31.078 484 3HG2 THR 63 3HG2 THR 63 -11.891 -9.636 -29.651 485 H VAL 64 H VAL 64 -10.446 -12.563 -28.681 486 HA VAL 64 HA VAL 64 -8.582 -13.884 -30.527 487 HB VAL 64 HB VAL 64 -10.709 -15.154 -28.798 488 1HG1 VAL 64 1HG1 VAL 64 -8.354 -16.350 -30.255 489 2HG1 VAL 64 2HG1 VAL 64 -10.075 -16.483 -30.671 490 3HG1 VAL 64 3HG1 VAL 64 -9.479 -17.205 -29.187 491 1HG2 VAL 64 1HG2 VAL 64 -7.768 -14.844 -28.207 492 2HG2 VAL 64 2HG2 VAL 64 -8.912 -15.816 -27.269 493 3HG2 VAL 64 3HG2 VAL 64 -9.097 -14.063 -27.345 494 H TYR 65 H TYR 65 -9.283 -13.781 -32.539 495 HA TYR 65 HA TYR 65 -12.218 -13.865 -33.080 496 1HB TYR 65 1HB TYR 65 -11.158 -11.622 -33.107 497 2HB TYR 65 2HB TYR 65 -10.121 -12.229 -34.397 498 HD1 TYR 65 HD1 TYR 65 -11.501 -13.124 -36.550 499 HD2 TYR 65 HD2 TYR 65 -12.976 -10.352 -33.686 500 HE1 TYR 65 HE1 TYR 65 -13.098 -12.261 -38.209 501 HE2 TYR 65 HE2 TYR 65 -14.579 -9.502 -35.329 502 HH TYR 65 HH TYR 65 -15.350 -11.093 -38.110 503 H LYS 66 H LYS 66 -12.202 -16.039 -33.964 504 HA LYS 66 HA LYS 66 -10.805 -16.298 -36.420 505 1HB LYS 66 1HB LYS 66 -10.956 -18.268 -34.923 506 2HB LYS 66 2HB LYS 66 -12.699 -18.103 -34.880 507 1HG LYS 66 1HG LYS 66 -11.974 -19.930 -36.339 508 2HG LYS 66 2HG LYS 66 -12.842 -18.683 -37.232 509 1HD LYS 66 1HD LYS 66 -10.832 -17.830 -38.177 510 2HD LYS 66 2HD LYS 66 -9.831 -18.779 -37.079 511 1HE LYS 66 1HE LYS 66 -9.803 -19.774 -39.283 512 2HE LYS 66 2HE LYS 66 -10.626 -20.833 -38.155 513 1HZ LYS 66 1HZ LYS 66 -11.736 -20.699 -40.285 514 2HZ LYS 66 2HZ LYS 66 -12.027 -19.058 -40.123 515 3HZ LYS 66 3HZ LYS 66 -12.761 -20.169 -39.086 516 H ARG 67 H ARG 67 -11.985 -16.140 -38.177 517 HA ARG 67 HA ARG 67 -14.187 -14.503 -38.392 518 1HB ARG 67 1HB ARG 67 -12.614 -14.908 -40.207 519 2HB ARG 67 2HB ARG 67 -13.182 -16.554 -40.357 520 1HG ARG 67 1HG ARG 67 -14.005 -15.025 -42.120 521 2HG ARG 67 2HG ARG 67 -15.291 -15.818 -41.206 522 1HD ARG 67 1HD ARG 67 -15.849 -13.486 -41.505 523 2HD ARG 67 2HD ARG 67 -15.480 -13.871 -39.814 524 HE ARG 67 HE ARG 67 -13.142 -12.933 -40.548 525 1HH1 ARG 67 1HH1 ARG 67 -16.324 -11.660 -41.411 526 2HH1 ARG 67 2HH1 ARG 67 -15.852 -10.030 -41.387 527 1HH2 ARG 67 1HH2 ARG 67 -12.468 -10.680 -40.507 528 2HH2 ARG 67 2HH2 ARG 67 -13.605 -9.466 -40.864 529 H ASP 68 H ASP 68 -14.232 -17.690 -37.390 530 HA ASP 68 HA ASP 68 -17.013 -18.115 -38.157 531 1HB ASP 68 1HB ASP 68 -15.230 -19.968 -36.584 532 2HB ASP 68 2HB ASP 68 -16.849 -20.329 -37.155 533 H ARG 69 H ARG 69 -14.958 -17.339 -35.508 534 HA ARG 69 HA ARG 69 -17.082 -16.696 -33.868 535 1HB ARG 69 1HB ARG 69 -17.411 -19.109 -33.714 536 2HB ARG 69 2HB ARG 69 -15.745 -19.318 -33.199 537 1HG ARG 69 1HG ARG 69 -17.159 -19.466 -31.269 538 2HG ARG 69 2HG ARG 69 -16.250 -17.962 -31.189 539 1HD ARG 69 1HD ARG 69 -18.234 -16.781 -32.138 540 2HD ARG 69 2HD ARG 69 -19.119 -18.306 -32.024 541 HE ARG 69 HE ARG 69 -17.860 -17.363 -29.618 542 1HH1 ARG 69 1HH1 ARG 69 -20.850 -17.383 -31.524 543 2HH1 ARG 69 2HH1 ARG 69 -21.866 -17.055 -30.197 544 1HH2 ARG 69 1HH2 ARG 69 -19.279 -16.944 -27.781 545 2HH2 ARG 69 2HH2 ARG 69 -20.957 -16.815 -28.026 546 H ILE 70 H ILE 70 -16.191 -15.088 -32.902 547 HA ILE 70 HA ILE 70 -13.577 -14.881 -31.677 548 HB ILE 70 HB ILE 70 -16.188 -13.599 -31.039 549 1HG1 ILE 70 1HG1 ILE 70 -13.995 -12.508 -32.720 550 2HG1 ILE 70 2HG1 ILE 70 -15.501 -13.166 -33.379 551 1HG2 ILE 70 1HG2 ILE 70 -14.563 -13.398 -29.243 552 2HG2 ILE 70 2HG2 ILE 70 -14.984 -11.858 -29.973 553 3HG2 ILE 70 3HG2 ILE 70 -13.424 -12.609 -30.360 554 1HD1 ILE 70 1HD1 ILE 70 -15.562 -10.734 -33.368 555 2HD1 ILE 70 2HD1 ILE 70 -15.184 -10.709 -31.644 556 3HD1 ILE 70 3HD1 ILE 70 -16.727 -11.356 -32.199 557 H VAL 71 H VAL 71 -13.120 -15.606 -29.888 558 HA VAL 71 HA VAL 71 -15.264 -16.888 -28.438 559 HB VAL 71 HB VAL 71 -13.652 -18.442 -27.290 560 1HG1 VAL 71 1HG1 VAL 71 -13.339 -19.861 -29.293 561 2HG1 VAL 71 2HG1 VAL 71 -13.839 -18.497 -30.297 562 3HG1 VAL 71 3HG1 VAL 71 -14.971 -19.209 -29.143 563 1HG2 VAL 71 1HG2 VAL 71 -11.590 -17.089 -27.720 564 2HG2 VAL 71 2HG2 VAL 71 -11.734 -17.526 -29.423 565 3HG2 VAL 71 3HG2 VAL 71 -11.466 -18.774 -28.209 566 H LEU 72 H LEU 72 -12.877 -14.577 -28.207 567 HA LEU 72 HA LEU 72 -13.974 -13.714 -25.679 568 1HB LEU 72 1HB LEU 72 -10.985 -14.265 -25.858 569 2HB LEU 72 2HB LEU 72 -11.736 -13.308 -24.614 570 HG LEU 72 HG LEU 72 -13.044 -15.540 -24.133 571 1HD1 LEU 72 1HD1 LEU 72 -12.259 -16.867 -25.906 572 2HD1 LEU 72 2HD1 LEU 72 -11.573 -17.505 -24.407 573 3HD1 LEU 72 3HD1 LEU 72 -10.574 -16.544 -25.500 574 1HD2 LEU 72 1HD2 LEU 72 -11.670 -14.426 -22.527 575 2HD2 LEU 72 2HD2 LEU 72 -10.213 -15.003 -23.327 576 3HD2 LEU 72 3HD2 LEU 72 -11.283 -16.149 -22.517 577 H ASN 73 H ASN 73 -14.428 -11.676 -26.226 578 HA ASN 73 HA ASN 73 -12.283 -10.194 -27.615 579 1HB ASN 73 1HB ASN 73 -13.791 -8.755 -28.776 580 2HB ASN 73 2HB ASN 73 -14.279 -10.398 -29.094 581 1HD2 ASN 73 1HD2 ASN 73 -15.923 -10.795 -26.620 582 2HD2 ASN 73 2HD2 ASN 73 -17.206 -9.684 -26.760 583 H ASN 74 H ASN 74 -13.167 -10.484 -24.794 584 HA ASN 74 HA ASN 74 -12.757 -7.696 -24.194 585 1HB ASN 74 1HB ASN 74 -15.255 -8.046 -24.149 586 2HB ASN 74 2HB ASN 74 -15.013 -9.160 -22.807 587 1HD2 ASN 74 1HD2 ASN 74 -16.480 -6.627 -22.909 588 2HD2 ASN 74 2HD2 ASN 74 -15.778 -5.636 -21.698 589 H CYS 75 H CYS 75 -10.807 -8.610 -23.862 590 HA CYS 75 HA CYS 75 -10.474 -9.569 -21.133 591 1HB CYS 75 1HB CYS 75 -9.026 -10.351 -23.643 592 2HB CYS 75 2HB CYS 75 -8.241 -10.470 -22.068 593 H GLN 76 H GLN 76 -9.320 -8.188 -19.913 594 HA GLN 76 HA GLN 76 -7.845 -6.197 -21.312 595 1HB GLN 76 1HB GLN 76 -10.051 -5.723 -19.302 596 2HB GLN 76 2HB GLN 76 -8.861 -4.496 -19.744 597 1HG GLN 76 1HG GLN 76 -9.520 -4.615 -22.033 598 2HG GLN 76 2HG GLN 76 -10.680 -5.885 -21.706 599 1HE2 GLN 76 1HE2 GLN 76 -12.669 -5.328 -20.724 600 2HE2 GLN 76 2HE2 GLN 76 -13.170 -3.692 -20.561 601 H LEU 77 H LEU 77 -6.099 -6.484 -20.692 602 HA LEU 77 HA LEU 77 -5.616 -8.241 -18.559 603 1HB LEU 77 1HB LEU 77 -4.546 -8.766 -20.536 604 2HB LEU 77 2HB LEU 77 -4.007 -7.130 -20.798 605 HG LEU 77 HG LEU 77 -2.306 -7.417 -19.046 606 1HD1 LEU 77 1HD1 LEU 77 -3.433 -10.178 -18.848 607 2HD1 LEU 77 2HD1 LEU 77 -3.325 -8.954 -17.583 608 3HD1 LEU 77 3HD1 LEU 77 -1.856 -9.699 -18.217 609 1HD2 LEU 77 1HD2 LEU 77 -1.598 -7.827 -21.254 610 2HD2 LEU 77 2HD2 LEU 77 -2.406 -9.373 -21.314 611 3HD2 LEU 77 3HD2 LEU 77 -0.971 -9.187 -20.311 612 H GLN 78 H GLN 78 -4.540 -7.660 -16.563 613 HA GLN 78 HA GLN 78 -4.001 -4.839 -16.309 614 1HB GLN 78 1HB GLN 78 -4.118 -7.066 -14.312 615 2HB GLN 78 2HB GLN 78 -3.409 -5.511 -13.882 616 1HG GLN 78 1HG GLN 78 -5.460 -4.371 -14.401 617 2HG GLN 78 2HG GLN 78 -6.165 -5.865 -15.014 618 1HE2 GLN 78 1HE2 GLN 78 -6.984 -7.273 -13.648 619 2HE2 GLN 78 2HE2 GLN 78 -7.153 -7.038 -11.937 620 H ASN 79 H ASN 79 -2.000 -7.835 -15.961 621 HA ASN 79 HA ASN 79 0.187 -6.599 -17.129 622 1HB ASN 79 1HB ASN 79 0.407 -5.480 -14.942 623 2HB ASN 79 2HB ASN 79 0.245 -7.022 -14.119 624 1HD2 ASN 79 1HD2 ASN 79 2.164 -6.757 -13.108 625 2HD2 ASN 79 2HD2 ASN 79 3.704 -6.886 -13.873 626 HA PRO 80 HA PRO 80 -0.046 -10.900 -17.593 627 1HB PRO 80 1HB PRO 80 2.157 -11.295 -19.199 628 2HB PRO 80 2HB PRO 80 0.571 -10.768 -19.771 629 1HG PRO 80 1HG PRO 80 2.970 -9.112 -19.071 630 2HG PRO 80 2HG PRO 80 1.894 -8.977 -20.476 631 1HD PRO 80 1HD PRO 80 1.602 -7.330 -18.402 632 2HD PRO 80 2HD PRO 80 0.198 -8.040 -19.264 633 H GLN 81 H GLN 81 2.764 -9.282 -16.335 634 HA GLN 81 HA GLN 81 3.819 -11.793 -15.541 635 1HB GLN 81 1HB GLN 81 5.828 -10.648 -14.731 636 2HB GLN 81 2HB GLN 81 5.483 -10.260 -16.405 637 1HG GLN 81 1HG GLN 81 4.465 -8.176 -15.632 638 2HG GLN 81 2HG GLN 81 4.976 -8.612 -14.001 639 1HE2 GLN 81 1HE2 GLN 81 6.037 -7.524 -17.121 640 2HE2 GLN 81 2HE2 GLN 81 7.664 -7.178 -16.664 641 H ARG 82 H ARG 82 2.414 -12.364 -14.371 642 HA ARG 82 HA ARG 82 0.899 -11.567 -12.295 643 1HB ARG 82 1HB ARG 82 1.211 -13.927 -11.318 644 2HB ARG 82 2HB ARG 82 0.589 -13.777 -12.956 645 1HG ARG 82 1HG ARG 82 2.737 -14.330 -13.887 646 2HG ARG 82 2HG ARG 82 3.480 -14.293 -12.289 647 1HD ARG 82 1HD ARG 82 1.312 -16.209 -13.123 648 2HD ARG 82 2HD ARG 82 3.031 -16.586 -13.154 649 HE ARG 82 HE ARG 82 1.319 -16.285 -10.837 650 1HH1 ARG 82 1HH1 ARG 82 4.634 -16.703 -12.048 651 2HH1 ARG 82 2HH1 ARG 82 5.264 -17.288 -10.591 652 1HH2 ARG 82 1HH2 ARG 82 2.173 -17.154 -8.820 653 2HH2 ARG 82 2HH2 ARG 82 3.814 -17.558 -8.710 Start of MODEL 19 1 H MET 1 H MET 1 3.579 -17.509 -12.164 2 HA MET 1 HA MET 1 2.971 -20.289 -12.839 3 1HB MET 1 1HB MET 1 2.725 -17.758 -14.507 4 2HB MET 1 2HB MET 1 2.569 -19.385 -15.134 5 1HG MET 1 1HG MET 1 0.389 -18.392 -14.891 6 2HG MET 1 2HG MET 1 0.561 -19.704 -13.730 7 1HE MET 1 1HE MET 1 -1.629 -18.719 -12.502 8 2HE MET 1 2HE MET 1 -1.707 -17.399 -13.670 9 3HE MET 1 3HE MET 1 -1.773 -17.055 -11.941 10 H GLN 2 H GLN 2 4.436 -20.965 -14.665 11 HA GLN 2 HA GLN 2 7.111 -19.769 -14.303 12 1HB GLN 2 1HB GLN 2 6.300 -22.509 -15.311 13 2HB GLN 2 2HB GLN 2 7.956 -21.943 -15.173 14 1HG GLN 2 1HG GLN 2 7.674 -21.743 -12.748 15 2HG GLN 2 2HG GLN 2 6.018 -22.325 -12.903 16 1HE2 GLN 2 1HE2 GLN 2 5.659 -24.488 -13.369 17 2HE2 GLN 2 2HE2 GLN 2 6.900 -25.673 -13.228 18 H THR 3 H THR 3 4.883 -18.930 -16.072 19 HA THR 3 HA THR 3 6.230 -18.337 -18.585 20 HB THR 3 HB THR 3 3.528 -19.736 -18.651 21 HG1 THR 3 HG1 THR 3 5.993 -20.905 -18.280 22 1HG2 THR 3 1HG2 THR 3 4.180 -20.143 -20.965 23 2HG2 THR 3 2HG2 THR 3 5.773 -19.460 -20.650 24 3HG2 THR 3 3HG2 THR 3 4.343 -18.432 -20.578 25 H ASP 4 H ASP 4 5.390 -16.550 -19.405 26 HA ASP 4 HA ASP 4 4.065 -14.933 -17.522 27 1HB ASP 4 1HB ASP 4 4.506 -14.599 -20.515 28 2HB ASP 4 2HB ASP 4 3.754 -13.371 -19.504 29 H THR 5 H THR 5 1.865 -14.356 -17.483 30 HA THR 5 HA THR 5 0.151 -15.850 -19.259 31 HB THR 5 HB THR 5 0.118 -15.974 -16.227 32 HG1 THR 5 HG1 THR 5 1.036 -17.521 -18.136 33 1HG2 THR 5 1HG2 THR 5 -2.210 -15.704 -17.047 34 2HG2 THR 5 2HG2 THR 5 -1.929 -17.311 -16.378 35 3HG2 THR 5 3HG2 THR 5 -1.965 -17.074 -18.126 36 H LEU 6 H LEU 6 -1.934 -14.858 -19.487 37 HA LEU 6 HA LEU 6 -1.644 -12.049 -19.074 38 1HB LEU 6 1HB LEU 6 -3.935 -13.510 -20.394 39 2HB LEU 6 2HB LEU 6 -3.731 -11.771 -20.370 40 HG LEU 6 HG LEU 6 -2.148 -13.813 -21.837 41 1HD1 LEU 6 1HD1 LEU 6 -4.123 -13.016 -22.930 42 2HD1 LEU 6 2HD1 LEU 6 -2.687 -12.399 -23.758 43 3HD1 LEU 6 3HD1 LEU 6 -3.614 -11.342 -22.697 44 1HD2 LEU 6 1HD2 LEU 6 -0.618 -12.025 -22.588 45 2HD2 LEU 6 2HD2 LEU 6 -0.485 -12.325 -20.856 46 3HD2 LEU 6 3HD2 LEU 6 -1.377 -10.923 -21.443 47 H GLU 7 H GLU 7 -4.550 -11.457 -18.789 48 HA GLU 7 HA GLU 7 -4.284 -11.163 -15.997 49 1HB GLU 7 1HB GLU 7 -5.122 -9.340 -17.351 50 2HB GLU 7 2HB GLU 7 -6.458 -10.325 -17.912 51 1HG GLU 7 1HG GLU 7 -7.460 -10.377 -15.816 52 2HG GLU 7 2HG GLU 7 -6.027 -9.729 -15.028 53 H TYR 8 H TYR 8 -5.544 -13.433 -18.107 54 HA TYR 8 HA TYR 8 -6.988 -14.861 -18.266 55 1HB TYR 8 1HB TYR 8 -7.042 -16.650 -16.473 56 2HB TYR 8 2HB TYR 8 -5.464 -16.158 -17.043 57 HD1 TYR 8 HD1 TYR 8 -7.811 -16.078 -14.211 58 HD2 TYR 8 HD2 TYR 8 -3.871 -15.175 -15.531 59 HE1 TYR 8 HE1 TYR 8 -7.093 -15.812 -11.877 60 HE2 TYR 8 HE2 TYR 8 -3.145 -14.902 -13.201 61 HH TYR 8 HH TYR 8 -4.233 -14.324 -11.040 62 H GLN 9 H GLN 9 -8.319 -12.450 -17.503 63 HA GLN 9 HA GLN 9 -10.717 -13.557 -16.461 64 1HB GLN 9 1HB GLN 9 -9.382 -11.156 -15.187 65 2HB GLN 9 2HB GLN 9 -11.067 -11.595 -14.945 66 1HG GLN 9 1HG GLN 9 -10.362 -13.747 -14.102 67 2HG GLN 9 2HG GLN 9 -8.678 -13.255 -14.238 68 1HE2 GLN 9 1HE2 GLN 9 -11.599 -12.951 -12.424 69 2HE2 GLN 9 2HE2 GLN 9 -10.927 -12.060 -11.106 70 H CYS 10 H CYS 10 -11.695 -13.347 -18.146 71 HA CYS 10 HA CYS 10 -12.098 -10.697 -19.213 72 1HB CYS 10 1HB CYS 10 -11.664 -13.266 -20.819 73 2HB CYS 10 2HB CYS 10 -12.085 -11.667 -21.499 74 H ASP 11 H ASP 11 -14.289 -10.512 -20.002 75 HA ASP 11 HA ASP 11 -16.034 -11.505 -18.101 76 1HB ASP 11 1HB ASP 11 -16.338 -9.398 -19.382 77 2HB ASP 11 2HB ASP 11 -16.833 -10.370 -20.764 78 H GLU 12 H GLU 12 -15.852 -12.461 -21.505 79 HA GLU 12 HA GLU 12 -17.958 -14.411 -21.024 80 1HB GLU 12 1HB GLU 12 -16.484 -14.067 -23.593 81 2HB GLU 12 2HB GLU 12 -18.134 -14.621 -23.329 82 1HG GLU 12 1HG GLU 12 -18.681 -12.342 -22.508 83 2HG GLU 12 2HG GLU 12 -17.036 -11.895 -22.975 84 H LYS 13 H LYS 13 -14.549 -14.392 -20.923 85 HA LYS 13 HA LYS 13 -14.526 -17.173 -20.588 86 1HB LYS 13 1HB LYS 13 -12.584 -17.323 -22.158 87 2HB LYS 13 2HB LYS 13 -14.206 -17.641 -22.856 88 1HG LYS 13 1HG LYS 13 -13.867 -15.330 -23.994 89 2HG LYS 13 2HG LYS 13 -12.356 -15.217 -23.135 90 1HD LYS 13 1HD LYS 13 -12.934 -17.565 -24.879 91 2HD LYS 13 2HD LYS 13 -12.380 -16.068 -25.585 92 1HE LYS 13 1HE LYS 13 -10.476 -17.500 -25.259 93 2HE LYS 13 2HE LYS 13 -10.366 -16.205 -24.081 94 1HZ LYS 13 1HZ LYS 13 -11.483 -18.882 -23.440 95 2HZ LYS 13 2HZ LYS 13 -10.902 -17.719 -22.323 96 3HZ LYS 13 3HZ LYS 13 -9.865 -18.538 -23.318 97 HA PRO 14 HA PRO 14 -11.068 -15.656 -18.350 98 1HB PRO 14 1HB PRO 14 -10.211 -18.475 -18.022 99 2HB PRO 14 2HB PRO 14 -10.659 -17.317 -16.770 100 1HG PRO 14 1HG PRO 14 -12.242 -19.406 -17.417 101 2HG PRO 14 2HG PRO 14 -12.900 -17.848 -16.891 102 1HD PRO 14 1HD PRO 14 -12.666 -18.963 -19.660 103 2HD PRO 14 2HD PRO 14 -13.999 -18.051 -18.911 104 H LEU 15 H LEU 15 -8.727 -15.467 -18.946 105 HA LEU 15 HA LEU 15 -8.126 -16.919 -21.383 106 1HB LEU 15 1HB LEU 15 -8.850 -14.685 -22.017 107 2HB LEU 15 2HB LEU 15 -7.652 -13.985 -20.941 108 HG LEU 15 HG LEU 15 -5.879 -15.003 -22.293 109 1HD1 LEU 15 1HD1 LEU 15 -6.405 -15.862 -24.543 110 2HD1 LEU 15 2HD1 LEU 15 -8.123 -15.722 -24.183 111 3HD1 LEU 15 3HD1 LEU 15 -7.118 -16.856 -23.275 112 1HD2 LEU 15 1HD2 LEU 15 -7.752 -13.209 -23.818 113 2HD2 LEU 15 2HD2 LEU 15 -6.034 -13.446 -24.166 114 3HD2 LEU 15 3HD2 LEU 15 -6.532 -12.698 -22.654 115 H THR 16 H THR 16 -7.070 -18.216 -19.837 116 HA THR 16 HA THR 16 -4.718 -17.088 -18.702 117 HB THR 16 HB THR 16 -5.284 -20.038 -18.710 118 HG1 THR 16 HG1 THR 16 -6.728 -19.472 -16.845 119 1HG2 THR 16 1HG2 THR 16 -4.492 -19.752 -16.375 120 2HG2 THR 16 2HG2 THR 16 -4.400 -18.005 -16.674 121 3HG2 THR 16 3HG2 THR 16 -3.336 -19.096 -17.546 122 H VAL 17 H VAL 17 -2.945 -16.975 -19.836 123 HA VAL 17 HA VAL 17 -2.654 -18.595 -22.273 124 HB VAL 17 HB VAL 17 -1.644 -15.797 -21.749 125 1HG1 VAL 17 1HG1 VAL 17 -1.654 -17.463 -24.229 126 2HG1 VAL 17 2HG1 VAL 17 -0.216 -17.016 -23.303 127 3HG1 VAL 17 3HG1 VAL 17 -1.142 -15.780 -24.163 128 1HG2 VAL 17 1HG2 VAL 17 -4.035 -15.782 -21.944 129 2HG2 VAL 17 2HG2 VAL 17 -3.957 -16.711 -23.441 130 3HG2 VAL 17 3HG2 VAL 17 -3.316 -15.068 -23.389 131 H LYS 18 H LYS 18 -0.633 -19.508 -22.592 132 HA LYS 18 HA LYS 18 1.221 -19.044 -20.436 133 1HB LYS 18 1HB LYS 18 0.960 -21.384 -22.371 134 2HB LYS 18 2HB LYS 18 2.386 -21.152 -21.390 135 1HG LYS 18 1HG LYS 18 0.943 -22.841 -20.414 136 2HG LYS 18 2HG LYS 18 1.028 -21.438 -19.353 137 1HD LYS 18 1HD LYS 18 -1.108 -20.680 -20.164 138 2HD LYS 18 2HD LYS 18 -1.219 -22.042 -21.279 139 1HE LYS 18 1HE LYS 18 -1.123 -22.215 -18.258 140 2HE LYS 18 2HE LYS 18 -2.562 -22.430 -19.253 141 1HZ LYS 18 1HZ LYS 18 -1.514 -24.393 -20.252 142 2HZ LYS 18 2HZ LYS 18 -1.636 -24.532 -18.585 143 3HZ LYS 18 3HZ LYS 18 -0.151 -24.163 -19.282 144 H LEU 19 H LEU 19 2.038 -17.207 -21.168 145 HA LEU 19 HA LEU 19 2.577 -16.763 -23.890 146 1HB LEU 19 1HB LEU 19 1.502 -15.126 -22.412 147 2HB LEU 19 2HB LEU 19 2.895 -15.374 -21.350 148 HG LEU 19 HG LEU 19 4.332 -14.336 -22.730 149 1HD1 LEU 19 1HD1 LEU 19 2.111 -14.021 -24.789 150 2HD1 LEU 19 2HD1 LEU 19 3.546 -15.035 -24.956 151 3HD1 LEU 19 3HD1 LEU 19 3.702 -13.279 -24.946 152 1HD2 LEU 19 1HD2 LEU 19 3.101 -12.801 -21.364 153 2HD2 LEU 19 2HD2 LEU 19 1.833 -12.668 -22.575 154 3HD2 LEU 19 3HD2 LEU 19 3.435 -12.006 -22.903 155 H ASN 20 H ASN 20 4.254 -18.089 -24.287 156 HA ASN 20 HA ASN 20 6.600 -17.732 -22.613 157 1HB ASN 20 1HB ASN 20 5.905 -19.996 -23.739 158 2HB ASN 20 2HB ASN 20 6.602 -19.298 -25.192 159 1HD2 ASN 20 1HD2 ASN 20 8.655 -17.858 -23.335 160 2HD2 ASN 20 2HD2 ASN 20 9.779 -19.112 -23.010 161 H ASN 21 H ASN 21 6.806 -15.637 -22.963 162 HA ASN 21 HA ASN 21 6.401 -14.259 -25.321 163 1HB ASN 21 1HB ASN 21 6.310 -13.211 -23.120 164 2HB ASN 21 2HB ASN 21 8.054 -13.418 -22.977 165 1HD2 ASN 21 1HD2 ASN 21 8.274 -11.213 -22.684 166 2HD2 ASN 21 2HD2 ASN 21 8.157 -10.101 -24.012 167 HA PRO 22 HA PRO 22 11.152 -13.959 -26.232 168 1HB PRO 22 1HB PRO 22 12.705 -15.970 -25.231 169 2HB PRO 22 2HB PRO 22 12.521 -14.392 -24.460 170 1HG PRO 22 1HG PRO 22 11.048 -16.919 -23.949 171 2HG PRO 22 2HG PRO 22 11.834 -15.842 -22.754 172 1HD PRO 22 1HD PRO 22 9.212 -15.758 -23.136 173 2HD PRO 22 2HD PRO 22 10.126 -14.232 -22.990 174 H ARG 23 H ARG 23 9.357 -16.839 -25.905 175 HA ARG 23 HA ARG 23 10.655 -18.188 -28.133 176 1HB ARG 23 1HB ARG 23 10.059 -19.571 -26.230 177 2HB ARG 23 2HB ARG 23 8.400 -19.012 -26.299 178 1HG ARG 23 1HG ARG 23 8.105 -20.147 -28.446 179 2HG ARG 23 2HG ARG 23 9.776 -20.702 -28.374 180 1HD ARG 23 1HD ARG 23 9.326 -22.088 -26.512 181 2HD ARG 23 2HD ARG 23 7.752 -21.337 -26.237 182 HE ARG 23 HE ARG 23 7.601 -22.294 -28.760 183 1HH1 ARG 23 1HH1 ARG 23 8.440 -23.856 -25.741 184 2HH1 ARG 23 2HH1 ARG 23 7.634 -25.318 -26.060 185 1HH2 ARG 23 1HH2 ARG 23 6.460 -24.196 -29.240 186 2HH2 ARG 23 2HH2 ARG 23 6.455 -25.543 -28.193 187 H GLN 24 H GLN 24 8.152 -15.972 -27.637 188 HA GLN 24 HA GLN 24 6.501 -15.109 -28.816 189 1HB GLN 24 1HB GLN 24 8.182 -16.273 -30.982 190 2HB GLN 24 2HB GLN 24 6.821 -15.214 -31.369 191 1HG GLN 24 1HG GLN 24 7.966 -13.457 -29.983 192 2HG GLN 24 2HG GLN 24 9.334 -14.556 -29.826 193 1HE2 GLN 24 1HE2 GLN 24 10.596 -14.987 -31.656 194 2HE2 GLN 24 2HE2 GLN 24 10.568 -13.972 -33.039 195 H GLU 25 H GLU 25 5.818 -17.412 -27.623 196 HA GLU 25 HA GLU 25 3.730 -18.416 -29.368 197 1HB GLU 25 1HB GLU 25 5.831 -20.096 -28.096 198 2HB GLU 25 2HB GLU 25 4.194 -20.727 -28.169 199 1HG GLU 25 1HG GLU 25 4.148 -20.591 -30.494 200 2HG GLU 25 2HG GLU 25 5.693 -19.728 -30.574 201 H VAL 26 H VAL 26 1.894 -18.835 -28.417 202 HA VAL 26 HA VAL 26 1.602 -18.667 -25.428 203 HB VAL 26 HB VAL 26 -0.434 -17.492 -25.705 204 1HG1 VAL 26 1HG1 VAL 26 0.267 -15.306 -26.550 205 2HG1 VAL 26 2HG1 VAL 26 1.702 -16.061 -27.241 206 3HG1 VAL 26 3HG1 VAL 26 1.458 -16.057 -25.495 207 1HG2 VAL 26 1HG2 VAL 26 -1.235 -18.372 -27.802 208 2HG2 VAL 26 2HG2 VAL 26 0.034 -17.520 -28.675 209 3HG2 VAL 26 3HG2 VAL 26 -1.248 -16.606 -27.876 210 H SER 27 H SER 27 0.418 -20.050 -24.563 211 HA SER 27 HA SER 27 -1.272 -21.672 -26.321 212 1HB SER 27 1HB SER 27 -0.080 -22.562 -23.693 213 2HB SER 27 2HB SER 27 -0.941 -23.512 -24.915 214 HG SER 27 HG SER 27 1.050 -22.316 -26.126 215 H PHE 28 H PHE 28 -3.293 -21.204 -25.925 216 HA PHE 28 HA PHE 28 -3.849 -20.212 -23.251 217 1HB PHE 28 1HB PHE 28 -5.250 -18.415 -23.945 218 2HB PHE 28 2HB PHE 28 -3.751 -18.268 -24.841 219 HD1 PHE 28 HD1 PHE 28 -7.328 -19.097 -25.045 220 HD2 PHE 28 HD2 PHE 28 -3.767 -18.358 -27.241 221 HE1 PHE 28 HE1 PHE 28 -8.659 -18.859 -27.093 222 HE2 PHE 28 HE2 PHE 28 -5.103 -18.126 -29.299 223 HZ PHE 28 HZ PHE 28 -7.540 -18.375 -29.226 224 H VAL 29 H VAL 29 -5.998 -20.217 -22.712 225 HA VAL 29 HA VAL 29 -7.188 -22.699 -23.539 226 HB VAL 29 HB VAL 29 -6.683 -22.385 -21.132 227 1HG1 VAL 29 1HG1 VAL 29 -6.989 -20.023 -20.917 228 2HG1 VAL 29 2HG1 VAL 29 -7.922 -20.906 -19.720 229 3HG1 VAL 29 3HG1 VAL 29 -8.732 -20.205 -21.128 230 1HG2 VAL 29 1HG2 VAL 29 -9.617 -22.652 -21.773 231 2HG2 VAL 29 2HG2 VAL 29 -8.855 -23.118 -20.248 232 3HG2 VAL 29 3HG2 VAL 29 -8.405 -23.938 -21.742 233 H TYR 30 H TYR 30 -8.569 -22.587 -24.911 234 HA TYR 30 HA TYR 30 -10.209 -20.338 -25.724 235 1HB TYR 30 1HB TYR 30 -9.979 -22.043 -27.372 236 2HB TYR 30 2HB TYR 30 -10.391 -23.319 -26.235 237 HD1 TYR 30 HD1 TYR 30 -12.492 -24.213 -26.325 238 HD2 TYR 30 HD2 TYR 30 -11.944 -20.268 -27.791 239 HE1 TYR 30 HE1 TYR 30 -14.842 -24.162 -27.016 240 HE2 TYR 30 HE2 TYR 30 -14.307 -20.209 -28.497 241 HH TYR 30 HH TYR 30 -16.577 -22.522 -27.475 242 H ASP 31 H ASP 31 -10.983 -23.275 -23.975 243 HA ASP 31 HA ASP 31 -12.580 -21.920 -22.061 244 1HB ASP 31 1HB ASP 31 -14.255 -21.876 -23.766 245 2HB ASP 31 2HB ASP 31 -13.942 -23.548 -24.208 246 H ASN 32 H ASN 32 -12.180 -25.091 -23.662 247 HA ASN 32 HA ASN 32 -11.553 -26.187 -21.031 248 1HB ASN 32 1HB ASN 32 -13.894 -26.693 -21.512 249 2HB ASN 32 2HB ASN 32 -13.495 -27.317 -23.087 250 1HD2 ASN 32 1HD2 ASN 32 -13.439 -27.950 -19.644 251 2HD2 ASN 32 2HD2 ASN 32 -13.268 -29.660 -19.785 252 H GLN 33 H GLN 33 -9.941 -25.358 -23.647 253 HA GLN 33 HA GLN 33 -8.310 -27.636 -23.590 254 1HB GLN 33 1HB GLN 33 -8.269 -28.045 -25.953 255 2HB GLN 33 2HB GLN 33 -9.942 -28.201 -25.436 256 1HG GLN 33 1HG GLN 33 -10.413 -25.982 -26.290 257 2HG GLN 33 2HG GLN 33 -8.702 -25.822 -26.705 258 1HE2 GLN 33 1HE2 GLN 33 -11.140 -25.761 -28.433 259 2HE2 GLN 33 2HE2 GLN 33 -10.872 -26.960 -29.626 260 H LEU 34 H LEU 34 -6.371 -27.134 -24.435 261 HA LEU 34 HA LEU 34 -5.917 -24.289 -24.362 262 1HB LEU 34 1HB LEU 34 -4.172 -26.641 -23.678 263 2HB LEU 34 2HB LEU 34 -3.494 -25.042 -23.937 264 HG LEU 34 HG LEU 34 -3.636 -25.570 -21.563 265 1HD1 LEU 34 1HD1 LEU 34 -5.549 -23.457 -22.369 266 2HD1 LEU 34 2HD1 LEU 34 -3.812 -23.303 -22.104 267 3HD1 LEU 34 3HD1 LEU 34 -4.882 -23.665 -20.750 268 1HD2 LEU 34 1HD2 LEU 34 -5.790 -25.840 -20.410 269 2HD2 LEU 34 2HD2 LEU 34 -5.477 -27.152 -21.543 270 3HD2 LEU 34 3HD2 LEU 34 -6.609 -25.872 -21.973 271 H LEU 35 H LEU 35 -5.110 -23.450 -26.219 272 HA LEU 35 HA LEU 35 -3.913 -25.290 -28.133 273 1HB LEU 35 1HB LEU 35 -4.942 -24.205 -30.051 274 2HB LEU 35 2HB LEU 35 -6.161 -24.818 -28.973 275 HG LEU 35 HG LEU 35 -5.427 -21.887 -29.295 276 1HD1 LEU 35 1HD1 LEU 35 -6.443 -22.805 -31.262 277 2HD1 LEU 35 2HD1 LEU 35 -7.543 -21.713 -30.422 278 3HD1 LEU 35 3HD1 LEU 35 -7.763 -23.457 -30.292 279 1HD2 LEU 35 1HD2 LEU 35 -7.718 -23.184 -27.803 280 2HD2 LEU 35 2HD2 LEU 35 -7.467 -21.452 -28.028 281 3HD2 LEU 35 3HD2 LEU 35 -6.338 -22.380 -27.048 282 H HIS 36 H HIS 36 -2.258 -24.467 -29.450 283 HA HIS 36 HA HIS 36 -1.078 -22.132 -28.208 284 1HB HIS 36 1HB HIS 36 1.116 -23.121 -28.534 285 2HB HIS 36 2HB HIS 36 0.089 -24.160 -27.562 286 HD2 HIS 36 HD2 HIS 36 -1.126 -26.294 -29.361 287 HE1 HIS 36 HE1 HIS 36 2.499 -26.433 -31.531 288 HE2 HIS 36 HE2 HIS 36 0.231 -27.486 -31.222 289 H LEU 37 H LEU 37 -0.209 -20.660 -29.338 290 HA LEU 37 HA LEU 37 -0.313 -20.744 -32.301 291 1HB LEU 37 1HB LEU 37 -1.312 -18.432 -30.665 292 2HB LEU 37 2HB LEU 37 -1.294 -18.557 -32.386 293 HG LEU 37 HG LEU 37 -2.929 -20.567 -32.055 294 1HD1 LEU 37 1HD1 LEU 37 -2.737 -20.888 -29.713 295 2HD1 LEU 37 2HD1 LEU 37 -4.388 -20.359 -30.075 296 3HD1 LEU 37 3HD1 LEU 37 -3.219 -19.231 -29.393 297 1HD2 LEU 37 1HD2 LEU 37 -3.778 -17.716 -31.604 298 2HD2 LEU 37 2HD2 LEU 37 -4.895 -19.049 -31.859 299 3HD2 LEU 37 3HD2 LEU 37 -3.744 -18.635 -33.123 300 H LYS 38 H LYS 38 0.993 -19.179 -33.269 301 HA LYS 38 HA LYS 38 3.086 -18.322 -31.440 302 1HB LYS 38 1HB LYS 38 4.719 -18.947 -33.037 303 2HB LYS 38 2HB LYS 38 3.659 -20.301 -32.596 304 1HG LYS 38 1HG LYS 38 2.554 -20.242 -34.678 305 2HG LYS 38 2HG LYS 38 3.311 -18.706 -35.115 306 1HD LYS 38 1HD LYS 38 5.458 -19.731 -35.069 307 2HD LYS 38 2HD LYS 38 4.759 -21.296 -34.645 308 1HE LYS 38 1HE LYS 38 3.483 -21.253 -36.787 309 2HE LYS 38 2HE LYS 38 4.294 -19.744 -37.203 310 1HZ LYS 38 1HZ LYS 38 5.388 -21.640 -38.257 311 2HZ LYS 38 2HZ LYS 38 5.647 -22.354 -36.759 312 3HZ LYS 38 3HZ LYS 38 6.415 -20.920 -37.137 313 H GLN 39 H GLN 39 4.277 -16.651 -32.082 314 HA GLN 39 HA GLN 39 2.902 -14.675 -33.698 315 1HB GLN 39 1HB GLN 39 3.504 -13.718 -31.740 316 2HB GLN 39 2HB GLN 39 4.995 -14.623 -31.577 317 1HG GLN 39 1HG GLN 39 5.495 -12.305 -31.853 318 2HG GLN 39 2HG GLN 39 5.974 -13.129 -33.332 319 1HE2 GLN 39 1HE2 GLN 39 5.476 -10.390 -32.793 320 2HE2 GLN 39 2HE2 GLN 39 4.263 -9.867 -33.907 321 H GLY 40 H GLY 40 3.275 -14.737 -35.628 322 1HA GLY 40 1HA GLY 40 6.020 -14.967 -36.667 323 2HA GLY 40 2HA GLY 40 4.782 -16.041 -37.323 324 H ILE 41 H ILE 41 2.872 -15.039 -38.200 325 HA ILE 41 HA ILE 41 3.515 -12.834 -39.906 326 HB ILE 41 HB ILE 41 0.827 -14.119 -39.341 327 1HG1 ILE 41 1HG1 ILE 41 2.745 -14.661 -41.616 328 2HG1 ILE 41 2HG1 ILE 41 2.598 -15.688 -40.195 329 1HG2 ILE 41 1HG2 ILE 41 0.697 -11.889 -40.326 330 2HG2 ILE 41 2HG2 ILE 41 0.181 -13.106 -41.505 331 3HG2 ILE 41 3HG2 ILE 41 1.789 -12.372 -41.613 332 1HD1 ILE 41 1HD1 ILE 41 0.421 -15.109 -42.182 333 2HD1 ILE 41 2HD1 ILE 41 0.294 -16.170 -40.780 334 3HD1 ILE 41 3HD1 ILE 41 1.386 -16.584 -42.108 335 H SER 42 H SER 42 3.459 -10.823 -39.184 336 HA SER 42 HA SER 42 1.932 -10.332 -36.743 337 1HB SER 42 1HB SER 42 4.333 -8.949 -37.793 338 2HB SER 42 2HB SER 42 3.533 -8.722 -36.207 339 HG SER 42 HG SER 42 4.295 -11.290 -36.895 340 H ALA 43 H ALA 43 1.895 -7.768 -36.502 341 HA ALA 43 HA ALA 43 1.304 -6.190 -38.616 342 1HB ALA 43 1HB ALA 43 -1.132 -5.877 -38.004 343 2HB ALA 43 2HB ALA 43 -0.999 -7.312 -36.985 344 3HB ALA 43 3HB ALA 43 -0.793 -7.449 -38.731 345 H SER 44 H SER 44 -0.210 -4.360 -37.026 346 HA SER 44 HA SER 44 1.752 -3.546 -35.167 347 1HB SER 44 1HB SER 44 -1.125 -2.631 -35.417 348 2HB SER 44 2HB SER 44 0.194 -1.737 -34.646 349 HG SER 44 HG SER 44 0.993 -2.444 -37.040 350 H GLY 45 H GLY 45 2.141 -5.036 -33.613 351 1HA GLY 45 1HA GLY 45 1.244 -5.314 -31.215 352 2HA GLY 45 2HA GLY 45 -0.052 -6.182 -32.037 353 H ALA 46 H ALA 46 0.284 -8.281 -31.604 354 HA ALA 46 HA ALA 46 2.655 -9.473 -32.599 355 1HB ALA 46 1HB ALA 46 2.794 -10.789 -30.454 356 2HB ALA 46 2HB ALA 46 1.677 -9.600 -29.753 357 3HB ALA 46 3HB ALA 46 3.267 -9.093 -30.296 358 H ARG 47 H ARG 47 1.897 -11.248 -33.647 359 HA ARG 47 HA ARG 47 -0.849 -11.626 -33.047 360 1HB ARG 47 1HB ARG 47 0.513 -11.914 -35.699 361 2HB ARG 47 2HB ARG 47 -1.092 -12.532 -35.396 362 1HG ARG 47 1HG ARG 47 -1.752 -10.149 -34.820 363 2HG ARG 47 2HG ARG 47 -0.153 -9.694 -35.456 364 1HD ARG 47 1HD ARG 47 -2.047 -9.608 -37.136 365 2HD ARG 47 2HD ARG 47 -0.635 -10.567 -37.603 366 HE ARG 47 HE ARG 47 -2.686 -12.059 -36.260 367 1HH1 ARG 47 1HH1 ARG 47 -1.775 -10.883 -39.467 368 2HH1 ARG 47 2HH1 ARG 47 -2.349 -12.234 -40.312 369 1HH2 ARG 47 1HH2 ARG 47 -3.454 -13.955 -37.391 370 2HH2 ARG 47 2HH2 ARG 47 -3.341 -14.017 -39.094 371 H TYR 48 H TYR 48 -0.916 -13.527 -31.914 372 HA TYR 48 HA TYR 48 0.841 -15.735 -32.643 373 1HB TYR 48 1HB TYR 48 -1.088 -15.378 -30.332 374 2HB TYR 48 2HB TYR 48 0.073 -16.685 -30.558 375 HD1 TYR 48 HD1 TYR 48 2.421 -16.371 -30.051 376 HD2 TYR 48 HD2 TYR 48 -0.319 -13.143 -29.652 377 HE1 TYR 48 HE1 TYR 48 4.108 -15.094 -28.794 378 HE2 TYR 48 HE2 TYR 48 1.350 -11.868 -28.398 379 HH TYR 48 HH TYR 48 3.305 -12.207 -27.104 380 H THR 49 H THR 49 0.072 -16.872 -34.186 381 HA THR 49 HA THR 49 -2.743 -17.421 -34.187 382 HB THR 49 HB THR 49 -1.419 -15.956 -36.472 383 HG1 THR 49 HG1 THR 49 -2.502 -15.027 -34.381 384 1HG2 THR 49 1HG2 THR 49 -4.251 -17.014 -36.289 385 2HG2 THR 49 2HG2 THR 49 -2.981 -17.664 -37.320 386 3HG2 THR 49 3HG2 THR 49 -3.601 -16.038 -37.609 387 H ASP 50 H ASP 50 -3.081 -19.410 -34.992 388 HA ASP 50 HA ASP 50 -0.975 -20.501 -36.685 389 1HB ASP 50 1HB ASP 50 -1.086 -21.801 -34.615 390 2HB ASP 50 2HB ASP 50 -2.812 -22.070 -34.855 391 H GLY 51 H GLY 51 -4.394 -20.092 -36.156 392 1HA GLY 51 1HA GLY 51 -5.303 -19.735 -38.586 393 2HA GLY 51 2HA GLY 51 -5.020 -21.469 -38.634 394 H ILE 52 H ILE 52 -5.701 -21.602 -35.715 395 HA ILE 52 HA ILE 52 -8.433 -22.249 -36.033 396 HB ILE 52 HB ILE 52 -7.109 -21.756 -33.319 397 1HG1 ILE 52 1HG1 ILE 52 -6.971 -24.409 -33.389 398 2HG1 ILE 52 2HG1 ILE 52 -6.873 -24.154 -35.121 399 1HG2 ILE 52 1HG2 ILE 52 -9.424 -23.500 -34.148 400 2HG2 ILE 52 2HG2 ILE 52 -9.521 -21.967 -33.283 401 3HG2 ILE 52 3HG2 ILE 52 -8.769 -23.369 -32.515 402 1HD1 ILE 52 1HD1 ILE 52 -4.689 -24.427 -34.062 403 2HD1 ILE 52 2HD1 ILE 52 -4.977 -22.990 -33.084 404 3HD1 ILE 52 3HD1 ILE 52 -4.825 -22.856 -34.832 405 H TYR 53 H TYR 53 -6.822 -19.792 -34.089 406 HA TYR 53 HA TYR 53 -8.863 -17.871 -34.849 407 1HB TYR 53 1HB TYR 53 -7.705 -18.033 -32.058 408 2HB TYR 53 2HB TYR 53 -8.902 -16.903 -32.681 409 HD1 TYR 53 HD1 TYR 53 -8.413 -19.927 -30.919 410 HD2 TYR 53 HD2 TYR 53 -11.145 -18.004 -33.539 411 HE1 TYR 53 HE1 TYR 53 -10.170 -21.515 -30.243 412 HE2 TYR 53 HE2 TYR 53 -12.904 -19.579 -32.877 413 HH TYR 53 HH TYR 53 -12.554 -21.716 -30.212 414 H VAL 54 H VAL 54 -7.957 -15.686 -34.224 415 HA VAL 54 HA VAL 54 -5.064 -15.544 -34.696 416 HB VAL 54 HB VAL 54 -7.381 -13.755 -35.222 417 1HG1 VAL 54 1HG1 VAL 54 -4.399 -13.161 -35.674 418 2HG1 VAL 54 2HG1 VAL 54 -5.436 -12.356 -34.502 419 3HG1 VAL 54 3HG1 VAL 54 -5.704 -12.110 -36.229 420 1HG2 VAL 54 1HG2 VAL 54 -7.133 -15.432 -36.899 421 2HG2 VAL 54 2HG2 VAL 54 -5.426 -15.040 -37.120 422 3HG2 VAL 54 3HG2 VAL 54 -6.664 -13.885 -37.604 423 H PHE 55 H PHE 55 -4.129 -15.210 -32.739 424 HA PHE 55 HA PHE 55 -5.642 -13.726 -30.740 425 1HB PHE 55 1HB PHE 55 -4.751 -15.979 -30.137 426 2HB PHE 55 2HB PHE 55 -3.123 -15.386 -30.427 427 HD1 PHE 55 HD1 PHE 55 -1.967 -14.163 -28.752 428 HD2 PHE 55 HD2 PHE 55 -6.103 -15.027 -28.328 429 HE1 PHE 55 HE1 PHE 55 -1.879 -13.411 -26.416 430 HE2 PHE 55 HE2 PHE 55 -6.035 -14.281 -26.008 431 HZ PHE 55 HZ PHE 55 -3.922 -13.471 -25.038 432 H TRP 56 H TRP 56 -5.254 -11.633 -30.839 433 HA TRP 56 HA TRP 56 -2.704 -10.723 -31.836 434 1HB TRP 56 1HB TRP 56 -4.976 -10.221 -32.954 435 2HB TRP 56 2HB TRP 56 -5.243 -9.187 -31.551 436 HD1 TRP 56 HD1 TRP 56 -2.243 -7.952 -31.456 437 HE1 TRP 56 HE1 TRP 56 -1.617 -6.197 -33.231 438 HE3 TRP 56 HE3 TRP 56 -5.753 -9.082 -34.994 439 HZ2 TRP 56 HZ2 TRP 56 -2.483 -5.407 -35.783 440 HZ3 TRP 56 HZ3 TRP 56 -5.789 -7.774 -37.078 441 HH2 TRP 56 HH2 TRP 56 -4.188 -5.974 -37.461 442 H SER 57 H SER 57 -1.585 -9.866 -30.461 443 HA SER 57 HA SER 57 -2.591 -8.999 -27.821 444 1HB SER 57 1HB SER 57 -0.979 -10.959 -27.873 445 2HB SER 57 2HB SER 57 0.205 -9.882 -28.593 446 HG SER 57 HG SER 57 -1.031 -9.243 -26.143 447 H LYS 58 H LYS 58 -2.678 -6.773 -27.789 448 HA LYS 58 HA LYS 58 -0.458 -5.372 -28.978 449 1HB LYS 58 1HB LYS 58 -1.987 -3.854 -30.231 450 2HB LYS 58 2HB LYS 58 -1.903 -5.494 -30.839 451 1HG LYS 58 1HG LYS 58 -4.051 -5.925 -29.523 452 2HG LYS 58 2HG LYS 58 -4.165 -4.170 -29.361 453 1HD LYS 58 1HD LYS 58 -4.014 -3.970 -31.811 454 2HD LYS 58 2HD LYS 58 -3.953 -5.729 -31.908 455 1HE LYS 58 1HE LYS 58 -6.191 -5.067 -32.413 456 2HE LYS 58 2HE LYS 58 -6.196 -5.797 -30.812 457 1HZ LYS 58 1HZ LYS 58 -7.527 -3.790 -30.941 458 2HZ LYS 58 2HZ LYS 58 -6.202 -2.873 -31.359 459 3HZ LYS 58 3HZ LYS 58 -6.295 -3.561 -29.833 460 H GLY 59 H GLY 59 0.294 -4.105 -27.547 461 1HA GLY 59 1HA GLY 59 0.463 -2.284 -26.166 462 2HA GLY 59 2HA GLY 59 -1.220 -1.936 -26.496 463 H ASP 60 H ASP 60 -2.779 -3.094 -25.283 464 HA ASP 60 HA ASP 60 -1.916 -3.994 -22.592 465 1HB ASP 60 1HB ASP 60 -2.445 -1.552 -22.525 466 2HB ASP 60 2HB ASP 60 -4.026 -1.930 -23.197 467 H GLU 61 H GLU 61 -3.559 -4.777 -25.351 468 HA GLU 61 HA GLU 61 -5.690 -6.061 -23.866 469 1HB GLU 61 1HB GLU 61 -7.246 -5.610 -25.649 470 2HB GLU 61 2HB GLU 61 -6.588 -4.090 -25.059 471 1HG GLU 61 1HG GLU 61 -5.053 -4.033 -26.933 472 2HG GLU 61 2HG GLU 61 -5.715 -5.557 -27.516 473 H ALA 62 H ALA 62 -6.542 -7.843 -24.939 474 HA ALA 62 HA ALA 62 -4.806 -8.983 -26.908 475 1HB ALA 62 1HB ALA 62 -6.018 -10.425 -24.539 476 2HB ALA 62 2HB ALA 62 -4.300 -10.118 -24.816 477 3HB ALA 62 3HB ALA 62 -5.188 -11.217 -25.877 478 H THR 63 H THR 63 -5.975 -9.475 -28.589 479 HA THR 63 HA THR 63 -8.911 -9.591 -28.393 480 HB THR 63 HB THR 63 -7.346 -8.731 -30.826 481 HG1 THR 63 HG1 THR 63 -8.298 -6.824 -28.931 482 1HG2 THR 63 1HG2 THR 63 -9.753 -9.176 -30.974 483 2HG2 THR 63 2HG2 THR 63 -9.374 -7.484 -31.297 484 3HG2 THR 63 3HG2 THR 63 -10.056 -7.959 -29.736 485 H VAL 64 H VAL 64 -9.733 -11.664 -29.137 486 HA VAL 64 HA VAL 64 -7.898 -13.090 -30.851 487 HB VAL 64 HB VAL 64 -7.943 -14.113 -28.597 488 1HG1 VAL 64 1HG1 VAL 64 -10.852 -14.431 -28.886 489 2HG1 VAL 64 2HG1 VAL 64 -9.977 -13.362 -27.795 490 3HG1 VAL 64 3HG1 VAL 64 -9.829 -15.111 -27.619 491 1HG2 VAL 64 1HG2 VAL 64 -7.629 -15.623 -30.483 492 2HG2 VAL 64 2HG2 VAL 64 -9.375 -15.814 -30.626 493 3HG2 VAL 64 3HG2 VAL 64 -8.536 -16.409 -29.192 494 H TYR 65 H TYR 65 -8.603 -12.939 -32.771 495 HA TYR 65 HA TYR 65 -11.534 -12.916 -33.451 496 1HB TYR 65 1HB TYR 65 -9.353 -11.050 -33.923 497 2HB TYR 65 2HB TYR 65 -10.085 -11.594 -35.409 498 HD1 TYR 65 HD1 TYR 65 -11.943 -10.471 -36.231 499 HD2 TYR 65 HD2 TYR 65 -10.922 -10.073 -32.134 500 HE1 TYR 65 HE1 TYR 65 -13.606 -8.671 -36.010 501 HE2 TYR 65 HE2 TYR 65 -12.589 -8.270 -31.888 502 HH TYR 65 HH TYR 65 -14.968 -7.679 -34.128 503 H LYS 66 H LYS 66 -11.558 -15.220 -34.368 504 HA LYS 66 HA LYS 66 -9.963 -15.445 -36.697 505 1HB LYS 66 1HB LYS 66 -10.664 -17.486 -35.390 506 2HB LYS 66 2HB LYS 66 -12.339 -17.035 -35.646 507 1HG LYS 66 1HG LYS 66 -11.775 -18.793 -37.155 508 2HG LYS 66 2HG LYS 66 -12.001 -17.299 -38.062 509 1HD LYS 66 1HD LYS 66 -9.561 -16.994 -38.183 510 2HD LYS 66 2HD LYS 66 -9.334 -18.490 -37.274 511 1HE LYS 66 1HE LYS 66 -10.460 -19.733 -39.052 512 2HE LYS 66 2HE LYS 66 -10.656 -18.246 -39.980 513 1HZ LYS 66 1HZ LYS 66 -8.781 -19.467 -40.786 514 2HZ LYS 66 2HZ LYS 66 -8.142 -19.624 -39.253 515 3HZ LYS 66 3HZ LYS 66 -8.186 -18.100 -39.993 516 H ARG 67 H ARG 67 -11.038 -15.233 -38.580 517 HA ARG 67 HA ARG 67 -12.512 -12.952 -38.933 518 1HB ARG 67 1HB ARG 67 -11.317 -13.985 -40.793 519 2HB ARG 67 2HB ARG 67 -12.512 -15.273 -40.867 520 1HG ARG 67 1HG ARG 67 -12.852 -13.592 -42.612 521 2HG ARG 67 2HG ARG 67 -14.232 -13.664 -41.507 522 1HD ARG 67 1HD ARG 67 -13.283 -11.749 -40.284 523 2HD ARG 67 2HD ARG 67 -12.001 -11.627 -41.490 524 HE ARG 67 HE ARG 67 -14.258 -11.511 -42.955 525 1HH1 ARG 67 1HH1 ARG 67 -13.142 -9.681 -40.124 526 2HH1 ARG 67 2HH1 ARG 67 -14.034 -8.284 -40.473 527 1HH2 ARG 67 1HH2 ARG 67 -15.496 -9.622 -43.437 528 2HH2 ARG 67 2HH2 ARG 67 -15.395 -8.230 -42.484 529 H ASP 68 H ASP 68 -13.887 -16.184 -38.570 530 HA ASP 68 HA ASP 68 -16.544 -14.948 -38.585 531 1HB ASP 68 1HB ASP 68 -16.276 -16.892 -40.099 532 2HB ASP 68 2HB ASP 68 -15.816 -17.883 -38.722 533 H ARG 69 H ARG 69 -14.145 -15.838 -36.426 534 HA ARG 69 HA ARG 69 -16.156 -16.176 -34.478 535 1HB ARG 69 1HB ARG 69 -15.770 -18.465 -35.216 536 2HB ARG 69 2HB ARG 69 -14.078 -18.330 -34.754 537 1HG ARG 69 1HG ARG 69 -15.348 -19.528 -33.048 538 2HG ARG 69 2HG ARG 69 -14.736 -17.972 -32.447 539 1HD ARG 69 1HD ARG 69 -16.864 -16.939 -32.689 540 2HD ARG 69 2HD ARG 69 -17.516 -18.337 -33.539 541 HE ARG 69 HE ARG 69 -17.138 -19.530 -31.364 542 1HH1 ARG 69 1HH1 ARG 69 -17.574 -16.021 -31.289 543 2HH1 ARG 69 2HH1 ARG 69 -18.544 -16.044 -29.888 544 1HH2 ARG 69 1HH2 ARG 69 -18.446 -19.532 -29.442 545 2HH2 ARG 69 2HH2 ARG 69 -19.067 -18.085 -28.816 546 H ILE 70 H ILE 70 -15.527 -14.350 -33.521 547 HA ILE 70 HA ILE 70 -12.946 -14.086 -32.229 548 HB ILE 70 HB ILE 70 -15.537 -12.646 -31.752 549 1HG1 ILE 70 1HG1 ILE 70 -14.397 -10.703 -33.074 550 2HG1 ILE 70 2HG1 ILE 70 -13.399 -11.991 -33.727 551 1HG2 ILE 70 1HG2 ILE 70 -13.992 -12.373 -29.953 552 2HG2 ILE 70 2HG2 ILE 70 -14.187 -10.843 -30.804 553 3HG2 ILE 70 3HG2 ILE 70 -12.738 -11.817 -31.066 554 1HD1 ILE 70 1HD1 ILE 70 -15.219 -11.337 -35.219 555 2HD1 ILE 70 2HD1 ILE 70 -16.394 -11.835 -34.002 556 3HD1 ILE 70 3HD1 ILE 70 -15.322 -13.027 -34.747 557 H VAL 71 H VAL 71 -12.655 -14.637 -30.266 558 HA VAL 71 HA VAL 71 -15.000 -15.871 -29.011 559 HB VAL 71 HB VAL 71 -13.771 -17.613 -27.833 560 1HG1 VAL 71 1HG1 VAL 71 -14.596 -18.177 -29.999 561 2HG1 VAL 71 2HG1 VAL 71 -13.048 -18.987 -29.725 562 3HG1 VAL 71 3HG1 VAL 71 -13.121 -17.570 -30.754 563 1HG2 VAL 71 1HG2 VAL 71 -11.594 -16.419 -27.569 564 2HG2 VAL 71 2HG2 VAL 71 -11.236 -16.788 -29.269 565 3HG2 VAL 71 3HG2 VAL 71 -11.435 -18.086 -28.088 566 H LEU 72 H LEU 72 -12.806 -13.523 -28.735 567 HA LEU 72 HA LEU 72 -14.104 -12.544 -26.470 568 1HB LEU 72 1HB LEU 72 -12.206 -14.190 -25.676 569 2HB LEU 72 2HB LEU 72 -11.225 -12.758 -25.855 570 HG LEU 72 HG LEU 72 -12.224 -13.094 -23.497 571 1HD1 LEU 72 1HD1 LEU 72 -13.154 -10.662 -24.923 572 2HD1 LEU 72 2HD1 LEU 72 -11.476 -10.878 -24.362 573 3HD1 LEU 72 3HD1 LEU 72 -12.809 -10.767 -23.200 574 1HD2 LEU 72 1HD2 LEU 72 -14.524 -13.740 -24.543 575 2HD2 LEU 72 2HD2 LEU 72 -14.761 -11.994 -24.595 576 3HD2 LEU 72 3HD2 LEU 72 -14.442 -12.792 -23.068 577 H ASN 73 H ASN 73 -13.869 -10.164 -26.958 578 HA ASN 73 HA ASN 73 -11.321 -9.428 -28.227 579 1HB ASN 73 1HB ASN 73 -12.401 -7.719 -29.647 580 2HB ASN 73 2HB ASN 73 -12.963 -9.338 -30.007 581 1HD2 ASN 73 1HD2 ASN 73 -14.120 -6.714 -30.541 582 2HD2 ASN 73 2HD2 ASN 73 -15.700 -6.734 -29.860 583 H ASN 74 H ASN 74 -12.247 -9.232 -25.489 584 HA ASN 74 HA ASN 74 -11.283 -6.560 -25.004 585 1HB ASN 74 1HB ASN 74 -13.755 -6.247 -25.027 586 2HB ASN 74 2HB ASN 74 -13.910 -7.463 -23.764 587 1HD2 ASN 74 1HD2 ASN 74 -14.846 -6.028 -22.311 588 2HD2 ASN 74 2HD2 ASN 74 -13.958 -4.741 -21.569 589 H CYS 75 H CYS 75 -9.566 -8.032 -24.499 590 HA CYS 75 HA CYS 75 -9.693 -8.989 -21.749 591 1HB CYS 75 1HB CYS 75 -8.210 -10.112 -24.122 592 2HB CYS 75 2HB CYS 75 -7.607 -10.364 -22.487 593 H GLN 76 H GLN 76 -8.066 -8.219 -20.454 594 HA GLN 76 HA GLN 76 -6.548 -6.108 -21.729 595 1HB GLN 76 1HB GLN 76 -8.327 -5.871 -19.313 596 2HB GLN 76 2HB GLN 76 -7.256 -4.612 -19.933 597 1HG GLN 76 1HG GLN 76 -8.426 -4.341 -21.835 598 2HG GLN 76 2HG GLN 76 -9.308 -5.848 -21.706 599 1HE2 GLN 76 1HE2 GLN 76 -10.909 -5.999 -20.081 600 2HE2 GLN 76 2HE2 GLN 76 -11.739 -4.621 -19.467 601 H LEU 77 H LEU 77 -4.674 -6.124 -21.017 602 HA LEU 77 HA LEU 77 -4.262 -8.244 -19.209 603 1HB LEU 77 1HB LEU 77 -2.950 -8.454 -21.105 604 2HB LEU 77 2HB LEU 77 -2.304 -6.831 -20.985 605 HG LEU 77 HG LEU 77 -0.989 -7.583 -18.958 606 1HD1 LEU 77 1HD1 LEU 77 -2.164 -10.235 -19.626 607 2HD1 LEU 77 2HD1 LEU 77 -2.370 -9.309 -18.146 608 3HD1 LEU 77 3HD1 LEU 77 -0.788 -9.978 -18.555 609 1HD2 LEU 77 1HD2 LEU 77 0.104 -7.554 -21.101 610 2HD2 LEU 77 2HD2 LEU 77 -0.609 -9.094 -21.533 611 3HD2 LEU 77 3HD2 LEU 77 0.592 -9.022 -20.245 612 H GLN 78 H GLN 78 -3.756 -7.836 -17.004 613 HA GLN 78 HA GLN 78 -3.229 -5.114 -16.326 614 1HB GLN 78 1HB GLN 78 -3.077 -5.931 -13.955 615 2HB GLN 78 2HB GLN 78 -4.602 -6.224 -14.761 616 1HG GLN 78 1HG GLN 78 -3.963 -8.527 -15.139 617 2HG GLN 78 2HG GLN 78 -2.416 -8.228 -14.344 618 1HE2 GLN 78 1HE2 GLN 78 -5.836 -8.392 -13.899 619 2HE2 GLN 78 2HE2 GLN 78 -5.828 -8.665 -12.201 620 H ASN 79 H ASN 79 -1.280 -8.095 -15.835 621 HA ASN 79 HA ASN 79 1.102 -6.962 -16.688 622 1HB ASN 79 1HB ASN 79 0.768 -5.668 -14.504 623 2HB ASN 79 2HB ASN 79 0.831 -7.217 -13.674 624 1HD2 ASN 79 1HD2 ASN 79 2.551 -6.412 -12.523 625 2HD2 ASN 79 2HD2 ASN 79 4.156 -6.369 -13.174 626 HA PRO 80 HA PRO 80 0.638 -11.252 -17.025 627 1HB PRO 80 1HB PRO 80 3.108 -11.891 -18.138 628 2HB PRO 80 2HB PRO 80 1.657 -11.409 -19.011 629 1HG PRO 80 1HG PRO 80 4.021 -9.802 -18.216 630 2HG PRO 80 2HG PRO 80 2.996 -9.644 -19.649 631 1HD PRO 80 1HD PRO 80 2.848 -7.952 -17.516 632 2HD PRO 80 2HD PRO 80 1.460 -8.331 -18.556 633 H GLN 81 H GLN 81 4.103 -10.740 -16.094 634 HA GLN 81 HA GLN 81 3.790 -13.005 -14.354 635 1HB GLN 81 1HB GLN 81 6.267 -12.945 -14.163 636 2HB GLN 81 2HB GLN 81 5.620 -13.310 -15.765 637 1HG GLN 81 1HG GLN 81 6.121 -11.066 -16.492 638 2HG GLN 81 2HG GLN 81 6.657 -10.629 -14.867 639 1HE2 GLN 81 1HE2 GLN 81 7.330 -12.536 -17.655 640 2HE2 GLN 81 2HE2 GLN 81 9.009 -12.805 -17.344 641 H ARG 82 H ARG 82 3.479 -9.902 -14.103 642 HA ARG 82 HA ARG 82 3.407 -8.331 -12.534 643 1HB ARG 82 1HB ARG 82 3.859 -10.645 -10.716 644 2HB ARG 82 2HB ARG 82 3.465 -9.021 -10.127 645 1HG ARG 82 1HG ARG 82 1.317 -9.163 -11.297 646 2HG ARG 82 2HG ARG 82 1.748 -10.771 -11.886 647 1HD ARG 82 1HD ARG 82 1.961 -11.498 -9.504 648 2HD ARG 82 2HD ARG 82 1.339 -9.923 -9.031 649 HE ARG 82 HE ARG 82 -0.730 -10.453 -10.058 650 1HH1 ARG 82 1HH1 ARG 82 1.490 -13.199 -9.777 651 2HH1 ARG 82 2HH1 ARG 82 0.286 -14.375 -9.922 652 1HH2 ARG 82 1HH2 ARG 82 -2.386 -12.054 -10.263 653 2HH2 ARG 82 2HH2 ARG 82 -1.993 -13.708 -10.171 Start of MODEL 20 1 H MET 1 H MET 1 6.016 -24.814 -15.355 2 HA MET 1 HA MET 1 4.512 -23.547 -16.692 3 1HB MET 1 1HB MET 1 2.422 -24.306 -15.634 4 2HB MET 1 2HB MET 1 2.859 -23.462 -14.159 5 1HG MET 1 1HG MET 1 2.713 -21.326 -15.318 6 2HG MET 1 2HG MET 1 2.296 -22.158 -16.816 7 1HE MET 1 1HE MET 1 0.577 -19.786 -15.486 8 2HE MET 1 2HE MET 1 -1.058 -20.397 -15.735 9 3HE MET 1 3HE MET 1 0.145 -20.561 -17.010 10 H GLN 2 H GLN 2 6.152 -22.156 -16.813 11 HA GLN 2 HA GLN 2 6.476 -20.159 -14.674 12 1HB GLN 2 1HB GLN 2 8.672 -21.575 -16.213 13 2HB GLN 2 2HB GLN 2 8.937 -20.183 -15.169 14 1HG GLN 2 1HG GLN 2 8.257 -21.421 -13.238 15 2HG GLN 2 2HG GLN 2 7.747 -22.778 -14.234 16 1HE2 GLN 2 1HE2 GLN 2 9.281 -24.113 -15.104 17 2HE2 GLN 2 2HE2 GLN 2 10.911 -24.149 -14.548 18 H THR 3 H THR 3 5.099 -20.480 -17.297 19 HA THR 3 HA THR 3 6.287 -18.826 -19.253 20 HB THR 3 HB THR 3 3.484 -19.131 -19.468 21 HG1 THR 3 HG1 THR 3 3.750 -21.626 -19.292 22 1HG2 THR 3 1HG2 THR 3 5.160 -19.129 -21.250 23 2HG2 THR 3 2HG2 THR 3 4.127 -20.559 -21.339 24 3HG2 THR 3 3HG2 THR 3 5.770 -20.690 -20.695 25 H ASP 4 H ASP 4 5.398 -16.822 -19.941 26 HA ASP 4 HA ASP 4 4.428 -15.271 -17.724 27 1HB ASP 4 1HB ASP 4 6.186 -14.336 -19.258 28 2HB ASP 4 2HB ASP 4 5.019 -14.348 -20.567 29 H THR 5 H THR 5 2.375 -13.744 -18.297 30 HA THR 5 HA THR 5 0.585 -15.180 -19.981 31 HB THR 5 HB THR 5 0.436 -16.587 -18.000 32 HG1 THR 5 HG1 THR 5 -1.825 -15.818 -17.251 33 1HG2 THR 5 1HG2 THR 5 1.299 -15.051 -16.323 34 2HG2 THR 5 2HG2 THR 5 -0.248 -15.712 -15.795 35 3HG2 THR 5 3HG2 THR 5 -0.163 -14.072 -16.440 36 H LEU 6 H LEU 6 -1.720 -14.171 -19.303 37 HA LEU 6 HA LEU 6 -1.221 -11.294 -19.074 38 1HB LEU 6 1HB LEU 6 -3.370 -12.657 -20.688 39 2HB LEU 6 2HB LEU 6 -3.374 -10.932 -20.357 40 HG LEU 6 HG LEU 6 -1.208 -12.391 -21.835 41 1HD1 LEU 6 1HD1 LEU 6 -3.272 -12.241 -23.094 42 2HD1 LEU 6 2HD1 LEU 6 -2.034 -11.188 -23.787 43 3HD1 LEU 6 3HD1 LEU 6 -3.338 -10.503 -22.807 44 1HD2 LEU 6 1HD2 LEU 6 -0.347 -10.142 -22.338 45 2HD2 LEU 6 2HD2 LEU 6 -0.348 -10.423 -20.600 46 3HD2 LEU 6 3HD2 LEU 6 -1.600 -9.440 -21.329 47 H GLU 7 H GLU 7 -4.309 -11.073 -18.827 48 HA GLU 7 HA GLU 7 -4.052 -10.426 -16.073 49 1HB GLU 7 1HB GLU 7 -5.334 -9.047 -17.604 50 2HB GLU 7 2HB GLU 7 -6.386 -10.393 -17.998 51 1HG GLU 7 1HG GLU 7 -7.207 -10.442 -15.729 52 2HG GLU 7 2HG GLU 7 -6.148 -9.101 -15.301 53 H TYR 8 H TYR 8 -4.888 -13.105 -17.817 54 HA TYR 8 HA TYR 8 -5.926 -14.825 -17.688 55 1HB TYR 8 1HB TYR 8 -5.366 -16.404 -15.781 56 2HB TYR 8 2HB TYR 8 -4.058 -15.627 -16.644 57 HD1 TYR 8 HD1 TYR 8 -5.936 -15.671 -13.467 58 HD2 TYR 8 HD2 TYR 8 -2.491 -14.263 -15.512 59 HE1 TYR 8 HE1 TYR 8 -4.942 -15.001 -11.329 60 HE2 TYR 8 HE2 TYR 8 -1.492 -13.579 -13.383 61 HH TYR 8 HH TYR 8 -2.148 -13.036 -11.174 62 H GLN 9 H GLN 9 -7.568 -12.601 -16.162 63 HA GLN 9 HA GLN 9 -9.828 -14.294 -15.604 64 1HB GLN 9 1HB GLN 9 -8.649 -12.433 -13.531 65 2HB GLN 9 2HB GLN 9 -10.282 -13.083 -13.447 66 1HG GLN 9 1HG GLN 9 -9.462 -15.274 -13.421 67 2HG GLN 9 2HG GLN 9 -7.820 -14.702 -13.643 68 1HE2 GLN 9 1HE2 GLN 9 -10.405 -15.056 -11.375 69 2HE2 GLN 9 2HE2 GLN 9 -9.536 -14.651 -9.950 70 H CYS 10 H CYS 10 -10.025 -13.267 -17.527 71 HA CYS 10 HA CYS 10 -10.426 -10.383 -17.542 72 1HB CYS 10 1HB CYS 10 -10.716 -12.294 -19.842 73 2HB CYS 10 2HB CYS 10 -10.478 -10.542 -19.896 74 H ASP 11 H ASP 11 -12.352 -9.595 -18.765 75 HA ASP 11 HA ASP 11 -14.657 -10.042 -17.464 76 1HB ASP 11 1HB ASP 11 -14.511 -8.124 -18.798 77 2HB ASP 11 2HB ASP 11 -14.244 -9.062 -20.263 78 H GLU 12 H GLU 12 -14.135 -11.422 -20.673 79 HA GLU 12 HA GLU 12 -16.493 -13.056 -20.253 80 1HB GLU 12 1HB GLU 12 -16.252 -11.816 -22.327 81 2HB GLU 12 2HB GLU 12 -14.755 -12.663 -22.675 82 1HG GLU 12 1HG GLU 12 -16.370 -13.688 -24.009 83 2HG GLU 12 2HG GLU 12 -16.064 -14.743 -22.624 84 H LYS 13 H LYS 13 -13.005 -13.480 -20.317 85 HA LYS 13 HA LYS 13 -13.382 -16.389 -20.225 86 1HB LYS 13 1HB LYS 13 -11.345 -15.036 -21.995 87 2HB LYS 13 2HB LYS 13 -11.631 -16.753 -21.828 88 1HG LYS 13 1HG LYS 13 -13.563 -14.781 -22.931 89 2HG LYS 13 2HG LYS 13 -12.484 -15.735 -23.915 90 1HD LYS 13 1HD LYS 13 -13.488 -17.801 -23.150 91 2HD LYS 13 2HD LYS 13 -14.566 -16.930 -22.030 92 1HE LYS 13 1HE LYS 13 -15.482 -15.845 -24.162 93 2HE LYS 13 2HE LYS 13 -14.555 -17.057 -25.034 94 1HZ LYS 13 1HZ LYS 13 -16.809 -17.840 -24.690 95 2HZ LYS 13 2HZ LYS 13 -16.665 -17.561 -23.046 96 3HZ LYS 13 3HZ LYS 13 -15.773 -18.783 -23.730 97 HA PRO 14 HA PRO 14 -9.977 -15.575 -17.626 98 1HB PRO 14 1HB PRO 14 -9.206 -18.173 -17.038 99 2HB PRO 14 2HB PRO 14 -10.525 -17.342 -16.213 100 1HG PRO 14 1HG PRO 14 -10.640 -19.403 -18.343 101 2HG PRO 14 2HG PRO 14 -11.791 -19.064 -17.044 102 1HD PRO 14 1HD PRO 14 -12.057 -18.284 -19.720 103 2HD PRO 14 2HD PRO 14 -12.976 -17.634 -18.352 104 H LEU 15 H LEU 15 -8.010 -15.037 -18.559 105 HA LEU 15 HA LEU 15 -7.276 -16.350 -21.061 106 1HB LEU 15 1HB LEU 15 -7.987 -14.072 -21.287 107 2HB LEU 15 2HB LEU 15 -6.932 -13.580 -19.985 108 HG LEU 15 HG LEU 15 -4.980 -14.058 -21.464 109 1HD1 LEU 15 1HD1 LEU 15 -7.068 -14.336 -23.591 110 2HD1 LEU 15 2HD1 LEU 15 -6.093 -15.642 -22.940 111 3HD1 LEU 15 3HD1 LEU 15 -5.319 -14.323 -23.830 112 1HD2 LEU 15 1HD2 LEU 15 -5.297 -12.086 -22.884 113 2HD2 LEU 15 2HD2 LEU 15 -5.787 -11.822 -21.212 114 3HD2 LEU 15 3HD2 LEU 15 -7.006 -12.086 -22.454 115 H THR 16 H THR 16 -6.233 -17.903 -19.534 116 HA THR 16 HA THR 16 -3.945 -16.679 -18.414 117 HB THR 16 HB THR 16 -4.445 -19.657 -18.112 118 HG1 THR 16 HG1 THR 16 -6.285 -18.823 -17.260 119 1HG2 THR 16 1HG2 THR 16 -2.275 -18.774 -17.429 120 2HG2 THR 16 2HG2 THR 16 -3.222 -19.201 -15.988 121 3HG2 THR 16 3HG2 THR 16 -3.097 -17.512 -16.518 122 H VAL 17 H VAL 17 -2.643 -16.280 -20.008 123 HA VAL 17 HA VAL 17 -2.340 -17.916 -22.313 124 HB VAL 17 HB VAL 17 -0.854 -15.412 -21.481 125 1HG1 VAL 17 1HG1 VAL 17 0.419 -16.650 -23.175 126 2HG1 VAL 17 2HG1 VAL 17 -0.264 -15.180 -23.857 127 3HG1 VAL 17 3HG1 VAL 17 -1.026 -16.735 -24.173 128 1HG2 VAL 17 1HG2 VAL 17 -2.346 -14.263 -23.035 129 2HG2 VAL 17 2HG2 VAL 17 -3.213 -15.024 -21.699 130 3HG2 VAL 17 3HG2 VAL 17 -3.220 -15.774 -23.296 131 H LYS 18 H LYS 18 -0.491 -19.118 -22.867 132 HA LYS 18 HA LYS 18 1.572 -19.164 -20.812 133 1HB LYS 18 1HB LYS 18 0.848 -21.251 -22.854 134 2HB LYS 18 2HB LYS 18 2.353 -21.305 -21.966 135 1HG LYS 18 1HG LYS 18 0.823 -22.819 -20.895 136 2HG LYS 18 2HG LYS 18 1.032 -21.419 -19.845 137 1HD LYS 18 1HD LYS 18 -1.069 -20.497 -20.746 138 2HD LYS 18 2HD LYS 18 -1.302 -21.980 -21.671 139 1HE LYS 18 1HE LYS 18 -1.301 -23.260 -19.567 140 2HE LYS 18 2HE LYS 18 -1.108 -21.755 -18.671 141 1HZ LYS 18 1HZ LYS 18 -3.273 -21.026 -19.703 142 2HZ LYS 18 2HZ LYS 18 -3.368 -22.338 -18.661 143 3HZ LYS 18 3HZ LYS 18 -3.455 -22.607 -20.274 144 H LEU 19 H LEU 19 2.263 -17.236 -21.564 145 HA LEU 19 HA LEU 19 3.045 -16.839 -24.241 146 1HB LEU 19 1HB LEU 19 2.246 -15.317 -22.158 147 2HB LEU 19 2HB LEU 19 3.982 -15.160 -22.048 148 HG LEU 19 HG LEU 19 2.313 -14.530 -24.414 149 1HD1 LEU 19 1HD1 LEU 19 1.859 -12.991 -22.612 150 2HD1 LEU 19 2HD1 LEU 19 2.813 -12.149 -23.836 151 3HD1 LEU 19 3HD1 LEU 19 3.580 -12.728 -22.352 152 1HD2 LEU 19 1HD2 LEU 19 5.241 -13.982 -23.906 153 2HD2 LEU 19 2HD2 LEU 19 4.336 -13.375 -25.293 154 3HD2 LEU 19 3HD2 LEU 19 4.578 -15.112 -25.087 155 H ASN 20 H ASN 20 4.623 -18.186 -24.711 156 HA ASN 20 HA ASN 20 7.022 -18.281 -23.066 157 1HB ASN 20 1HB ASN 20 6.219 -20.273 -24.498 158 2HB ASN 20 2HB ASN 20 6.710 -19.347 -25.911 159 1HD2 ASN 20 1HD2 ASN 20 7.647 -21.911 -25.008 160 2HD2 ASN 20 2HD2 ASN 20 9.336 -21.808 -24.744 161 H ASN 21 H ASN 21 7.766 -16.257 -23.034 162 HA ASN 21 HA ASN 21 7.339 -14.318 -24.964 163 1HB ASN 21 1HB ASN 21 7.747 -13.716 -22.659 164 2HB ASN 21 2HB ASN 21 9.408 -14.292 -22.814 165 1HD2 ASN 21 1HD2 ASN 21 7.171 -11.742 -23.768 166 2HD2 ASN 21 2HD2 ASN 21 8.379 -10.645 -24.283 167 HA PRO 22 HA PRO 22 11.943 -14.417 -26.477 168 1HB PRO 22 1HB PRO 22 12.685 -17.260 -26.103 169 2HB PRO 22 2HB PRO 22 13.640 -15.801 -25.827 170 1HG PRO 22 1HG PRO 22 12.705 -17.212 -23.774 171 2HG PRO 22 2HG PRO 22 12.731 -15.440 -23.727 172 1HD PRO 22 1HD PRO 22 10.440 -17.287 -24.274 173 2HD PRO 22 2HD PRO 22 10.495 -15.836 -23.255 174 H ARG 23 H ARG 23 9.653 -16.874 -26.830 175 HA ARG 23 HA ARG 23 10.491 -17.398 -29.620 176 1HB ARG 23 1HB ARG 23 10.177 -19.415 -28.240 177 2HB ARG 23 2HB ARG 23 8.512 -18.943 -27.925 178 1HG ARG 23 1HG ARG 23 8.051 -19.094 -30.337 179 2HG ARG 23 2HG ARG 23 9.691 -19.695 -30.597 180 1HD ARG 23 1HD ARG 23 7.561 -20.988 -28.896 181 2HD ARG 23 2HD ARG 23 8.011 -21.488 -30.521 182 HE ARG 23 HE ARG 23 10.307 -21.550 -28.973 183 1HH1 ARG 23 1HH1 ARG 23 7.174 -23.241 -29.172 184 2HH1 ARG 23 2HH1 ARG 23 7.789 -24.667 -28.474 185 1HH2 ARG 23 1HH2 ARG 23 11.088 -23.526 -28.021 186 2HH2 ARG 23 2HH2 ARG 23 10.028 -24.845 -27.821 187 H GLN 24 H GLN 24 8.020 -15.972 -27.687 188 HA GLN 24 HA GLN 24 6.093 -15.053 -27.963 189 1HB GLN 24 1HB GLN 24 7.235 -14.605 -30.658 190 2HB GLN 24 2HB GLN 24 5.630 -13.955 -30.269 191 1HG GLN 24 1HG GLN 24 6.748 -12.784 -28.336 192 2HG GLN 24 2HG GLN 24 8.292 -13.308 -28.998 193 1HE2 GLN 24 1HE2 GLN 24 8.995 -12.421 -30.932 194 2HE2 GLN 24 2HE2 GLN 24 8.339 -10.950 -31.557 195 H GLU 25 H GLU 25 5.870 -17.481 -27.741 196 HA GLU 25 HA GLU 25 3.790 -18.372 -29.622 197 1HB GLU 25 1HB GLU 25 5.807 -19.822 -29.562 198 2HB GLU 25 2HB GLU 25 5.562 -20.002 -27.820 199 1HG GLU 25 1HG GLU 25 3.397 -21.096 -28.288 200 2HG GLU 25 2HG GLU 25 3.752 -20.990 -30.013 201 H VAL 26 H VAL 26 1.937 -18.652 -28.713 202 HA VAL 26 HA VAL 26 1.672 -18.577 -25.719 203 HB VAL 26 HB VAL 26 -0.420 -17.404 -25.963 204 1HG1 VAL 26 1HG1 VAL 26 0.532 -15.148 -26.529 205 2HG1 VAL 26 2HG1 VAL 26 1.941 -15.956 -27.224 206 3HG1 VAL 26 3HG1 VAL 26 1.599 -16.100 -25.499 207 1HG2 VAL 26 1HG2 VAL 26 0.332 -17.109 -28.856 208 2HG2 VAL 26 2HG2 VAL 26 -0.955 -16.209 -28.058 209 3HG2 VAL 26 3HG2 VAL 26 -1.063 -17.968 -28.198 210 H SER 27 H SER 27 0.671 -20.138 -24.845 211 HA SER 27 HA SER 27 -1.157 -21.676 -26.517 212 1HB SER 27 1HB SER 27 -0.442 -22.358 -23.663 213 2HB SER 27 2HB SER 27 -0.991 -23.396 -24.964 214 HG SER 27 HG SER 27 0.967 -23.573 -25.747 215 H PHE 28 H PHE 28 -3.209 -21.219 -26.328 216 HA PHE 28 HA PHE 28 -4.110 -19.935 -23.935 217 1HB PHE 28 1HB PHE 28 -3.757 -18.022 -25.109 218 2HB PHE 28 2HB PHE 28 -4.237 -18.691 -26.673 219 HD1 PHE 28 HD1 PHE 28 -5.847 -18.100 -23.311 220 HD2 PHE 28 HD2 PHE 28 -6.126 -17.688 -27.521 221 HE1 PHE 28 HE1 PHE 28 -8.062 -17.039 -23.067 222 HE2 PHE 28 HE2 PHE 28 -8.328 -16.634 -27.284 223 HZ PHE 28 HZ PHE 28 -9.305 -16.313 -25.056 224 H VAL 29 H VAL 29 -6.139 -20.018 -23.542 225 HA VAL 29 HA VAL 29 -7.308 -22.493 -24.203 226 HB VAL 29 HB VAL 29 -7.024 -21.786 -21.917 227 1HG1 VAL 29 1HG1 VAL 29 -7.172 -19.399 -22.091 228 2HG1 VAL 29 2HG1 VAL 29 -8.338 -19.964 -20.899 229 3HG1 VAL 29 3HG1 VAL 29 -8.874 -19.496 -22.506 230 1HG2 VAL 29 1HG2 VAL 29 -9.918 -22.008 -22.729 231 2HG2 VAL 29 2HG2 VAL 29 -9.307 -22.199 -21.083 232 3HG2 VAL 29 3HG2 VAL 29 -8.793 -23.322 -22.345 233 H TYR 30 H TYR 30 -8.509 -22.666 -25.664 234 HA TYR 30 HA TYR 30 -10.140 -20.603 -26.935 235 1HB TYR 30 1HB TYR 30 -9.025 -22.265 -28.417 236 2HB TYR 30 2HB TYR 30 -9.867 -23.554 -27.596 237 HD1 TYR 30 HD1 TYR 30 -11.268 -24.564 -29.145 238 HD2 TYR 30 HD2 TYR 30 -11.184 -20.310 -28.972 239 HE1 TYR 30 HE1 TYR 30 -13.106 -24.464 -30.768 240 HE2 TYR 30 HE2 TYR 30 -13.014 -20.205 -30.602 241 HH TYR 30 HH TYR 30 -13.963 -21.631 -32.373 242 H ASP 31 H ASP 31 -10.919 -20.466 -24.807 243 HA ASP 31 HA ASP 31 -12.529 -20.349 -23.457 244 1HB ASP 31 1HB ASP 31 -14.113 -20.289 -25.273 245 2HB ASP 31 2HB ASP 31 -14.114 -22.044 -25.388 246 H ASN 32 H ASN 32 -12.454 -23.718 -24.518 247 HA ASN 32 HA ASN 32 -11.912 -24.495 -21.756 248 1HB ASN 32 1HB ASN 32 -14.312 -25.392 -23.298 249 2HB ASN 32 2HB ASN 32 -13.542 -26.519 -22.190 250 1HD2 ASN 32 1HD2 ASN 32 -15.416 -23.546 -22.452 251 2HD2 ASN 32 2HD2 ASN 32 -15.792 -23.450 -20.787 252 H GLN 33 H GLN 33 -10.214 -24.478 -24.265 253 HA GLN 33 HA GLN 33 -9.076 -27.028 -23.871 254 1HB GLN 33 1HB GLN 33 -9.149 -27.793 -26.155 255 2HB GLN 33 2HB GLN 33 -10.808 -27.513 -25.656 256 1HG GLN 33 1HG GLN 33 -10.766 -25.371 -26.789 257 2HG GLN 33 2HG GLN 33 -9.111 -25.711 -27.316 258 1HE2 GLN 33 1HE2 GLN 33 -8.774 -27.378 -28.871 259 2HE2 GLN 33 2HE2 GLN 33 -10.064 -27.972 -29.840 260 H LEU 34 H LEU 34 -6.973 -27.032 -24.938 261 HA LEU 34 HA LEU 34 -6.095 -24.247 -25.036 262 1HB LEU 34 1HB LEU 34 -4.842 -26.688 -23.852 263 2HB LEU 34 2HB LEU 34 -3.851 -25.318 -24.321 264 HG LEU 34 HG LEU 34 -4.258 -25.350 -21.919 265 1HD1 LEU 34 1HD1 LEU 34 -5.094 -23.117 -21.592 266 2HD1 LEU 34 2HD1 LEU 34 -5.640 -23.085 -23.270 267 3HD1 LEU 34 3HD1 LEU 34 -3.924 -23.236 -22.901 268 1HD2 LEU 34 1HD2 LEU 34 -6.490 -24.970 -20.970 269 2HD2 LEU 34 2HD2 LEU 34 -6.400 -26.506 -21.833 270 3HD2 LEU 34 3HD2 LEU 34 -7.192 -25.121 -22.580 271 H LEU 35 H LEU 35 -5.007 -23.646 -26.810 272 HA LEU 35 HA LEU 35 -3.342 -25.562 -28.146 273 1HB LEU 35 1HB LEU 35 -4.043 -25.012 -30.414 274 2HB LEU 35 2HB LEU 35 -5.346 -25.686 -29.471 275 HG LEU 35 HG LEU 35 -6.150 -24.085 -31.006 276 1HD1 LEU 35 1HD1 LEU 35 -6.376 -23.024 -28.225 277 2HD1 LEU 35 2HD1 LEU 35 -7.408 -24.220 -29.014 278 3HD1 LEU 35 3HD1 LEU 35 -7.392 -22.548 -29.585 279 1HD2 LEU 35 1HD2 LEU 35 -4.372 -22.021 -29.731 280 2HD2 LEU 35 2HD2 LEU 35 -5.649 -21.667 -30.895 281 3HD2 LEU 35 3HD2 LEU 35 -4.268 -22.651 -31.375 282 H HIS 36 H HIS 36 -2.089 -24.295 -29.939 283 HA HIS 36 HA HIS 36 -1.241 -21.904 -28.543 284 1HB HIS 36 1HB HIS 36 1.167 -22.420 -29.134 285 2HB HIS 36 2HB HIS 36 0.434 -23.399 -27.880 286 HD2 HIS 36 HD2 HIS 36 1.098 -23.874 -31.767 287 HE1 HIS 36 HE1 HIS 36 1.754 -27.498 -29.695 288 HE2 HIS 36 HE2 HIS 36 2.196 -26.227 -31.799 289 H LEU 37 H LEU 37 -0.639 -20.255 -29.486 290 HA LEU 37 HA LEU 37 -0.827 -20.086 -32.431 291 1HB LEU 37 1HB LEU 37 -1.416 -17.881 -30.464 292 2HB LEU 37 2HB LEU 37 -1.652 -17.801 -32.171 293 HG LEU 37 HG LEU 37 -3.261 -19.851 -31.648 294 1HD1 LEU 37 1HD1 LEU 37 -2.798 -19.915 -29.269 295 2HD1 LEU 37 2HD1 LEU 37 -4.487 -19.529 -29.572 296 3HD1 LEU 37 3HD1 LEU 37 -3.365 -18.252 -29.096 297 1HD2 LEU 37 1HD2 LEU 37 -3.975 -17.952 -32.815 298 2HD2 LEU 37 2HD2 LEU 37 -3.892 -16.933 -31.372 299 3HD2 LEU 37 3HD2 LEU 37 -5.115 -18.203 -31.500 300 H LYS 38 H LYS 38 0.428 -18.136 -33.175 301 HA LYS 38 HA LYS 38 2.663 -17.476 -31.475 302 1HB LYS 38 1HB LYS 38 4.334 -18.360 -32.818 303 2HB LYS 38 2HB LYS 38 3.096 -19.625 -32.694 304 1HG LYS 38 1HG LYS 38 3.421 -17.778 -35.015 305 2HG LYS 38 2HG LYS 38 4.110 -19.418 -34.978 306 1HD LYS 38 1HD LYS 38 1.735 -20.209 -34.617 307 2HD LYS 38 2HD LYS 38 1.262 -18.532 -34.912 308 1HE LYS 38 1HE LYS 38 2.289 -18.652 -37.151 309 2HE LYS 38 2HE LYS 38 2.708 -20.338 -36.859 310 1HZ LYS 38 1HZ LYS 38 -0.013 -19.192 -37.024 311 2HZ LYS 38 2HZ LYS 38 0.301 -20.824 -36.648 312 3HZ LYS 38 3HZ LYS 38 0.718 -20.198 -38.157 313 H GLN 39 H GLN 39 3.869 -15.887 -32.380 314 HA GLN 39 HA GLN 39 2.307 -14.130 -34.054 315 1HB GLN 39 1HB GLN 39 3.482 -13.102 -32.264 316 2HB GLN 39 2HB GLN 39 5.035 -13.670 -32.916 317 1HG GLN 39 1HG GLN 39 4.838 -12.229 -34.809 318 2HG GLN 39 2HG GLN 39 3.173 -11.833 -34.397 319 1HE2 GLN 39 1HE2 GLN 39 6.501 -11.277 -33.656 320 2HE2 GLN 39 2HE2 GLN 39 6.273 -9.902 -32.655 321 H GLY 40 H GLY 40 2.137 -14.935 -35.830 322 1HA GLY 40 1HA GLY 40 4.482 -15.591 -37.506 323 2HA GLY 40 2HA GLY 40 2.819 -16.010 -37.907 324 H ILE 41 H ILE 41 1.635 -13.563 -37.454 325 HA ILE 41 HA ILE 41 2.903 -11.706 -39.321 326 HB ILE 41 HB ILE 41 -0.054 -12.449 -39.176 327 1HG1 ILE 41 1HG1 ILE 41 1.247 -14.145 -40.409 328 2HG1 ILE 41 2HG1 ILE 41 0.150 -13.280 -41.474 329 1HG2 ILE 41 1HG2 ILE 41 0.236 -10.084 -39.583 330 2HG2 ILE 41 2HG2 ILE 41 -0.400 -10.875 -41.029 331 3HG2 ILE 41 3HG2 ILE 41 1.305 -10.424 -40.941 332 1HD1 ILE 41 1HD1 ILE 41 2.036 -11.938 -42.299 333 2HD1 ILE 41 2HD1 ILE 41 2.293 -13.663 -42.547 334 3HD1 ILE 41 3HD1 ILE 41 3.124 -12.830 -41.235 335 H SER 42 H SER 42 2.659 -9.560 -38.551 336 HA SER 42 HA SER 42 1.011 -9.289 -36.188 337 1HB SER 42 1HB SER 42 2.864 -7.921 -35.137 338 2HB SER 42 2HB SER 42 3.149 -9.660 -35.261 339 HG SER 42 HG SER 42 4.375 -9.263 -37.097 340 H ALA 43 H ALA 43 1.483 -6.675 -35.548 341 HA ALA 43 HA ALA 43 1.328 -4.909 -37.587 342 1HB ALA 43 1HB ALA 43 -1.119 -4.341 -37.349 343 2HB ALA 43 2HB ALA 43 -1.323 -5.800 -36.383 344 3HB ALA 43 3HB ALA 43 -0.864 -5.924 -38.081 345 H SER 44 H SER 44 -0.513 -3.184 -35.966 346 HA SER 44 HA SER 44 1.222 -2.266 -33.998 347 1HB SER 44 1HB SER 44 -1.777 -1.895 -34.109 348 2HB SER 44 2HB SER 44 -0.583 -0.775 -33.448 349 HG SER 44 HG SER 44 -1.181 -0.085 -35.469 350 H GLY 45 H GLY 45 1.812 -3.813 -32.496 351 1HA GLY 45 1HA GLY 45 0.979 -4.525 -30.202 352 2HA GLY 45 2HA GLY 45 -0.300 -5.325 -31.114 353 H ALA 46 H ALA 46 -0.020 -7.403 -31.140 354 HA ALA 46 HA ALA 46 2.316 -8.561 -32.177 355 1HB ALA 46 1HB ALA 46 1.351 -8.843 -29.353 356 2HB ALA 46 2HB ALA 46 2.976 -8.380 -29.864 357 3HB ALA 46 3HB ALA 46 2.398 -10.038 -30.125 358 H ARG 47 H ARG 47 1.478 -10.337 -33.233 359 HA ARG 47 HA ARG 47 -1.215 -10.784 -32.458 360 1HB ARG 47 1HB ARG 47 -0.169 -10.737 -35.255 361 2HB ARG 47 2HB ARG 47 -1.672 -11.528 -34.852 362 1HG ARG 47 1HG ARG 47 -2.523 -9.369 -33.989 363 2HG ARG 47 2HG ARG 47 -1.026 -8.608 -34.559 364 1HD ARG 47 1HD ARG 47 -2.906 -8.445 -36.185 365 2HD ARG 47 2HD ARG 47 -1.474 -9.278 -36.812 366 HE ARG 47 HE ARG 47 -3.253 -11.122 -35.644 367 1HH1 ARG 47 1HH1 ARG 47 -3.092 -9.128 -38.597 368 2HH1 ARG 47 2HH1 ARG 47 -3.809 -10.322 -39.564 369 1HH2 ARG 47 1HH2 ARG 47 -4.207 -12.743 -37.025 370 2HH2 ARG 47 2HH2 ARG 47 -4.460 -12.391 -38.669 371 H TYR 48 H TYR 48 -1.411 -12.838 -31.737 372 HA TYR 48 HA TYR 48 0.358 -14.974 -32.720 373 1HB TYR 48 1HB TYR 48 -1.448 -14.822 -30.313 374 2HB TYR 48 2HB TYR 48 -0.225 -16.047 -30.657 375 HD1 TYR 48 HD1 TYR 48 -0.865 -12.785 -29.209 376 HD2 TYR 48 HD2 TYR 48 2.205 -15.420 -30.519 377 HE1 TYR 48 HE1 TYR 48 0.789 -11.469 -27.959 378 HE2 TYR 48 HE2 TYR 48 3.864 -14.108 -29.262 379 HH TYR 48 HH TYR 48 4.115 -11.821 -28.423 380 H THR 49 H THR 49 -0.558 -16.199 -34.156 381 HA THR 49 HA THR 49 -3.415 -16.610 -33.997 382 HB THR 49 HB THR 49 -2.204 -15.245 -36.414 383 HG1 THR 49 HG1 THR 49 -3.140 -14.239 -34.224 384 1HG2 THR 49 1HG2 THR 49 -4.499 -15.195 -37.334 385 2HG2 THR 49 2HG2 THR 49 -5.063 -16.131 -35.949 386 3HG2 THR 49 3HG2 THR 49 -3.939 -16.850 -37.098 387 H ASP 50 H ASP 50 -3.922 -18.590 -34.750 388 HA ASP 50 HA ASP 50 -1.943 -19.820 -36.509 389 1HB ASP 50 1HB ASP 50 -1.856 -20.607 -34.080 390 2HB ASP 50 2HB ASP 50 -3.390 -21.415 -34.407 391 H GLY 51 H GLY 51 -4.933 -18.702 -36.458 392 1HA GLY 51 1HA GLY 51 -6.233 -19.071 -38.466 393 2HA GLY 51 2HA GLY 51 -5.832 -20.774 -38.347 394 H ILE 52 H ILE 52 -6.381 -20.788 -35.454 395 HA ILE 52 HA ILE 52 -9.154 -21.484 -35.597 396 HB ILE 52 HB ILE 52 -7.464 -21.132 -33.086 397 1HG1 ILE 52 1HG1 ILE 52 -7.480 -23.721 -33.075 398 2HG1 ILE 52 2HG1 ILE 52 -7.965 -23.608 -34.757 399 1HG2 ILE 52 1HG2 ILE 52 -9.135 -22.587 -31.975 400 2HG2 ILE 52 2HG2 ILE 52 -10.103 -22.535 -33.451 401 3HG2 ILE 52 3HG2 ILE 52 -9.803 -21.058 -32.546 402 1HD1 ILE 52 1HD1 ILE 52 -5.406 -22.528 -33.592 403 2HD1 ILE 52 2HD1 ILE 52 -5.862 -22.508 -35.300 404 3HD1 ILE 52 3HD1 ILE 52 -5.584 -24.037 -34.479 405 H TYR 53 H TYR 53 -7.323 -18.859 -34.261 406 HA TYR 53 HA TYR 53 -9.353 -16.964 -34.680 407 1HB TYR 53 1HB TYR 53 -9.269 -16.134 -32.305 408 2HB TYR 53 2HB TYR 53 -10.339 -17.491 -32.611 409 HD1 TYR 53 HD1 TYR 53 -10.194 -19.385 -31.297 410 HD2 TYR 53 HD2 TYR 53 -6.937 -16.688 -31.305 411 HE1 TYR 53 HE1 TYR 53 -9.161 -20.642 -29.483 412 HE2 TYR 53 HE2 TYR 53 -5.890 -17.938 -29.490 413 HH TYR 53 HH TYR 53 -6.894 -21.015 -28.532 414 H VAL 54 H VAL 54 -8.621 -14.877 -33.999 415 HA VAL 54 HA VAL 54 -5.759 -14.584 -34.502 416 HB VAL 54 HB VAL 54 -8.167 -12.830 -34.710 417 1HG1 VAL 54 1HG1 VAL 54 -5.259 -12.172 -35.397 418 2HG1 VAL 54 2HG1 VAL 54 -6.190 -11.455 -34.084 419 3HG1 VAL 54 3HG1 VAL 54 -6.622 -11.114 -35.760 420 1HG2 VAL 54 1HG2 VAL 54 -7.691 -12.826 -37.154 421 2HG2 VAL 54 2HG2 VAL 54 -8.059 -14.421 -36.504 422 3HG2 VAL 54 3HG2 VAL 54 -6.388 -13.977 -36.859 423 H PHE 55 H PHE 55 -4.711 -14.387 -32.555 424 HA PHE 55 HA PHE 55 -6.105 -12.991 -30.411 425 1HB PHE 55 1HB PHE 55 -5.295 -15.209 -29.791 426 2HB PHE 55 2HB PHE 55 -3.684 -14.814 -30.365 427 HD1 PHE 55 HD1 PHE 55 -2.301 -14.899 -28.555 428 HD2 PHE 55 HD2 PHE 55 -6.023 -12.912 -28.144 429 HE1 PHE 55 HE1 PHE 55 -1.663 -14.185 -26.296 430 HE2 PHE 55 HE2 PHE 55 -5.411 -12.211 -25.891 431 HZ PHE 55 HZ PHE 55 -3.216 -12.845 -24.960 432 H TRP 56 H TRP 56 -5.676 -10.909 -30.241 433 HA TRP 56 HA TRP 56 -3.208 -9.942 -31.373 434 1HB TRP 56 1HB TRP 56 -5.542 -9.301 -32.314 435 2HB TRP 56 2HB TRP 56 -5.692 -8.378 -30.818 436 HD1 TRP 56 HD1 TRP 56 -3.011 -6.920 -30.563 437 HE1 TRP 56 HE1 TRP 56 -2.223 -5.210 -32.299 438 HE3 TRP 56 HE3 TRP 56 -5.900 -8.397 -34.507 439 HZ2 TRP 56 HZ2 TRP 56 -2.782 -4.541 -34.981 440 HZ3 TRP 56 HZ3 TRP 56 -5.722 -7.155 -36.627 441 HH2 TRP 56 HH2 TRP 56 -4.194 -5.268 -36.855 442 H SER 57 H SER 57 -1.986 -9.171 -30.022 443 HA SER 57 HA SER 57 -2.852 -8.433 -27.315 444 1HB SER 57 1HB SER 57 -1.305 -10.424 -27.443 445 2HB SER 57 2HB SER 57 -0.136 -9.400 -28.266 446 HG SER 57 HG SER 57 0.391 -9.458 -26.092 447 H LYS 58 H LYS 58 -3.161 -6.270 -27.687 448 HA LYS 58 HA LYS 58 -1.418 -4.948 -29.532 449 1HB LYS 58 1HB LYS 58 -3.806 -4.524 -29.509 450 2HB LYS 58 2HB LYS 58 -3.698 -3.948 -27.861 451 1HG LYS 58 1HG LYS 58 -2.392 -2.050 -28.589 452 2HG LYS 58 2HG LYS 58 -2.422 -2.653 -30.253 453 1HD LYS 58 1HD LYS 58 -4.773 -2.472 -30.357 454 2HD LYS 58 2HD LYS 58 -4.868 -2.129 -28.634 455 1HE LYS 58 1HE LYS 58 -3.613 -0.039 -29.011 456 2HE LYS 58 2HE LYS 58 -3.630 -0.367 -30.746 457 1HZ LYS 58 1HZ LYS 58 -5.369 1.177 -29.964 458 2HZ LYS 58 2HZ LYS 58 -6.091 -0.079 -29.109 459 3HZ LYS 58 3HZ LYS 58 -5.987 -0.139 -30.781 460 H GLY 59 H GLY 59 -1.377 -5.635 -26.280 461 1HA GLY 59 1HA GLY 59 0.970 -4.929 -25.492 462 2HA GLY 59 2HA GLY 59 0.282 -3.317 -25.651 463 H ASP 60 H ASP 60 -1.841 -3.035 -24.540 464 HA ASP 60 HA ASP 60 -1.631 -4.282 -21.900 465 1HB ASP 60 1HB ASP 60 -2.207 -1.466 -22.719 466 2HB ASP 60 2HB ASP 60 -2.843 -2.086 -21.201 467 H GLU 61 H GLU 61 -3.316 -4.578 -24.497 468 HA GLU 61 HA GLU 61 -5.806 -5.280 -23.129 469 1HB GLU 61 1HB GLU 61 -7.128 -4.395 -24.934 470 2HB GLU 61 2HB GLU 61 -6.139 -3.085 -24.293 471 1HG GLU 61 1HG GLU 61 -4.540 -3.494 -26.102 472 2HG GLU 61 2HG GLU 61 -5.658 -4.676 -26.775 473 H ALA 62 H ALA 62 -6.863 -6.984 -24.165 474 HA ALA 62 HA ALA 62 -5.266 -8.355 -26.160 475 1HB ALA 62 1HB ALA 62 -4.688 -9.296 -23.997 476 2HB ALA 62 2HB ALA 62 -5.578 -10.448 -24.998 477 3HB ALA 62 3HB ALA 62 -6.394 -9.615 -23.667 478 H THR 63 H THR 63 -6.458 -8.798 -27.760 479 HA THR 63 HA THR 63 -9.325 -9.254 -27.387 480 HB THR 63 HB THR 63 -8.079 -7.672 -29.662 481 HG1 THR 63 HG1 THR 63 -8.838 -6.941 -27.128 482 1HG2 THR 63 1HG2 THR 63 -10.952 -8.042 -28.808 483 2HG2 THR 63 2HG2 THR 63 -10.203 -8.825 -30.200 484 3HG2 THR 63 3HG2 THR 63 -10.405 -7.068 -30.172 485 H VAL 64 H VAL 64 -9.935 -11.128 -28.304 486 HA VAL 64 HA VAL 64 -8.258 -12.176 -30.413 487 HB VAL 64 HB VAL 64 -7.676 -13.583 -28.602 488 1HG1 VAL 64 1HG1 VAL 64 -10.552 -13.594 -27.847 489 2HG1 VAL 64 2HG1 VAL 64 -9.185 -12.912 -26.962 490 3HG1 VAL 64 3HG1 VAL 64 -9.335 -14.660 -27.137 491 1HG2 VAL 64 1HG2 VAL 64 -8.264 -14.841 -30.578 492 2HG2 VAL 64 2HG2 VAL 64 -9.931 -14.962 -30.018 493 3HG2 VAL 64 3HG2 VAL 64 -8.638 -15.750 -29.119 494 H TYR 65 H TYR 65 -9.239 -12.320 -32.188 495 HA TYR 65 HA TYR 65 -12.192 -12.588 -32.328 496 1HB TYR 65 1HB TYR 65 -11.452 -10.217 -32.198 497 2HB TYR 65 2HB TYR 65 -10.487 -10.504 -33.638 498 HD1 TYR 65 HD1 TYR 65 -13.137 -12.230 -34.704 499 HD2 TYR 65 HD2 TYR 65 -12.310 -8.244 -33.481 500 HE1 TYR 65 HE1 TYR 65 -14.997 -11.426 -36.080 501 HE2 TYR 65 HE2 TYR 65 -14.176 -7.433 -34.853 502 HH TYR 65 HH TYR 65 -16.496 -9.499 -36.132 503 H LYS 66 H LYS 66 -12.138 -14.535 -33.400 504 HA LYS 66 HA LYS 66 -10.754 -14.844 -35.895 505 1HB LYS 66 1HB LYS 66 -11.161 -16.834 -34.333 506 2HB LYS 66 2HB LYS 66 -12.852 -16.435 -34.452 507 1HG LYS 66 1HG LYS 66 -12.381 -18.326 -35.875 508 2HG LYS 66 2HG LYS 66 -12.900 -16.922 -36.809 509 1HD LYS 66 1HD LYS 66 -10.498 -16.479 -37.315 510 2HD LYS 66 2HD LYS 66 -10.105 -17.991 -36.509 511 1HE LYS 66 1HE LYS 66 -10.219 -18.427 -38.878 512 2HE LYS 66 2HE LYS 66 -11.593 -19.196 -38.097 513 1HZ LYS 66 1HZ LYS 66 -11.685 -16.611 -39.593 514 2HZ LYS 66 2HZ LYS 66 -13.041 -17.395 -38.928 515 3HZ LYS 66 3HZ LYS 66 -12.199 -18.085 -40.159 516 H ARG 67 H ARG 67 -11.886 -14.487 -37.625 517 HA ARG 67 HA ARG 67 -14.547 -13.361 -37.545 518 1HB ARG 67 1HB ARG 67 -13.067 -14.431 -39.933 519 2HB ARG 67 2HB ARG 67 -14.496 -13.389 -39.937 520 1HG ARG 67 1HG ARG 67 -11.952 -12.607 -38.627 521 2HG ARG 67 2HG ARG 67 -12.250 -12.225 -40.341 522 1HD ARG 67 1HD ARG 67 -14.113 -10.866 -39.729 523 2HD ARG 67 2HD ARG 67 -14.067 -11.427 -38.061 524 HE ARG 67 HE ARG 67 -11.771 -10.335 -38.066 525 1HH1 ARG 67 1HH1 ARG 67 -14.481 -9.102 -39.967 526 2HH1 ARG 67 2HH1 ARG 67 -14.048 -7.469 -39.786 527 1HH2 ARG 67 1HH2 ARG 67 -11.201 -8.085 -37.761 528 2HH2 ARG 67 2HH2 ARG 67 -12.140 -6.875 -38.509 529 H ASP 68 H ASP 68 -15.282 -14.906 -36.381 530 HA ASP 68 HA ASP 68 -17.062 -16.833 -37.290 531 1HB ASP 68 1HB ASP 68 -15.038 -18.165 -37.991 532 2HB ASP 68 2HB ASP 68 -14.492 -18.135 -36.322 533 H ARG 69 H ARG 69 -14.841 -15.838 -34.840 534 HA ARG 69 HA ARG 69 -16.793 -15.678 -32.825 535 1HB ARG 69 1HB ARG 69 -16.490 -18.146 -32.780 536 2HB ARG 69 2HB ARG 69 -14.803 -17.892 -32.317 537 1HG ARG 69 1HG ARG 69 -15.874 -16.405 -30.438 538 2HG ARG 69 2HG ARG 69 -17.297 -17.383 -30.759 539 1HD ARG 69 1HD ARG 69 -14.578 -18.374 -29.987 540 2HD ARG 69 2HD ARG 69 -15.954 -18.230 -28.902 541 HE ARG 69 HE ARG 69 -16.085 -19.982 -31.252 542 1HH1 ARG 69 1HH1 ARG 69 -16.252 -19.678 -27.713 543 2HH1 ARG 69 2HH1 ARG 69 -16.575 -21.328 -27.433 544 1HH2 ARG 69 1HH2 ARG 69 -16.512 -22.224 -30.879 545 2HH2 ARG 69 2HH2 ARG 69 -16.747 -22.845 -29.307 546 H ILE 70 H ILE 70 -16.122 -13.957 -31.938 547 HA ILE 70 HA ILE 70 -13.419 -13.340 -31.033 548 HB ILE 70 HB ILE 70 -16.033 -12.191 -30.121 549 1HG1 ILE 70 1HG1 ILE 70 -14.208 -11.083 -32.196 550 2HG1 ILE 70 2HG1 ILE 70 -15.725 -11.904 -32.575 551 1HG2 ILE 70 1HG2 ILE 70 -14.190 -11.708 -28.614 552 2HG2 ILE 70 2HG2 ILE 70 -14.690 -10.225 -29.424 553 3HG2 ILE 70 3HG2 ILE 70 -13.232 -11.068 -29.950 554 1HD1 ILE 70 1HD1 ILE 70 -15.984 -9.489 -32.733 555 2HD1 ILE 70 2HD1 ILE 70 -15.385 -9.296 -31.086 556 3HD1 ILE 70 3HD1 ILE 70 -16.930 -10.102 -31.375 557 H VAL 71 H VAL 71 -12.710 -13.864 -29.318 558 HA VAL 71 HA VAL 71 -14.219 -15.656 -27.472 559 HB VAL 71 HB VAL 71 -11.218 -15.365 -27.697 560 1HG1 VAL 71 1HG1 VAL 71 -11.162 -17.590 -26.723 561 2HG1 VAL 71 2HG1 VAL 71 -12.923 -17.550 -26.563 562 3HG1 VAL 71 3HG1 VAL 71 -11.920 -16.387 -25.684 563 1HG2 VAL 71 1HG2 VAL 71 -12.041 -15.962 -29.879 564 2HG2 VAL 71 2HG2 VAL 71 -12.956 -17.310 -29.208 565 3HG2 VAL 71 3HG2 VAL 71 -11.184 -17.330 -29.163 566 H LEU 72 H LEU 72 -12.386 -12.707 -27.721 567 HA LEU 72 HA LEU 72 -13.245 -11.971 -25.068 568 1HB LEU 72 1HB LEU 72 -10.961 -13.416 -24.933 569 2HB LEU 72 2HB LEU 72 -10.319 -11.880 -25.476 570 HG LEU 72 HG LEU 72 -10.833 -10.764 -23.461 571 1HD1 LEU 72 1HD1 LEU 72 -13.036 -11.694 -23.075 572 2HD1 LEU 72 2HD1 LEU 72 -12.007 -11.794 -21.650 573 3HD1 LEU 72 3HD1 LEU 72 -12.299 -13.231 -22.629 574 1HD2 LEU 72 1HD2 LEU 72 -9.593 -12.139 -21.886 575 2HD2 LEU 72 2HD2 LEU 72 -8.866 -12.182 -23.492 576 3HD2 LEU 72 3HD2 LEU 72 -9.831 -13.544 -22.927 577 H ASN 73 H ASN 73 -13.523 -9.735 -25.301 578 HA ASN 73 HA ASN 73 -11.582 -8.334 -26.981 579 1HB ASN 73 1HB ASN 73 -13.279 -6.938 -28.021 580 2HB ASN 73 2HB ASN 73 -13.666 -8.629 -28.303 581 1HD2 ASN 73 1HD2 ASN 73 -14.598 -5.717 -26.613 582 2HD2 ASN 73 2HD2 ASN 73 -16.175 -6.238 -26.170 583 H ASN 74 H ASN 74 -12.253 -8.787 -24.153 584 HA ASN 74 HA ASN 74 -11.883 -6.102 -23.297 585 1HB ASN 74 1HB ASN 74 -14.367 -6.272 -23.335 586 2HB ASN 74 2HB ASN 74 -14.276 -7.689 -22.300 587 1HD2 ASN 74 1HD2 ASN 74 -15.601 -6.594 -20.825 588 2HD2 ASN 74 2HD2 ASN 74 -14.975 -5.411 -19.751 589 H CYS 75 H CYS 75 -9.878 -7.083 -22.960 590 HA CYS 75 HA CYS 75 -9.639 -7.887 -20.296 591 1HB CYS 75 1HB CYS 75 -9.674 -10.092 -21.575 592 2HB CYS 75 2HB CYS 75 -8.301 -9.485 -22.483 593 H GLN 76 H GLN 76 -7.502 -7.334 -19.641 594 HA GLN 76 HA GLN 76 -5.951 -5.806 -21.386 595 1HB GLN 76 1HB GLN 76 -6.357 -3.948 -19.577 596 2HB GLN 76 2HB GLN 76 -7.398 -4.064 -21.009 597 1HG GLN 76 1HG GLN 76 -8.970 -5.267 -19.873 598 2HG GLN 76 2HG GLN 76 -7.933 -5.362 -18.417 599 1HE2 GLN 76 1HE2 GLN 76 -9.426 -4.286 -17.037 600 2HE2 GLN 76 2HE2 GLN 76 -9.767 -2.602 -17.173 601 H LEU 77 H LEU 77 -4.149 -5.307 -20.248 602 HA LEU 77 HA LEU 77 -3.801 -7.521 -18.477 603 1HB LEU 77 1HB LEU 77 -2.305 -7.504 -20.255 604 2HB LEU 77 2HB LEU 77 -1.693 -5.899 -19.856 605 HG LEU 77 HG LEU 77 -0.704 -6.900 -17.752 606 1HD1 LEU 77 1HD1 LEU 77 -2.194 -8.688 -17.397 607 2HD1 LEU 77 2HD1 LEU 77 -0.567 -9.338 -17.628 608 3HD1 LEU 77 3HD1 LEU 77 -1.758 -9.421 -18.928 609 1HD2 LEU 77 1HD2 LEU 77 0.079 -8.185 -20.359 610 2HD2 LEU 77 2HD2 LEU 77 1.078 -8.119 -18.914 611 3HD2 LEU 77 3HD2 LEU 77 0.646 -6.630 -19.758 612 H GLN 78 H GLN 78 -3.828 -7.309 -16.410 613 HA GLN 78 HA GLN 78 -3.350 -4.774 -15.123 614 1HB GLN 78 1HB GLN 78 -3.795 -7.501 -13.879 615 2HB GLN 78 2HB GLN 78 -3.813 -5.966 -13.032 616 1HG GLN 78 1HG GLN 78 -5.818 -6.974 -15.041 617 2HG GLN 78 2HG GLN 78 -6.065 -6.707 -13.317 618 1HE2 GLN 78 1HE2 GLN 78 -6.027 -5.343 -16.410 619 2HE2 GLN 78 2HE2 GLN 78 -6.454 -3.720 -15.968 620 H ASN 79 H ASN 79 -1.889 -8.084 -14.843 621 HA ASN 79 HA ASN 79 0.719 -7.162 -14.767 622 1HB ASN 79 1HB ASN 79 1.173 -7.870 -12.377 623 2HB ASN 79 2HB ASN 79 0.181 -6.425 -12.492 624 1HD2 ASN 79 1HD2 ASN 79 0.380 -9.653 -11.330 625 2HD2 ASN 79 2HD2 ASN 79 -1.185 -9.720 -10.612 626 HA PRO 80 HA PRO 80 0.163 -11.086 -16.458 627 1HB PRO 80 1HB PRO 80 2.705 -11.583 -17.361 628 2HB PRO 80 2HB PRO 80 1.496 -10.625 -18.178 629 1HG PRO 80 1HG PRO 80 3.709 -9.688 -16.388 630 2HG PRO 80 2HG PRO 80 3.146 -8.987 -17.915 631 1HD PRO 80 1HD PRO 80 2.454 -7.934 -15.542 632 2HD PRO 80 2HD PRO 80 1.349 -7.992 -16.949 633 H GLN 81 H GLN 81 3.572 -11.886 -15.777 634 HA GLN 81 HA GLN 81 2.770 -14.184 -14.358 635 1HB GLN 81 1HB GLN 81 4.582 -14.078 -16.082 636 2HB GLN 81 2HB GLN 81 5.514 -13.099 -14.958 637 1HG GLN 81 1HG GLN 81 5.456 -14.866 -13.360 638 2HG GLN 81 2HG GLN 81 4.563 -15.878 -14.505 639 1HE2 GLN 81 1HE2 GLN 81 6.189 -14.885 -16.787 640 2HE2 GLN 81 2HE2 GLN 81 7.714 -15.669 -16.628 641 H ARG 82 H ARG 82 3.490 -11.093 -13.627 642 HA ARG 82 HA ARG 82 4.085 -11.751 -10.825 643 1HB ARG 82 1HB ARG 82 5.188 -9.426 -12.410 644 2HB ARG 82 2HB ARG 82 5.502 -9.764 -10.714 645 1HG ARG 82 1HG ARG 82 6.708 -11.761 -11.287 646 2HG ARG 82 2HG ARG 82 6.257 -11.581 -12.979 647 1HD ARG 82 1HD ARG 82 7.961 -9.650 -11.379 648 2HD ARG 82 2HD ARG 82 8.550 -10.776 -12.606 649 HE ARG 82 HE ARG 82 6.862 -9.507 -14.063 650 1HH1 ARG 82 1HH1 ARG 82 9.040 -8.047 -11.685 651 2HH1 ARG 82 2HH1 ARG 82 9.071 -6.525 -12.435 652 1HH2 ARG 82 1HH2 ARG 82 6.907 -7.389 -15.089 653 2HH2 ARG 82 2HH2 ARG 82 7.814 -6.133 -14.380
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